*HEADER    RNA BINDING PROTEIN                     25-JAN-18   6C8U              
*TITLE     SOLUTION STRUCTURE OF MUSASHI2 RRM1                                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: RNA-BINDING PROTEIN MUSASHI HOMOLOG 2;                     
*COMPND   3 CHAIN: 1;                                                            
*COMPND   4 SYNONYM: MUSASHI-2;                                                  
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 OTHER_DETAILS: RRM 1 DOMAIN (UNP RESIDUES 21-111)                    
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: MSI2;                                                          
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562                                         
*KEYWDS    RNA RECOGNITION MOTIF, RNA BINDING PROTEIN                            
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    M.XING,L.LAN,J.T.DOUGLAS,P.GAO,R.P.HANZLIK,L.XU                       
*REVDAT   1   30-JAN-19 6C8U    0                                                
# Restraints file 1: msi2_ha.tbl
?!remark non gly Ha shifts
OBSE (resid 8 and (name HA)) 4.40
OBSE (resid 9 and (name HA)) 4.67
OBSE (resid 10 and (name HA)) 4.53 
OBSE (resid 11 and (name HA)) 4.13
OBSE (resid 12 and (name HA)) 4.64 
OBSE (resid 13 and (name HA)) 4.31 
!OBSE (resid 14 and (name HA#)) 4.01 !Gly
OBSE (resid 15 and (name HA)) 4.32 
OBSE (resid 16 and (name HA)) 4.25 
OBSE (resid 17 and (name HA)) 4.62 
OBSE (resid 18 and (name HA)) 4.15 
OBSE (resid 19 and (name HA)) 4.53 
OBSE (resid 20 and (name HA)) 4.47 
OBSE (resid 21 and (name HA)) 4.20 
!OBSE (resid 22 and (name HA)) 
OBSE (resid 23 and (name HA)) 4.72 
OBSE (resid 24 and (name HA)) 4.22 
!OBSE (resid 25 and (name HA#)) 4.02 !Gly 
OBSE (resid 26 and (name HA)) 5.07 
OBSE (resid 27 and (name HA)) 5.03 
OBSE (resid 28 and (name HA)) 4.56
OBSE (resid 29 and (name HA)) 4.16 
!OBSE (resid 30 and (name HA#)) 4.50 3.92 !Gly 
!OBSE (resid 31 and (name HA#)) 4.03 3.82 !Gly 
OBSE (resid 32 and (name HA)) 4.11  
OBSE (resid 33 and (name HA)) 4.26
OBSE (resid 34 and (name HA)) 4.40
OBSE (resid 35 and (name HA)) 3.93 
OBSE (resid 36 and (name HA)) 4.07
OBSE (resid 37 and (name HA)) 4.50
OBSE (resid 38 and (name HA)) 4.04 
OBSE (resid 39 and (name HA)) 4.36 
OBSE (resid 40 and (name HA)) 4.36 
OBSE (resid 41 and (name HA)) 4.11 
OBSE (resid 42 and (name HA)) 3.86
OBSE (resid 43 and (name HA)) 4.32 
OBSE (resid 44 and (name HA)) 4.15 
OBSE (resid 45 and (name HA)) 4.54 
OBSE (resid 46 and (name HA)) 4.97 
OBSE (resid 47 and (name HA)) 4.01 
OBSE (resid 48 and (name HA)) 4.45 
!OBSE (resid 49 and (name HA)) 4.43, 3.95 !Gly 
OBSE (resid 50 and (name HA)) 4.36 
OBSE (resid 51 and (name HA)) 4.15 
OBSE (resid 52 and (name HA)) 4.49 
OBSE (resid 53 and (name HA)) 4.58 
OBSE (resid 54 and (name HA)) 5.02
OBSE (resid 55 and (name HA)) 5.03 
OBSE (resid 56 and (name HA)) 4.00 
OBSE (resid 57 and (name HA)) 4.50 
OBSE (resid 58 and (name HA)) 4.83 
OBSE (resid 59 and (name HA)) 4.75 
OBSE (resid 60 and (name HA)) 4.50 
OBSE (resid 61 and (name HA)) 4.25
OBSE (resid 62 and (name HA)) 4.27 
OBSE (resid 63 and (name HA)) 3.96 
OBSE (resid 64 and (name HA)) 4.31 
OBSE (resid 65 and (name HA)) 4.50 
OBSE (resid 66 and (name HA)) 4.40 
!OBSE (resid 67 and (name HA)) 4.16 !gly
OBSE (resid 68 and (name HA)) 5.26
!OBSE (resid 69 and (name HA)) 4.18,3.90 !gly 
OBSE (resid 70 and (name HA)) 5.59
OBSE (resid 71 and (name HA)) 4.39
OBSE (resid 72 and (name HA)) 4.80
OBSE (resid 73 and (name HA)) 4.82 
OBSE (resid 74 and (name HA)) 3.99
OBSE (resid 75 and (name HA)) 5.21 
OBSE (resid 76 and (name HA)) 4.40 
OBSE (resid 77 and (name HA)) 4.26
OBSE (resid 78 and (name HA)) 3.87 
OBSE (resid 79 and (name HA)) 3.56 
OBSE (resid 80 and (name HA)) 4.30 
OBSE (resid 81 and (name HA)) 4.14 
OBSE (resid 82 and (name HA)) 2.79 
OBSE (resid 83 and (name HA)) 4.31
!OBSE (resid 84 and (name HA)) 4.06, 3.78 !gly
OBSE (resid 85 and (name HA)) 4.93 
OBSE (resid 86 and (name HA)) 4.40
OBSE (resid 87 and (name HA)) 4.97 
OBSE (resid 88 and (name HA)) 4.60 
OBSE (resid 89 and (name HA)) 5.02
OBSE (resid 90 and (name HA)) 4.26 
OBSE (resid 91 and (name HA)) 4.25 
OBSE (resid 92 and (name HA)) 3.92
OBSE (resid 93 and (name HA)) 4.68 
OBSE (resid 94 and (name HA)) 4.58 
OBSE (resid 95 and (name HA)) 4.15 
OBSE (resid 96 and (name HA)) 5.30 
OBSE (resid 97 and (name HA)) 5.13
OBSE (resid 98 and (name HA)) 4.71 
OBSE (resid 99 and (name HA)) 4.04
OBSE (resid 100 and (name HA)) 4.31
OBSE (resid 101 and (name HA)) 4.77 
OBSE (resid 102 and (name HA)) 4.51 
OBSE (resid 103 and (name HA)) 4.31 
OBSE (resid 104 and (name HA)) 4.40
OBSE (resid 105 and (name HA)) 4.30 
OBSE (resid 106 and (name HA)) 4.60 
OBSE (resid 107 and (name HA)) 4.44 
OBSE (resid 108 and (name HA)) 4.27
OBSE (resid 109 and (name HA)) 4.51 
OBSE (resid 110 and (name HA)) 4.82 
OBSE (resid 111 and (name HA)) 4.70
OBSE (resid 112 and (name HA)) 4.46 
OBSE (resid 113 and (name HA)) 4.39
OBSE (resid 114 and (name HA)) 4.35
OBSE (resid 115 and (name HA)) 4.14
# Restraints file 2: msi2_cacb.tbl
?
!remark Ca and Cb shifts

  !!    s8
 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 )  			  58.47 63.93
  !!    t9
 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 ) 			  61.89 69.88
  !!    s10
 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 ) 			  58.41 63.86
  !!    v11
 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 )    			  62.22 32.74
  !!    d12
 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 )  		          55.60 41.22
  !!    l13
 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 )     			  55.53 42.33
  !!    g14
 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 )     			  45.72 0.00
  !!    t15
 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 )     			  62.45 69.55
  !!    e16
 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 )    			  57.50 29.80
  !!    n17
 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 )    			  53.84 38.73 
  !!    l18
 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 )     			  56.00 42.05
  !!    y19
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 )     	                  58.59 38.33
  !!    f20
 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 )     			  58.22 39.34 
  !!    q21
 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 )     			  56.43 29.12
  !!    s22
 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 )     		        58.99 63.93 
  !!    n23
 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 ) 		                53.46 39.47
  !!    a24
 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 )   			  54.02 18.66
  !!    g25
 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 )   			  45.25 0.00
  !!    k26
 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 )    			  56.39 34.65
  !!    m27
 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 )     			 55.50 37.02
  !!    f28
 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 )    			  55.26 41.07 
  !!    i29
 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 )    			  58.89 36.99
  !!    g30
 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 )    			  43.83 0.00
  !!    g31
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 )    			  46.65 0.00
  !!    l32
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 )    			  54.23 42.87
  !!    s33
 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 )    			  57.81 63.03
  !!    w34
 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 )    			  59.10 27.89
  !!    q35
 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 )    			  56.07 28.88
  !!    t36
 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 )    			  64.94 68.57
  !!    s37
 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 )  			  58.52 61.97
  !!    p38
 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 )    			  65.86 31.26
  !!    d39
 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 )    			  57.40 40.32
  !!    s40
 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 )    			  61.14 62.64
  !!    l41
 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 )   			  58.21 43.18 
  !!    r42
 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 )    			  59.78 30.28
  !!    d43
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 )     			  57.65 40.61
  !!    y44
 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 )    			  62.06 39.66 
  !!    f45
 assign (resid 44 and name c ) (resid 45 and name n ) 
        (resid 45 and name ca) (resid 45 and name c )
	(resid 46 and name n )     			  63.48 38.80
  !!    s46
 assign (resid 45 and name c ) (resid 46 and name n ) 
        (resid 46 and name ca) (resid 46 and name c )
	(resid 47 and name n )     			  61.32 62.92
  !!    k47
 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 )     			  58.01 31.25 
  !!    f48
 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 )     			  58.40 39.73
  !!    g49
 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 )    			  44.69 0.00
  !!    e50
 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 )     			  57.06 30.31
  !!    i51
 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 )     			  60.60 39.61
  !!    r52
 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 )    			  56.81 31.62 
  !!    e53
 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 )    			  55.42 33.47 
  !!    c54
 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 )     			  58.05 28.72
  !!    m55
 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 )    			  54.66 35.94
  !!    v56
 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 )     			  62.35 34.65 
  !!    m57
 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 )     			  54.83 30.70
  !!    r58
 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 )     			  54.33 33.46
  !!    d59
 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 )     			  51.99 42.77 
  !!    p60
 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 )     			  64.66 32.14 
  !!    t61
 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 )     			 64.94 68.74 
  !!    t62
 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 )    			  62.07 70.57
  !!    k63
 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 )     			  57.81 29.38
  !!    r64
 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 )     			  55.99 31.17
  !!    s65
 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 )    			  58.64 64.11
  !!    r66
 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 )     			  56.11 31.03 
  !!    g67
 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 )     			  45.61 0.00 
  !!    f68
 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 )     	                  54.96 41.78
  !!    g69
 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 )    			  45.00 0.00
  !!    f70
 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 )                            56.67 44.09                			  
  !!    v71
 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 )    			  60.37 35.91 
  !!    t72
 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 )    			  60.96 69.43
  !!    f73
 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 )    			  58.76 40.78
  !!    a74
 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 )     			  54.38 19.02
  !!    d75
 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 )                            49.67 43.25
  !!    p76
 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 )  			  64.91 32.08
  !!    a77
 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 )     			  54.38 19.02
  !!    s78
 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 )     			  62.50 62.53
  !!    v79
 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 )     			  65.53 31.58
  !!    d80
 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 )     			  57.32 40.23 
  !!    k81
 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 )    			  59.33 32.58 
  !!    v82
 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 )     			  66.87 31.24 
  !!    l83
 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 )     			  56.40 41.15
  !!    g84
 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 )     			  45.26 0.00
  !!    q85
 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 )     			  52.19 29.40 
  !!    p86
 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 )    			  64.88 32.40 
  !!    h87
 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 )    			  55.59 31.62
  !!    h88
 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 )     			  55.90 34.44
  !!    e89
 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 )     			  54.28 33.03
  !!    l90
 assign (resid 89 and name c ) (resid 90 and name n ) 
        (resid 90 and name ca) (resid 90 and name c )
	(resid 91 and name n )    			 54.26 45.35
  !!    d91
 assign (resid 90 and name c ) (resid 91 and name n )
        (resid 91 and name ca) (resid 91 and name c )
        (resid 92 and name n )    			  56.71 38.92
  !!    s92
 assign (resid 91 and name c ) (resid 92 and name n ) 
        (resid 92 and name ca) (resid 92 and name c ) 
	(resid 93 and name n )    			  59.92 62.05
  !!    k93
 assign (resid 92 and name c ) (resid 93 and name n ) 
        (resid 93 and name ca) (resid 93 and name c ) 
	(resid 94 and name n )    			  53.55 35.22 
  !!    t94
 assign (resid 93 and name c ) (resid 94 and name n )
        (resid 94 and name ca) (resid 94 and name c )
	(resid 95 and name n )     			  63.78 69.00 
  !!    i95
 assign (resid 94 and name c ) (resid 95 and name n ) 
        (resid 95 and name ca) (resid 95 and name c )
	(resid 96 and name n )     			  60.45 40.39 
  !!    d96
 assign (resid 95 and name c ) (resid 96 and name n ) 
        (resid 96 and name ca) (resid 96 and name c ) 
	(resid 97 and name n )    			  51.35 42.38
  !!    p97
 assign (resid 96 and name c ) (resid 97 and name n ) 
        (resid 97 and name ca) (resid 97 and name c )
	(resid 98 and name n )     			  61.65 32.36
  !!    k98
 assign (resid 97 and name c ) (resid 98 and name n ) 
        (resid 98 and name ca) (resid 98 and name c )
	(resid 99 and name n )     			  54.64 36.63 
  !!    v99
 assign (resid 98 and name c ) (resid 99 and name n ) 
        (resid 99 and name ca) (resid 99 and name c )
	(resid 100 and name n )     			  63.98 32.04
  !!    a100
 assign (resid 99 and name c ) (resid 100 and name n ) 
        (resid 100 and name ca) (resid 100 and name c )
	(resid 101 and name n )    			  52.86 19.07
  !!    f101
 assign (resid 100 and name c ) (resid 101 and name n )
        (resid 101 and name ca) (resid 101 and name c )
	(resid 102 and name n )    			  55.08 39.18
  !!    p102
 assign (resid 101 and name c ) (resid 102 and name n )
        (resid 102 and name ca) (resid 102 and name c )
	(resid 103 and name n )    			  63.13 32.08
  !!    r103
 assign (resid 102 and name c ) (resid 103 and name n ) 
        (resid 103 and name ca) (resid 103 and name c ) 
	(resid 104 and name n )   			  56.43 31.72
  !!    r104
 assign (resid 103 and name c ) (resid 104 and name n ) 
        (resid 104 and name ca) (resid 104 and name c )
	(resid 105 and name n )    			  55.91 31.89 
 !!     a105
 assign (resid 104 and name c ) (resid 105 and name n ) 
        (resid 105 and name ca) (resid 105 and name c )
	(resid 106 and name n )    			  52.24 19.26
  !!    q106
 assign (resid 105 and name c ) (resid 106 and name n )
        (resid 106 and name ca) (resid 106 and name c )
	(resid 107 and name n )    			  53.71 28.95
  !!    p107
 assign (resid 106 and name c ) (resid 107 and name n )
        (resid 107 and name ca) (resid 107 and name c )
	(resid 108 and name n )    			  63.23 32.24
  !!    k108
 assign (resid 107 and name c ) (resid 108 and name n ) 
        (resid 108 and name ca) (resid 108 and name c ) 
	(resid 109 and name n )   			  56.39 32.95
  !!    m109
 assign (resid 108 and name c ) (resid 109 and name n ) 
        (resid 109 and name ca) (resid 109 and name c )
	(resid 110 and name n )    			  55.36 32.96 
  !!    v110
 assign (resid 109 and name c ) (resid 110 and name n ) 
        (resid 110 and name ca) (resid 110 and name c )
	(resid 111 and name n )    			  62.30 32.84 
  !!    t111
 assign (resid 110 and name c ) (resid 111 and name n )
        (resid 111 and name ca) (resid 111 and name c )
	(resid 112 and name n )    			  62.00 69.96
  !!    r112
 assign (resid 111 and name c ) (resid 112 and name n )
        (resid 112 and name ca) (resid 112 and name c )
	(resid 113 and name n )    			  55.97 30.90
  !!    t113
 assign (resid 112 and name c ) (resid 113 and name n ) 
        (resid 113 and name ca) (resid 113 and name c ) 
	(resid 114 and name n )   			  62.00 69.93 
  !!    k114
 assign (resid 113 and name c ) (resid 114 and name n ) 
        (resid 114 and name ca) (resid 114 and name c )
	(resid 115 and name n )    			  56.41 33.08
 !!     k115
 assign (resid 114 and name c ) (resid 115 and name n ) 
        (resid 115 and name ca) (resid 115 and name c )
	(resid 116 and name n )    			  57.93 33.47 
# Restraints file 3: Hbond.tbl

! Hydrogen Bond Restraints
! atom1-atom2: (distance) (dminus) (dplus)


!
assign (resid 27 and name O ) (residue 71 and name HN) 1.7 0.0 0.7
assign (resid 27 and name O ) (residue 71 and name N) 2.7 0.0 0.5
assign (resid 27 and name HN ) (residue 71 and name O) 1.7 0.0 0.7
assign (resid 27 and name N ) (residue 71 and name O) 2.7 0.0 0.5

!
assign (resid 28 and name O ) (residue 98 and name HN) 1.7 0.0 0.7
assign (resid 28 and name O ) (residue 98 and name N) 2.7 0.0 0.5
assign (resid 28 and name HN ) (residue 98 and name O) 1.7 0.0 0.7
assign (resid 28 and name N ) (residue 98 and name O) 2.7 0.0 0.5

!
assign (resid 29 and name O ) (residue 69 and name HN) 1.7 0.0 0.7
assign (resid 29 and name O ) (residue 69 and name N) 2.7 0.0 0.5
assign (resid 29 and name HN ) (residue 69 and name O) 1.7 0.0 0.7
assign (resid 29 and name N ) (residue 69 and name O) 2.7 0.0 0.5

!
assign (resid 30 and name O ) (residue 96 and name HN) 1.7 0.0 0.7
assign (resid 30 and name O ) (residue 96 and name N) 2.7 0.0 0.5
assign (resid 30 and name HN ) (residue 96 and name O) 1.7 0.0 0.7
assign (resid 30 and name N ) (residue 96 and name O) 2.7 0.0 0.5

!
assign (resid 55 and name O ) (residue 70 and name HN) 1.7 0.0 0.7
assign (resid 55 and name O ) (residue 70 and name N) 2.7 0.0 0.5
assign (resid 55 and name HN ) (residue 70 and name O) 1.7 0.0 0.7
assign (resid 55 and name N ) (residue 70 and name O) 2.7 0.0 0.5

!
assign (resid 53 and name O ) (residue 72 and name HN) 1.7 0.0 0.7
assign (resid 53 and name O ) (residue 72 and name N) 2.7 0.0 0.5
assign (resid 53 and name HN ) (residue 72 and name O) 1.7 0.0 0.7
assign (resid 53 and name N ) (residue 72 and name O) 2.7 0.0 0.5


!
assign (resid 90 and name O ) (residue 93 and name HN) 1.7 0.0 0.7
assign (resid 90 and name O ) (residue 93 and name N) 2.7 0.0 0.5
assign (resid 90 and name HN ) (residue 93 and name O) 1.7 0.0 0.7
assign (resid 90 and name N ) (residue 93 and name O) 2.7 0.0 0.5

! 
assign (resid 47 and name HN ) (residue 44 and name O) 1.7 0.0 0.7
assign (resid 46 and name HN ) (residue 42 and name O) 1.7 0.0 0.7
assign (resid 45 and name HN ) (residue 41 and name O) 1.7 0.0 0.7
assign (resid 44 and name HN ) (residue 40 and name O) 1.7 0.0 0.7
assign (resid 43 and name HN ) (residue 39 and name O) 1.7 0.0 0.7
assign (resid 42 and name HN ) (residue 38 and name O) 1.7 0.0 0.7

! 
assign (resid 81 and name HN ) (residue 77 and name O) 1.7 0.0 0.7
assign (resid 82 and name HN ) (residue 78 and name O) 1.7 0.0 0.7
assign (resid 83 and name HN ) (residue 79 and name O) 1.7 0.0 0.7
assign (resid 84 and name HN ) (residue 80 and name O) 1.7 0.0 0.7


# Restraints file 4: N15master.tbl
?

!T9
assign (resid   9 and name   HN) (resid  9 and name  HG2#) 2.0 0.5 0.7
assign (resid   9 and name   HN) (resid  9 and name  HB) 2.0 0.5 1.3
assign (resid   9 and name   HN) (resid  9 and name  HA) 2.0 0.5 1.3

!V11
assign (resid   11 and name   HN) (resid  10 and name  HA) 2.0 0.5 1.3
assign (resid   11 and name   HN) (resid  10 and name  HB#) 2.0 0.5 1.3
assign (resid   11 and name   HN) (resid  11 and name  HA) 2.0 0.5 1.
assign (resid   11 and name   HN) (resid  11 and name  HB) 2.0 0.5 0.7
assign (resid   11 and name   HN) (resid  11 and name  HG1#) 2.0 0.5 3.5
assign (resid   11 and name   HN) (resid  11 and name  HG2#) 2.0 0.5 0.7


!G14
assign (resid   14 and name   HN) (resid  15 and name  HN) 2.0 0.5 1.3
assign (resid   14 and name   HN) (resid  13 and name  HB#) 2.0 0.5 1.3
assign (resid   14 and name   HN) (resid  13 and name  HD1#) 2.0 0.5 2.0
assign (resid   14 and name   HN) (resid  14 and name  HA#) 2.0 0.5 0.7
assign (resid   14 and name   HN) (resid  13 and name  HA) 2.0 0.5 1.3

!T15
assign (resid   15 and name   HN) (resid  16 and name  HN) 2.0 0.5 1.3
assign (resid   15 and name   HN) (resid  17 and name  HN) 2.0 0.5 2.0
assign (resid   15 and name   HN) (resid  15 and name  HA) 2.0 0.5 1.3
assign (resid   15 and name   HN) (resid  14 and name  HA#) 2.0 0.5 0.7
assign (resid   15 and name   HN) (resid  15 and name  HG2#) 2.0 0.5 0.7
assign (resid   15 and name   HN) (resid  16 and name  HB#) 2.0 0.5 2.0
assign (resid   15 and name   HN) (resid  13 and name  HB#) 2.0 0.5 2.0
assign (resid   15 and name   HN) (resid  16 and name  HG#) 2.0 0.5 3.5
assign (resid   15 and name   HN) (resid  17 and name  HB#) 2.0 0.5 3.5

!E16
assign (resid   16 and name   HN) (resid  16 and name  HA) 2.0 0.5 1.3
assign (resid   16 and name   HN) (resid  16 and name  HG#) 2.0 0.5 2.0
assign (resid   16 and name   HN) (resid  16 and name  HB#) 2.0 0.5 0.7
assign (resid   16 and name   HN) (resid  18 and name  HD1#) 2.0 0.5 3.5
assign (resid   16 and name   HN) (resid  15 and name  HG2#) 2.0 0.5 2.0

!N17
assign (resid   17 and name   HN) (resid  16 and name  HN) 2.0 0.5 0.7
assign (resid   17 and name   HN) (resid  18 and name  HN) 2.0 0.5 1.3
assign (resid   17 and name   HN) (resid  17 and name  HD21) 2.0 0.5 3.5
assign (resid   17 and name   HN) (resid  17 and name  HD22) 2.0 0.5 3.5
assign (resid   17 and name   HN) (resid  16 and name  HA) 2.0 0.5 1.3
assign (resid   17 and name   HN) (resid  17 and name  HB1) 2.0 0.5 0.7
assign (resid   17 and name   HN) (resid  17 and name  HB2) 2.0 0.5 0.7
assign (resid   17 and name   HN) (resid  16 and name  HG#) 2.0 0.5 1.3
assign (resid   17 and name   HN) (resid  16 and name  HB#) 2.0 0.5 1.3
assign (resid   17 and name   HN) (resid  18 and name  HD1#) 2.0 0.5 3.5

!N17HD21
assign (resid   17 and name   HD21) (resid  17 and name  HD22) 2.0 0.5 0.7
assign (resid   17 and name   HD21) (resid  17 and name  HB#) 2.0 0.5 0.7

!N17HD22
assign (resid   17 and name   HD22) (resid  17 and name  HB#) 2.0 0.5 0.7

!L18

!Y19
assign (resid   19 and name   HN) (resid  19 and name  HD#) 2.0 0.5 2.0
assign (resid   19 and name   HN) (resid  19 and name  HA) 2.0 0.5 1.3
assign (resid   19 and name   HN) (resid  18 and name  HA) 2.0 0.5 1.3
assign (resid   19 and name   HN) (resid  20 and name  HB#) 2.0 0.5 3.5
assign (resid   19 and name   HN) (resid  19 and name  HB#) 2.0 0.5 0.7
assign (resid   19 and name   HN) (resid  18 and name  HB#) 2.0 0.5 1.3
assign (resid   19 and name   HN) (resid  18 and name  HD1#) 2.0 0.5 1.3

!F20
assign (resid   20 and name   HN) (resid  20 and name  HA) 2.0 0.5 0.7
assign (resid   20 and name   HN) (resid  20 and name  HB#) 2.0 0.5 0.7

!Q21
assign (resid   21 and name   HN) (resid  20 and name  HN) 2.0 0.5 1.3
assign (resid   21 and name   HN) (resid  21 and name  HE21) 2.0 0.5 2.0
assign (resid   21 and name   HN) (resid  21 and name  HG#) 2.0 0.5 0.7
assign (resid   21 and name   HN) (resid  21 and name  HB#) 2.0 0.5 1.3

!Q21HE21
assign (resid   21 and name   HE21) (resid  21 and name  HE22) 2.0 0.5 0.7

!N23
assign (resid   23 and name   HN) (resid  23 and name  HB#) 2.0 0.5 0.7
assign (resid   23 and name   HN) (resid  23 and name  HA) 2.0 0.5 1.3
assign (resid   23 and name   HN) (resid  24 and name  HB#) 2.0 0.5 2.0

!N23HD21
assign (resid   23 and name   HD21) (resid  23 and name  HD22) 2.0 0.5 0.7
assign (resid   23 and name   HD21) (resid  23 and name  HB#) 2.0 0.5 0.7

!N32HD22
assign (resid   23 and name   HD22) (resid  23 and name  HB#) 2.0 0.5 0.7

!A24
assign (resid   24 and name   HN) (resid  24 and name  HA) 2.0 0.5 1.3
assign (resid   24 and name   HN) (resid  23 and name  HB#) 2.0 0.5 3.5
assign (resid   24 and name   HN) (resid  24 and name  HB#) 2.0 0.5 0.7

!G25
assign (resid   25 and name   HN) (resid  24 and name  HN) 2.0 0.5 3.5
assign (resid   25 and name   HN) (resid  26 and name  HN) 2.0 0.5 0.7
assign (resid   25 and name   HN) (resid  26 and name  HA) 2.0 0.5 3.5
assign (resid   25 and name   HN) (resid  25 and name  HA#) 2.0 0.5 0.7
assign (resid   25 and name   HN) (resid  23 and name  HB#) 2.0 0.5 4.0
assign (resid   25 and name   HN) (resid  24 and name  HB#) 2.0 0.5 1.3
assign (resid   25 and name   HN) (resid  79 and name  HG1#) 2.0 0.5 3.5 
assign (resid   25 and name   HN) (resid  79 and name  HG2#) 2.0 0.5 3.5 

!K26
assign (resid   26 and name   HN) (resid  27 and name  HN) 2.0 0.5 2.5
assign (resid   26 and name   HN) (resid  100 and name  HN) 2.0 0.5 3.5
assign (resid   26 and name   HN) (resid  24 and name  HN) 2.0 0.5 3.5
assign (resid   26 and name   HN) (resid  24 and name  HA) 2.0 0.5 1.3
assign (resid   26 and name   HN) (resid  25 and name  HA1) 2.0 0.5 1.3
assign (resid   26 and name   HN) (resid  25 and name  HA2) 2.0 0.5 1.3
assign (resid   26 and name   HN) (resid  26 and name  HB#) 2.0 0.5 1.3
assign (resid   26 and name   HN) (resid  26 and name  HD#) 2.0 0.5 1.3
assign (resid   26 and name   HN) (resid  26 and name  HG#) 2.0 0.5 1.3

!M27
assign (resid   27 and name   HN) (resid  73 and name  HN) 2.0 0.5 2.0
assign (resid   27 and name   HN) (resid  71 and name  HN) 2.0 0.5 1.3
assign (resid   27 and name   HN) (resid  27 and name  HG#) 2.0 0.5 2.0
assign (resid   27 and name   HN) (resid  27 and name  HB1) 2.0 0.5 1.3
assign (resid   27 and name   HN) (resid  27 and name  HB2) 2.0 0.5 1.3
assign (resid   27 and name   HN) (resid  26 and name  HG#) 2.0 0.5 1.3
assign (resid   27 and name   HN) (resid  26 and name  HA) 2.0 0.5 0.7

!F28
assign (resid   28 and name   HN) (resid  27 and name  HN) 2.0 0.5 2.0
assign (resid   28 and name   HN) (resid  98 and name  HN) 2.0 0.5 1.3
assign (resid   28 and name   HN) (resid  29 and name  HN) 2.0 0.5 2.0
assign (resid   28 and name   HN) (resid  71 and name  HN) 2.0 0.5 3.5
assign (resid   28 and name   HN) (resid 100 and name  HN) 2.0 0.5 2.0
assign (resid   28 and name   HN) (resid  28 and name  HD#) 2.0 0.5 3.5
assign (resid   28 and name   HN) (resid  99 and name  HA) 2.0 0.5 2.0
assign (resid   28 and name   HN) (resid  28 and name  HB#) 2.0 0.5 0.7
assign (resid   28 and name   HN) (resid  27 and name  HB#) 2.0 0.5 2.0 
assign (resid   28 and name   HN) (resid  29 and name  HD1#) 2.0 0.5 3.5
assign (resid   28 and name   HN) (resid  29 and name  HG1#) 2.0 0.5 3.5

!I29
assign (resid   29 and name   HN) (resid  70 and name  HA) 2.0 0.5 0.7
assign (resid   29 and name   HN) (resid  28 and name  HD#) 2.0 0.5 0.7
assign (resid   29 and name   HN) (resid  28 and name  HN) 2.0 0.5 2.0
assign (resid   29 and name   HN) (resid  98 and name  HN) 2.0 0.5 3.5
assign (resid   29 and name   HN) (resid  69 and name  HN) 2.0 0.5 1.3
assign (resid   29 and name   HN) (resid  70 and name  HN) 2.0 0.5 2.0
assign (resid   29 and name   HN) (resid  28 and name  HB#) 2.0 0.5 2.0
assign (resid   29 and name   HN) (resid  29 and name  HG11) 2.0 0.5 1.3
assign (resid   29 and name   HN) (resid  71 and name  HG2#) 2.0 0.5 3.5
assign (resid   29 and name   HN) (resid  29 and name  HB) 2.0 0.5 0.7
assign (resid   29 and name   HN) (resid  29 and name  HG2#) 2.0 0.5 3.5
assign (resid   29 and name   HN) (resid  32 and name  HD1#) 2.0 0.5 3.5
assign (resid   29 and name   HN) (resid  29 and name  HD1#) 2.0 0.5 2.0 


!G30
assign (resid   30 and name   HN) (resid  29 and name  HN) 2.0 0.5 2.0
assign (resid   30 and name   HN) (resid  96 and name  HN) 2.0 0.5 1.3
assign (resid   30 and name   HN) (resid  95 and name  HA) 2.0 0.5 3.5
assign (resid   30 and name   HN) (resid  30 and name  HA1) 2.0 0.5 0.7
assign (resid   30 and name   HN) (resid  30 and name  HA2) 2.0 0.5 0.7
assign (resid   30 and name   HN) (resid  96 and name  HB1) 2.0 0.5 1.3
assign (resid   30 and name   HN) (resid  96 and name  HB2) 2.0 0.5 3.5
assign (resid   30 and name   HN) (resid  29 and name  HG2#) 2.0 0.5 1.3
assign (resid   30 and name   HN) (resid  29 and name  HD1#) 2.0 0.5 3.5

!G31
assign (resid   31 and name   HN) (resid  30 and name  HN) 2.0 0.5 2.5
assign (resid   31 and name   HN) (resid  32 and name  HN) 2.0 0.5 0.7
assign (resid   31 and name   HN) (resid  68 and name  HN) 2.0 0.5 3.5 
assign (resid   31 and name   HN) (resid  30 and name  HA1) 2.0 0.5 0.7
assign (resid   31 and name   HN) (resid  30 and name  HA2) 2.0 0.5 0.7
assign (resid   31 and name   HN) (resid  68 and name  HB1) 2.0 0.5 2.0
assign (resid   31 and name   HN) (resid  68 and name  HB2) 2.0 0.5 2.0
assign (resid   31 and name   HN) (resid  32 and name  HG#) 2.0 0.5 2.0
assign (resid   31 and name   HN) (resid  32 and name  HB#) 2.0 0.5 3.5

!L32
assign (resid   32 and name   HN) (resid  67 and name  HN) 2.0 0.5 3.5
assign (resid   32 and name   HN) (resid  32 and name  HB#) 2.0 0.5 0.7
assign (resid   32 and name   HN) (resid  32 and name  HG) 2.0 0.5 0.7
assign (resid   32 and name   HN) (resid  68 and name  HA) 2.0 0.5 1.3


!S33
assign (resid   33 and name   HN) (resid  32 and name  HN) 2.0 0.5 2.5
assign (resid   33 and name   HN) (resid  35 and name  HN) 2.0 0.5 3.0
assign (resid   33 and name   HN) (resid  36 and name  HN) 2.0 0.5 1.3
assign (resid   33 and name   HN) (resid  34 and name  HA) 2.0 0.5 3.5
assign (resid   33 and name   HN) (resid  32 and name  HA) 2.0 0.5 0.7
assign (resid   33 and name   HN) (resid  36 and name  HA) 2.0 0.5 3.5
assign (resid   33 and name   HN) (resid  33 and name  HB1) 2.0 0.5 0.7
assign (resid   33 and name   HN) (resid  33 and name  HB2) 2.0 0.5 1.3
assign (resid   33 and name   HN) (resid  36 and name  HB) 2.0 0.5 2.0 
assign (resid   33 and name   HN) (resid  91 and name  HB#) 2.0 0.5 4.0
assign (resid   33 and name   HN) (resid  93 and name  HG#) 2.0 0.5 3.5
assign (resid   33 and name   HN) (resid  90 and name  HD1#) 2.0 0.5 2.0
assign (resid   33 and name   HN) (resid  32 and name  HD1#) 2.0 0.5 3.5
assign (resid   33 and name   HN) (resid  32 and name  HD2#) 2.0 0.5 3.5
assign (resid   33 and name   HN) (resid  36 and name  HG2#) 2.0 0.5 2.0 

!W34
assign (resid   34 and name   HN) (resid  34 and name  HE1) 2.0 0.5 2.0
assign (resid   34 and name   HN) (resid  33 and name  HN) 2.0 0.5 2.0
assign (resid   34 and name   HN) (resid  34 and name  HD1) 2.0 0.5 0.7
assign (resid   34 and name   HN) (resid  33 and name  HA) 2.0 0.5 0.7
assign (resid   34 and name   HN) (resid  34 and name  HA) 2.0 0.5 0.7
assign (resid   34 and name   HN) (resid  33 and name  HB#) 2.0 0.5 1.3
assign (resid   34 and name   HN) (resid  35 and name  HA) 2.0 0.5 3.5
assign (resid   34 and name   HN) (resid  34 and name  HB1) 2.0 0.5 0.7
assign (resid   34 and name   HN) (resid  34 and name  HB2) 2.0 0.5 1.3
assign (resid   34 and name   HN) (resid  35 and name  HB#) 2.0 0.5 3.5
assign (resid   34 and name   HN) (resid  35 and name  HG#) 2.0 0.5 2.0

!W34HE1
assign (resid   34 and name   HE1) (resid  34 and name  HH2) 2.0 0.5 3.5
assign (resid   34 and name   HE1) (resid  34 and name  HD1) 2.0 0.5 0.7
assign (resid   34 and name   HE1) (resid  34 and name  HB1) 2.0 0.5 3.5
assign (resid   34 and name   HE1) (resid  34 and name  HB2) 2.0 0.5 3.5
assign (resid   34 and name   HE1) (resid  33 and name  HB2) 2.0 0.5 3.5
assign (resid   34 and name   HE1) (resid  35 and name  HB#) 2.0 0.5 2.0
assign (resid   34 and name   HE1) (resid  35 and name  HG#) 2.0 0.5 2.0
assign (resid   34 and name   HE1) (resid  34 and name  HZ2) 2.0 0.5 0.7

!Q35
assign (resid   35 and name   HN) (resid  34 and name  HN) 2.0 0.5 1.3
assign (resid   35 and name   HN) (resid  36 and name  HN) 2.0 0.5 2.5
assign (resid   35 and name   HN) (resid  34 and name  HD1) 2.0 0.5 2.0
assign (resid   35 and name   HN) (resid  35 and name  HE21) 2.0 0.5 3.5
assign (resid   35 and name   HN) (resid  35 and name  HA) 2.0 0.5 1.3
assign (resid   35 and name   HN) (resid  33 and name  HB#) 2.0 0.5 1.3
assign (resid   35 and name   HN) (resid  34 and name  HB#) 2.0 0.5 2.0
assign (resid   35 and name   HN) (resid  35 and name  HG#) 2.0 0.5 0.7
assign (resid   35 and name   HN) (resid  35 and name  HB#) 2.0 0.5 1.3
assign (resid   35 and name   HN) (resid  36 and name  HG2#) 2.0 0.5 3.5 

!Q35HE21
assign (resid   35 and name   HE21) (resid  35 and name  HE22) 2.0 0.5 0.7
assign (resid   35 and name   HE21) (resid  35 and name  HA) 2.0 0.5 3.5
assign (resid   35 and name   HE21) (resid  35 and name  HG#) 2.0 0.5 0.7
assign (resid   35 and name   HE21) (resid  35 and name  HB#) 2.0 0.5 2.0

!Q35HE22
assign (resid   35 and name   HE22) (resid  35 and name  HA) 2.0 0.5 3.5

!T36
assign (resid   36 and name   HN) (resid  37 and name  HN) 2.0 0.5 3.5
assign (resid   36 and name   HN) (resid  36 and name  HB) 2.0 0.5 0.7
assign (resid   36 and name   HN) (resid  33 and name  HB#) 2.0 0.5 3.5
assign (resid   36 and name   HN) (resid  35 and name  HA) 2.0 0.5 1.3
assign (resid   36 and name   HN) (resid  34 and name  HN) 2.0 0.5 2.0
assign (resid   36 and name   HN) (resid  35 and name  HB#) 2.0 0.5 0.7
assign (resid   36 and name   HN) (resid  36 and name  HG2#) 2.0 0.5 2.0
assign (resid   36 and name   HN) (resid  32 and name  HB#) 2.0 0.5 3.5
assign (resid   36 and name   HN) (resid  32 and name  HD2#) 2.0 0.5 3.5


!S37

assign (resid   37 and name   HN) (resid  56 and name  HG2#) 2.0 0.5 3.5
assign (resid   37 and name   HN) (resid  56 and name  HG1#) 2.0 0.5 3.5
assign (resid   37 and name   HN) (resid  36 and name  HG2#) 2.0 0.5 1.3

!P38


!D39
assign (resid   39 and name   HN) (resid  42 and name  HN) 2.0 0.5 3.5
assign (resid   39 and name   HN) (resid  37 and name  HN) 2.0 0.5 3.5
assign (resid   39 and name   HN) (resid  41 and name  HN) 2.0 0.5 2.0
assign (resid   39 and name   HN) (resid  37 and name  HA) 2.0 0.5 2.0
assign (resid   39 and name   HN) (resid  38 and name  HA) 2.0 0.5 1.3
assign (resid   39 and name   HN) (resid  37 and name  HB#) 2.0 0.5 2.0
assign (resid   39 and name   HN) (resid  38 and name  HD#) 2.0 0.5 2.0
assign (resid   39 and name   HN) (resid  38 and name  HG#) 2.0 0.5 0.7
assign (resid   39 and name   HN) (resid  38 and name  HB#) 2.0 0.5 1.3
assign (resid   39 and name   HN) (resid  39 and name  HB1) 2.0 0.5 1.3
assign (resid   39 and name   HN) (resid  39 and name  HB2) 2.0 0.5 0.7
assign (resid   39 and name   HN) (resid  36 and name  HG2#) 2.0 0.5 4.0


!S40
assign (resid   40 and name   HN) (resid  41 and name  HN) 2.0 0.5 0.7
assign (resid   40 and name   HN) (resid  42 and name  HN) 2.0 0.5 2.0
assign (resid   40 and name   HN) (resid  37 and name  HN) 2.0 0.5 1.3
assign (resid   40 and name   HN) (resid  40 and name  HB1) 2.0 0.5 1.3
assign (resid   40 and name   HN) (resid  40 and name  HB2) 2.0 0.5 0.7
assign (resid   40 and name   HN) (resid  37 and name  HA) 2.0 0.5 3.5
assign (resid   40 and name   HN) (resid  39 and name  HA) 2.0 0.5 1.3
assign (resid   40 and name   HN) (resid  41 and name  HB#) 2.0 0.5 3.5
assign (resid   40 and name   HN) (resid  36 and name  HG2#) 2.0 0.5 4.0
assign (resid   40 and name   HN) (resid  39 and name  HB1) 2.0 0.5 1.3
assign (resid   40 and name   HN) (resid  39 and name  HB2) 2.0 0.5 1.3
assign (resid   40 and name   HN) (resid  38 and name  HD1) 2.0 0.5 3.5
assign (resid   40 and name   HN) (resid  38 and name  HD2) 2.0 0.5 3.5
assign (resid   40 and name   HN) (resid  42 and name  HB1) 2.0 0.5 3.5
assign (resid   40 and name   HN) (resid  42 and name  HB2) 2.0 0.5 3.5
assign (resid   40 and name   HN) (resid  41 and name  HG) 2.0 0.5 3.5

!L41
assign (resid   41 and name   HN) (resid  42 and name  HN) 2.0 0.5 0.7
assign (resid   41 and name   HN) (resid  43 and name  HN) 2.0 0.5 2.0
assign (resid   41 and name   HN) (resid  38 and name  HA) 2.0 0.5 1.3
assign (resid   41 and name   HN) (resid  40 and name  HB#) 2.0 0.5 1.3 
assign (resid   41 and name   HN) (resid  37 and name  HA) 2.0 0.5 3.5
assign (resid   41 and name   HN) (resid  39 and name  HB1) 2.0 0.5 3.5
assign (resid   41 and name   HN) (resid  39 and name  HB2) 2.0 0.5 3.5
assign (resid   41 and name   HN) (resid  41 and name  HB1) 2.0 0.5 0.7 
assign (resid   41 and name   HN) (resid  41 and name  HB2) 2.0 0.5 1.3
assign (resid   41 and name   HN) (resid  38 and name  HB1) 2.0 0.5 3.5
assign (resid   41 and name   HN) (resid  38 and name  HB2) 2.0 0.5 3.5
assign (resid   41 and name   HN) (resid  41 and name  HD2#) 2.0 0.5 3.5
assign (resid   41 and name   HN) (resid  36 and name  HG2#) 2.0 0.5 3.5
assign (resid   41 and name   HN) (resid  56 and name  HG2#) 2.0 0.5 3.5
assign (resid   41 and name   HN) (resid  41 and name  HG) 2.0 0.5 1.3

!R42
assign (resid   42 and name   HN) (resid  43 and name  HN) 2.0 0.5 0.7
assign (resid   42 and name   HN) (resid  42 and name  HA) 2.0 0.5 0.7
assign (resid   42 and name   HN) (resid  42 and name  HB#) 2.0 0.5 0.7
assign (resid   42 and name   HN) (resid  42 and name  HG#) 2.0 0.5 2.0
assign (resid   42 and name   HN) (resid  42 and name  HE#) 2.0 0.5 3.5
assign (resid   42 and name   HN) (resid  41 and name  HD1#) 2.0 0.5 3.5
assign (resid   42 and name   HN) (resid  51 and name  HD1#) 2.0 0.5 3.5
assign (resid   42 and name   HN) (resid  38 and name  HA) 2.0 0.5 2.0


!D43
assign (resid   43 and name   HN) (resid  43 and name  HA) 2.0 0.5 0.7
assign (resid   43 and name   HN) (resid  43 and name  HB#) 2.0 0.5 0.7
assign (resid   43 and name   HN) (resid  44 and name  HB#) 2.0 0.5 3.5
assign (resid   43 and name   HN) (resid  39 and name  HB1) 2.0 0.5 3.5
assign (resid   43 and name   HN) (resid  39 and name  HB2) 2.0 0.5 3.5

!Y44
assign (resid   44 and name   HN) (resid  46 and name  HN) 2.0 0.5 2.0
assign (resid   44 and name   HN) (resid  43 and name  HN) 2.0 0.5 0.7
assign (resid   44 and name   HN) (resid  45 and name  HN) 2.0 0.5 0.7
assign (resid   44 and name   HN) (resid  45 and name  HD#) 2.0 0.5 2.0
assign (resid   44 and name   HN) (resid  43 and name  HA) 2.0 0.5 2.0
assign (resid   44 and name   HN) (resid  40 and name  HA) 2.0 0.5 2.5
assign (resid   44 and name   HN) (resid  44 and name  HA) 2.0 0.5 0.7
assign (resid   44 and name   HN) (resid  41 and name  HA) 2.0 0.5 1.3
assign (resid   44 and name   HN) (resid  42 and name  HA) 2.0 0.5 3.5
assign (resid   44 and name   HN) (resid  44 and name  HB1) 2.0 0.5 1.3
assign (resid   44 and name   HN) (resid  44 and name  HB2) 2.0 0.5 1.3
assign (resid   44 and name   HN) (resid  43 and name  HB1) 2.0 0.5 1.3
assign (resid   44 and name   HN) (resid  43 and name  HB2) 2.0 0.5 1.3


!F45
assign (resid   45 and name   HN) (resid  48 and name  HN) 2.0 0.5 3.5
assign (resid   45 and name   HN) (resid  47 and name  HN) 2.0 0.5 2.0
assign (resid   45 and name   HN) (resid  44 and name  HN) 2.0 0.5 0.7
assign (resid   45 and name   HN) (resid  46 and name  HN) 2.0 0.5 1.3
assign (resid   45 and name   HN) (resid  41 and name  HA) 2.0 0.5 2.0
assign (resid   45 and name   HN) (resid  44 and name  HA) 2.0 0.5 2.0
assign (resid   45 and name   HN) (resid  45 and name  HB1) 2.0 0.5 1.3
assign (resid   45 and name   HN) (resid  45 and name  HB2) 2.0 0.5 1.3
assign (resid   45 and name   HN) (resid  44 and name  HB#) 2.0 0.5 1.3
assign (resid   45 and name   HN) (resid  41 and name  HB#) 2.0 0.5 4.0
assign (resid   45 and name   HN) (resid  42 and name  HG#) 2.0 0.5 4.0
assign (resid   45 and name   HN) (resid  51 and name  HD1#) 2.0 0.5 1.3

!S46
assign (resid   46 and name   HN) (resid  49 and name  HN) 2.0 0.5 3.5
assign (resid   46 and name   HN) (resid  42 and name  HN) 2.0 0.5 3.5
assign (resid   46 and name   HN) (resid  44 and name  HN) 2.0 0.5 2.0
assign (resid   46 and name   HN) (resid  44 and name  HN) 2.0 0.5 2.0
assign (resid   46 and name   HN) (resid  47 and name  HN) 2.0 0.5 0.7
assign (resid   46 and name   HN) (resid  48 and name  HN) 2.0 0.5 3.5
assign (resid   46 and name   HN) (resid  43 and name  HA) 2.0 0.5 2.0
assign (resid   46 and name   HN) (resid  46 and name  HB#) 2.0 0.5 1.3 
assign (resid   46 and name   HN) (resid  42 and name  HA) 2.0 0.5 2.0
assign (resid   46 and name   HN) (resid  45 and name  HB1) 2.0 0.5 2.0
assign (resid   46 and name   HN) (resid  45 and name  HB2) 2.0 0.5 2.0
assign (resid   46 and name   HN) (resid  44 and name  HB1) 2.0 0.5 3.5
assign (resid   46 and name   HN) (resid  44 and name  HB2) 2.0 0.5 3.5
assign (resid   46 and name   HN) (resid  47 and name  HG1) 2.0 0.5 3.5
assign (resid   46 and name   HN) (resid  47 and name  HG2) 2.0 0.5 3.5 
assign (resid   46 and name   HN) (resid  51 and name  HG1#) 2.0 0.5 3.5
assign (resid   46 and name   HN) (resid  51 and name  HB) 2.0 0.5 3.5
assign (resid   46 and name   HN) (resid  47 and name  HB1) 2.0 0.5 3.5
assign (resid   46 and name   HN) (resid  47 and name  HB2) 2.0 0.5 3.5
assign (resid   46 and name   HN) (resid  51 and name  HD1#) 2.0 0.5 1.3


!K47
assign (resid   47 and name   HN) (resid  48 and name  HN) 2.0 0.5 0.7
assign (resid   47 and name   HN) (resid  44 and name  HN) 2.0 0.5 3.5
assign (resid   47 and name   HN) (resid  47 and name  HA) 2.0 0.5 0.7
assign (resid   47 and name   HN) (resid  46 and name  HB#) 2.0 0.5 2.0
assign (resid   47 and name   HN) (resid  48 and name  HB#) 2.0 0.5 3.5
assign (resid   47 and name   HN) (resid  47 and name  HB#) 2.0 0.5 0.7
assign (resid   47 and name   HN) (resid  47 and name  HG1) 2.0 0.5 1.3
assign (resid   47 and name   HN) (resid  47 and name  HG2) 2.0 0.5 1.3
assign (resid   47 and name   HN) (resid  51 and name  HD1#) 2.0 0.5 1.3

!F48
assign (resid   48 and name   HN) (resid  49 and name  HN) 2.0 0.5 0.7
assign (resid   48 and name   HN) (resid  48 and name  HB#) 2.0 0.5 0.7
assign (resid   48 and name   HN) (resid  47 and name  HB#) 2.0 0.5 1.3
assign (resid   48 and name   HN) (resid  51 and name  HD1#) 2.0 0.5 3.5
assign (resid   48 and name   HN) (resid  82 and name  HG2#) 2.0 0.5 3.5

!G49
assign (resid   49 and name   HN) (resid  50 and name  HN) 2.0 0.5 2.0
assign (resid   49 and name   HN) (resid  47 and name  HN) 2.0 0.5 2.0
assign (resid   49 and name   HN) (resid  51 and name  HN) 2.0 0.5 4.0
assign (resid   49 and name   HN) (resid  51 and name  HG1#) 2.0 0.5 3.5
assign (resid   49 and name   HN) (resid  51 and name  HD1#) 2.0 0.5 3.5
assign (resid   49 and name   HN) (resid  48 and name  HB#) 2.0 0.5 1.3 
assign (resid   49 and name   HN) (resid  45 and name  HB#) 2.0 0.5 3.5 
assign (resid   49 and name   HN) (resid  45 and name  HA) 2.0 0.5 3.5 
assign (resid   49 and name   HN) (resid  49 and name  HA1) 2.0 0.5 0.7
assign (resid   49 and name   HN) (resid  49 and name  HA2) 2.0 0.5 0.7

!E50
assign (resid   50 and name   HN) (resid  51 and name  HN) 2.0 0.5 2.0
assign (resid   50 and name   HN) (resid  75 and name  HN) 2.0 0.5 3.5
assign (resid   50 and name   HN) (resid  74 and name  HN) 2.0 0.5 3.5
assign (resid   50 and name   HN) (resid  46 and name  HA) 2.0 0.5 3.5
assign (resid   50 and name   HN) (resid  50 and name  HA) 2.0 0.5 0.7
assign (resid   50 and name   HN) (resid  49 and name  HA1) 2.0 0.5 0.7
assign (resid   50 and name   HN) (resid  49 and name  HA2) 2.0 0.5 0.7
assign (resid   50 and name   HN) (resid  50 and name  HG#) 2.0 0.5 2.0
assign (resid   50 and name   HN) (resid  50 and name  HB1) 2.0 0.5 0.7 
assign (resid   50 and name   HN) (resid  50 and name  HB2) 2.0 0.5 0.7 


!I51
assign (resid   51 and name   HN) (resid  50 and name  HA) 2.0 0.5 0.7
assign (resid   51 and name   HN) (resid  50 and name  HB#) 2.0 0.5 2.0
assign (resid   51 and name   HN) (resid  50 and name  HG1) 2.0 0.5 0.7 
assign (resid   51 and name   HN) (resid  50 and name  HG2) 2.0 0.5 0.7  
assign (resid   51 and name   HN) (resid  51 and name  HB) 2.0 0.5 0.7
assign (resid   51 and name   HN) (resid  51 and name  HG11) 2.0 0.5 0.7
assign (resid   51 and name   HN) (resid  51 and name  HG2#) 2.0 0.5 3.5
assign (resid   51 and name   HN) (resid  51 and name  HD1#) 2.0 0.5 3.5
assign (resid   51 and name   HN) (resid  74 and name  HB#) 2.0 0.5 3.5


!R52
assign (resid   52 and name   HN) (resid  74 and name  HN) 2.0 0.5 0.7 
assign (resid   52 and name   HN) (resid  72 and name  HN) 2.0 0.5 3.5
assign (resid   52 and name   HN) (resid  53 and name  HN) 2.0 0.5 0.7
assign (resid   52 and name   HN) (resid  51 and name  HA) 2.0 0.5 0.7
assign (resid   52 and name   HN) (resid  52 and name  HD#) 2.0 0.5 3.5
assign (resid   52 and name   HN) (resid  72 and name  HG2#) 2.0 0.5 2.0
assign (resid   52 and name   HN) (resid  53 and name  HB#) 2.0 0.5 3.5
assign (resid   52 and name   HN) (resid  51 and name  HB) 2.0 0.5 2.0
assign (resid   52 and name   HN) (resid  51 and name  HG2#) 2.0 0.5 0.7
assign (resid   52 and name   HN) (resid  52 and name  HB1) 2.0 0.5 0.7
assign (resid   52 and name   HN) (resid  52 and name  HB2) 2.0 0.5 0.7
assign (resid   52 and name   HN) (resid  52 and name  HG#) 2.0 0.5 3.5
assign (resid   52 and name   HN) (resid  51 and name  HG11) 2.0 0.5 3.5

!E53
assign (resid   53 and name   HN) (resid  74 and name  HN) 2.0 0.5 3.5 
assign (resid   53 and name   HN) (resid  73 and name  HN) 2.0 0.5 3.5
assign (resid   53 and name   HN) (resid  72 and name  HN) 2.0 0.5 1.3
assign (resid   53 and name   HN) (resid  54 and name  HN) 2.0 0.5 2.0
assign (resid   53 and name   HN) (resid  72 and name  HA) 2.0 0.5 3.5
assign (resid   53 and name   HN) (resid  72 and name  HB) 2.0 0.5 0.7 
assign (resid   53 and name   HN) (resid  54 and name  HB#) 2.0 0.5 3.5
assign (resid   53 and name   HN) (resid  53 and name  HB1) 2.0 0.5 1.3
assign (resid   53 and name   HN) (resid  53 and name  HB2) 2.0 0.5 1.3
assign (resid   53 and name   HN) (resid  53 and name  HG#) 2.0 0.5 3.5
assign (resid   53 and name   HN) (resid  52 and name  HB1) 2.0 0.5 1.3
assign (resid   53 and name   HN) (resid  52 and name  HB2) 2.0 0.5 1.3
assign (resid   53 and name   HN) (resid  52 and name  HG#) 2.0 0.5 2.0
assign (resid   53 and name   HN) (resid  51 and name  HG11) 2.0 0.5 3.5
assign (resid   53 and name   HN) (resid  51 and name  HG2#) 2.0 0.5 0.7
assign (resid   53 and name   HN) (resid  71 and name  HG1#) 2.0 0.5 2.0
assign (resid   53 and name   HN) (resid  72 and name  HG2#) 2.0 0.5 2.0

!C54
assign (resid   54 and name   HN) (resid  55 and name  HN) 2.0 0.5 2.0
assign (resid   54 and name   HN) (resid  72 and name  HN) 2.0 0.5 3.5
assign (resid   54 and name   HN) (resid  42 and name  HE#) 2.0 0.5 3.5
assign (resid   54 and name   HN) (resid  54 and name  HB#) 2.0 0.5 1.3 
assign (resid   54 and name   HN) (resid  53 and name  HB1) 2.0 0.5 2.0
assign (resid   54 and name   HN) (resid  53 and name  HB2) 2.0 0.5 2.0
assign (resid   54 and name   HN) (resid  51 and name  HG2#) 2.0 0.5 3.5

!M55
assign (resid   55 and name   HN) (resid  54 and name  HA) 2.0 0.5 0.7
assign (resid   55 and name   HN) (resid  54 and name  HB#) 2.0 0.5 1.3
assign (resid   55 and name   HN) (resid  55 and name  HG#) 2.0 0.5 3.5
assign (resid   55 and name   HN) (resid  55 and name  HB1) 2.0 0.5 1.3
assign (resid   55 and name   HN) (resid  55 and name  HB2) 2.0 0.5 1.3
assign (resid   55 and name   HN) (resid  71 and name  HG1#) 2.0 0.5 4.0
assign (resid   55 and name   HN) (resid  41 and name  HD1#) 2.0 0.5 3.5
assign (resid   55 and name   HN) (resid  71 and name  HG2#) 2.0 0.5 3.5

!V56
assign (resid   56 and name   HN) (resid  57 and name  HN) 2.0 0.5 2.0
assign (resid   56 and name   HN) (resid  55 and name  HN) 2.0 0.5 2.0
assign (resid   56 and name   HN) (resid  56 and name  HA) 2.0 0.5 1.3
assign (resid   56 and name   HN) (resid  69 and name  HA#) 2.0 0.5 3.5
assign (resid   56 and name   HN) (resid  55 and name  HG#) 2.0 0.5 1.3
assign (resid   56 and name   HN) (resid  56 and name  HB) 2.0 0.5 0.7
assign (resid   56 and name   HN) (resid  55 and name  HB1) 2.0 0.5 2.0
assign (resid   56 and name   HN) (resid  55 and name  HB2) 2.0 0.5 2.0
assign (resid   56 and name   HN) (resid  38 and name  HB#) 2.0 0.5 0.7 
assign (resid   56 and name   HN) (resid  38 and name  HD#) 2.0 0.5 2.0 
assign (resid   56 and name   HN) (resid  56 and name  HG2#) 2.0 0.5 0.7


!M57
assign (resid   57 and name   HN) (resid  70 and name  HN) 2.0 0.5 3.5
assign (resid   57 and name   HN) (resid  56 and name  HA) 2.0 0.5 0.7
assign (resid   57 and name   HN) (resid  56 and name  HB) 2.0 0.5 2.0
assign (resid   57 and name   HN) (resid  56 and name  HG1#) 2.0 0.5 0.7
assign (resid   57 and name   HN) (resid  56 and name  HG2#) 2.0 0.5 2.0
assign (resid   57 and name   HN) (resid  32 and name  HD1#) 2.0 0.5 3.5
assign (resid   57 and name   HN) (resid  57 and name  HB#) 2.0 0.5 1.3 
assign (resid   57 and name   HN) (resid  57 and name  HG#) 2.0 0.5 1.3 
assign (resid   57 and name   HN) (resid  58 and name  HB#) 2.0 0.5 3.5

!R58

!D59
assign (resid   59 and name   HN) (resid  63 and name  HN) 2.0 0.5 2.0 
assign (resid   59 and name   HN) (resid  62 and name  HN) 2.0 0.5 3.5 
assign (resid   59 and name   HN) (resid  61 and name  HN) 2.0 0.5 3.5 
assign (resid   59 and name   HN) (resid  65 and name  HN) 2.0 0.5 3.5 
assign (resid   59 and name   HN) (resid  60 and name  HD#) 2.0 0.5 2.0
assign (resid   59 and name   HN) (resid  59 and name  HB1) 2.0 0.5 1.3 
assign (resid   59 and name   HN) (resid  59 and name  HB2) 2.0 0.5 1.3 
assign (resid   59 and name   HN) (resid  58 and name  HB#) 2.0 0.5 1.3 
assign (resid   59 and name   HN) (resid  58 and name  HG#) 2.0 0.5 2.0 
assign (resid   59 and name   HN) (resid  59 and name  HA) 2.0 0.5 0.7

!P60


!T61
assign (resid   61 and name   HN) (resid  63 and name  HN) 2.0 0.5 1.3
assign (resid   61 and name   HN) (resid  61 and name  HA) 2.0 0.5 0.7
assign (resid   61 and name   HN) (resid  62 and name  HA) 2.0 0.5 3.5 
assign (resid   61 and name   HN) (resid  60 and name  HD#) 2.0 0.5 1.3 
assign (resid   61 and name   HN) (resid  63 and name  HA) 2.0 0.5 3.5  
assign (resid   61 and name   HN) (resid  59 and name  HB1) 2.0 0.5 2.0
assign (resid   61 and name   HN) (resid  59 and name  HB2) 2.0 0.5 2.0
assign (resid   61 and name   HN) (resid  61 and name  HG2#) 2.0 0.5 0.7

!T62
assign (resid   62 and name   HN) (resid  61 and name  HN) 2.0 0.5 0.7
assign (resid   62 and name   HN) (resid  64 and name  HN) 2.0 0.5 2.0
assign (resid   62 and name   HN) (resid  62 and name  HA) 2.0 0.5 1.3
assign (resid   62 and name   HN) (resid  59 and name  HB1) 2.0 0.5 2.0 
assign (resid   62 and name   HN) (resid  59 and name  HB2) 2.0 0.5 2.0
assign (resid   62 and name   HN) (resid  62 and name  HG2#) 2.0 0.5 0.7
assign (resid   62 and name   HN) (resid  61 and name  HG2#) 2.0 0.5 2.0

!K63
assign (resid   63 and name   HN) (resid  62 and name  HA) 2.0 0.5 1.3
assign (resid   63 and name   HN) (resid  63 and name  HA) 2.0 0.5 0.7
assign (resid   63 and name   HN) (resid  63 and name  HB#) 2.0 0.5 1.3
assign (resid   63 and name   HN) (resid  63 and name  HG#) 2.0 0.5 0.7
assign (resid   63 and name   HN) (resid  63 and name  HD#) 2.0 0.5 1.3
assign (resid   63 and name   HN) (resid  63 and name  HE#) 2.0 0.5 2.0

!R64
assign (resid   64 and name   HN) (resid  63 and name  HN) 2.0 0.5 0.7
assign (resid   64 and name   HN) (resid  59 and name  HN) 2.0 0.5 2.0 
assign (resid   64 and name   HN) (resid  64 and name  HB#) 2.0 0.5 0.7
assign (resid   64 and name   HN) (resid  64 and name  HG#) 2.0 0.5 0.7
assign (resid   64 and name   HN) (resid  63 and name  HB#) 2.0 0.5 2.0
assign (resid   64 and name   HN) (resid  63 and name  HG#) 2.0 0.5 2.0
assign (resid   64 and name   HN) (resid  59 and name  HB#) 2.0 0.5 1.3 
assign (resid   64 and name   HN) (resid  58 and name  HB#) 2.0 0.5 3.5

!S65
assign (resid   65 and name   HN) (resid  65 and name  HB#) 2.0 0.5 0.7
assign (resid   65 and name   HN) (resid  64 and name  HB#) 2.0 0.5 2.0

!R66

!G67
assign (resid   67 and name   HN) (resid  66 and name  HN) 2.0 0.5 0.7 
assign (resid   67 and name   HN) (resid  65 and name  HN) 2.0 0.5 3.5
assign (resid   67 and name   HN) (resid  68 and name  HN) 2.0 0.5 0.7 
assign (resid   67 and name   HN) (resid  65 and name  HA) 2.0 0.5 2.0
assign (resid   67 and name   HN) (resid  66 and name  HA) 2.0 0.5 1.3
assign (resid   67 and name   HN) (resid  67 and name  HA#) 2.0 0.5 0.7
assign (resid   67 and name   HN) (resid  66 and name  HB#) 2.0 0.5 2.0
assign (resid   67 and name   HN) (resid  66 and name  HG#) 2.0 0.5 3.5

!F68


!G69
assign (resid   69 and name   HN) (resid  70 and name  HN) 2.0 0.5 2.0
assign (resid   69 and name   HN) (resid  57 and name  HN) 2.0 0.5 3.5
assign (resid   69 and name   HN) (resid  68 and name  HD#) 2.0 0.5 1.3
assign (resid   69 and name   HN) (resid  28 and name  HE#) 2.0 0.5 2.0
assign (resid   69 and name   HN) (resid  68 and name  HA) 2.0 0.5 0.7
assign (resid   69 and name   HN) (resid  68 and name  HB#) 2.0 0.5 1.3
assign (resid   69 and name   HN) (resid  69 and name  HA1) 2.0 0.5 0.7
assign (resid   69 and name   HN) (resid  69 and name  HA2) 2.0 0.5 0.7
assign (resid   69 and name   HN) (resid  29 and name  HB) 2.0 0.5 1.3
assign (resid   69 and name   HN) (resid  29 and name  HG1#) 2.0 0.5 3.5
assign (resid   69 and name   HN) (resid  29 and name  HG2#) 2.0 0.5 3.5
assign (resid   69 and name   HN) (resid  32 and name  HD1#) 2.0 0.5 1.3
assign (resid   69 and name   HN) (resid  32 and name  HD2#) 2.0 0.5 3.5
assign (resid   69 and name   HN) (resid  41 and name  HD2#) 2.0 0.5 3.5


!F70
assign (resid   70 and name   HN) (resid  71 and name  HN) 2.0 0.5 2.0
assign (resid   70 and name   HN) (resid  55 and name  HN) 2.0 0.5 1.3
assign (resid   70 and name   HN) (resid  70 and name  HA) 2.0 0.5 1.3
assign (resid   70 and name   HN) (resid  69 and name  HA1) 2.0 0.5 0.7
assign (resid   70 and name   HN) (resid  69 and name  HA2) 2.0 0.5 0.7
assign (resid   70 and name   HN) (resid  56 and name  HA) 2.0 0.5 1.5
assign (resid   70 and name   HN) (resid  70 and name  HB1) 2.0 0.5 1.3
assign (resid   70 and name   HN) (resid  70 and name  HB2) 2.0 0.5 0.7
assign (resid   70 and name   HN) (resid  55 and name  HB#) 2.0 0.5 2.0
assign (resid   70 and name   HN) (resid  41 and name  HD1#) 2.0 0.5 2.0
assign (resid   70 and name   HN) (resid  32 and name  HD1#) 2.0 0.5 3.5 
assign (resid   70 and name   HN) (resid  71 and name  HB) 2.0 0.5 4.0
assign (resid   70 and name   HN) (resid  54 and name  HA) 2.0 0.5 3.5
assign (resid   70 and name   HN) (resid  55 and name  HG#) 2.0 0.5 2.0 

!V71
assign (resid   71 and name   HN) (resid  72 and name  HN) 2.0 0.5 3.5
assign (resid   71 and name   HN) (resid  73 and name  HN) 2.0 0.5 3.5
assign (resid   71 and name   HN) (resid  70 and name  HA) 2.0 0.5 0.7
assign (resid   71 and name   HN) (resid  71 and name  HG2#) 2.0 0.5 1.3
assign (resid   71 and name   HN) (resid  71 and name  HG1#) 2.0 0.5 2.5
assign (resid   71 and name   HN) (resid  70 and name  HB#) 2.0 0.5 0.7
assign (resid   71 and name   HN) (resid  26 and name  HD#) 2.0 0.5 3.5
assign (resid   71 and name   HN) (resid  26 and name  HG#) 2.0 0.5 2.0

!T72

assign (resid   72 and name   HN) (resid  71 and name  HA) 2.0 0.5 0.7
assign (resid   72 and name   HN) (resid  53 and name  HA) 2.0 0.5 3.5
assign (resid   72 and name   HN) (resid  72 and name  HB) 2.0 0.5 0.7
assign (resid   72 and name   HN) (resid  54 and name  HB1) 2.0 0.5 3.5
assign (resid   72 and name   HN) (resid  54 and name  HB2) 2.0 0.5 2.0
assign (resid   72 and name   HN) (resid  71 and name  HB) 2.0 0.5 2.0
assign (resid   72 and name   HN) (resid  72 and name  HG2#) 2.0 0.5 2.0
assign (resid   72 and name   HN) (resid  51 and name  HG2#) 2.0 0.5 2.0
assign (resid   72 and name   HN) (resid  71 and name  HG2#) 2.0 0.5 2.0
assign (resid   72 and name   HN) (resid  71 and name  HG1#) 2.0 0.5 0.7

!F73
assign (resid   73 and name   HN) (resid  71 and name  HN) 2.0 0.5 4.0
assign (resid   73 and name   HN) (resid  74 and name  HN) 2.0 0.5 3.5
assign (resid   73 and name   HN) (resid  73 and name  HD#) 2.0 0.5 0.7
assign (resid   73 and name   HN) (resid  72 and name  HA) 2.0 0.5 0.7
assign (resid   73 and name   HN) (resid  73 and name  HA) 2.0 0.5 0.7
assign (resid   73 and name   HN) (resid  51 and name  HG2#) 2.0 0.5 3.5
assign (resid   73 and name   HN) (resid  73 and name  HB2) 2.0 0.5 1.3
assign (resid   73 and name   HN) (resid  73 and name  HB1) 2.0 0.5 1.3
assign (resid   73 and name   HN) (resid  52 and name  HB#) 2.0 0.5 3.5
assign (resid   73 and name   HN) (resid  72 and name  HG2#) 2.0 0.5 0.7
assign (resid   73 and name   HN) (resid  71 and name  HG1#) 2.0 0.5 2.0 
assign (resid   73 and name   HN) (resid  27 and name  HG#) 2.0 0.5 3.5
assign (resid   73 and name   HN) (resid  26 and name  HB#) 2.0 0.5 3.5
assign (resid   73 and name   HN) (resid  51 and name  HG11) 2.0 0.5 3.5

!A74
assign (resid   74 and name   HN) (resid  75 and name  HN) 2.0 0.5 0.7
assign (resid   74 and name   HN) (resid  74 and name  HA) 2.0 0.5 0.7
assign (resid   74 and name   HN) (resid  75 and name  HB#) 2.0 0.5 3.5
assign (resid   74 and name   HN) (resid  73 and name  HB#) 2.0 0.5 1.3
assign (resid   74 and name   HN) (resid  74 and name  HB#) 2.0 0.5 0.7
assign (resid   74 and name   HN) (resid  51 and name  HG1#) 2.0 0.5 3.5
assign (resid   74 and name   HN) (resid  51 and name  HB) 2.0 0.5 4.0
assign (resid   74 and name   HN) (resid  52 and name  HB#) 2.0 0.5 3.5

!D75
assign (resid   75 and name   HN) (resid  75 and name  HA) 2.0 0.5 0.7
assign (resid   75 and name   HN) (resid  75 and name  HB1) 2.0 0.5 0.7
assign (resid   75 and name   HN) (resid  75 and name  HB2) 2.0 0.5 0.7
assign (resid   75 and name   HN) (resid  74 and name  HA) 2.0 0.5 0.7
assign (resid   75 and name   HN) (resid  74 and name  HB#) 2.0 0.5 1.3
assign (resid   75 and name   HN) (resid  74 and name  HA) 2.0 0.5 1.3
assign (resid   75 and name   HN) (resid  73 and name  HB1) 2.0 0.5 0.7 
assign (resid   75 and name   HN) (resid  73 and name  HB2) 2.0 0.5 2.0 
assign (resid   75 and name   HN) (resid  73 and name  HD#) 2.0 0.5 3.5

!P76

!A77
assign (resid   77 and name   HN) (resid  75 and name  HN) 2.0 0.5 3.5
assign (resid   77 and name   HN) (resid  79 and name  HN) 2.0 0.5 2.0
assign (resid   77 and name   HN) (resid  75 and name  HA) 2.0 0.5 2.0
assign (resid   77 and name   HN) (resid  77 and name  HA) 2.0 0.5 0.7
assign (resid   77 and name   HN) (resid  76 and name  HD#) 2.0 0.5 0.7
assign (resid   77 and name   HN) (resid  76 and name  HB2) 2.0 0.5 1.3
assign (resid   77 and name   HN) (resid  76 and name  HB1) 2.0 0.5 2.0
assign (resid   77 and name   HN) (resid  75 and name  HB1) 2.0 0.5 2.0
assign (resid   77 and name   HN) (resid  75 and name  HB2) 2.0 0.5 2.0
assign (resid   77 and name   HN) (resid  78 and name  HB#) 2.0 0.5 3.5
assign (resid   77 and name   HN) (resid  77 and name  HB#) 2.0 0.5 0.7
assign (resid   77 and name   HN) (resid  76 and name  HG#) 2.0 0.5 2.0

!S78
assign (resid   78 and name   HN) (resid  75 and name  HN) 2.0 0.5 2.5
assign (resid   78 and name   HN) (resid  77 and name  HN) 2.0 0.5 0.7
assign (resid   78 and name   HN) (resid  79 and name  HN) 2.0 0.5 0.7
assign (resid   78 and name   HN) (resid  80 and name  HN) 2.0 0.5 2.0
assign (resid   78 and name   HN) (resid  77 and name  HA) 2.0 0.5 1.3
assign (resid   78 and name   HN) (resid  76 and name  HA) 2.0 0.5 2.0
assign (resid   78 and name   HN) (resid  79 and name  HA) 2.0 0.5 3.5
assign (resid   78 and name   HN) (resid  78 and name  HB1) 2.0 0.5 1.3
assign (resid   78 and name   HN) (resid  78 and name  HB2) 2.0 0.5 0.7
assign (resid   78 and name   HN) (resid  75 and name  HB#) 2.0 0.5 1.3
assign (resid   78 and name   HN) (resid  81 and name  HD#) 2.0 0.5 3.5
assign (resid   78 and name   HN) (resid  76 and name  HB#) 2.0 0.5 4.0
assign (resid   78 and name   HN) (resid  79 and name  HG2#) 2.0 0.5 3.5
assign (resid   78 and name   HN) (resid  77 and name  HB#) 2.0 0.5 1.3
assign (resid   78 and name   HN) (resid  75 and name  HA) 2.0 0.5 3.5

!V79
assign (resid   79 and name   HN) (resid  75 and name  HN) 2.0 0.5 3.5
assign (resid   79 and name   HN) (resid  80 and name  HN) 2.0 0.5 0.7
assign (resid   79 and name   HN) (resid  78 and name  HA) 2.0 0.5 1.3
assign (resid   79 and name   HN) (resid  79 and name  HA) 2.0 0.5 0.7
assign (resid   79 and name   HN) (resid  77 and name  HA) 2.0 0.5 3.5
assign (resid   79 and name   HN) (resid  80 and name  HA) 2.0 0.5 3.5
assign (resid   79 and name   HN) (resid  73 and name  HB#) 2.0 0.5 2.0
assign (resid   79 and name   HN) (resid  80 and name  HB#) 2.0 0.5 3.5 
assign (resid   79 and name   HN) (resid  81 and name  HG#) 2.0 0.5 3.5 
assign (resid   79 and name   HN) (resid  77 and name  HB#) 2.0 0.5 3.5
assign (resid   79 and name   HN) (resid  79 and name  HB) 2.0 0.5 0.7
assign (resid   79 and name   HN) (resid  76 and name  HB1) 2.0 0.5 3.5 
assign (resid   79 and name   HN) (resid  76 and name  HB2) 2.0 0.5 3.5 
assign (resid   79 and name   HN) (resid  79 and name  HG2#) 2.0 0.5 0.7
assign (resid   79 and name   HN) (resid  79 and name  HG1#) 2.0 0.5 2.0
assign (resid   79 and name   HN) (resid  82 and name  HG2#) 2.0 0.5 3.5

!D80
assign (resid   80 and name   HN) (resid  83 and name  HN) 2.0 0.5 3.5
assign (resid   80 and name   HN) (resid  77 and name  HN) 2.0 0.5 3.5
assign (resid   80 and name   HN) (resid  81 and name  HN) 2.0 0.5 0.7
assign (resid   80 and name   HN) (resid  80 and name  HA) 2.0 0.5 0.7
assign (resid   80 and name   HN) (resid  77 and name  HA) 2.0 0.5 1.3
assign (resid   80 and name   HN) (resid  76 and name  HA) 2.0 0.5 3.5
assign (resid   80 and name   HN) (resid  78 and name  HA) 2.0 0.5 2.0
assign (resid   80 and name   HN) (resid  79 and name  HA) 2.0 0.5 1.3
assign (resid   80 and name   HN) (resid  78 and name  HB#) 2.0 0.5 3.5
assign (resid   80 and name   HN) (resid  80 and name  HB1) 2.0 0.5 0.7
assign (resid   80 and name   HN) (resid  80 and name  HB2) 2.0 0.5 1.3
assign (resid   80 and name   HN) (resid  79 and name  HB) 2.0 0.5 0.7
assign (resid   80 and name   HN) (resid  79 and name  HG1#) 2.0 0.5 2.0
assign (resid   80 and name   HN) (resid  79 and name  HG2#) 2.0 0.5 2.0
assign (resid   80 and name   HN) (resid  82 and name  HG2#) 2.0 0.5 3.5
assign (resid   80 and name   HN) (resid  77 and name  HB#) 2.0 0.5 3.5

!K81
assign (resid   81 and name   HN) (resid  78 and name  HN) 2.0 0.5 3.5
assign (resid   81 and name   HN) (resid  82 and name  HN) 2.0 0.5 0.7
assign (resid   81 and name   HN) (resid  83 and name  HN) 2.0 0.5 2.0
assign (resid   81 and name   HN) (resid  81 and name  HA) 2.0 0.5 0.7
assign (resid   81 and name   HN) (resid  78 and name  HA) 2.0 0.5 1.3 
assign (resid   81 and name   HN) (resid  79 and name  HA) 2.0 0.5 3.5
assign (resid   81 and name   HN) (resid  80 and name  HA) 2.0 0.5 1.3
assign (resid   81 and name   HN) (resid  81 and name  HE#) 2.0 0.5 3.5
assign (resid   81 and name   HN) (resid  78 and name  HB#) 2.0 0.5 3.5
assign (resid   81 and name   HN) (resid  80 and name  HB1) 2.0 0.5 1.3 
assign (resid   81 and name   HN) (resid  80 and name  HB2) 2.0 0.5 1.3 
assign (resid   81 and name   HN) (resid  81 and name  HB#) 2.0 0.5 0.7
assign (resid   81 and name   HN) (resid  79 and name  HB) 2.0 0.5 3.5
assign (resid   81 and name   HN) (resid  81 and name  HG1) 2.0 0.5 0.7 
assign (resid   81 and name   HN) (resid  81 and name  HG2) 2.0 0.5 1.3
assign (resid   81 and name   HN) (resid  82 and name  HG2#) 2.0 0.5 3.5 

!V82
assign (resid   82 and name   HN) (resid  83 and name  HN) 2.0 0.5 0.7
assign (resid   82 and name   HN) (resid  80 and name  HN) 2.0 0.5 2.0
assign (resid   82 and name   HN) (resid  79 and name  HA) 2.0 0.5 1.3
assign (resid   82 and name   HN) (resid  82 and name  HA) 2.0 0.5 0.7
assign (resid   82 and name   HN) (resid  82 and name  HG2#) 2.0 0.5 0.7
assign (resid   82 and name   HN) (resid  81 and name  HA) 2.0 0.5 1.3
assign (resid   82 and name   HN) (resid  78 and name  HA) 2.0 0.5 2.0

!L83
assign (resid   83 and name   HN) (resid  83 and name  HB1) 2.0 0.5 0.7
assign (resid   83 and name   HN) (resid  83 and name  HG) 2.0 0.5 2.0
assign (resid   83 and name   HN) (resid  83 and name  HB2) 2.0 0.5 0.7
assign (resid   83 and name   HN) (resid  83 and name  HD1#) 2.0 0.5 3.5
assign (resid   83 and name   HN) (resid  83 and name  HD2#) 2.0 0.5 3.5

!G84
assign (resid   84 and name   HN) (resid  83 and name  HN) 2.0 0.5 0.7
assign (resid   84 and name   HN) (resid  85 and name  HN) 2.0 0.5 0.7
assign (resid   84 and name   HN) (resid  82 and name  HN) 2.0 0.5 3.5
assign (resid   84 and name   HN) (resid  81 and name  HN) 2.0 0.5 4.0
assign (resid   84 and name   HN) (resid  82 and name  HG1#) 2.0 0.5 3.5
assign (resid   84 and name   HN) (resid  82 and name  HG2#) 2.0 0.5 4.0
assign (resid   84 and name   HN) (resid  83 and name  HA) 2.0 0.5 3.5
assign (resid   84 and name   HN) (resid  84 and name  HA1) 2.0 0.5 1.3
assign (resid   84 and name   HN) (resid  84 and name  HA2) 2.0 0.5 0.7


!Q85
assign (resid   85 and name   HN) (resid  83 and name  HN) 2.0 0.5 2.0
assign (resid   85 and name   HN) (resid  84 and name  HA1) 2.0 0.5 1.3
assign (resid   85 and name   HN) (resid  84 and name  HA2) 2.0 0.5 1.3
assign (resid   85 and name   HN) (resid  86 and name  HD#) 2.0 0.5 2.0
assign (resid   85 and name   HN) (resid  86 and name  HA) 2.0 0.5 3.5
assign (resid   85 and name   HN) (resid  83 and name  HB1) 2.0 0.5 3.5
assign (resid   85 and name   HN) (resid  83 and name  HB2) 2.0 0.5 3.5
assign (resid   85 and name   HN) (resid  82 and name  HG1#) 2.0 0.5 3.5
assign (resid   85 and name   HN) (resid  85 and name  HB1) 2.0 0.5 1.3
assign (resid   85 and name   HN) (resid  85 and name  HB2) 2.0 0.5 0.7
assign (resid   85 and name   HN) (resid  85 and name  HG#) 2.0 0.5 0.7


!Q85HE21
assign (resid   85 and name   HE21) (resid  85 and name  HE22) 2.0 0.5 0.7
assign (resid   85 and name   HE21) (resid  85 and name  HB#) 2.0 0.5 1.3
assign (resid   85 and name   HE21) (resid  85 and name  HG#) 2.0 0.5 0.7

!P86

!H87
assign (resid   87 and name   HN) (resid  87 and name  HB1) 2.0 0.5 0.7
assign (resid   87 and name   HN) (resid  87 and name  HB2) 2.0 0.5 1.3
assign (resid   87 and name   HN) (resid  86 and name  HB#) 2.0 0.5 1.3


!H88
assign (resid   88 and name   HN) (resid  89 and name  HN) 2.0 0.5 2.0
assign (resid   88 and name   HN) (resid  95 and name  HN) 2.0 0.5 2.0
assign (resid   88 and name   HN) (resid  88 and name  HB2) 2.0 0.5 0.7 
assign (resid   88 and name   HN) (resid  88 and name  HB1) 2.0 0.5 1.3 
assign (resid   88 and name   HN) (resid  87 and name  HB#) 2.0 0.5 2.0 
assign (resid   88 and name   HN) (resid  94 and name  HG2#) 2.0 0.5 3.5 
 
!E89
assign (resid   89 and name   HN) (resid  89 and name  HG#) 2.0 0.5 2.0

!L90
assign (resid   90 and name   HN) (resid  91 and name  HN) 2.0 0.5 2.0
assign (resid   90 and name   HN) (resid  89 and name  HN) 2.0 0.5 2.0
assign (resid   90 and name   HN) (resid  95 and name  HN) 2.0 0.5 2.0
assign (resid   90 and name   HN) (resid  93 and name  HN) 2.0 0.5 1.3
assign (resid   90 and name   HN) (resid  94 and name  HN) 2.0 0.5 3.5
assign (resid   90 and name   HN) (resid  93 and name  HA) 2.0 0.5 3.5
assign (resid   90 and name   HN) (resid  90 and name  HA) 2.0 0.5 1.3
assign (resid   90 and name   HN) (resid  91 and name  HA) 2.0 0.5 3.5
assign (resid   90 and name   HN) (resid  91 and name  HB#) 2.0 0.5 3.5
assign (resid   90 and name   HN) (resid  90 and name  HG) 2.0 0.5 2.0 
assign (resid   90 and name   HN) (resid  89 and name  HG#) 2.0 0.5 1.3
assign (resid   90 and name   HN) (resid  90 and name  HB1) 2.0 0.5 1.3
assign (resid   90 and name   HN) (resid  90 and name  HB2) 2.0 0.5 1.3
assign (resid   90 and name   HN) (resid  89 and name  HB#) 2.0 0.5 2.0
assign (resid   90 and name   HN) (resid  95 and name  HD1#) 2.0 0.5 3.5 

!D91
assign (resid   91 and name   HN) (resid  91 and name  HA) 2.0 0.5 0.7
assign (resid   91 and name   HN) (resid  90 and name  HA) 2.0 0.5 0.7
assign (resid   91 and name   HN) (resid  91 and name  HB1) 2.0 0.5 1.3
assign (resid   91 and name   HN) (resid  91 and name  HB2) 2.0 0.5 1.3
assign (resid   91 and name   HN) (resid  90 and name  HD1#) 2.0 0.5 0.7
assign (resid   91 and name   HN) (resid  90 and name  HB1) 2.0 0.5 2.0 
assign (resid   91 and name   HN) (resid  90 and name  HB2) 2.0 0.5 2.0
assign (resid   91 and name   HN) (resid  90 and name  HG) 2.0 0.5 1.3
assign (resid   91 and name   HN) (resid  90 and name  HD2#) 2.0 0.5 3.5

!S92
assign (resid   92 and name   HN) (resid  90 and name  HN) 2.0 0.5 2.0
assign (resid   92 and name   HN) (resid  93 and name  HN) 2.0 0.5 0.7
assign (resid   92 and name   HN) (resid  91 and name  HN) 2.0 0.5 0.7
assign (resid   92 and name   HN) (resid  91 and name  HA) 2.0 0.5 1.3
assign (resid   92 and name   HN) (resid  92 and name  HA) 2.0 0.5 0.7
assign (resid   92 and name   HN) (resid  92 and name  HB#) 2.0 0.5 2.0
assign (resid   92 and name   HN) (resid  90 and name  HA) 2.0 0.5 2.0
assign (resid   92 and name   HN) (resid  91 and name  HB1) 2.0 0.5 2.0
assign (resid   92 and name   HN) (resid  91 and name  HB2) 2.0 0.5 2.0
assign (resid   92 and name   HN) (resid  89 and name  HG#) 2.0 0.5 1.3
assign (resid   92 and name   HN) (resid  89 and name  HB#) 2.0 0.5 3.5
assign (resid   92 and name   HN) (resid  90 and name  HB#) 2.0 0.5 4.0

!K93
assign (resid   93 and name   HN) (resid  93 and name  HG#) 2.0 0.5 0.7
assign (resid   93 and name   HN) (resid  94 and name  HN) 2.0 0.5 2.0
assign (resid   93 and name   HN) (resid  91 and name  HN) 2.0 0.5 2.0
assign (resid   93 and name   HN) (resid  91 and name  HB#) 2.0 0.5 1.3
assign (resid   93 and name   HN) (resid  92 and name  HA) 2.0 0.5 1.3
assign (resid   93 and name   HN) (resid  93 and name  HB1) 2.0 0.5 2.0
assign (resid   93 and name   HN) (resid  93 and name  HB2) 2.0 0.5 2.0
assign (resid   93 and name   HN) (resid  93 and name  Hb#) 2.0 0.5 1.3

!T94

assign (resid   94 and name   HN) (resid  95 and name  HN) 2.0 0.5 2.5
assign (resid   94 and name   HN) (resid  94 and name  HB) 2.0 0.5 0.7
assign (resid   94 and name   HN) (resid  95 and name  HA) 2.0 0.5 3.5
assign (resid   94 and name   HN) (resid  93 and name  HB2) 2.0 0.5 1.3
assign (resid   94 and name   HN) (resid  93 and name  HB1) 2.0 0.5 1.3
assign (resid   94 and name   HN) (resid  93 and name  HG1) 2.0 0.5 3.5
assign (resid   94 and name   HN) (resid  93 and name  HG2) 2.0 0.5 3.5
assign (resid   94 and name   HN) (resid  94 and name  HG2#) 2.0 0.5 2.0 

!I95

assign (resid   95 and name   HN) (resid  95 and name  HA) 2.0 0.5 1.3
assign (resid   95 and name   HN) (resid  95 and name  HG2#) 2.0 0.5 0.7
assign (resid   95 and name   HN) (resid  95 and name  HB) 2.0 0.5 2.0
assign (resid   95 and name   HN) (resid  95 and name  HG11) 2.0 0.5 1.3
assign (resid   95 and name   HN) (resid  95 and name  HG12) 2.0 0.5 1.3
assign (resid   95 and name   HN) (resid  95 and name  HD1#) 2.0 0.5 3.5
assign (resid   95 and name   HN) (resid  94 and name  HG2#) 2.0 0.5 2.0

!D96
assign (resid   96 and name   HN) (resid  95 and name  HN) 2.0 0.5 2.5
assign (resid   96 and name   HN) (resid  31 and name  HN) 2.0 0.5 3.5
assign (resid   96 and name   HN) (resid  96 and name  HA) 2.0 0.5 1.3
assign (resid   96 and name   HN) (resid  30 and name  HA1) 2.0 0.5 2.0
assign (resid   96 and name   HN) (resid  30 and name  HA2) 2.0 0.5 2.0
assign (resid   96 and name   HN) (resid  97 and name  HD#) 2.0 0.5 2.0
assign (resid   96 and name   HN) (resid  96 and name  HB1) 2.0 0.5 0.7
assign (resid   96 and name   HN) (resid  96 and name  HB2) 2.0 0.5 0.7
assign (resid   96 and name   HN) (resid  95 and name  HB) 2.0 0.5 0.7
assign (resid   96 and name   HN) (resid  95 and name  HG2#) 2.0 0.5 2.0
assign (resid   96 and name   HN) (resid  95 and name  HD1#) 2.0 0.5 3.5
assign (resid   96 and name   HN) (resid  95 and name  HG1#) 2.0 0.5 2.0

!P97

!K98

assign (resid   98 and name   HN) (resid  97 and name  HA) 2.0 0.5 0.7
assign (resid   98 and name   HN) (resid  29 and name  HA) 2.0 0.5 1.3
assign (resid   98 and name   HN) (resid  99 and name  HA) 2.0 0.5 3.5
assign (resid   98 and name   HN) (resid  29 and name  HD1#) 2.0 0.5 3.5
assign (resid   98 and name   HN) (resid  29 and name  HG1#) 2.0 0.5 3.5
assign (resid   98 and name   HN) (resid  29 and name  HG2#) 2.0 0.5 3.5
assign (resid   98 and name   HN) (resid  98 and name  HB#) 2.0 0.5 1.3
assign (resid   98 and name   HN) (resid  98 and name  HG#) 2.0 0.5 0.7
assign (resid   98 and name   HN) (resid  98 and name  HE#) 2.0 0.5 3.5
assign (resid   98 and name   HN) (resid  98 and name  HD#) 2.0 0.5 2.0

!V99
assign (resid   99 and name   HN) (resid  100 and name  HN) 2.0 0.5 3.5
assign (resid   99 and name   HN) (resid  99 and name  HA) 2.0 0.5 1.3
assign (resid   99 and name   HN) (resid  98 and name  HN) 2.0 0.5 3.5
assign (resid   99 and name   HN) (resid  99 and name  HB) 2.0 0.5 0.7
assign (resid   99 and name   HN) (resid  99 and name  HG2#) 2.0 0.5 0.7
assign (resid   99 and name   HN) (resid  99 and name  HG1#) 2.0 0.5 3.5

!A100
assign (resid   100 and name   HN) (resid  27 and name  HN) 2.0 0.5 3.5
assign (resid   100 and name   HN) (resid  100 and name  HA) 2.0 0.5 0.7
assign (resid   100 and name   HN) (resid  99 and name  HA) 2.0 0.5 0.7
assign (resid   100 and name   HN) (resid  27 and name  HG#) 2.0 0.5 2.0
assign (resid   100 and name   HN) (resid  27 and name  HB#) 2.0 0.5 3.5
assign (resid   100 and name   HN) (resid  99 and name  HB) 2.0 0.5 2.0
assign (resid   100 and name   HN) (resid  100 and name  HB#) 2.0 0.5 0.7
assign (resid   100 and name   HN) (resid  99 and name  HG1#) 2.0 0.5 0.7
assign (resid   100 and name   HN) (resid  101 and name  HD#) 2.0 0.5 3.5 


!F101
assign (resid   101 and name   HN) (resid  101 and name  HD#) 2.0 0.5 1.3
assign (resid   101 and name   HN) (resid  100 and name  HA) 2.0 0.5 0.7
assign (resid   101 and name   HN) (resid  100 and name  HB#) 2.0 0.5 0.7
assign (resid   101 and name   HN) (resid  101 and name  HB1) 2.0 0.5 1.3
assign (resid   101 and name   HN) (resid  101 and name  HB2) 2.0 0.5 1.3
assign (resid   101 and name   HN) (resid  102 and name  HG#) 2.0 0.5 3.5


!P102

!R103
assign (resid   103 and name   HN) (resid  102 and name  HA) 2.0 0.5 0.7
assign (resid   103 and name   HN) (resid  102 and name  HB#) 2.0 0.5 1.3
assign (resid   103 and name   HN) (resid  103 and name  HB#) 2.0 0.5 0.7

!R104

!A105
assign (resid   105 and name   HN) (resid  105 and name  HA) 2.0 0.5 0.7
assign (resid   105 and name   HN) (resid  104 and name  HA) 2.0 0.5 0.7
assign (resid   105 and name   HN) (resid  105 and name  HB#) 2.0 0.5 0.7
assign (resid   105 and name   HN) (resid  104 and name  HB#) 2.0 0.5 2.0
assign (resid   105 and name   HN) (resid  104 and name  HD#) 2.0 0.5 2.0

!Q106
assign (resid   106 and name   HN) (resid  105 and name  HA) 2.0 0.5 0.7
assign (resid   106 and name   HN) (resid  105 and name  HB#) 2.0 0.5 0.7
assign (resid   106 and name   HN) (resid  106 and name  HB1) 2.0 0.5 0.7
assign (resid   106 and name   HN) (resid  106 and name  HB2) 2.0 0.5 0.7

!Q106HE21
assign (resid   106 and name   HE21) (resid  106 and name  HE22) 2.0 0.5 0.7
assign (resid   106 and name   HE21) (resid  106 and name  HG#) 2.0 0.5 0.7

!Q106HE22
assign (resid   106 and name   HE22) (resid  106 and name  HB#) 2.0 0.5 2.0

!P107

!K108
assign (resid   108 and name   HN) (resid  108 and name  HA) 2.0 0.5 1.3
assign (resid   108 and name   HN) (resid  107 and name  HA) 2.0 0.5 0.7
assign (resid   108 and name   HN) (resid  107 and name  HG#) 2.0 0.5 2.0
assign (resid   108 and name   HN) (resid  108 and name  HB#) 2.0 0.5 0.7
assign (resid   108 and name   HN) (resid  108 and name  HG#) 2.0 0.5 0.7
assign (resid   108 and name   HN) (resid  108 and name  HD#) 2.0 0.5 2.0
assign (resid   108 and name   HN) (resid  107 and name  HB#) 2.0 0.5 1.3


!M109
assign (resid   109 and name   HN) (resid  109 and name  HG#) 2.0 0.5 0.7

!V110
assign (resid   110 and name   HN) (resid  109 and name  HA) 2.0 0.5 1.3
assign (resid   110 and name   HN) (resid  109 and name  HG#) 2.0 0.5 3.5
assign (resid   110 and name   HN) (resid  109 and name  HB#) 2.0 0.5 2.0
assign (resid   110 and name   HN) (resid  110 and name  HB) 2.0 0.5 0.7
assign (resid   110 and name   HN) (resid  110 and name  HG2#) 2.0 0.5 0.7

!T111
assign (resid   111 and name   HN) (resid  111 and name  HB) 2.0 0.5 0.7 
assign (resid   111 and name   HN) (resid  111 and name  HA) 2.0 0.5 0.7 
assign (resid   111 and name   HN) (resid  110 and name  HG1#) 2.0 0.5 1.3
assign (resid   111 and name   HN) (resid  110 and name  HB) 2.0 0.5 1.3

!R112
assign (resid   112 and name   HN) (resid  112 and name  HB#) 2.0 0.5 1.3
assign (resid   112 and name   HN) (resid  111 and name  HG2#) 2.0 0.5 3.5
assign (resid   112 and name   HN) (resid  112 and name  HA) 2.0 0.5 3.5
assign (resid   112 and name   HN) (resid  111 and name  HN) 2.0 0.5 2.0

!T113
assign (resid   113 and name   HN) (resid  113 and name  HG2#) 2.0 0.5 3.5

!K114
assign (resid   114 and name   HN) (resid  114 and name  HB#) 2.0 0.5 1.3
assign (resid   114 and name   HN) (resid  114 and name  HA) 2.0 0.5 0.7

!K115
assign (resid   115 and name   HN) (resid  115 and name  HB#) 2.0 0.5 1.3
assign (resid   115 and name   HN) (resid  115 and name  HA) 2.0 0.5 0.7
# Restraints file 5: dihed.tbl
! phi and psi dihedral restraint file generated by Talos
! with select corrections suggested by TALOS+ 
! TALOS filename:
! pred.tab


! Talos derived phi restraint d:
!assign (resid   8 and name C)
       ! (resid   9 and name N)
       ! (resid   9 and name CA)
       ! (resid   9 and name C)
       !1.0 -98 42 2

! Talos derived phi restraint d:
!assign (resid   9 and name C)
       ! (resid   10 and name N)
       ! (resid   10 and name CA)
       ! (resid   10 and name C)
       !1.0 -92 128 2

! Talos derived phi restraint d:
!assign (resid   10 and name C)
       ! (resid   11 and name N)
       ! (resid   11 and name CA)
       ! (resid   11 and name C)
       !1.0 -94 132 2

! Talos derived phi restraint w:
!assign (resid    11 and name C)
       ! (resid   12 and name N)
       ! (resid   12 and name CA)
       ! (resid   12 and name C)
       !1.0 -107 121 2

! Talos derived phi restraint d:
!assign (resid    12 and name C)
       ! (resid   13 and name N)
       ! (resid   13 and name CA)
       ! (resid   13 and name C)
       !1.0 -82 49 2

! Talos derived phi restraint d:
!assign (resid   13 and name C)
       !(resid   14 and name N)
       !(resid   14 and name CA)
       !(resid   14 and name C)
       !1.0 -118  80 2

! Talos derived phi restraint d:
!assign (resid   14 and name C)
      ! (resid   15 and name N)
       !(resid   15 and name CA)
       !(resid   15 and name C)
       !1.0 -70  14 2

! Talos derived phi restraint d:
!assign (resid   15 and name C)
     !  (resid   16 and name N)
     !  (resid   16 and name CA)
     !  (resid   16 and name C)
     !  1.0 -61  16 2

! Talos derived phi restraint d:
assign (resid   16 and name C)
       (resid   17 and name N)
       (resid   17 and name CA)
       (resid   17 and name C)
       1.0 -67  12 2

! Talos derived phi restraint d:
assign (resid   17 and name C)
       (resid   18 and name N)
       (resid   18 and name CA)
       (resid   18 and name C)
       1.0 -70  22 2

! Talos derived phi restraint d:
assign (resid   18 and name C)
       (resid   19 and name N)
       (resid   19 and name CA)
       (resid   19 and name C)
       1.0 -71 28 2

! Talos derived phi restraint d:
!assign (resid   19 and name C)
       !(resid   20 and name N)
       !(resid   20 and name CA)
       !(resid   20 and name C)
       !1.0 -89  44 2

! Talos derived phi restraint d:
!assign (resid   20 and name C)
       !(resid   21 and name N)
       !(resid   21 and name CA)
      ! (resid   21 and name C)
      ! 1.0 -74  26 2

! Talos derived phi restraint d:
!assign (resid   21 and name C)
      ! (resid   22 and name N)
      ! (resid   22 and name CA)
      ! (resid   22 and name C)
      ! 1.0 -71  24 2

! Talos derived phi restraint d:
!assign (resid   22 and name C)
     !  (resid   23 and name N)
      ! (resid   23 and name CA)
      ! (resid   23 and name C)
      ! 1.0 -85  46 2

! Talos derived phi restraint d:
!assign (resid   23 and name C)
      ! (resid   24 and name N)
      ! (resid   24 and name CA)
      ! (resid   24 and name C)
       !1.0 -92  56 2

! Talos derived phi restraint d:
!assign (resid   24 and name C)
      ! (resid   25 and name N)
      ! (resid   25 and name CA)
       !(resid   25 and name C)
       !1.0 94 30 2

! Talos derived phi restraint :
assign (resid   25 and name C)
        (resid   26 and name N)
        (resid   26 and name CA)
        (resid   26 and name C)
       1.0 -90 30 2

! Talos derived phi restraint:
assign (resid   26 and name C)
       (resid   27 and name N)
       (resid   27 and name CA)
       (resid   27 and name C)
       1.0 -123 44 2

! Talos derived phi restraint:
assign (resid   27 and name C)
       (resid   28 and name N)
       (resid   28 and name CA)
       (resid   28 and name C)
       1.0 -116 24 2

! Talos derived phi restraint:
assign (resid   28 and name C)
       (resid   29 and name N)
       (resid   29 and name CA)
       (resid   29 and name C)
       1.0 -113 22 2

! Talos derived phi restraint:
assign (resid   29 and name C)
       (resid   30 and name N)
       (resid   30 and name CA)
       (resid   30 and name C)
       1.0 -122 44 2

! Talos derived phi restraint w:
assign (resid   30 and name C)
       (resid   31 and name N)
       (resid   31 and name CA)
       (resid   31 and name C)
       1.0 75 25 2
!change center from 55 to 75

! Talos derived phi restraint :
assign (resid   31 and name C)
        (resid   32 and name N)
        (resid   32 and name CA)
        (resid   32 and name C)
       1.0 -82 36 2

! Talos derived phi restraint w:
assign (resid   32 and name C)
        (resid   33 and name N)
        (resid   33 and name CA)
        (resid   33 and name C)
       1.0 -85 72 2

! Talos derived phi restraint :
assign (resid   33 and name C)
        (resid   34 and name N)
        (resid   34 and name CA)
        (resid   34 and name C)
       1.0 -62 12 2

! Talos derived phi restraint:
assign (resid   34 and name C)
        (resid   35 and name N)
        (resid   35 and name CA)
        (resid   35 and name C)
       1.0 -96 30 2

! Talos derived phi restraint :
assign (resid   35 and name C)
        (resid   36 and name N)
        (resid   36 and name CA)
       (resid   36 and name C)
     1.0 -75 36 2

! Talos derived phi restraint:
assign (resid   36 and name C)
       (resid   37 and name N)
       (resid   37 and name CA)
       (resid   37 and name C)
       1.0 -78 47 2

! Talos derived phi restraint:
assign (resid   37 and name C)
       (resid   38 and name N)
       (resid   38 and name CA)
       (resid   38 and name C)
       1.0 -52 12 2

! Talos derived phi restraint :
assign (resid   38 and name C)
       (resid   39 and name N)
       (resid   39 and name CA)
       (resid   39 and name C)
       1.0 -67 12 2

! Talos derived phi restraint:
assign (resid   39 and name C)
       (resid   40 and name N)
       (resid   40 and name CA)
       (resid   40 and name C)
       1.0 -62 8 2

! Talos derived phi restraint:
assign (resid   40 and name C)
       (resid   41 and name N)
       (resid   41 and name CA)
       (resid   41 and name C)
       1.0 -63 9 2


! Talos derived phi restraint:
assign (resid   41 and name C)
       (resid   42 and name N)
       (resid   42 and name CA)
       (resid   42 and name C)
       1.0 -64 14 2

! Talos derived phi restraint :
assign (resid   42 and name C)
        (resid   43 and name N)
       (resid   43 and name CA)
       (resid   43 and name C)
        1.0 -65 9 2

! Talos derived phi restraint :
assign (resid   43 and name C)
        (resid   44 and name N)
        (resid   44 and name CA)
        (resid   44 and name C)
       1.0 -64 7 2

! Talos derived phi restraint:
assign (resid   44 and name C)
       (resid   45 and name N)
       (resid   45 and name CA)
       (resid   45 and name C)
       1.0 -61 9 2

! Talos derived phi restraint:
assign (resid   45 and name C)
       (resid   46 and name N)
       (resid   46 and name CA)
       (resid   46 and name C)
       1.0 -65 12 2

! Talos derived phi restraint:
assign (resid   46 and name C)
       (resid   47 and name N)
       (resid   47 and name CA)
       (resid   47 and name C)
       1.0 -70 15 2

! Talos derived phi restraint:
assign (resid   47 and name C)
       (resid   48 and name N)
       (resid   48 and name CA)
       (resid   48 and name C)
       1.0 -93 40 2


! Talos derived phi restraint w:
!assign (resid   48 and name C)
 !       (resid   49 and name N)
  !     (resid   49 and name CA)
   !     (resid   49 and name C)
    !   1.0 -140 140 2

! Talos derived phi restraint:
assign (resid   49 and name C)
       (resid   50 and name N)
       (resid   50 and name CA)
       (resid   50 and name C)
       1.0 -94 44 2

! Talos derived phi restraint:
assign (resid   50 and name C)
       (resid   51 and name N)
       (resid   51 and name CA)
       (resid   51 and name C)
       1.0 -84 58 2

! Talos derived phi restraint:
assign (resid   51 and name C)
       (resid   52 and name N)
       (resid   52 and name CA)
       (resid   52 and name C)
       1.0 -98 28 2

! Talos derived phi restraint:
assign (resid   52 and name C)
       (resid   53 and name N)
        (resid   53 and name CA)
        (resid   53 and name C)
       1.0 -145 30 2

! Talos derived phi restraint:
assign (resid   53 and name C)
       (resid   54 and name N)
       (resid   54 and name CA)
       (resid   54 and name C)
       1.0 -126 30 2

! Talos derived phi restraint:
assign (resid   54 and name C)
       (resid   55 and name N)
       (resid   55 and name CA)
       (resid   55 and name C)
       1.0 -130 44 2


! Talos derived phi restraint:
assign (resid   55 and name C)
       (resid   56 and name N)
       (resid   56 and name CA)
       (resid   56 and name C)
       1.0 -109 47 2


! Talos derived phi restraint:
assign (resid   56 and name C)
       (resid   57 and name N)
       (resid   57 and name CA)
       (resid   57 and name C)
       1.0 -91 22 2

! Talos derived phi restraint:
assign (resid   57 and name C)
       (resid   58 and name N)
       (resid   58 and name CA)
       (resid   58 and name C)
       1.0 -107 30 2

! Talos derived phi restraint:
assign (resid   58 and name C)
       (resid   59 and name N)
       (resid   59 and name CA)
       (resid   59 and name C)
       1.0 -80 37 2

! Talos derived phi restraint :
assign (resid   59 and name C)
        (resid   60 and name N)
        (resid   60 and name CA)
       (resid   60 and name C)
       1.0 -65 16 2

!change center from -55 to -65

! Talos derived phi restraint :
assign (resid   60 and name C)
       (resid   61 and name N)
        (resid   61 and name CA)
        (resid   61 and name C)
      1.0 -64 16 2


! Talos derived phi restraint :
assign (resid   61 and name C)
       (resid   62 and name N)
       (resid   62 and name CA)
       (resid   62 and name C)
       1.0 -99 30 2

! Talos derived phi restraint:
assign (resid   62 and name C)
       (resid   63 and name N)
       (resid   63 and name CA)
       (resid   63 and name C)
       1.0 61 16 2

! Talos derived phi restraint :
assign (resid   63 and name C)
       (resid   64 and name N)
       (resid   64 and name CA)
       (resid   64 and name C)
       1.0 -88 36 2


! Talos derived phi restraint w:
assign (resid   64 and name C)
        (resid   65 and name N)
        (resid   65 and name CA)
        (resid   65 and name C)
       1.0 -78 120 2


! Talos derived phi restraint w:
assign (resid   65 and name C)
       (resid   66 and name N)
       (resid   66 and name CA)
       (resid   66 and name C)
       1.0 -101 36 2

! Talos derived phi restraint :
assign (resid   66 and name C)
        (resid   67 and name N)
        (resid   67 and name CA)
        (resid   67 and name C)
       1.0 68 24 2

! Talos derived phi restraint :
assign (resid   67 and name C)
        (resid   68 and name N)
        (resid   68 and name CA)
        (resid   68 and name C)
       1.0 -134 47 2

! Talos derived phi restraint w:
!assign (resid   68 and name C)
     !   (resid   69 and name N)
      !  (resid   69 and name CA)
      !  (resid   69 and name C)
      ! 1.0 -152 106 2

! Talos derived phi restraint:
assign (resid   69 and name C)
       (resid   70 and name N)
       (resid   70 and name CA)
       (resid   70 and name C)
       1.0 -145 30 2

! Talos derived phi restraint:
assign (resid   70 and name C)
       (resid   71 and name N)
       (resid   71 and name CA)
       (resid   71 and name C)
       1.0 -136 38 2


! Talos derived phi restraint:
assign (resid   71 and name C)
       (resid   72 and name N)
       (resid   72 and name CA)
       (resid   72 and name C)
       1.0 -101 20 2

! Talos derived phi restraint :
assign (resid   72 and name C)
       (resid   73 and name N)
       (resid   73 and name CA)
      (resid   73 and name C)
       1.0 -85 46 2

! Talos derived phi restraint w:
assign (resid   73 and name C)
       (resid   74 and name N)
       (resid   74 and name CA)
       (resid   74 and name C)
       1.0 -79 26 2

! Talos derived phi restraint w:
assign (resid   74 and name C)
       (resid   75 and name N)
       (resid   75 and name CA)
       (resid   75 and name C)
       1.0 -111 62 2

! Talos derived phi restraint:
assign (resid   75 and name C)
       (resid   76 and name N)
       (resid   76 and name CA)
       (resid   76 and name C)
       1.0 -57 16 2

! Talos derived phi restraint:
assign (resid   76 and name C)
       (resid   77 and name N)
       (resid   77 and name CA)
       (resid   77 and name C)
       1.0 -65 12 2

! Talos derived phi restraint:
assign (resid   77 and name C)
       (resid   78 and name N)
       (resid   78 and name CA)
       (resid   78 and name C)
       1.0 -62 6 2

! Talos derived phi restraint :
assign (resid   78 and name C)
       (resid   79 and name N)
       (resid   79 and name CA)
       (resid   79 and name C)
       1.0 -63 7 2

! Talos derived phi restraint:
assign (resid   79 and name C)
       (resid   80 and name N)
       (resid   80 and name CA)
       (resid   80 and name C)
       1.0 -62 10 2

! Talos derived phi restraint:
assign (resid   80 and name C)
       (resid   81 and name N)
       (resid   81 and name CA)
       (resid   81 and name C)
       1.0 -64 7 2

! Talos derived phi restraint:
assign (resid   81 and name C)
       (resid   82 and name N)
       (resid   82 and name CA)
       (resid   82 and name C)
       1.0 -66 20 2

! Talos derived phi restraint :
assign (resid   82 and name C)
        (resid   83 and name N)
        (resid   83 and name CA)
        (resid   83 and name C)
       1.0 -75 26 2


! Talos derived phi restraint w:
!assign (resid   83 and name C)
      ! (resid   84 and name N)
      ! (resid   84 and name CA)
       !(resid   84 and name C)
       !1.0 83 12 2

! Talos derived phi restraint:
assign (resid   84 and name C)
       (resid   85 and name N)
       (resid   85 and name CA)
       (resid   85 and name C)
       1.0 -91 42 2

! Talos derived phi restraint :
assign (resid   85 and name C)
        (resid   86 and name N)
       (resid   86 and name CA)
        (resid   86 and name C)
       1.0 -65 20 2

! Talos derived phi restraint:
assign (resid   86 and name C)
       (resid   87 and name N)
       (resid   87 and name CA)
       (resid   87 and name C)
       1.0 -130 48 2

! Talos derived phi restraint:
assign (resid   87 and name C)
       (resid   88 and name N)
       (resid   88 and name CA)
       (resid   88 and name C)
       1.0 -129 30 2

! Talos derived phi restraint:
assign (resid   88 and name C)
       (resid   89 and name N)
       (resid   89 and name CA)
       (resid   89 and name C)
       1.0 -139 36 2

! Talos derived phi restraint:
assign (resid   89 and name C)
       (resid   90 and name N)
       (resid   90 and name CA)
       (resid   90 and name C)
       1.0 -141 26 2

! Talos derived phi restraint:
assign (resid   90 and name C)
       (resid   91 and name N)
       (resid   91 and name CA)
       (resid   91 and name C)
       1.0 52 8 2


! Talos derived phi restraint:
assign (resid   91 and name C)
       (resid   92 and name N)
       (resid   92 and name CA)
       (resid   92 and name C)
       1.0 67 22 2

! Talos derived phi restraint:
assign (resid   92 and name C)
       (resid   93 and name N)
       (resid   93 and name CA)
       (resid   93 and name C)
       1.0 -111 40 2

! Talos derived phi restraint :
assign (resid   93 and name C)
       (resid   94 and name N)
        (resid   94 and name CA)
        (resid   94 and name C)
       1.0 -71 16 2

! Talos derived phi restraint:
assign (resid   94 and name C)
       (resid   95 and name N)
       (resid   95 and name CA)
       (resid   95 and name C)
       1.0 -111 20 2

! Talos derived phi restraint w:
assign (resid   95 and name C)
       (resid   96 and name N)
       (resid   96 and name CA)
       (resid   96 and name C)
       1.0 -130 34 2

! Talos derived phi restraint:
assign (resid   96 and name C)
       (resid   97 and name N)
       (resid   97 and name CA)
       (resid   97 and name C)
       1.0 -68 14 2

! Talos derived phi restraint:
assign (resid   97 and name C)
        (resid   98 and name N)
        (resid   98 and name CA)
       (resid   98 and name C)
       1.0 -129 40 2



! Talos derived phi restraint :
assign (resid   98 and name C)
        (resid   99 and name N)
        (resid   99 and name CA)
        (resid   99 and name C)
       1.0 -80 44 2

! Talos derived phi restraint w:
!assign (resid   99 and name C)
      ! (resid   100 and name N)
       !(resid   100 and name CA)
       !(resid   100 and name C)
       !1.0 -96 24 2


! Talos derived phi restraint:
assign (resid   100 and name C)
       (resid   101 and name N)
       (resid   101 and name CA)
       (resid   101 and name C)
       1.0 -105 36 2

! Talos derived phi restraint:
assign (resid   101 and name C)
       (resid   102 and name N)
       (resid   102 and name CA)
       (resid   102 and name C)
       1.0 -70 14 2

! Talos derived phi restraint d:
!assign (resid   102 and name C)
       !(resid   103 and name N)
       !(resid   103 and name CA)
       !(resid   103 and name C)
      ! 1.0 -100 46 2

! Talos derived phi restraint d:
!assign (resid   103 and name C)
      ! (resid   104 and name N)
      ! (resid   104 and name CA)
       !(resid   104 and name C)
       !1.0 -87 120 2

! Talos derived phi restraint d:
!assign (resid   104 and name C)
       !(resid   105 and name N)
      ! (resid   105 and name CA)
      ! (resid   105 and name C)
      ! 1.0 -98 130 2

! Talos derived phi restraint d:
!assign (resid   105 and name C)
       !(resid   106 and name N)
       !(resid   106 and name CA)
      ! (resid   106 and name C)
      ! 1.0 -98 34 2

! Talos derived phi restraint d:
!assign (resid   106 and name C)
      ! (resid   107 and name N)
      ! (resid   107 and name CA)
      ! (resid   107 and name C)
      ! 1.0 -70 14 2

! Talos derived phi restraint d:
!assign (resid   107 and name C)
      ! (resid   108 and name N)
       ! (resid   108 and name CA)
      !  (resid   108 and name C)
      ! 1.0 -103 38 2

! Talos derived phi restraint d:
!assign (resid   108 and name C)
     !  (resid   109 and name N)
     !  (resid   109 and name CA)
     !  (resid   109 and name C)
      ! 1.0 -80 120 2

! Talos derived phi restraint d:
!assign (resid   109 and name C)
     !  (resid   110 and name N)
      ! (resid   110 and name CA)
     !  (resid   110 and name C)
     !  1.0 -82 120 2

! Talos derived phi restraint d:
!assign (resid   110 and name C)
      !  (resid   111 and name N)
      !  (resid   111 and name CA)
     !   (resid   111 and name C)
     !  1.0 -96 120 2

! Talos derived phi restraint d:
!assign (resid   111 and name C)
       ! (resid   112 and name N)
       ! (resid   112 and name CA)
       ! (resid   112 and name C)
      ! 1.0 -77 120 2

! Talos derived phi restraint d:
!assign (resid   112 and name C)
      ! (resid   113 and name N)
      ! (resid   113 and name CA)
      ! (resid   113 and name C)
      ! 1.0 -88 120 2

! Talos derived phi restraint d:
!assign (resid   113 and name C)
       ! (resid   114 and name N)
       ! (resid   114 and name CA)
       ! (resid   114 and name C)
       ! 1.0 -84 34 2

! Talos derived phi restraint d :
!assign (resid   114 and name C)
      ! (resid   115 and name N)
      ! (resid   115 and name CA)
      ! (resid   115 and name C)
      ! 1.0 -93 58 2


! Talos derived psi restraint d:
!assign (resid   9 and name N)
       !(resid   9 and name CA)
       !(resid   9 and name C)
       !(resid   10 and name N)
       !1.0 -10  46 2

! Talos derived psi restraint d:
!assign (resid   10 and name N)
       !(resid   10 and name CA)
       !(resid   10 and name C)
       !(resid   11 and name N)
       !1.0 138 40 2

! Talos derived psi restraint d:
!assign (resid   11 and name N)
       !(resid   11 and name CA)
       !(resid   11 and name C)
       !(resid   12 and name N)
       !1.0 136  44 2

! Talos derived psi restraint w:
!assign (resid   12 and name N)
       !(resid   12 and name CA)
       !(resid   12 and name C)
       !(resid   13 and name N)
       !1.0 158  90 2

! Talos derived psi restraint d:
!assign (resid   13 and name N)
       !(resid   13 and name CA)
       !(resid   13 and name C)
       !(resid   14 and name N)
       !1.0 -27 58 2

! Talos derived psi restraint d:
assign (resid   14 and name N)
       (resid   14 and name CA)
       (resid   14 and name C)
       (resid   15 and name N)
       1.0  137 66 2

! Talos derived psi restraint d:
!assign (resid   15 and name N)
     !  (resid   15 and name CA)
      ! (resid   15 and name C)
      ! (resid   16 and name N)
      ! 1.0 -31 20 2
!change center from 157 to 150


! Talos derived psi restraint d:
!assign (resid   16 and name N)
     !  (resid   16 and name CA)
      ! (resid   16 and name C)
     !  (resid   17 and name N)
     !  1.0 -34  22 2

! Talos derived psi restraint d:
!assign (resid   17 and name N)
     !  (resid   17 and name CA)
     !  (resid   17 and name C)
      ! (resid   18 and name N)
     !  1.0 -35 22 2

! Talos derived psi restraint d:
!assign (resid   18 and name N)
      ! (resid   18 and name CA)
      ! (resid   18 and name C)
      ! (resid   19 and name N)
      ! 1.0 -34 22 2

! Talos derived psi restraint d:
!assign (resid   19 and name N)
     !  (resid   19 and name CA)
     !  (resid   19 and name C)
      ! (resid   20 and name N)
       !1.0 -29 32 2


! Talos derived psi restraint d:
!assign (resid   20 and name N)
     !  (resid   20 and name CA)
     !  (resid   20 and name C)
      ! (resid   21 and name N)
      ! 1.0 -13 40 2


! Talos derived psi restraint d:
!assign (resid   21 and name N)
     !  (resid   21 and name CA)
     !  (resid   21 and name C)
     !  (resid   22 and name N)
     !  1.0 -32 22 2

! Talos derived psi restraint d:
!assign (resid   22 and name N)
     !  (resid   22 and name CA)
      ! (resid   22 and name C)
      ! (resid   23 and name N)
      ! 1.0 -27 28 2
!change center from 163 to 153


! Talos derived psi restraint d:
!assign (resid   23 and name N)
     !  (resid   23 and name CA)
      ! (resid   23 and name C)
      ! (resid   24 and name N)
     !  1.0 -15 50 2


! Talos derived psi restraint d:
!assign (resid   24 and name N)
      ! (resid   24 and name CA)
     !  (resid   24 and name C)
      ! (resid   25 and name N)
      ! 1.0 0 56 2


! Talos derived psi restraint d:
!assign (resid   25 and name N)
      ! (resid   25 and name CA)
      ! (resid   25 and name C)
       !(resid   26 and name N)
      ! 1.0 -11 17 2

! Talos derived psi restraint :
!assign (resid   26 and name N)
       !(resid   26 and name CA)
       !(resid   26 and name C)
       !(resid   27 and name N)
       !1.0 147 52 2

! Talos derived psi restraint:
assign (resid   27 and name N)
       (resid   27 and name CA)
       (resid   27 and name C)
       (resid   28 and name N)
       1.0 130 21 2

! Talos derived psi restraint:
assign (resid   28 and name N)
       (resid   28 and name CA)
       (resid   28 and name C)
       (resid   29 and name N)
       1.0 122 21 2


! Talos derived psi restraint:
assign (resid   29 and name N)
       (resid   29 and name CA)
       (resid   29 and name C)
       (resid   30 and name N)
       1.0 128 22 2


! Talos derived psi restraint:
assign (resid   30 and name N)
       (resid   30 and name CA)
       (resid   30 and name C)
       (resid   31 and name N)
       1.0 166 56 2


! Talos derived psi restraint w:
assign (resid   31 and name N)
      (resid   31 and name CA)
       (resid   31 and name C)
       (resid   32 and name N)
       1.0 43 22 2


! Talos derived psi restraint :
assign (resid   32 and name N)
       (resid   32 and name CA)
       (resid   32 and name C)
       (resid   33 and name N)
       1.0 151 20 2

! Talos derived psi restraint w:
assign (resid   33 and name N)
       (resid   33 and name CA)
      (resid   33 and name C)
      (resid   34 and name N)
      1.0 131 43 2

! Talos derived psi restraint :
assign (resid   34 and name N)
       (resid   34 and name CA)
       (resid   34 and name C)
       (resid   35 and name N)
       1.0 -22 20 2

! Talos derived psi restraint:
assign (resid   35 and name N)
       (resid   35 and name CA)
       (resid   35 and name C)
       (resid   36 and name N)
       1.0 7 37 2

! Talos derived psi restraint :
assign (resid   36 and name N)
        (resid   36 and name CA)
        (resid   36 and name C)
        (resid   37 and name N)
       1.0 132 17 2

! Talos derived psi restraint:
assign (resid   37 and name N)
       (resid   37 and name CA)
       (resid   37 and name C)
       (resid   38 and name N)
       1.0 146 35 2

! Talos derived psi restraint:
assign (resid   38 and name N)
       (resid   38 and name CA)
       (resid   38 and name C)
       (resid   39 and name N)
       1.0 -37 11 2

! Talos derived psi restraint :
assign (resid   39 and name N)
       (resid   39 and name CA)
      (resid   39 and name C)
       (resid   40 and name N)
       1.0 -35 20 2

! Talos derived psi restraint:
assign (resid   40 and name N)
       (resid   40 and name CA)
       (resid   40 and name C)
       (resid   41 and name N)
       1.0 -43 7 2

! Talos derived psi restraint:
assign (resid   41 and name N)
       (resid   41 and name CA)
       (resid   41 and name C)
       (resid   42 and name N)
       1.0 -44 12 2

! Talos derived psi restraint:
assign (resid   42 and name N)
       (resid   42 and name CA)
       (resid   42 and name C)
       (resid   43 and name N)
       1.0 -39 10 2

! Talos derived psi restraint :
assign (resid   43 and name N)
       (resid   43 and name CA)
       (resid   43 and name C)
       (resid   44 and name N)
       1.0 -42 5 2

! Talos derived psi restraint :
assign (resid   44 and name N)
       (resid   44 and name CA)
       (resid   44 and name C)
       (resid   45 and name N)
       1.0 -44 12 2


! Talos derived psi restraint:
assign (resid   45 and name N)
       (resid   45 and name CA)
       (resid   45 and name C)
       (resid   46 and name N)
       1.0 -42 15 2

! Talos derived psi restraint:
assign (resid   46 and name N)
       (resid   46 and name CA)
       (resid   46 and name C)
       (resid   47 and name N)
       1.0 -35 20 2

! Talos derived psi restraint:
assign (resid   47 and name N)
       (resid   47 and name CA)
       (resid   47 and name C)
       (resid   48 and name N)
       1.0 -25 24 2

! Talos derived psi restraint:
assign (resid   48 and name N)
       (resid   48 and name CA)
       (resid   48 and name C)
       (resid   49 and name N)
       1.0 -9 35 2

! Talos derived psi restraint w:
!assign (resid   49 and name N)
      ! (resid   49 and name CA)
      ! (resid   49 and name C)
      ! (resid   50 and name N)
      !1.0 176 31 2

!Talos derived psi restraint:
assign (resid   50 and name N)
       (resid   50 and name CA)
       (resid   50 and name C)
       (resid   51 and name N)
       1.0 137 26 2

!Talos derived psi restraint:
assign (resid   51 and name N)
       (resid   51 and name CA)
       (resid   51 and name C)
       (resid   52 and name N)
       1.0 129 34 2

!Talos derived psi restraint:
assign (resid   52 and name N)
       (resid   52 and name CA)
       (resid   52 and name C)
       (resid   53 and name N)
       1.0 -34 22 2

!Talos derived psi restraint:
assign (resid   53 and name N)
        (resid   53 and name CA)
        (resid   53 and name C)
        (resid   54 and name N)
       1.0 146 11 2

!Talos derived psi restraint:
assign (resid   54 and name N)
       (resid   54 and name CA)
       (resid   54 and name C)
       (resid   55 and name N)
       1.0 129 28 2

!Talos derived psi restraint:
assign (resid   55 and name N)
       (resid   55 and name CA)
       (resid   55 and name C)
       (resid   56 and name N)
       1.0 144 28 2

!Talos derived psi restraint:
assign (resid   56 and name N)
       (resid   56 and name CA)
       (resid   56 and name C)
       (resid   57 and name N)
       1.0 133 26 2


!Talos derived psi restraint:
assign (resid   57 and name N)
       (resid   57 and name CA)
       (resid   57 and name C)
       (resid   58 and name N)
       1.0 129 40 2

!Talos derived psi restraint:
assign (resid   58 and name N)
       (resid   58 and name CA)
       (resid   58 and name C)
       (resid   59 and name N)
       1.0 138 24 2

!Talos derived psi restraint:
assign (resid   59 and name N)
       (resid   59 and name CA)
       (resid   59 and name C)
       (resid   60 and name N)
       1.0 136 44 2

!Talos derived psi restraint :
assign (resid   60 and name N)
       (resid   60 and name CA)
       (resid   60 and name C)
       (resid   61 and name N)
       1.0 -24 15 2
!change center from -34 to -24

!Talos derived psi restraint w:
assign (resid   61 and name N)
       (resid   61 and name CA)
       (resid   61 and name C)
       (resid   62 and name N)
       1.0 -25 18 2

!Talos derived psi restraint:
assign (resid   62 and name N)
       (resid   62 and name CA)
       (resid   62 and name C)
       (resid   63 and name N)
       1.0 -5 22 2

!Talos derived psi restraint:
assign (resid   63 and name N)
       (resid   63 and name CA)
       (resid   63 and name C)
       (resid   64 and name N)
       1.0 33 20 2

!Talos derived psi restraint:
assign (resid   64 and name N)
       (resid   64 and name CA)
       (resid   64 and name C)
       (resid   65 and name N)
       1.0 147 24 2

!Talos derived psi restraint w:
assign (resid   65 and name N)
       (resid   65 and name CA)
       (resid   65 and name C)
       (resid   66 and name N)
       1.0 127 34 2

!Talos derived psi restraint w :
assign (resid   66 and name N)
       (resid   66 and name CA)
       (resid   66 and name C)
       (resid   67 and name N)
       1.0 -16 80 2

!Talos derived psi restraint :
assign (resid   67 and name N)
        (resid   67 and name CA)
        (resid   67 and name C)
        (resid   68 and name N)
       1.0 37 30 2

!Talos derived psi restraint w:
assign (resid   68 and name N)
       (resid   68 and name CA)
       (resid   68 and name C)
       (resid   69 and name N)
       1.0 155 20 2

!Talos derived psi restraint w:
assign (resid   69 and name N)
       (resid   69 and name CA)
       (resid   69 and name C)
       (resid   70 and name N)
       1.0 169 40 2

!Talos derived psi restraint :
assign (resid   70 and name N)
       (resid   70 and name CA)
       (resid   70 and name C)
       (resid   71 and name N)
       1.0 152 16 2

!Talos derived psi restraint :
assign (resid   71 and name N)
       (resid   71 and name CA)
       (resid   71 and name C)
       (resid   72 and name N)
       1.0 134 34 2


!Talos derived psi restraint :
assign (resid   72 and name N)
        (resid   72 and name CA)
        (resid   72 and name C)
        (resid   73 and name N)
       1.0 119 20 2

!Talos derived psi restraint w:
assign (resid   73 and name N)
       (resid   73 and name CA)
       (resid   73 and name C)
       (resid   74 and name N)
       1.0 144 30 2

!Talos derived psi restraint w:
assign (resid   74 and name N)
       (resid   74 and name CA)
       (resid   74 and name C)
       (resid   75 and name N)
       1.0 -32 48 2

!Talos derived psi restraint :
assign (resid   75 and name N)
       (resid   75 and name CA)
       (resid   75 and name C)
       (resid   76 and name N)
       1.0 114 52 2

!Talos derived psi restraint :
assign (resid   76 and name N)
       (resid   76 and name CA)
       (resid   76 and name C)
       (resid   77 and name N)
       1.0 -32 15 2

!Talos derived psi restraint :
assign (resid   77 and name N)
       (resid   77 and name CA)
       (resid   77 and name C)
       (resid   78 and name N)
       1.0 -33 20 2


!Talos derived psi restraint :
assign (resid   78 and name N)
       (resid   78 and name CA)
       (resid   78 and name C)
       (resid   79 and name N)
       1.0 -44 12 2

!Talos derived psi restraint :
assign (resid   79 and name N)
       (resid   79 and name CA)
       (resid   79 and name C)
       (resid   80 and name N)
       1.0 -40 20 2

!Talos derived psi restraint :
assign (resid   80 and name N)
       (resid   80 and name CA)
       (resid   80 and name C)
       (resid   81 and name N)
       1.0 -40 13 2

!Talos derived psi restraint :
assign (resid   81 and name N)
       (resid   81 and name CA)
       (resid   81 and name C)
       (resid   82 and name N)
       1.0 -41 11 2

!Talos derived psi restraint :
assign (resid   82 and name N)
       (resid   82 and name CA)
       (resid   82 and name C)
       (resid   83 and name N)
       1.0 -46 13 2

!Talos derived psi restraint :
assign (resid   83 and name N)
       (resid   83 and name CA)
       (resid   83 and name C)
       (resid   84 and name N)
      1.0 -13 35 2

!Talos derived psi restraint w:
!assign (resid   84 and name N)
     !  (resid   84 and name CA)
     !  (resid   84 and name C)
     !  (resid   85 and name N)
     !  1.0 16 22 2

!Talos derived psi restraint :
assign (resid   85 and name N)
       (resid   85 and name CA)
       (resid   85 and name C)
       (resid   86 and name N)
       1.0 120 50 2

!Talos derived psi restraint :
assign (resid   86 and name N)
       (resid   86 and name CA)
       (resid   86 and name C)
       (resid   87 and name N)
       1.0 -21 14 2

!Talos derived psi restraint :
assign (resid   87 and name N)
       (resid   87 and name CA)
       (resid   87 and name C)
       (resid   88 and name N)
       1.0 124 48 2

!Talos derived psi restraint :
assign (resid   88 and name N)
       (resid   88 and name CA)
       (resid   88 and name C)
       (resid   89 and name N)
       1.0 133 28 2

!Talos derived psi restraint :
assign (resid   89 and name N)
       (resid   89 and name CA)
       (resid   89 and name C)
       (resid   90 and name N)
       1.0 156 20 2

!Talos derived psi restraint :
assign (resid   90 and name N)
        (resid   90 and name CA)
        (resid   90 and name C)
       (resid   91 and name N)
       1.0 128 20 2


!Talos derived psi restraint :
assign (resid   91 and name N)
       (resid   91 and name CA)
       (resid   91 and name C)
       (resid   92 and name N)
       1.0 45 7 2

!Talos derived psi restraint :
assign (resid   92 and name N)
       (resid   92 and name CA)
       (resid   92 and name C)
       (resid   93 and name N)
       1.0 16 30 2

!Talos derived psi restraint :
assign (resid   93 and name N)
       (resid   93 and name CA)
       (resid   93 and name C)
       (resid   94 and name N)
       1.0 134 18 2

!Talos derived psi restraint :
assign (resid   94 and name N)
       (resid   94 and name CA)
       (resid   94 and name C)
       (resid   95 and name N)
       1.0 132 24 2

!Talos derived psi restraint :
!assign (resid   95 and name N)
       !(resid   95 and name CA)
      ! (resid   95 and name C)
       !(resid   96 and name N)
      ! 1.0 -11 32 2

!Talos derived psi restraint w :
assign (resid   96 and name N)
       (resid   96 and name CA)
       (resid   96 and name C)
       (resid   97 and name N)
       1.0 108 90 2

!Talos derived psi restraint :
assign (resid   97 and name N)
        (resid   97 and name CA)
        (resid   97 and name C)
        (resid   98 and name N)
       1.0 147 22 2

!Talos derived psi restraint :
assign (resid   98 and name N)
       (resid   98 and name CA)
       (resid   98 and name C)
       (resid   99 and name N)
       1.0 159 26 2

!Talos derived psi restraint :
assign (resid   99 and name N)
        (resid   99 and name CA)
        (resid   99 and name C)
        (resid   100 and name N)
       1.0 136 29 2

!Talos derived psi restraint w:
!assign (resid   100 and name N)
      ! (resid   100 and name CA)
      !(resid   100 and name C)
      ! (resid   101 and name N)
      ! 1.0 -13 44 2

!Talos derived psi restraint :
assign (resid   101 and name N)
       (resid   101 and name CA)
       (resid   101 and name C)
       (resid   102 and name N)
       1.0 123 48 2

!Talos derived psi restraint d :
!assign (resid   102 and name N)
       !(resid   102 and name CA)
       !(resid   102 and name C)
       !(resid   103 and name N)
       !1.0 150 20 2


!Talos derived psi restraint d:
!assign (resid   103 and name N)
      ! (resid   103 and name CA)
      ! (resid   103 and name C)
       !(resid   104 and name N)
       !1.0 126 30 2

!Talos derived psi restraint d:
!assign (resid   104 and name N)
      ! (resid   104 and name CA)
      ! (resid   104 and name C)
      ! (resid   105 and name N)
      ! 1.0 131 38 2

!Talos derived psi restraint d:
!assign (resid   105 and name N)
     !  (resid   105 and name CA)
     !  (resid   105 and name C)
      ! (resid   106 and name N)
      ! 1.0 139 44 2

!Talos derived psi restraint d :
!assign (resid   106 and name N)
      ! (resid   106 and name CA)
       !(resid   106 and name C)
      ! (resid   107 and name N)
      ! 1.0 122 37 2

!Talos derived psi restraint d :
!assign (resid   107 and name N)
       !(resid   107 and name CA)
      ! (resid   107 and name C)
      ! (resid   108 and name N)
      ! 1.0 150 22 2

!Talos derived psi restraint d :
!assign (resid   108 and name N)
     ! (resid   108 and name CA)
      ! (resid   108 and name C)
      ! (resid   109 and name N)
      ! 1.0 125 30 2

!Talos derived psi restraint d:
!assign (resid   109 and name N)
     !  (resid   109 and name CA)
      ! (resid   109 and name C)
      ! (resid   110 and name N)
      ! 1.0 132 30 2

!Talos derived psi restraint d:
!assign (resid   110 and name N)
      ! (resid   110 and name CA)
      ! (resid   110 and name C)
      ! (resid   111 and name N)
      ! 1.0 130 30 2

!Talos derived psi restraint d:
!assign (resid   111 and name N)
      ! (resid   111 and name CA)
       !(resid   111 and name C)
       !(resid   112 and name N)
      ! 1.0 119 24 2

!Talos derived psi restraint d:
!assign (resid   112 and name N)
      ! (resid   112 and name CA)
      ! (resid   112 and name C)
      ! (resid   113 and name N)
      ! 1.0 128 24 2

!Talos derived psi restraint d:
!assign (resid   113 and name N)
       !(resid   113 and name CA)
       !(resid   113 and name C)
       !(resid   114 and name N)
      ! 1.0 124 30 2

!Talos derived psi restraint d:
!assign (resid   114 and name N)
       !(resid   114 and name CA)
       !(resid   114 and name C)
       !(resid   115 and name N)
       ! 1.0 128 44 2


# Restraints file 6: msi2_center.tbl
?! center average distance constraints to force protons over
! aromatic ring currents.  MUST use CENTER averaging for these



!Q35 over W34 ring
assign (resid 35 and name HG1) (resid 34 and (name CD1 or name CH2 or name CZ3)) 2.0 0.0 1.5 
assign (resid 35 and name HG2) (resid 34 and (name CD1 or name CH2 or name CZ3)) 2.0 0.0 1.5 

!V71 over F73 ring
assign (resid 71 and name HG1#) (resid 73 and (name CD2 or name CE1)) 2.5 0.0 1.5

!V82 over F48 ring
assign (resid 82 and name HG2#) (resid 48 and (name CD2 or name CE1)) 2.5 0.0 1.5
assign (resid 82 and name HA) (resid 48 and (name CD2 or name CE1)) 2.5 0.0 1.5

!M57 over F68 ring
assign (resid 57 and name HB1) (resid 68 and (name CD2 or name CE1)) 2.5 0.0 1.5
assign (resid 57 and name HB2) (resid 68 and (name CD2 or name CE1)) 2.5 0.0 1.5








# Restraints file 7: 13Cmaster.tbl
?
!E16
assign (resid   16 and name   HG#) (resid  16 and name  HB#) 2.0 0.5 0.7
assign (resid   16 and name   HG#) (resid  16 and name  HA) 2.0 0.5 1.3

!N17
assign (resid   17 and name   HB#) (resid  17 and name  HD21) 2.0 0.5 0.7
assign (resid   17 and name   HB#) (resid  17 and name  HA) 2.0 0.5 0.7

!Y19
assign (resid   19 and name   HB#) (resid  19 and name  HD#) 2.0 0.5 0.7
assign (resid   19 and name   HB#) (resid  19 and name  HE#) 2.0 0.5 2.0

!F20
assign (resid   20 and name   HB#) (resid  20 and name  HA) 2.0 0.5 0.7
assign (resid   20 and name   HB#) (resid  21 and name  HA) 2.0 0.5 2.5

!A24
assign (resid   24 and name   HA) (resid  25 and name  HN) 2.0 0.5 0.7
assign (resid   24 and name   HA) (resid  25 and name  HA#) 2.0 0.5 3.5
assign (resid   24 and name   HA) (resid  23 and name  HN) 2.0 0.5 3.5
assign (resid   24 and name   HA) (resid  24 and name  HB#) 2.0 0.5 0.7

!G25
assign (resid   25 and name   HA#) (resid  79 and name  HG2#) 2.0 0.5 1.3 

!K26
assign (resid   26 and name   HA) (resid  26 and name  HE#) 2.0 0.5 3.5
assign (resid   26 and name   HA) (resid  26 and name  HG#) 2.0 0.5 1.3
assign (resid   26 and name   HA) (resid  26 and name  HD#) 2.0 0.5 3.5
assign (resid   26 and name   HA) (resid  26 and name  HB#) 2.0 0.5 0.7
assign (resid   26 and name   HA) (resid  26 and name  HN) 2.0 0.5 1.3
assign (resid   26 and name   HA) (resid  72 and name  HA) 2.0 0.5 0.7

assign (resid   26 and name   HB#) (resid  26 and name  HG#) 2.0 0.5 0.7
assign (resid   26 and name   HG#) (resid  26 and name  HD#) 2.0 0.5 0.7
assign (resid   26 and name   HD#) (resid  26 and name  HE#) 2.0 0.5 0.7

!M27
assign (resid   27 and name   HA) (resid  99 and name  HA) 2.0 0.5 0.7
assign (resid   27 and name   HA) (resid  28 and name  HN) 2.0 0.5 0.7
assign (resid   27 and name   HA) (resid  27 and name  HN) 2.0 0.5 1.3
assign (resid   27 and name   HA) (resid  27 and name  HG#) 2.0 0.5 1.3
assign (resid   27 and name   HA) (resid  99 and name  HG2#) 2.0 0.5 2.0
assign (resid   27 and name   HA) (resid  99 and name  HG1#) 2.0 0.5 2.0

assign (resid   27 and name   HE#) (resid  27 and name  HB#) 2.0 0.5 0.7
assign (resid   27 and name   HE#) (resid  29 and name  HD1#) 2.0 0.5 3.5
assign (resid   27 and name   HE#) (resid  82 and name  HG1#) 2.0 0.5 1.3
assign (resid   27 and name   HE#) (resid  83 and name  HD2#) 2.0 0.5 1.3 

!F28
assign (resid   28 and name   HA) (resid  28 and name  HN) 2.0 0.5 1.3
assign (resid   28 and name   HA) (resid  28 and name  HB#) 2.0 0.5 1.3
assign (resid   28 and name   HA) (resid  70 and name  HD#) 2.0 0.5 0.7

assign (resid   28 and name   HD#) (resid  70 and name  HA) 2.0 0.5 2.0
assign (resid   28 and name   HD#) (resid  28 and name  HB#) 2.0 0.5 0.7

assign (resid   28 and name   HE#) (resid  28 and name  HB#) 2.0 0.5 3.5

!I29
assign (resid   29 and name   HD1#) (resid  97 and name  HA) 2.0 0.5 1.3
assign (resid   29 and name   HD1#) (resid  29 and name  HG1#) 2.0 0.5 0.7
assign (resid   29 and name   HD1#) (resid  29 and name  HG2#) 2.0 0.5 0.7
assign (resid   29 and name   HD1#) (resid  29 and name  HA) 2.0 0.5 0.7

assign (resid   29 and name   HG2#) (resid  29 and name  HA) 2.0 0.5 0.7
assign (resid   29 and name   HG2#) (resid  29 and name  HB) 2.0 0.5 0.7

assign (resid   29 and name   HB) (resid  41 and name  HD1#) 2.0 0.5 2.0
assign (resid   29 and name   HB) (resid  29 and name  HG1#) 2.0 0.5 0.7


assign (resid   29 and name   HA) (resid  97 and name  HA) 2.0 0.5 0.7
assign (resid   29 and name   HA) (resid  30 and name  HN) 2.0 0.5 0.7
assign (resid   29 and name   HA) (resid  29 and name  HB) 2.0 0.5 0.7

!G30
assign (resid   30 and name   HA2) (resid  28 and name  HE#) 2.0 0.5 3.5 
assign (resid   30 and name   HA2) (resid  30 and name  HA1) 2.0 0.5 0.7
assign (resid   30 and name   HA2) (resid  68 and name  HB#) 2.0 0.5 1.3 

assign (resid   30 and name   HA1) (resid  68 and name  HB#) 2.0 0.5 2.0 
assign (resid   30 and name   HA1) (resid  28 and name  HE#) 2.0 0.5 3.5

!G31
assign (resid   31 and name   HA1) (resid  31 and name  HA2) 2.0 0.5 0.7
assign (resid   31 and name   HA#) (resid  32 and name  HN) 2.0 0.5 1.3

!L32
assign (resid   32 and name   HA) (resid  33 and name  HA) 2.0 0.5 2.5
assign (resid   32 and name   HA) (resid  32 and name  HB#) 2.0 0.5 1.3
assign (resid   32 and name   HA) (resid  95 and name  HG2#) 2.0 0.5 1.3
assign (resid   32 and name   HA) (resid  32 and name  HD2#) 2.0 0.5 0.7
assign (resid   32 and name   HA) (resid  32 and name  HN) 2.0 0.5 0.7

assign (resid   32 and name   HB#) (resid  32 and name  HG#) 2.0 0.5 0.7

!S33
assign (resid   33 and name   HA) (resid  33 and name  HB1) 2.0 0.5 1.3
assign (resid   33 and name   HA) (resid  33 and name  HB2) 2.0 0.5 1.3

!W34
assign (resid   34 and name   HA) (resid  34 and name  HD1) 2.0 0.5 2.0
assign (resid   34 and name   HA) (resid  34 and name  HB#) 2.0 0.5 0.7


assign (resid   34 and name   HZ2) (resid  34 and name  HH2) 2.0 0.5 0.7

!Q35
assign (resid   35 and name   HA) (resid  35 and name  HB#) 2.0 0.5 0.7

assign (resid   35 and name   HB#) (resid  35 and name  HG#) 2.0 0.5 0.7

!T36
assign (resid   36 and name   HA) (resid  37 and name  HN) 2.0 0.5 0.7
assign (resid   36 and name   HA) (resid  36 and name  HG2#) 2.0 0.5 0.7
assign (resid   36 and name   HA) (resid  36 and name  HB) 2.0 0.5 0.7

!S37
assign (resid   37 and name   HA) (resid  38 and name  HD#) 2.0 0.5 0.7

!P38
assign (resid   38 and name   HA) (resid  56 and name  HG2#) 2.0 0.5 1.3
assign (resid   38 and name   HA) (resid  56 and name  HG1#) 2.0 0.5 3.5
assign (resid   38 and name   HA) (resid  56 and name  HB) 2.0 0.5 2.0
assign (resid   38 and name   HA) (resid  38 and name  HB#) 2.0 0.5 0.7
assign (resid   38 and name   HA) (resid  38 and name  HG#) 2.0 0.5 2.0
assign (resid   38 and name   HA) (resid  38 and name  HD#) 2.0 0.5 2.0
assign (resid   38 and name   HA) (resid  39 and name  HB#) 2.0 0.5 3.5

assign (resid   38 and name   HB#) (resid  38 and name  HG#) 2.0 0.5 0.7
assign (resid   38 and name   HG#) (resid  38 and name  HD#) 2.0 0.5 0.7

!D39
assign (resid   39 and name   HA) (resid  39 and name  HB2) 2.0 0.5 0.7
assign (resid   39 and name   HA) (resid  39 and name  HB1) 2.0 0.5 1.3

!S40
assign (resid   40 and name   HA) (resid  43 and name  HB#) 2.0 0.5 1.3
assign (resid   40 and name   HA) (resid  40 and name  HB#) 2.0 0.5 0.7

!L41
assign (resid   41 and name   HA) (resid  41 and name  HG) 2.0 0.5 1.3
assign (resid   41 and name   HG) (resid  41 and name  HD1#) 2.0 0.5 0.7

!R42
assign (resid   42 and name   HA) (resid  42 and name  HB#) 2.0 0.5 1.3
assign (resid   42 and name   HA) (resid  42 and name  HG#) 2.0 0.5 1.3

assign (resid   42 and name   HB#) (resid  42 and name  HG#) 2.0 0.5 0.7

!D43
assign (resid   43 and name   HA) (resid  43 and name  HB#) 2.0 0.5 1.3

!Y44
assign (resid   44 and name   HA) (resid  44 and name  HD#) 2.0 0.5 0.7
assign (resid   44 and name   HD#) (resid  44 and name  HE#) 2.0 0.5 0.7
assign (resid   44 and name   HD#) (resid  44 and name  HN) 2.0 0.5 3.5
assign (resid   44 and name   HD#) (resid  44 and name  HB1) 2.0 0.5 1.3
assign (resid   44 and name   HD#) (resid  44 and name  HB2) 2.0 0.5 0.7
assign (resid   44 and name   HD#) (resid  90 and name  HD1#) 2.0 0.5 2.0
assign (resid   44 and name   HE#) (resid  95 and name  HD1#) 2.0 0.5 3.5


!F45
assign (resid   45 and name   HA) (resid  45 and name  HB1) 2.0 0.5 0.7
assign (resid   45 and name   HA) (resid  45 and name  HB2) 2.0 0.5 0.7
assign (resid   45 and name   HD#) (resid  45 and name  HE#) 2.0 0.5 0.7
assign (resid   45 and name   HD#) (resid  45 and name  HN) 2.0 0.5 2.0
assign (resid   45 and name   HD#) (resid  45 and name  HZ) 2.0 0.5 2.0
assign (resid   45 and name   HD#) (resid  45 and name  HB#) 2.0 0.5 1.3
assign (resid   45 and name   HD#) (resid  45 and name  HA) 2.0 0.5 3.5
assign (resid   45 and name   HE#) (resid  45 and name  HZ) 2.0 0.5 0.7



!S46
assign (resid   46 and name   HA) (resid  45 and name  HN) 2.0 0.5 3.5
assign (resid   46 and name   HA) (resid  46 and name  HN) 2.0 0.5 0.7
assign (resid   46 and name   HA) (resid  49 and name  HN) 2.0 0.5 1.3
assign (resid   46 and name   HA) (resid  47 and name  HN) 2.0 0.5 1.3
assign (resid   46 and name   HA) (resid  46 and name  HB#) 2.0 0.5 0.7
assign (resid   46 and name   HA) (resid  51 and name  HD1#) 2.0 0.5 1.3
assign (resid   46 and name   HA) (resid  51 and name  HG1#) 2.0 0.5 2.0
assign (resid   46 and name   HA) (resid  48 and name  HN) 2.0 0.5 2.0


!K47
assign (resid   47 and name   HA) (resid  47 and name  HB#) 2.0 0.5 0.7
assign (resid   47 and name   HB#) (resid  47 and name  HG#) 2.0 0.5 0.7
assign (resid   47 and name   HD#) (resid  47 and name  HE#) 2.0 0.5 0.7

!F48
assign (resid   48 and name   HA) (resid  48 and name  HD#) 2.0 0.5 1.3 
assign (resid   48 and name   HA) (resid  48 and name  HE#) 2.0 0.5 3.5
assign (resid   48 and name   HD#) (resid  48 and name  HE#) 2.0 0.5 0.7
assign (resid   48 and name   HE#) (resid  48 and name  HZ) 2.0 0.5 0.7
assign (resid   48 and name   HB#) (resid  48 and name  HD#) 2.0 0.5 1.3
assign (resid   48 and name   HD#) (resid  82 and name  HG2#) 2.0 0.5 2.0
assign (resid   48 and name   HA) (resid  48 and name  HB1) 2.0 0.5 0.7
assign (resid   48 and name   HA) (resid  48 and name  HB2) 2.0 0.5 0.7

!G49
assign (resid   49 and name   HA1) (resid  49 and name  HA2) 2.0 0.5 0.7
assign (resid   49 and name   HA#) (resid  73 and name  HD#) 2.0 0.5 1.3
assign (resid   49 and name   HA#) (resid  50 and name  HB#) 2.0 0.5 3.5
assign (resid   49 and name   HA#) (resid  73 and name  HB#) 2.0 0.5 3.5

!E50
assign (resid   50 and name   HA) (resid  50 and name  HB#) 2.0 0.5 1.3
assign (resid   50 and name   HB#) (resid  50 and name  HG#) 2.0 0.5 0.7

!I51
assign (resid   51 and name   HD1#) (resid  73 and name  HA) 2.0 0.5 3.5
assign (resid   51 and name   HD1#) (resid  42 and name  HA) 2.0 0.5 0.7
assign (resid   51 and name   HD1#) (resid  42 and name  HD#) 2.0 0.5 3.5
assign (resid   51 and name   HD1#) (resid  42 and name  HG#) 2.0 0.5 1.3
assign (resid   51 and name   HD1#) (resid  51 and name  HB) 2.0 0.5 0.7
assign (resid   51 and name   HD1#) (resid  51 and name  HG11) 2.0 0.5 0.7
assign (resid   51 and name   HD1#) (resid  51 and name  HG12) 2.0 0.5 0.7
assign (resid   51 and name   HD1#) (resid  71 and name  HA) 2.0 0.5 3.5

assign (resid   51 and name   HA) (resid  51 and name  HB) 2.0 0.5 0.7
assign (resid   51 and name   HB) (resid  51 and name  HG11) 2.0 0.5 0.7
assign (resid   51 and name   HB) (resid  51 and name  HG12) 2.0 0.5 0.7
assign (resid   51 and name   HG1#) (resid  51 and name  HG2#) 2.0 0.5 0.7
assign (resid   51 and name   HG1#) (resid  51 and name  HD1#) 2.0 0.5 0.7

!R52
assign (resid   52 and name   HA) (resid  52 and name  HB#) 2.0 0.5 0.7
assign (resid   52 and name   HB#) (resid  52 and name  HG#) 2.0 0.5 0.7
assign (resid   52 and name   HG#) (resid  52 and name  HD#) 2.0 0.5 0.7

!E53
assign (resid   53 and name   HA) (resid  54 and name  HN) 2.0 0.5 0.7
assign (resid   53 and name   HA) (resid  53 and name  HB#) 2.0 0.5 1.3

!C54
assign (resid   54 and name   HB#) (resid  54 and name  HA) 2.0 0.5 0.7
assign (resid   54 and name   HB#) (resid  71 and name  HB) 2.0 0.5 3.5
assign (resid   54 and name   HB#) (resid  71 and name  HA) 2.0 0.5 1.3

assign (resid   54 and name   HA) (resid  54 and name  HN) 2.0 0.5 0.7
assign (resid   54 and name   HA) (resid  72 and name  HN) 2.0 0.5 1.3

!M55
assign (resid   55 and name   HA) (resid  55 and name  HB1) 2.0 0.5 0.7
assign (resid   55 and name   HA) (resid  55 and name  HB2) 2.0 0.5 0.7
assign (resid   55 and name   HB#) (resid  55 and name  HG#) 2.0 0.5 0.7
assign (resid   55 and name   HE#) (resid  55 and name  HG#) 2.0 0.5 1.3
assign (resid   55 and name   HE#) (resid  70 and name  HN) 2.0 0.5 3.5
assign (resid   55 and name   HE#) (resid  70 and name  HD#) 2.0 0.5 2.0


!V56
assign (resid   56 and name   HA) (resid  56 and name  HB) 2.0 0.5 0.7
assign (resid   56 and name   HA) (resid  56 and name  HG2#) 2.0 0.5 1.3
assign (resid   56 and name   HA) (resid  56 and name  HG1#) 2.0 0.5 0.7
assign (resid   56 and name   HB) (resid  56 and name  HG1#) 2.0 0.5 0.7
assign (resid   56 and name   HB) (resid  56 and name  HG2#) 2.0 0.5 0.7

!M57
assign (resid   57 and name   HE#) (resid  57 and name  HG#) 2.0 0.5 0.7
assign (resid   57 and name   HA) (resid  57 and name  HB#) 2.0 0.5 0.7
assign (resid   57 and name   HB#) (resid  57 and name  HG#) 2.0 0.5 0.7

!R58
assign (resid   58 and name   HA) (resid  58 and name  HB#) 2.0 0.5 0.7
assign (resid   58 and name   HB#) (resid  58 and name  HG#) 2.0 0.5 0.7
assign (resid   58 and name   HG#) (resid  58 and name  HD#) 2.0 0.5 0.7
assign (resid   58 and name   HA) (resid  58 and name  HD#) 2.0 0.5 2.0
assign (resid   58 and name   HA) (resid  58 and name  HG#) 2.0 0.5 0.7


!D59
assign (resid   59 and name   HA) (resid  59 and name  HB2) 2.0 0.5 0.7
assign (resid   59 and name   HA) (resid  59 and name  HB1) 2.0 0.5 0.7
assign (resid   59 and name   HA) (resid  60 and name  HD#) 2.0 0.5 0.7

!P60
assign (resid   60 and name   HA) (resid  60 and name  HB#) 2.0 0.5 0.7
assign (resid   60 and name   HB#) (resid 60 and name  HG#) 2.0 0.5 0.7
assign (resid   60 and name   HG#) (resid 60 and name  HD#) 2.0 0.5 0.7

!T61
assign (resid   61 and name   HA) (resid  61 and name  HB) 2.0 0.5 0.7
assign (resid   61 and name   HA) (resid  61 and name  HG2#) 2.0 0.5 0.7
assign (resid   61 and name   HB) (resid  61 and name  HG2#) 2.0 0.5 0.7

!T62
assign (resid   62 and name   HA) (resid  62 and name  HB) 2.0 0.5 0.7
assign (resid   62 and name   HA) (resid  62 and name  HG2#) 2.0 0.5 0.7
assign (resid   62 and name   HB) (resid  62 and name  HG2#) 2.0 0.5 0.7

!K63
assign (resid   63 and name   HA) (resid  63 and name  HB#) 2.0 0.5 0.7
assign (resid   63 and name   HB#) (resid  63 and name  HG#) 2.0 0.5 0.7
assign (resid   63 and name   HD#) (resid  63 and name  HE#) 2.0 0.5 0.7

!R64
assign (resid   64 and name   HA) (resid  64 and name  HB#) 2.0 0.5 0.7
assign (resid   64 and name   HB#) (resid  64 and name  HG#) 2.0 0.5 0.7
assign (resid   64 and name   HG#) (resid  64 and name  HD#) 2.0 0.5 0.7

!S65
assign (resid   65 and name   HA) (resid  65 and name  HB#) 2.0 0.5 1.3

!R66

assign (resid   66 and name   HA) (resid  66 and name  HB#) 2.0 0.5 0.7
assign (resid   66 and name   HB#) (resid  66 and name  HG#) 2.0 0.5 0.7
assign (resid   66 and name   HG#) (resid  66 and name  HD#) 2.0 0.5 0.7

!G67

!F68
assign (resid   68 and name   HA) (resid  32 and name  HD1#) 2.0 0.5 1.3
assign (resid   68 and name   HA) (resid  32 and name  HG) 2.0 0.5 0.7
assign (resid   68 and name   HA) (resid  32 and name  HB#) 2.0 0.5 2.0
assign (resid   68 and name   HA) (resid  30 and name  HA#) 2.0 0.5 1.3
assign (resid   68 and name   HA) (resid  68 and name  HD#) 2.0 0.5 1.3
assign (resid   68 and name   HA) (resid  68 and name  HB#) 2.0 0.5 1.3

assign (resid   68 and name   HD#) (resid  68 and name  HE#) 2.0 0.5 0.7
assign (resid   68 and name   HE#) (resid  68 and name  HZ) 2.0 0.5 0.7


!G69
assign (resid   69 and name   HA1) (resid  32 and name  HD2#) 2.0 0.5 3.5 
assign (resid   69 and name   HA1) (resid  32 and name  HD1#) 2.0 0.5 1.3
assign (resid   69 and name   HA1) (resid  41 and name  HD1#) 2.0 0.5 3.5
assign (resid   69 and name   HA1) (resid  68 and name  HD#) 2.0 0.5 2.5
assign (resid   69 and name   HA1) (resid  70 and name  HD#) 2.0 0.5 2.0
assign (resid   69 and name   HA1) (resid  56 and name  HG2#) 2.0 0.5 1.3
assign (resid   69 and name   HA1) (resid  56 and name  HG1#) 2.0 0.5 2.0

assign (resid   69 and name   HA2) (resid  69 and name  HA1) 2.0 0.5 0.7
assign (resid   69 and name   HA2) (resid  56 and name  HG2#) 2.0 0.5 2.0
assign (resid   69 and name   HA2) (resid  56 and name  HG1#) 2.0 0.5 2.0
assign (resid   69 and name   HA2) (resid  70 and name  HD#) 2.0 0.5 1.3

!F70
assign (resid   70 and name   HA) (resid  29 and name  HG12) 2.0 0.5 3.5
assign (resid   70 and name   HA) (resid  29 and name  HG11) 2.0 0.5 3.5
assign (resid   70 and name   HA) (resid  71 and name  HA) 2.0 0.5 2.5
assign (resid   70 and name   HA) (resid  70 and name  HB2) 2.0 0.5 0.7
assign (resid   70 and name   HA) (resid  70 and name  HB1) 2.0 0.5 1.3
assign (resid   70 and name   HA) (resid  70 and name  HD#) 2.0 0.5 1.3
assign (resid   70 and name   HA) (resid  28 and name  HA) 2.0 0.5 0.7
assign (resid   70 and name   HA) (resid  69 and name  HA1) 2.0 0.5 2.5
assign (resid   70 and name   HA) (resid  69 and name  HA2) 2.0 0.5 2.5
assign (resid   70 and name   HA) (resid  29 and name  HD1#) 2.0 0.5 3.5
assign (resid   70 and name   HA) (resid  29 and name  HB) 2.0 0.5 3.5

assign (resid   70 and name   HD#) (resid  70 and name  HE#) 2.0 0.5 0.7
assign (resid   70 and name   HD#) (resid  70 and name  HN) 2.0 0.5 0.7
assign (resid   70 and name   HD#) (resid  70 and name  HB1) 2.0 0.5 0.7
assign (resid   70 and name   HD#) (resid  70 and name  HB2) 2.0 0.5 0.7
assign (resid   70 and name   HD#) (resid  71 and name  HN) 2.0 0.5 2.0

assign (resid   70 and name   HD#) (resid  68 and name  HD#) 2.0 0.5 2.0 

!V71
assign (resid   71 and name   HA) (resid  54 and name  HA) 2.0 0.5 0.7
assign (resid   71 and name   HA) (resid  71 and name  HB) 2.0 0.5 1.3
assign (resid   71 and name   HA) (resid  71 and name  HG1#) 2.0 0.5 0.7
assign (resid   71 and name   HA) (resid  72 and name  HG1#) 2.0 0.5 0.7
assign (resid   71 and name   HA) (resid  41 and name  HD1#) 2.0 0.5 3.5

assign (resid   71 and name   HG1#) (resid  42 and name  HN) 2.0 0.5 3.5
assign (resid   71 and name   HG1#) (resid  71 and name  HA) 2.0 0.5 1.3
assign (resid   71 and name   HG1#) (resid  71 and name  HB) 2.0 0.5 1.3
assign (resid   71 and name   HG1#) (resid  71 and name  HG2#) 2.0 0.5 0.7
assign (resid   71 and name   HG1#) (resid  51 and name  HG2#) 2.0 0.5 0.7
assign (resid   71 and name   HG1#) (resid  51 and name  HD1#) 2.0 0.5 0.7

assign (resid   71 and name   HG1#) (resid  51 and name  HG11) 2.0 0.5 1.3 
assign (resid   71 and name   HG1#) (resid  51 and name  HB) 2.0 0.5 3.5 
assign (resid   71 and name   HG1#) (resid  51 and name  HA) 2.0 0.5 2.0 
assign (resid   71 and name   HG1#) (resid  73 and name  HD#) 2.0 0.5 2.0 
assign (resid   71 and name   HG1#) (resid  45 and name  HB1) 2.0 0.5 1.3
assign (resid   71 and name   HG1#) (resid  45 and name  HB2) 2.0 0.5 1.3
assign (resid   71 and name   HG1#) (resid  54 and name  HB#) 2.0 0.5 1.3
assign (resid   71 and name   HG1#) (resid  54 and name  HA) 2.0 0.5 3.5
assign (resid   71 and name   HG1#) (resid  70 and name  HA) 2.0 0.5 3.5
assign (resid   71 and name   HG1#) (resid  73 and name  HE#) 2.0 0.5 3.5

assign (resid   71 and name   HG2#) (resid  41 and name  HB#) 2.0 0.5 1.3
assign (resid   71 and name   HG2#) (resid  41 and name  HD1#) 2.0 0.5 0.7
assign (resid   71 and name   HG2#) (resid  41 and name  HA) 2.0 0.5 3.5
assign (resid   71 and name   HG2#) (resid  45 and name  HD#) 2.0 0.5 1.3
assign (resid   71 and name   HG1#) (resid  45 and name  HB1) 2.0 0.5 2.0
assign (resid   71 and name   HG2#) (resid  45 and name  HB2) 2.0 0.5 2.0
assign (resid   71 and name   HG2#) (resid  45 and name  HA) 2.0 0.5 3.5
assign (resid   71 and name   HG2#) (resid  54 and name  HA) 2.0 0.5 3.5
assign (resid   71 and name   HG2#) (resid  54 and name  HB#) 2.0 0.5 1.3
assign (resid   71 and name   HG2#) (resid  71 and name  HB) 2.0 0.5 1.3
assign (resid   71 and name   HG2#) (resid  71 and name  HA) 2.0 0.5 0.7 
assign (resid   71 and name   HG2#) (resid  29 and name  HD1#) 2.0 0.5 2.0

!T72
assign (resid   72 and name   HA) (resid  72 and name  HB) 2.0 0.5 0.7
assign (resid   72 and name   HB) (resid  72 and name  HG2#) 2.0 0.5 0.7

!F73
assign (resid   73 and name   HA) (resid  73 and name  HD#) 2.0 0.5 1.3
assign (resid   73 and name   HA) (resid  74 and name  HN) 2.0 0.5 0.7
assign (resid   73 and name   HA) (resid  51 and name  HG2#) 2.0 0.5 1.3
assign (resid   73 and name   HA) (resid  73 and name  HB#) 2.0 0.5 1.3
assign (resid   73 and name   HA) (resid  51 and name  HA) 2.0 0.5 0.7

assign (resid   73 and name   HD#) (resid  73 and name  HE#) 2.0 0.5 0.7


!A74
assign (resid   74 and name   HA) (resid  52 and name  HN) 2.0 0.5 3.5
assign (resid   74 and name   HA) (resid  74 and name  HB#) 2.0 0.5 0.7

!D75
assign (resid   75 and name   HA) (resid  73 and name  HB#) 2.0 0.5 3.5
assign (resid   75 and name   HA) (resid  76 and name  HD#) 2.0 0.5 0.7
assign (resid   75 and name   HA) (resid  76 and name  HG#) 2.0 0.5 2.5
assign (resid   75 and name   HA) (resid  75 and name  HB#) 2.0 0.5 1.3

!P76
assign (resid   76 and name   HA) (resid  76 and name  HB1) 2.0 0.5 0.7
assign (resid   76 and name   HA) (resid  76 and name  HB2) 2.0 0.5 0.7
assign (resid   76 and name   HB1) (resid  76 and name  HG#) 2.0 0.5 0.7
assign (resid   76 and name   HB2) (resid  76 and name  HG#) 2.0 0.5 0.7
assign (resid   76 and name   HB2) (resid  76 and name  HD#) 2.0 0.5 2.0

!A77
assign (resid   77 and name   HB#) (resid  80 and name  HB#) 2.0 0.5 3.5
assign (resid   77 and name   HB#) (resid  77 and name  HA) 2.0 0.5 0.7
assign (resid   77 and name   HB#) (resid  81 and name  HE#) 2.0 0.5 2.0

assign (resid   77 and name   HA) (resid  80 and name  HB#) 2.0 0.5 1.3

!S78
assign (resid   78 and name   HA) (resid  78 and name  HB1) 2.0 0.5 1.3
assign (resid   78 and name   HA) (resid  78 and name  HB2) 2.0 0.5 0.7

!V79
assign (resid   79 and name   HA) (resid  82 and name  HG2#) 2.0 0.5 2.0
assign (resid   79 and name   HA) (resid  82 and name  HG1#) 2.0 0.5 3.5
assign (resid   79 and name   HA) (resid  79 and name  HG1#) 2.0 0.5 0.7
assign (resid   79 and name   HA) (resid  79 and name  HG2#) 2.0 0.5 0.7
assign (resid   79 and name   HA) (resid  99 and name  HG2#) 2.0 0.5 2.0
assign (resid   79 and name   HA) (resid  82 and name  HB) 2.0 0.5 1.3

assign (resid   79 and name   HB) (resid  79 and name  HG1#) 2.0 0.5 0.7
assign (resid   79 and name   HB) (resid  79 and name  HG2#) 2.0 0.5 0.7

!D80
assign (resid   80 and name   HA) (resid  80 and name  HB#) 2.0 0.5 1.3

!K81
assign (resid   81 and name   HA) (resid  81 and name  HB#) 2.0 0.5 0.7
assign (resid   81 and name   HB#) (resid  81 and name  HG#) 2.0 0.5 0.7
assign (resid   81 and name   HG#) (resid  81 and name  HD#) 2.0 0.5 0.7
assign (resid   81 and name   HD#) (resid  81 and name  HE#) 2.0 0.5 0.7

!V82
assign (resid   82 and name   HG1#) (resid  82 and name  HB) 2.0 0.5 0.7
assign (resid   82 and name   HG1#) (resid  82 and name  HA) 2.0 0.5 0.7

assign (resid   82 and name   HG2#) (resid  82 and name  HA) 2.0 0.5 0.7
assign (resid   82 and name   HG2#) (resid  82 and name  HB) 2.0 0.5 0.7

assign (resid   82 and name   HA) (resid  85 and name  HN) 2.0 0.5 1.3

!L83
assign (resid   83 and name   HA) (resid  83 and name  HB#) 2.0 0.5 0.7
assign (resid   83 and name   HB#) (resid  83 and name  HG#) 2.0 0.5 0.7
assign (resid   83 and name   HG#) (resid  83 and name  HD1#) 2.0 0.5 0.7
assign (resid   83 and name   HG#) (resid  83 and name  HD2#) 2.0 0.5 0.7

!G84
assign (resid   84 and name   HA1) (resid  84 and name  HA2) 2.0 0.5 0.7

!Q85
assign (resid   85 and name   HA) (resid  85 and name  HG#) 2.0 0.5 0.7
assign (resid   85 and name   HA) (resid  85 and name  HB#) 2.0 0.5 0.7
assign (resid   85 and name   HA) (resid  86 and name  HD#) 2.0 0.5 0.7

!P86
assign (resid   86 and name   HA) (resid  86 and name  HB#) 2.0 0.5 0.7
assign (resid   86 and name   HB#) (resid  86 and name  HG#) 2.0 0.5 0.7
assign (resid   86 and name   HG#) (resid  86 and name  HD#) 2.0 0.5 0.7

!H87
assign (resid   87 and name   HA) (resid  87 and name  HB#) 2.0 0.5 0.7

!H88
assign (resid   88 and name   HA) (resid  88 and name  HB1) 2.0 0.5 1.3
assign (resid   88 and name   HA) (resid  88 and name  HB2) 2.0 0.5 0.7

!E89
assign (resid   89 and name   HA) (resid  89 and name  HG#) 2.0 0.5 0.7
assign (resid   89 and name   HA) (resid  89 and name  HB#) 2.0 0.5 0.7
assign (resid   89 and name   HA) (resid  89 and name  HN) 2.0 0.5 0.7
assign (resid   89 and name   HA) (resid  93 and name  HN) 2.0 0.5 3.5
assign (resid   89 and name   HA) (resid  94 and name  HA) 2.0 0.5 0.7

assign (resid   89 and name   HB#) (resid  89 and name  HN) 2.0 0.5 1.3

!L90
assign (resid   90 and name   HA) (resid  90 and name  HD1#) 2.0 0.5 0.7
assign (resid   90 and name   HA) (resid  90 and name  HG) 2.0 0.5 1.3

assign (resid   90 and name   HD2#) (resid  90 and name  HD1#) 2.0 0.5 0.7
assign (resid   90 and name   HD2#) (resid  36 and name  HG2#) 2.0 0.5 1.3

assign (resid   90 and name   HD1#) (resid  44 and name  HB#) 2.0 0.5 2.0

!D91
assign (resid   91 and name   HA) (resid  91 and name  HB#) 2.0 0.5 1.3

!S92
assign (resid   92 and name   HA) (resid  92 and name  HB#) 2.0 0.5 1.3

!K93

assign (resid   93 and name   HA) (resid  93 and name  HB#) 2.0 0.5 0.7
assign (resid   93 and name   HB#) (resid  93 and name  HG#) 2.0 0.5 0.7
assign (resid   93 and name   HG#) (resid  93 and name  HD#) 2.0 0.5 0.7
assign (resid   93 and name   HD#) (resid  93 and name  HE#) 2.0 0.5 0.7

!T94
assign (resid   94 and name   HA) (resid  94 and name  HG2#) 2.0 0.5 0.7
assign (resid   94 and name   HA) (resid  89 and name  HB#) 2.0 0.5 3.5
assign (resid   94 and name   HA) (resid  95 and name  HA) 2.0 0.5 2.5

!I95
assign (resid   95 and name   HD1#) (resid  32 and name  HA) 2.0 0.5 0.7
assign (resid   95 and name   HD1#) (resid  90 and name  HD2#) 2.0 0.5 2.0
assign (resid   95 and name   HD1#) (resid  90 and name  HG) 2.0 0.5 3.5
assign (resid   95 and name   HD1#) (resid  95 and name  HG2#) 2.0 0.5 2.0


assign (resid   95 and name   HA) (resid  95 and name  HB) 2.0 0.5 0.7
assign (resid   95 and name   HB) (resid  95 and name  HG11) 2.0 0.5 0.7
assign (resid   95 and name   HB) (resid  95 and name  HG12) 2.0 0.5 0.7
assign (resid   95 and name   HB) (resid  95 and name  HG2#) 2.0 0.5 0.7



!D96
assign (resid   96 and name   HA) (resid  97 and name  HD#) 2.0 0.5 0.7
assign (resid   96 and name   HA) (resid  97 and name  HB#) 2.0 0.5 3.5
assign (resid   96 and name   HA) (resid  96 and name  HB#) 2.0 0.5 1.3

!P97
assign (resid   97 and name   HA) (resid  30 and name  HN) 2.0 0.5 1.3
assign (resid   97 and name   HA) (resid  98 and name  HB#) 2.0 0.5 3.5

assign (resid   97 and name   HA) (resid  97 and name  HB#) 2.0 0.5 0.7
assign (resid   97 and name   HB#) (resid  97 and name  HG#) 2.0 0.5 0.7
assign (resid   97 and name   HG#) (resid  97 and name  HD#) 2.0 0.5 0.7

!K98

assign (resid   98 and name   HA) (resid  98 and name  HB#) 2.0 0.5 0.7
assign (resid   98 and name   HB#) (resid  98 and name  HG#) 2.0 0.5 0.7
assign (resid   98 and name   HG#) (resid  98 and name  HD#) 2.0 0.5 0.7
assign (resid   98 and name   HD#) (resid  98 and name  HE#) 2.0 0.5 0.7

!V99

assign (resid   99 and name   HA) (resid  99 and name  HB#) 2.0 0.5 0.7
assign (resid   99 and name   HA) (resid  99 and name  HG1#) 2.0 0.5 1.3
assign (resid   99 and name   HA) (resid  99 and name  HG2#) 2.0 0.5 1.3
assign (resid   99 and name   HB) (resid  99 and name  HG1#) 2.0 0.5 0.7
assign (resid   99 and name   HB) (resid  99 and name  HG2#) 2.0 0.5 0.7

!A100
assign (resid   100 and name   HA) (resid  100 and name  HB#) 2.0 0.5 0.7

!F101
assign (resid   101 and name   HA) (resid  101 and name  HB#) 2.0 0.5 1.3
assign (resid   101 and name   HD#) (resid  101 and name  HE#) 2.0 0.5 0.7
assign (resid   101 and name   HA) (resid  102 and name  HD#) 2.0 0.5 0.7

!P102
assign (resid   102 and name   HA) (resid  102 and name  HB#) 2.0 0.5 0.7
assign (resid   102 and name   HB#) (resid 102 and name  HG#) 2.0 0.5 0.7
assign (resid   102 and name   HG#) (resid 102 and name  HD#) 2.0 0.5 0.7

!R103
assign (resid   103 and name   HA) (resid  103 and name  HD#) 2.0 0.5 3.5
assign (resid   103 and name   HA) (resid  103 and name  HB#) 2.0 0.5 0.7
assign (resid   103 and name   HA) (resid  103 and name  HG#) 2.0 0.5 1.3

!A105
assign (resid   105 and name   HA) (resid  105 and name  HB#) 2.0 0.5 0.7

!Q106
assign (resid   106 and name   HA) (resid  107 and name  HD#) 2.0 0.5 0.7
assign (resid   106 and name   HA) (resid  106 and name  HB#) 2.0 0.5 0.7
assign (resid   106 and name   HA) (resid  106 and name  HG#) 2.0 0.5 1.3

!M109
assign (resid   109 and name   HE#) (resid  109 and name  HA) 2.0 0.5 3.5

!T111
assign (resid   111 and name   HB) (resid  111 and name  HG2#) 2.0 0.5 0.7











  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET  -3           H1       MET  -3  -2.456  24.597  34.069
    2    H2   MET  -3           H2       MET  -3  -3.957  25.319  34.358
    3    H3   MET  -3           H3       MET  -3  -2.622  25.736  35.308
    4    HA   MET  -3           HA       MET  -3  -3.107  27.463  33.707
    5    HB2  MET  -3           HB2      MET  -3  -0.671  26.442  34.335
    6    HB3  MET  -3           HB3      MET  -3  -0.625  26.314  32.583
    7    HG2  MET  -3           HG2      MET  -3   0.361  28.391  33.244
    8    HG3  MET  -3           HG3      MET  -3  -1.167  28.717  32.428
    9    HE1  MET  -3           HE1      MET  -3  -1.076  31.216  33.411
   10    HE2  MET  -3           HE2      MET  -3   0.434  30.835  34.238
   11    HE3  MET  -3           HE3      MET  -3  -0.897  31.574  35.129
   12    H    HIS  -2           H        HIS  -2  -2.418  24.323  32.214
   13    HA   HIS  -2           HA       HIS  -2  -3.614  25.300  29.702
   14    HB2  HIS  -2           HB2      HIS  -2  -1.472  23.230  30.182
   15    HB3  HIS  -2           HB3      HIS  -2  -2.342  23.347  28.656
   16    HD1  HIS  -2           HD1      HIS  -2   0.436  24.828  30.555
   17    HD2  HIS  -2           HD2      HIS  -2  -1.852  25.802  27.225
   18    HE1  HIS  -2           HE1      HIS  -2   1.708  26.648  29.373
   19    HE2  HIS  -2           HE2      HIS  -2   0.306  27.223  27.360
   20    H    HIS  -1           H        HIS  -1  -5.289  24.209  28.822
   21    HA   HIS  -1           HA       HIS  -1  -6.304  21.872  30.304
   22    HB2  HIS  -1           HB2      HIS  -1  -7.739  24.131  28.924
   23    HB3  HIS  -1           HB3      HIS  -1  -8.550  22.612  29.289
   24    HD1  HIS  -1           HD1      HIS  -1  -6.615  25.306  31.157
   25    HD2  HIS  -1           HD2      HIS  -1  -9.680  22.562  31.747
   26    HE1  HIS  -1           HE1      HIS  -1  -7.480  25.752  33.476
   27    HE2  HIS  -1           HE2      HIS  -1  -9.335  24.081  33.812
   28    H    HIS   0           H        HIS   0  -7.122  20.122  29.185
   29    HA   HIS   0           HA       HIS   0  -6.259  19.906  26.390
   30    HB2  HIS   0           HB2      HIS   0  -6.841  17.866  28.529
   31    HB3  HIS   0           HB3      HIS   0  -6.714  17.410  26.834
   32    HD1  HIS   0           HD1      HIS   0  -4.683  18.349  29.788
   33    HD2  HIS   0           HD2      HIS   0  -4.104  17.659  25.731
   34    HE1  HIS   0           HE1      HIS   0  -2.197  18.102  29.495
   35    HE2  HIS   0           HE2      HIS   0  -1.870  17.684  27.032
   36    H    HIS   1           H        HIS   1  -7.639  19.469  24.745
   37    HA   HIS   1           HA       HIS   1 -10.501  19.648  25.348
   38    HB2  HIS   1           HB2      HIS   1  -9.117  21.107  23.606
   39    HB3  HIS   1           HB3      HIS   1  -9.466  19.742  22.551
   40    HD1  HIS   1           HD1      HIS   1 -11.871  19.475  21.721
   41    HD2  HIS   1           HD2      HIS   1 -11.377  22.626  24.385
   42    HE1  HIS   1           HE1      HIS   1 -14.008  20.797  21.603
   43    HE2  HIS   1           HE2      HIS   1 -13.687  22.699  23.224
   44    H    HIS   2           H        HIS   2 -11.953  18.115  24.794
   45    HA   HIS   2           HA       HIS   2 -10.967  15.680  23.460
   46    HB2  HIS   2           HB2      HIS   2 -12.722  15.898  25.909
   47    HB3  HIS   2           HB3      HIS   2 -12.598  14.424  24.955
   48    HD1  HIS   2           HD1      HIS   2 -10.960  16.285  27.644
   49    HD2  HIS   2           HD2      HIS   2  -9.935  13.261  24.985
   50    HE1  HIS   2           HE1      HIS   2  -8.873  15.242  28.584
   51    HE2  HIS   2           HE2      HIS   2  -8.271  13.413  26.959
   52    H    HIS   3           H        HIS   3 -12.385  14.629  22.089
   53    HA   HIS   3           HA       HIS   3 -14.655  16.235  21.178
   54    HB2  HIS   3           HB2      HIS   3 -13.134  13.948  19.919
   55    HB3  HIS   3           HB3      HIS   3 -14.604  14.617  19.219
   56    HD1  HIS   3           HD1      HIS   3 -14.351  16.656  17.785
   57    HD2  HIS   3           HD2      HIS   3 -10.938  15.851  20.015
   58    HE1  HIS   3           HE1      HIS   3 -12.604  18.258  16.944
   59    HE2  HIS   3           HE2      HIS   3 -10.546  17.754  18.308
   60    H    SER   4           H        SER   4 -16.736  15.460  21.016
   61    HA   SER   4           HA       SER   4 -17.304  13.019  22.563
   62    HB2  SER   4           HB2      SER   4 -19.576  14.037  22.900
   63    HB3  SER   4           HB3      SER   4 -18.255  14.960  23.616
   64    HG   SER   4           HG       SER   4 -18.318  16.238  21.630
   65    H    THR   5           H        THR   5 -18.011  14.718  19.558
   66    HA   THR   5           HA       THR   5 -19.727  12.534  18.661
   67    HB   THR   5           HB       THR   5 -20.688  14.663  18.180
   68    HG1  THR   5           HG1      THR   5 -20.272  14.582  15.665
   69   HG21  THR   5          HG21      THR   5 -18.147  15.433  16.729
   70   HG22  THR   5          HG22      THR   5 -18.686  16.081  18.278
   71   HG23  THR   5          HG23      THR   5 -19.622  16.397  16.817
   72    H    SER   6           H        SER   6 -18.411  10.845  18.248
   73    HA   SER   6           HA       SER   6 -16.472  11.165  16.055
   74    HB2  SER   6           HB2      SER   6 -15.085   9.391  17.165
   75    HB3  SER   6           HB3      SER   6 -15.169  10.904  18.065
   76    HG   SER   6           HG       SER   6 -16.535   8.480  18.585
   77    H    VAL   7           H        VAL   7 -16.850   9.910  14.368
   78    HA   VAL   7           HA       VAL   7 -18.644   7.591  14.676
   79    HB   VAL   7           HB       VAL   7 -18.026   9.020  12.077
   80   HG11  VAL   7          HG11      VAL   7 -20.290   7.175  12.848
   81   HG12  VAL   7          HG12      VAL   7 -18.909   6.751  11.835
   82   HG13  VAL   7          HG13      VAL   7 -20.078   7.949  11.277
   83   HG21  VAL   7          HG21      VAL   7 -20.383   9.493  13.902
   84   HG22  VAL   7          HG22      VAL   7 -20.172  10.177  12.291
   85   HG23  VAL   7          HG23      VAL   7 -19.069  10.627  13.591
   86    H    ASP   8           H        ASP   8 -15.626   8.713  13.204
   87    HA   ASP   8           HA       ASP   8 -14.938   6.127  12.122
   88    HB2  ASP   8           HB2      ASP   8 -13.484   8.765  12.268
   89    HB3  ASP   8           HB3      ASP   8 -12.735   7.312  11.615
   90    H    LEU   9           H        LEU   9 -12.990   4.959  12.660
   91    HA   LEU   9           HA       LEU   9 -12.652   4.646  15.500
   92    HB2  LEU   9           HB2      LEU   9 -11.074   2.799  14.816
   93    HB3  LEU   9           HB3      LEU   9 -12.734   2.629  14.288
   94    HG   LEU   9           HG       LEU   9 -11.706   3.780  12.083
   95   HD11  LEU   9          HD11      LEU   9  -9.438   2.095  13.116
   96   HD12  LEU   9          HD12      LEU   9  -9.440   3.858  13.130
   97   HD13  LEU   9          HD13      LEU   9  -9.510   2.987  11.598
   98   HD21  LEU   9          HD21      LEU   9 -11.515   1.508  11.155
   99   HD22  LEU   9          HD22      LEU   9 -12.974   1.719  12.122
  100   HD23  LEU   9          HD23      LEU   9 -11.592   0.851  12.789
  101    H    GLY  10           H        GLY  10 -10.562   4.556  16.584
  102    HA2  GLY  10           HA2      GLY  10  -8.528   6.335  15.406
  103    HA3  GLY  10           HA3      GLY  10  -9.123   6.621  17.034
  104    H    THR  11           H        THR  11  -7.647   4.092  15.029
  105    HA   THR  11           HA       THR  11  -5.912   3.384  17.290
  106    HB   THR  11           HB       THR  11  -7.604   1.677  17.344
  107    HG1  THR  11           HG1      THR  11  -5.028   1.144  16.805
  108   HG21  THR  11          HG21      THR  11  -7.950   0.129  15.397
  109   HG22  THR  11          HG22      THR  11  -7.060   1.280  14.400
  110   HG23  THR  11          HG23      THR  11  -8.576   1.761  15.161
  111    H    GLU  12           H        GLU  12  -6.097   4.366  14.143
  112    HA   GLU  12           HA       GLU  12  -3.623   3.068  13.301
  113    HB2  GLU  12           HB2      GLU  12  -4.214   3.884  11.047
  114    HB3  GLU  12           HB3      GLU  12  -5.426   2.832  11.750
  115    HG2  GLU  12           HG2      GLU  12  -6.849   4.705  12.233
  116    HG3  GLU  12           HG3      GLU  12  -5.606   5.832  11.695
  117    H    ASN  13           H        ASN  13  -5.011   6.173  13.881
  118    HA   ASN  13           HA       ASN  13  -2.893   7.756  12.836
  119    HB2  ASN  13           HB2      ASN  13  -5.399   8.320  13.237
  120    HB3  ASN  13           HB3      ASN  13  -4.872   8.752  14.850
  121   HD21  ASN  13          HD21      ASN  13  -6.017  10.191  12.627
  122   HD22  ASN  13          HD22      ASN  13  -4.955  11.490  12.339
  123    H    LEU  14           H        LEU  14  -2.895   5.907  15.637
  124    HA   LEU  14           HA       LEU  14  -1.336   7.805  17.214
  125    HB2  LEU  14           HB2      LEU  14  -2.054   4.972  17.933
  126    HB3  LEU  14           HB3      LEU  14  -1.388   6.186  19.006
  127    HG   LEU  14           HG       LEU  14  -3.643   7.451  18.241
  128   HD11  LEU  14          HD11      LEU  14  -4.134   5.270  16.922
  129   HD12  LEU  14          HD12      LEU  14  -5.426   6.041  17.847
  130   HD13  LEU  14          HD13      LEU  14  -4.588   4.635  18.505
  131   HD21  LEU  14          HD21      LEU  14  -4.612   6.689  20.358
  132   HD22  LEU  14          HD22      LEU  14  -2.904   7.094  20.536
  133   HD23  LEU  14          HD23      LEU  14  -3.406   5.405  20.446
  134    H    TYR  15           H        TYR  15  -0.964   4.810  15.515
  135    HA   TYR  15           HA       TYR  15   1.806   4.428  16.254
  136    HB2  TYR  15           HB2      TYR  15  -0.044   2.990  14.349
  137    HB3  TYR  15           HB3      TYR  15   1.658   2.567  14.508
  138    HD1  TYR  15           HD1      TYR  15  -1.602   2.607  16.214
  139    HD2  TYR  15           HD2      TYR  15   2.477   1.421  16.462
  140    HE1  TYR  15           HE1      TYR  15  -2.136   1.198  18.158
  141    HE2  TYR  15           HE2      TYR  15   1.953   0.006  18.403
  142    HH   TYR  15           HH       TYR  15  -1.229  -0.758  19.320
  143    H    PHE  16           H        PHE  16   3.585   5.050  15.147
  144    HA   PHE  16           HA       PHE  16   3.370   5.986  12.415
  145    HB2  PHE  16           HB2      PHE  16   3.946   7.664  14.756
  146    HB3  PHE  16           HB3      PHE  16   5.100   7.847  13.440
  147    HD1  PHE  16           HD1      PHE  16   4.447   8.810  11.337
  148    HD2  PHE  16           HD2      PHE  16   1.615   8.294  14.472
  149    HE1  PHE  16           HE1      PHE  16   2.877  10.293  10.158
  150    HE2  PHE  16           HE2      PHE  16   0.041   9.777  13.298
  151    HZ   PHE  16           HZ       PHE  16   0.671  10.776  11.138
  152    H    GLN  17           H        GLN  17   4.908   4.013  14.522
  153    HA   GLN  17           HA       GLN  17   7.629   4.355  13.596
  154    HB2  GLN  17           HB2      GLN  17   6.296   2.404  15.462
  155    HB3  GLN  17           HB3      GLN  17   7.969   2.207  14.961
  156    HG2  GLN  17           HG2      GLN  17   7.076   4.805  16.122
  157    HG3  GLN  17           HG3      GLN  17   7.396   3.435  17.185
  158   HE21  GLN  17          HE21      GLN  17   8.776   5.729  14.964
  159   HE22  GLN  17          HE22      GLN  17  10.428   5.447  15.381
  160    H    SER  18           H        SER  18   5.036   1.951  13.145
  161    HA   SER  18           HA       SER  18   6.674   0.487  11.225
  162    HB2  SER  18           HB2      SER  18   4.748  -1.122  11.209
  163    HB3  SER  18           HB3      SER  18   5.476  -0.888  12.798
  164    HG   SER  18           HG       SER  18   3.730   0.787  13.019
  165    H    ASN  19           H        ASN  19   6.761   1.324   9.258
  166    HA   ASN  19           HA       ASN  19   4.256   1.915   7.857
  167    HB2  ASN  19           HB2      ASN  19   6.596   3.768   8.166
  168    HB3  ASN  19           HB3      ASN  19   5.636   3.830   6.702
  169   HD21  ASN  19          HD21      ASN  19   4.920   5.769   6.992
  170   HD22  ASN  19          HD22      ASN  19   3.800   6.189   8.207
  171    H    ALA  20           H        ALA  20   7.774   1.472   7.513
  172    HA   ALA  20           HA       ALA  20   7.571   0.670   4.746
  173    HB1  ALA  20           HB1      ALA  20   9.980   0.419   4.844
  174    HB2  ALA  20           HB2      ALA  20   9.949   0.595   6.598
  175    HB3  ALA  20           HB3      ALA  20   9.493   1.951   5.568
  176    H    GLY  21           H        GLY  21   7.927  -1.354   3.880
  177    HA2  GLY  21           HA2      GLY  21   8.764  -3.674   4.333
  178    HA3  GLY  21           HA3      GLY  21   7.772  -3.617   5.780
  179    H    LYS  22           H        LYS  22   5.966  -1.990   3.659
  180    HA   LYS  22           HA       LYS  22   4.283  -4.259   3.056
  181    HB2  LYS  22           HB2      LYS  22   4.009  -1.298   3.003
  182    HB3  LYS  22           HB3      LYS  22   2.929  -2.247   1.990
  183    HG2  LYS  22           HG2      LYS  22   1.815  -3.126   3.754
  184    HG3  LYS  22           HG3      LYS  22   3.232  -3.078   4.804
  185    HD2  LYS  22           HD2      LYS  22   3.019  -0.617   4.915
  186    HD3  LYS  22           HD3      LYS  22   1.530  -0.735   3.971
  187    HE2  LYS  22           HE2      LYS  22   0.741  -0.635   6.153
  188    HE3  LYS  22           HE3      LYS  22   0.770  -2.369   5.833
  189    HZ1  LYS  22           HZ1      LYS  22   1.722  -1.981   7.965
  190    HZ2  LYS  22           HZ2      LYS  22   2.772  -0.801   7.360
  191    HZ3  LYS  22           HZ3      LYS  22   2.982  -2.421   6.924
  192    H    MET  23           H        MET  23   3.447  -4.723   1.021
  193    HA   MET  23           HA       MET  23   5.015  -3.816  -1.260
  194    HB2  MET  23           HB2      MET  23   4.334  -6.519  -0.294
  195    HB3  MET  23           HB3      MET  23   4.124  -6.259  -2.011
  196    HG2  MET  23           HG2      MET  23   6.525  -5.273  -1.900
  197    HG3  MET  23           HG3      MET  23   6.619  -6.153  -0.377
  198    HE1  MET  23           HE1      MET  23   6.881  -7.775  -4.596
  199    HE2  MET  23           HE2      MET  23   7.643  -6.339  -3.914
  200    HE3  MET  23           HE3      MET  23   5.898  -6.375  -4.172
  201    H    PHE  24           H        PHE  24   3.926  -3.133  -2.889
  202    HA   PHE  24           HA       PHE  24   1.057  -2.807  -2.793
  203    HB2  PHE  24           HB2      PHE  24   2.474  -0.813  -3.060
  204    HB3  PHE  24           HB3      PHE  24   3.226  -1.501  -4.481
  205    HD1  PHE  24           HD1      PHE  24   2.776   0.457  -5.772
  206    HD2  PHE  24           HD2      PHE  24  -0.438  -1.729  -4.028
  207    HE1  PHE  24           HE1      PHE  24   1.183   1.667  -7.195
  208    HE2  PHE  24           HE2      PHE  24  -2.025  -0.511  -5.452
  209    HZ   PHE  24           HZ       PHE  24  -1.223   1.185  -7.037
  210    H    ILE  25           H        ILE  25   0.029  -4.430  -3.733
  211    HA   ILE  25           HA       ILE  25   1.088  -5.840  -6.029
  212    HB   ILE  25           HB       ILE  25  -1.450  -6.573  -4.775
  213   HG12  ILE  25          HG12      ILE  25   0.031  -6.064  -2.848
  214   HG13  ILE  25          HG13      ILE  25  -0.463  -7.733  -2.917
  215   HG21  ILE  25          HG21      ILE  25  -0.798  -7.899  -6.622
  216   HG22  ILE  25          HG22      ILE  25  -0.571  -8.888  -5.181
  217   HG23  ILE  25          HG23      ILE  25   0.817  -8.139  -5.959
  218   HD11  ILE  25          HD11      ILE  25   1.727  -8.401  -3.686
  219   HD12  ILE  25          HD12      ILE  25   1.887  -7.420  -2.230
  220   HD13  ILE  25          HD13      ILE  25   2.224  -6.714  -3.810
  221    H    GLY  26           H        GLY  26   0.533  -5.162  -7.933
  222    HA2  GLY  26           HA2      GLY  26  -1.975  -3.782  -8.317
  223    HA3  GLY  26           HA3      GLY  26  -0.583  -3.532  -9.311
  224    H    GLY  27           H        GLY  27  -3.164  -3.955 -10.204
  225    HA2  GLY  27           HA2      GLY  27  -4.148  -4.989 -12.000
  226    HA3  GLY  27           HA3      GLY  27  -2.685  -5.927 -12.196
  227    H    LEU  28           H        LEU  28  -4.423  -6.123  -9.158
  228    HA   LEU  28           HA       LEU  28  -4.668  -8.879  -9.157
  229    HB2  LEU  28           HB2      LEU  28  -6.437  -6.909  -7.682
  230    HB3  LEU  28           HB3      LEU  28  -6.195  -8.591  -7.265
  231    HG   LEU  28           HG       LEU  28  -3.905  -6.629  -7.255
  232   HD11  LEU  28          HD11      LEU  28  -5.671  -5.747  -5.804
  233   HD12  LEU  28          HD12      LEU  28  -4.285  -6.316  -4.874
  234   HD13  LEU  28          HD13      LEU  28  -5.749  -7.295  -4.961
  235   HD21  LEU  28          HD21      LEU  28  -2.913  -8.224  -5.722
  236   HD22  LEU  28          HD22      LEU  28  -3.405  -9.053  -7.195
  237   HD23  LEU  28          HD23      LEU  28  -4.380  -9.199  -5.740
  238    H    SER  29           H        SER  29  -6.944 -10.022  -8.931
  239    HA   SER  29           HA       SER  29  -8.456  -9.368 -11.317
  240    HB2  SER  29           HB2      SER  29  -7.328 -11.668 -10.914
  241    HB3  SER  29           HB3      SER  29  -8.641 -11.950  -9.772
  242    HG   SER  29           HG       SER  29  -9.610 -12.613 -11.534
  243    H    TRP  30           H        TRP  30 -10.749 -10.198 -11.079
  244    HA   TRP  30           HA       TRP  30 -12.143  -8.557  -9.261
  245    HB2  TRP  30           HB2      TRP  30 -14.115  -9.414 -10.433
  246    HB3  TRP  30           HB3      TRP  30 -12.887  -8.931 -11.575
  247    HD1  TRP  30           HD1      TRP  30 -11.160 -11.522 -11.788
  248    HE1  TRP  30           HE1      TRP  30 -12.100 -13.681 -12.771
  249    HE3  TRP  30           HE3      TRP  30 -16.173 -10.599 -11.212
  250    HZ2  TRP  30           HZ2      TRP  30 -14.578 -14.847 -13.274
  251    HZ3  TRP  30           HZ3      TRP  30 -17.763 -12.311 -11.990
  252    HH2  TRP  30           HH2      TRP  30 -16.982 -14.393 -13.001
  253    H    GLN  31           H        GLN  31 -11.006 -11.743  -9.206
  254    HA   GLN  31           HA       GLN  31 -12.902 -12.728  -7.229
  255    HB2  GLN  31           HB2      GLN  31 -10.694 -13.994  -8.817
  256    HB3  GLN  31           HB3      GLN  31 -11.586 -14.861  -7.573
  257    HG2  GLN  31           HG2      GLN  31 -13.672 -14.428  -8.852
  258    HG3  GLN  31           HG3      GLN  31 -12.686 -13.708 -10.127
  259   HE21  GLN  31          HE21      GLN  31 -13.462 -16.640  -8.420
  260   HE22  GLN  31          HE22      GLN  31 -12.843 -17.732  -9.603
  261    H    THR  32           H        THR  32  -9.667 -11.581  -7.528
  262    HA   THR  32           HA       THR  32  -8.485 -12.755  -5.269
  263    HB   THR  32           HB       THR  32  -7.642 -10.109  -6.233
  264    HG1  THR  32           HG1      THR  32  -7.473 -10.816  -8.205
  265   HG21  THR  32          HG21      THR  32  -6.274 -11.097  -4.521
  266   HG22  THR  32          HG22      THR  32  -5.383 -11.168  -6.041
  267   HG23  THR  32          HG23      THR  32  -6.179 -12.610  -5.418
  268    H    SER  33           H        SER  33  -9.049 -12.544  -3.250
  269    HA   SER  33           HA       SER  33 -10.149 -10.028  -2.180
  270    HB2  SER  33           HB2      SER  33 -11.367 -12.318  -2.001
  271    HB3  SER  33           HB3      SER  33 -10.157 -12.695  -0.778
  272    HG   SER  33           HG       SER  33 -12.353 -11.529  -0.301
  273    HA   PRO  34           HA       PRO  34  -6.489  -9.230   0.278
  274    HB2  PRO  34           HB2      PRO  34  -7.533  -8.859   2.830
  275    HB3  PRO  34           HB3      PRO  34  -7.418  -7.602   1.591
  276    HG2  PRO  34           HG2      PRO  34  -9.758  -9.290   2.344
  277    HG3  PRO  34           HG3      PRO  34  -9.705  -7.573   1.893
  278    HD2  PRO  34           HD2      PRO  34 -10.546  -9.411   0.156
  279    HD3  PRO  34           HD3      PRO  34  -9.557  -8.035  -0.374
  280    H    ASP  35           H        ASP  35  -8.742 -11.608   1.337
  281    HA   ASP  35           HA       ASP  35  -6.955 -12.989   3.115
  282    HB2  ASP  35           HB2      ASP  35  -9.695 -13.260   2.230
  283    HB3  ASP  35           HB3      ASP  35  -8.912 -14.761   2.625
  284    H    SER  36           H        SER  36  -8.037 -13.159  -0.145
  285    HA   SER  36           HA       SER  36  -6.917 -15.688  -0.851
  286    HB2  SER  36           HB2      SER  36  -8.796 -14.587  -2.096
  287    HB3  SER  36           HB3      SER  36  -7.648 -13.384  -2.681
  288    HG   SER  36           HG       SER  36  -8.074 -15.946  -3.524
  289    H    LEU  37           H        LEU  37  -5.851 -12.315  -0.915
  290    HA   LEU  37           HA       LEU  37  -3.454 -12.708  -2.338
  291    HB2  LEU  37           HB2      LEU  37  -5.047 -10.675  -1.083
  292    HB3  LEU  37           HB3      LEU  37  -3.390 -10.473  -0.642
  293    HG   LEU  37           HG       LEU  37  -4.341 -10.680  -3.474
  294   HD11  LEU  37          HD11      LEU  37  -3.895  -8.259  -1.751
  295   HD12  LEU  37          HD12      LEU  37  -5.383  -8.761  -2.562
  296   HD13  LEU  37          HD13      LEU  37  -4.007  -8.199  -3.512
  297   HD21  LEU  37          HD21      LEU  37  -2.221  -9.777  -4.097
  298   HD22  LEU  37          HD22      LEU  37  -1.928 -11.151  -3.037
  299   HD23  LEU  37          HD23      LEU  37  -1.778  -9.511  -2.413
  300    H    ARG  38           H        ARG  38  -4.408 -12.601   1.040
  301    HA   ARG  38           HA       ARG  38  -1.862 -12.770   2.200
  302    HB2  ARG  38           HB2      ARG  38  -4.189 -12.080   3.215
  303    HB3  ARG  38           HB3      ARG  38  -4.331 -13.798   3.554
  304    HG2  ARG  38           HG2      ARG  38  -2.307 -13.727   4.893
  305    HG3  ARG  38           HG3      ARG  38  -2.093 -12.019   4.507
  306    HD2  ARG  38           HD2      ARG  38  -4.552 -13.091   5.870
  307    HD3  ARG  38           HD3      ARG  38  -3.131 -12.545   6.759
  308    HE   ARG  38           HE       ARG  38  -3.880 -10.512   4.994
  309   HH11  ARG  38          HH11      ARG  38  -5.168 -12.074   7.864
  310   HH12  ARG  38          HH12      ARG  38  -6.046 -10.670   8.372
  311   HH21  ARG  38          HH21      ARG  38  -5.972  -8.756   7.133
  312   HH22  ARG  38          HH22      ARG  38  -5.038  -8.690   5.676
  313    H    ASP  39           H        ASP  39  -4.398 -15.108   1.361
  314    HA   ASP  39           HA       ASP  39  -3.069 -17.413   2.267
  315    HB2  ASP  39           HB2      ASP  39  -5.440 -16.819   0.629
  316    HB3  ASP  39           HB3      ASP  39  -4.680 -18.373   0.297
  317    H    TYR  40           H        TYR  40  -3.066 -15.769  -0.902
  318    HA   TYR  40           HA       TYR  40  -1.635 -17.813  -2.259
  319    HB2  TYR  40           HB2      TYR  40  -3.151 -15.888  -3.196
  320    HB3  TYR  40           HB3      TYR  40  -1.646 -14.974  -3.209
  321    HD1  TYR  40           HD1      TYR  40  -3.294 -18.017  -4.522
  322    HD2  TYR  40           HD2      TYR  40  -0.026 -15.328  -4.893
  323    HE1  TYR  40           HE1      TYR  40  -2.682 -19.070  -6.662
  324    HE2  TYR  40           HE2      TYR  40   0.600 -16.368  -7.032
  325    HH   TYR  40           HH       TYR  40  -1.434 -18.471  -8.719
  326    H    PHE  41           H        PHE  41  -0.698 -14.626  -0.960
  327    HA   PHE  41           HA       PHE  41   2.021 -14.843  -1.653
  328    HB2  PHE  41           HB2      PHE  41   0.332 -12.955  -0.190
  329    HB3  PHE  41           HB3      PHE  41   2.060 -12.827   0.016
  330    HD1  PHE  41           HD1      PHE  41  -0.625 -12.923  -2.528
  331    HD2  PHE  41           HD2      PHE  41   3.380 -11.783  -1.653
  332    HE1  PHE  41           HE1      PHE  41  -0.463 -11.785  -4.711
  333    HE2  PHE  41           HE2      PHE  41   3.542 -10.641  -3.819
  334    HZ   PHE  41           HZ       PHE  41   1.620 -10.644  -5.355
  335    H    SER  42           H        SER  42   0.209 -15.898   1.127
  336    HA   SER  42           HA       SER  42   2.266 -15.995   3.069
  337    HB2  SER  42           HB2      SER  42  -0.211 -16.277   3.530
  338    HB3  SER  42           HB3      SER  42  -0.062 -17.914   2.895
  339    HG   SER  42           HG       SER  42   1.613 -16.991   4.970
  340    H    LYS  43           H        LYS  43   1.725 -17.561   0.298
  341    HA   LYS  43           HA       LYS  43   2.957 -20.095   0.841
  342    HB2  LYS  43           HB2      LYS  43   1.700 -18.770  -1.512
  343    HB3  LYS  43           HB3      LYS  43   2.703 -20.172  -1.760
  344    HG2  LYS  43           HG2      LYS  43   0.898 -20.763   0.348
  345    HG3  LYS  43           HG3      LYS  43  -0.015 -20.072  -0.992
  346    HD2  LYS  43           HD2      LYS  43   0.963 -21.714  -2.514
  347    HD3  LYS  43           HD3      LYS  43   1.905 -22.394  -1.185
  348    HE2  LYS  43           HE2      LYS  43  -0.148 -23.017  -0.030
  349    HE3  LYS  43           HE3      LYS  43  -1.108 -22.296  -1.322
  350    HZ1  LYS  43           HZ1      LYS  43  -0.191 -23.915  -2.861
  351    HZ2  LYS  43           HZ2      LYS  43  -0.946 -24.695  -1.563
  352    HZ3  LYS  43           HZ3      LYS  43   0.742 -24.601  -1.627
  353    H    PHE  44           H        PHE  44   4.020 -16.994   0.050
  354    HA   PHE  44           HA       PHE  44   6.557 -17.891  -1.140
  355    HB2  PHE  44           HB2      PHE  44   4.894 -15.752  -1.722
  356    HB3  PHE  44           HB3      PHE  44   6.243 -15.050  -0.850
  357    HD1  PHE  44           HD1      PHE  44   5.131 -16.545  -3.926
  358    HD2  PHE  44           HD2      PHE  44   8.556 -15.301  -1.725
  359    HE1  PHE  44           HE1      PHE  44   6.473 -16.614  -5.983
  360    HE2  PHE  44           HE2      PHE  44   9.906 -15.371  -3.784
  361    HZ   PHE  44           HZ       PHE  44   8.856 -16.030  -5.914
  362    H    GLY  45           H        GLY  45   5.118 -16.323   1.598
  363    HA2  GLY  45           HA2      GLY  45   7.251 -16.835   3.343
  364    HA3  GLY  45           HA3      GLY  45   7.185 -15.132   2.908
  365    H    GLU  46           H        GLU  46   6.680 -14.837   5.177
  366    HA   GLU  46           HA       GLU  46   4.000 -15.521   5.915
  367    HB2  GLU  46           HB2      GLU  46   5.921 -16.112   7.464
  368    HB3  GLU  46           HB3      GLU  46   6.059 -14.386   7.778
  369    HG2  GLU  46           HG2      GLU  46   3.857 -14.287   8.670
  370    HG3  GLU  46           HG3      GLU  46   3.508 -15.930   8.152
  371    H    ILE  47           H        ILE  47   2.562 -14.129   6.195
  372    HA   ILE  47           HA       ILE  47   3.085 -11.302   5.704
  373    HB   ILE  47           HB       ILE  47   0.575 -12.810   5.233
  374   HG12  ILE  47          HG12      ILE  47   1.790 -11.458   3.018
  375   HG13  ILE  47          HG13      ILE  47   2.859 -12.637   3.755
  376   HG21  ILE  47          HG21      ILE  47  -0.098 -10.601   5.827
  377   HG22  ILE  47          HG22      ILE  47  -0.202 -10.735   4.072
  378   HG23  ILE  47          HG23      ILE  47   1.165  -9.903   4.813
  379   HD11  ILE  47          HD11      ILE  47   0.329 -13.024   2.245
  380   HD12  ILE  47          HD12      ILE  47   0.694 -14.163   3.534
  381   HD13  ILE  47          HD13      ILE  47   1.816 -13.975   2.186
  382    H    ARG  48           H        ARG  48   2.470  -9.762   7.002
  383    HA   ARG  48           HA       ARG  48   1.610 -10.384   9.691
  384    HB2  ARG  48           HB2      ARG  48   3.378  -8.642   8.693
  385    HB3  ARG  48           HB3      ARG  48   1.969  -7.614   8.671
  386    HG2  ARG  48           HG2      ARG  48   1.686  -7.789  11.015
  387    HG3  ARG  48           HG3      ARG  48   2.915  -9.051  11.130
  388    HD2  ARG  48           HD2      ARG  48   4.622  -7.461  10.404
  389    HD3  ARG  48           HD3      ARG  48   3.397  -6.201  10.263
  390    HE   ARG  48           HE       ARG  48   3.197  -7.037  12.848
  391   HH11  ARG  48          HH11      ARG  48   6.678  -5.118  12.261
  392   HH12  ARG  48          HH12      ARG  48   5.859  -5.819  10.906
  393   HH21  ARG  48          HH21      ARG  48   5.787  -5.279  14.353
  394   HH22  ARG  48          HH22      ARG  48   4.285  -6.103  14.607
  395    H    GLU  49           H        GLU  49   0.498  -8.603   6.856
  396    HA   GLU  49           HA       GLU  49  -2.263  -8.821   7.508
  397    HB2  GLU  49           HB2      GLU  49  -1.216  -6.768   8.854
  398    HB3  GLU  49           HB3      GLU  49  -1.403  -5.962   7.307
  399    HG2  GLU  49           HG2      GLU  49  -3.370  -5.423   8.369
  400    HG3  GLU  49           HG3      GLU  49  -3.844  -6.842   7.436
  401    H    CYS  50           H        CYS  50  -3.568  -7.942   5.799
  402    HA   CYS  50           HA       CYS  50  -2.263  -7.198   3.368
  403    HB2  CYS  50           HB2      CYS  50  -2.575  -9.591   3.139
  404    HB3  CYS  50           HB3      CYS  50  -4.273  -9.437   3.571
  405    HG   CYS  50           HG       CYS  50  -3.783  -7.487   1.022
  406    H    MET  51           H        MET  51  -3.540  -6.073   1.954
  407    HA   MET  51           HA       MET  51  -6.143  -5.154   2.781
  408    HB2  MET  51           HB2      MET  51  -4.648  -3.638   3.907
  409    HB3  MET  51           HB3      MET  51  -3.837  -3.329   2.400
  410    HG2  MET  51           HG2      MET  51  -5.812  -2.240   1.513
  411    HG3  MET  51           HG3      MET  51  -6.674  -2.582   3.015
  412    HE1  MET  51           HE1      MET  51  -7.155   0.194   2.685
  413    HE2  MET  51           HE2      MET  51  -5.980   0.271   1.371
  414    HE3  MET  51           HE3      MET  51  -5.841   1.369   2.744
  415    H    VAL  52           H        VAL  52  -7.426  -4.820   1.192
  416    HA   VAL  52           HA       VAL  52  -6.468  -4.295  -1.515
  417    HB   VAL  52           HB       VAL  52  -8.757  -6.059  -0.820
  418   HG11  VAL  52          HG11      VAL  52  -8.832  -6.627  -3.216
  419   HG12  VAL  52          HG12      VAL  52  -7.587  -5.412  -3.512
  420   HG13  VAL  52          HG13      VAL  52  -9.175  -4.921  -2.922
  421   HG21  VAL  52          HG21      VAL  52  -7.452  -7.920  -1.568
  422   HG22  VAL  52          HG22      VAL  52  -6.536  -7.032  -0.347
  423   HG23  VAL  52          HG23      VAL  52  -6.150  -6.832  -2.053
  424    H    MET  53           H        MET  53  -7.275  -2.583  -2.354
  425    HA   MET  53           HA       MET  53  -9.061  -0.846  -0.983
  426    HB2  MET  53           HB2      MET  53  -7.347  -0.723  -3.353
  427    HB3  MET  53           HB3      MET  53  -8.814   0.231  -3.506
  428    HG2  MET  53           HG2      MET  53  -6.750   0.446  -1.324
  429    HG3  MET  53           HG3      MET  53  -7.010   1.581  -2.645
  430    HE1  MET  53           HE1      MET  53  -6.881   2.524   0.401
  431    HE2  MET  53           HE2      MET  53  -8.211   3.683   0.392
  432    HE3  MET  53           HE3      MET  53  -7.120   3.582  -0.990
  433    H    ARG  54           H        ARG  54 -11.162  -0.936  -0.950
  434    HA   ARG  54           HA       ARG  54 -12.644  -1.771  -3.346
  435    HB2  ARG  54           HB2      ARG  54 -12.766  -2.861  -0.587
  436    HB3  ARG  54           HB3      ARG  54 -14.295  -2.678  -1.438
  437    HG2  ARG  54           HG2      ARG  54 -13.443  -4.060  -3.263
  438    HG3  ARG  54           HG3      ARG  54 -11.909  -4.239  -2.408
  439    HD2  ARG  54           HD2      ARG  54 -13.026  -5.366  -0.578
  440    HD3  ARG  54           HD3      ARG  54 -14.593  -5.111  -1.346
  441    HE   ARG  54           HE       ARG  54 -13.470  -6.504  -3.235
  442   HH11  ARG  54          HH11      ARG  54 -12.828  -8.752   0.030
  443   HH12  ARG  54          HH12      ARG  54 -13.103  -7.052   0.215
  444   HH21  ARG  54          HH21      ARG  54 -13.110  -8.728  -3.452
  445   HH22  ARG  54          HH22      ARG  54 -12.832  -9.699  -2.045
  446    H    ASP  55           H        ASP  55 -14.892  -1.008  -3.379
  447    HA   ASP  55           HA       ASP  55 -15.195   1.563  -2.131
  448    HB2  ASP  55           HB2      ASP  55 -15.906   0.442  -4.717
  449    HB3  ASP  55           HB3      ASP  55 -17.068   1.547  -4.034
  450    HA   PRO  56           HA       PRO  56 -18.423  -0.525   0.334
  451    HB2  PRO  56           HB2      PRO  56 -19.078   2.251   1.140
  452    HB3  PRO  56           HB3      PRO  56 -18.706   0.845   2.148
  453    HG2  PRO  56           HG2      PRO  56 -16.938   2.808   1.871
  454    HG3  PRO  56           HG3      PRO  56 -16.422   1.110   1.938
  455    HD2  PRO  56           HD2      PRO  56 -16.669   2.909  -0.439
  456    HD3  PRO  56           HD3      PRO  56 -15.421   1.704  -0.056
  457    H    THR  57           H        THR  57 -18.824   1.735  -2.191
  458    HA   THR  57           HA       THR  57 -21.671   1.984  -2.020
  459    HB   THR  57           HB       THR  57 -21.417   3.063  -4.316
  460    HG1  THR  57           HG1      THR  57 -19.313   2.078  -4.699
  461   HG21  THR  57          HG21      THR  57 -20.497   5.142  -3.379
  462   HG22  THR  57          HG22      THR  57 -19.923   4.246  -1.972
  463   HG23  THR  57          HG23      THR  57 -21.654   4.386  -2.284
  464    H    THR  58           H        THR  58 -19.377   0.289  -4.115
  465    HA   THR  58           HA       THR  58 -21.594  -1.322  -5.204
  466    HB   THR  58           HB       THR  58 -20.169  -1.716  -7.196
  467    HG1  THR  58           HG1      THR  58 -18.500   0.414  -6.459
  468   HG21  THR  58          HG21      THR  58 -20.704   1.176  -6.520
  469   HG22  THR  58          HG22      THR  58 -21.812   0.055  -7.315
  470   HG23  THR  58          HG23      THR  58 -20.343   0.577  -8.140
  471    H    LYS  59           H        LYS  59 -18.901  -1.449  -3.218
  472    HA   LYS  59           HA       LYS  59 -17.698  -3.065  -2.180
  473    HB2  LYS  59           HB2      LYS  59 -19.611  -5.123  -3.255
  474    HB3  LYS  59           HB3      LYS  59 -18.704  -5.162  -1.752
  475    HG2  LYS  59           HG2      LYS  59 -20.704  -3.014  -2.206
  476    HG3  LYS  59           HG3      LYS  59 -21.261  -4.628  -1.751
  477    HD2  LYS  59           HD2      LYS  59 -19.880  -4.544   0.265
  478    HD3  LYS  59           HD3      LYS  59 -19.271  -2.956  -0.209
  479    HE2  LYS  59           HE2      LYS  59 -21.547  -2.056  -0.080
  480    HE3  LYS  59           HE3      LYS  59 -22.141  -3.640   0.417
  481    HZ1  LYS  59           HZ1      LYS  59 -21.815  -2.177   2.312
  482    HZ2  LYS  59           HZ2      LYS  59 -20.183  -1.983   1.916
  483    HZ3  LYS  59           HZ3      LYS  59 -20.761  -3.499   2.395
  484    H    ARG  60           H        ARG  60 -17.574  -2.566  -5.218
  485    HA   ARG  60           HA       ARG  60 -16.173  -4.936  -6.172
  486    HB2  ARG  60           HB2      ARG  60 -16.917  -2.317  -7.471
  487    HB3  ARG  60           HB3      ARG  60 -15.914  -3.517  -8.274
  488    HG2  ARG  60           HG2      ARG  60 -18.545  -4.360  -7.163
  489    HG3  ARG  60           HG3      ARG  60 -18.508  -3.437  -8.667
  490    HD2  ARG  60           HD2      ARG  60 -17.443  -5.115  -9.829
  491    HD3  ARG  60           HD3      ARG  60 -16.691  -5.785  -8.383
  492    HE   ARG  60           HE       ARG  60 -19.372  -6.220  -8.043
  493   HH11  ARG  60          HH11      ARG  60 -17.874  -8.576 -10.931
  494   HH12  ARG  60          HH12      ARG  60 -17.040  -7.117 -10.512
  495   HH21  ARG  60          HH21      ARG  60 -20.441  -8.140  -8.604
  496   HH22  ARG  60          HH22      ARG  60 -19.797  -9.153  -9.852
  497    H    SER  61           H        SER  61 -14.028  -5.015  -6.808
  498    HA   SER  61           HA       SER  61 -12.238  -3.253  -5.349
  499    HB2  SER  61           HB2      SER  61 -10.489  -4.888  -6.099
  500    HB3  SER  61           HB3      SER  61 -11.805  -5.617  -5.180
  501    HG   SER  61           HG       SER  61 -11.267  -6.816  -7.068
  502    H    ARG  62           H        ARG  62 -10.353  -2.285  -6.338
  503    HA   ARG  62           HA       ARG  62 -10.945  -1.187  -8.975
  504    HB2  ARG  62           HB2      ARG  62  -9.013  -0.403  -6.803
  505    HB3  ARG  62           HB3      ARG  62  -8.958   0.322  -8.402
  506    HG2  ARG  62           HG2      ARG  62 -11.288   1.084  -8.101
  507    HG3  ARG  62           HG3      ARG  62 -11.264   0.423  -6.466
  508    HD2  ARG  62           HD2      ARG  62 -10.796   2.715  -6.215
  509    HD3  ARG  62           HD3      ARG  62  -9.239   1.903  -6.057
  510    HE   ARG  62           HE       ARG  62  -9.873   2.831  -8.724
  511   HH11  ARG  62          HH11      ARG  62  -7.282   4.843  -6.406
  512   HH12  ARG  62          HH12      ARG  62  -8.297   3.636  -5.690
  513   HH21  ARG  62          HH21      ARG  62  -8.532   4.415  -9.639
  514   HH22  ARG  62          HH22      ARG  62  -7.416   5.283  -8.638
  515    H    GLY  63           H        GLY  63  -9.154  -3.715  -7.746
  516    HA2  GLY  63           HA2      GLY  63  -7.923  -5.234  -9.057
  517    HA3  GLY  63           HA3      GLY  63  -7.659  -3.968 -10.242
  518    H    PHE  64           H        PHE  64  -7.013  -3.186  -6.923
  519    HA   PHE  64           HA       PHE  64  -4.218  -3.925  -7.075
  520    HB2  PHE  64           HB2      PHE  64  -3.293  -1.752  -6.839
  521    HB3  PHE  64           HB3      PHE  64  -4.365  -1.721  -8.225
  522    HD1  PHE  64           HD1      PHE  64  -6.187  -0.254  -8.314
  523    HD2  PHE  64           HD2      PHE  64  -4.027  -0.751  -4.714
  524    HE1  PHE  64           HE1      PHE  64  -7.330   1.726  -7.376
  525    HE2  PHE  64           HE2      PHE  64  -5.139   1.231  -3.748
  526    HZ   PHE  64           HZ       PHE  64  -6.804   2.470  -5.084
  527    H    GLY  65           H        GLY  65  -3.056  -3.739  -5.041
  528    HA2  GLY  65           HA2      GLY  65  -4.389  -2.963  -2.685
  529    HA3  GLY  65           HA3      GLY  65  -4.331  -4.708  -2.865
  530    H    PHE  66           H        PHE  66  -3.068  -4.312  -0.854
  531    HA   PHE  66           HA       PHE  66  -0.264  -4.217  -1.372
  532    HB2  PHE  66           HB2      PHE  66  -1.823  -2.939   0.807
  533    HB3  PHE  66           HB3      PHE  66  -0.109  -3.154   0.881
  534    HD1  PHE  66           HD1      PHE  66   1.365  -1.654  -0.259
  535    HD2  PHE  66           HD2      PHE  66  -2.840  -1.491  -0.902
  536    HE1  PHE  66           HE1      PHE  66   1.635   0.497  -1.428
  537    HE2  PHE  66           HE2      PHE  66  -2.577   0.662  -2.080
  538    HZ   PHE  66           HZ       PHE  66  -0.337   1.653  -2.347
  539    H    VAL  67           H        VAL  67   0.933  -5.273   0.335
  540    HA   VAL  67           HA       VAL  67  -0.421  -7.119   2.099
  541    HB   VAL  67           HB       VAL  67   1.498  -8.133  -0.036
  542   HG11  VAL  67          HG11      VAL  67   0.791  -9.263   2.607
  543   HG12  VAL  67          HG12      VAL  67   2.252  -9.473   1.638
  544   HG13  VAL  67          HG13      VAL  67   0.798 -10.391   1.247
  545   HG21  VAL  67          HG21      VAL  67  -0.844  -7.990  -0.771
  546   HG22  VAL  67          HG22      VAL  67  -1.325  -8.996   0.591
  547   HG23  VAL  67          HG23      VAL  67  -0.288  -9.663  -0.673
  548    H    THR  68           H        THR  68   0.587  -7.331   3.857
  549    HA   THR  68           HA       THR  68   3.121  -5.949   4.156
  550    HB   THR  68           HB       THR  68   1.345  -6.619   6.399
  551    HG1  THR  68           HG1      THR  68   0.315  -5.465   4.436
  552   HG21  THR  68          HG21      THR  68   3.751  -5.178   6.010
  553   HG22  THR  68          HG22      THR  68   2.851  -5.401   7.519
  554   HG23  THR  68          HG23      THR  68   2.498  -4.018   6.487
  555    H    PHE  69           H        PHE  69   4.682  -7.318   4.014
  556    HA   PHE  69           HA       PHE  69   4.543  -9.966   5.049
  557    HB2  PHE  69           HB2      PHE  69   6.473  -8.397   3.453
  558    HB3  PHE  69           HB3      PHE  69   7.061  -9.811   4.305
  559    HD1  PHE  69           HD1      PHE  69   5.054  -8.592   1.566
  560    HD2  PHE  69           HD2      PHE  69   6.129 -12.043   3.812
  561    HE1  PHE  69           HE1      PHE  69   4.131 -10.041  -0.209
  562    HE2  PHE  69           HE2      PHE  69   5.215 -13.486   2.054
  563    HZ   PHE  69           HZ       PHE  69   4.223 -12.495   0.047
  564    H    ALA  70           H        ALA  70   5.111 -10.626   7.015
  565    HA   ALA  70           HA       ALA  70   6.265  -8.838   8.879
  566    HB1  ALA  70           HB1      ALA  70   4.416 -10.480   9.384
  567    HB2  ALA  70           HB2      ALA  70   5.717 -10.386  10.568
  568    HB3  ALA  70           HB3      ALA  70   5.673 -11.715   9.410
  569    H    ASP  71           H        ASP  71   7.741 -10.455   6.673
  570    HA   ASP  71           HA       ASP  71  10.150 -10.860   8.220
  571    HB2  ASP  71           HB2      ASP  71   8.930 -12.935   7.355
  572    HB3  ASP  71           HB3      ASP  71   9.517 -12.469   5.793
  573    HA   PRO  72           HA       PRO  72  11.833  -8.120   5.060
  574    HB2  PRO  72           HB2      PRO  72  14.455  -8.754   6.037
  575    HB3  PRO  72           HB3      PRO  72  13.588  -7.244   6.113
  576    HG2  PRO  72           HG2      PRO  72  14.134  -8.702   8.320
  577    HG3  PRO  72           HG3      PRO  72  12.708  -7.654   8.178
  578    HD2  PRO  72           HD2      PRO  72  12.905 -10.620   7.884
  579    HD3  PRO  72           HD3      PRO  72  11.636  -9.632   8.640
  580    H    ALA  73           H        ALA  73  12.582 -11.364   5.643
  581    HA   ALA  73           HA       ALA  73  14.414 -11.714   3.476
  582    HB1  ALA  73           HB1      ALA  73  13.003 -13.823   5.078
  583    HB2  ALA  73           HB2      ALA  73  14.568 -13.114   5.476
  584    HB3  ALA  73           HB3      ALA  73  14.382 -14.074   4.009
  585    H    SER  74           H        SER  74  11.027 -11.986   3.946
  586    HA   SER  74           HA       SER  74  10.451 -13.525   1.608
  587    HB2  SER  74           HB2      SER  74   8.965 -13.199   3.698
  588    HB3  SER  74           HB3      SER  74   8.451 -11.709   2.906
  589    HG   SER  74           HG       SER  74   7.347 -12.834   1.510
  590    H    VAL  75           H        VAL  75  10.784 -10.168   2.299
  591    HA   VAL  75           HA       VAL  75   9.716  -9.167  -0.119
  592    HB   VAL  75           HB       VAL  75  11.779  -7.763   1.578
  593   HG11  VAL  75          HG11      VAL  75   9.544  -6.672  -0.140
  594   HG12  VAL  75          HG12      VAL  75  11.262  -6.660  -0.537
  595   HG13  VAL  75          HG13      VAL  75  10.664  -5.707   0.821
  596   HG21  VAL  75          HG21      VAL  75  10.059  -8.488   3.113
  597   HG22  VAL  75          HG22      VAL  75   8.796  -7.868   2.050
  598   HG23  VAL  75          HG23      VAL  75   9.900  -6.750   2.852
  599    H    ASP  76           H        ASP  76  12.786 -10.290   0.932
  600    HA   ASP  76           HA       ASP  76  14.365  -9.435  -1.238
  601    HB2  ASP  76           HB2      ASP  76  14.960 -10.328   1.172
  602    HB3  ASP  76           HB3      ASP  76  15.028 -11.864   0.340
  603    H    LYS  77           H        LYS  77  12.708 -12.355  -0.409
  604    HA   LYS  77           HA       LYS  77  13.415 -13.951  -2.588
  605    HB2  LYS  77           HB2      LYS  77  11.057 -14.091  -0.729
  606    HB3  LYS  77           HB3      LYS  77  11.392 -15.315  -1.945
  607    HG2  LYS  77           HG2      LYS  77  13.686 -15.521  -0.825
  608    HG3  LYS  77           HG3      LYS  77  12.960 -14.634   0.514
  609    HD2  LYS  77           HD2      LYS  77  11.250 -16.332   0.758
  610    HD3  LYS  77           HD3      LYS  77  11.875 -17.200  -0.646
  611    HE2  LYS  77           HE2      LYS  77  14.001 -17.545   0.541
  612    HE3  LYS  77           HE3      LYS  77  13.337 -16.717   1.948
  613    HZ1  LYS  77           HZ1      LYS  77  13.205 -19.129   2.159
  614    HZ2  LYS  77           HZ2      LYS  77  12.254 -19.216   0.763
  615    HZ3  LYS  77           HZ3      LYS  77  11.663 -18.434   2.140
  616    H    VAL  78           H        VAL  78  10.705 -11.814  -2.064
  617    HA   VAL  78           HA       VAL  78   9.400 -12.457  -4.528
  618    HB   VAL  78           HB       VAL  78   8.847 -10.200  -2.580
  619   HG11  VAL  78          HG11      VAL  78   6.713  -9.905  -3.684
  620   HG12  VAL  78          HG12      VAL  78   7.086 -11.197  -4.824
  621   HG13  VAL  78          HG13      VAL  78   8.010  -9.697  -4.862
  622   HG21  VAL  78          HG21      VAL  78   6.936 -11.600  -1.896
  623   HG22  VAL  78          HG22      VAL  78   8.482 -12.395  -1.603
  624   HG23  VAL  78          HG23      VAL  78   7.495 -12.870  -2.985
  625    H    LEU  79           H        LEU  79  11.676  -9.978  -3.444
  626    HA   LEU  79           HA       LEU  79  11.451  -8.120  -5.497
  627    HB2  LEU  79           HB2      LEU  79  12.748  -8.346  -3.176
  628    HB3  LEU  79           HB3      LEU  79  14.062  -8.745  -4.245
  629    HG   LEU  79           HG       LEU  79  13.955  -6.399  -3.445
  630   HD11  LEU  79          HD11      LEU  79  13.887  -6.764  -6.430
  631   HD12  LEU  79          HD12      LEU  79  15.287  -6.996  -5.383
  632   HD13  LEU  79          HD13      LEU  79  14.587  -5.389  -5.576
  633   HD21  LEU  79          HD21      LEU  79  11.788  -5.907  -5.452
  634   HD22  LEU  79          HD22      LEU  79  12.402  -4.831  -4.198
  635   HD23  LEU  79          HD23      LEU  79  11.427  -6.233  -3.757
  636    H    GLY  80           H        GLY  80  13.410 -11.065  -5.216
  637    HA2  GLY  80           HA2      GLY  80  14.830 -10.693  -7.634
  638    HA3  GLY  80           HA3      GLY  80  14.789 -12.159  -6.690
  639    H    GLN  81           H        GLN  81  11.775 -12.058  -6.879
  640    HA   GLN  81           HA       GLN  81  11.535 -13.338  -9.473
  641    HB2  GLN  81           HB2      GLN  81   9.933 -13.423  -6.925
  642    HB3  GLN  81           HB3      GLN  81   9.391 -14.166  -8.408
  643    HG2  GLN  81           HG2      GLN  81  12.112 -14.857  -7.550
  644    HG3  GLN  81           HG3      GLN  81  10.809 -15.461  -6.535
  645   HE21  GLN  81          HE21      GLN  81   9.367 -16.974  -7.371
  646   HE22  GLN  81          HE22      GLN  81   9.697 -17.858  -8.819
  647    HA   PRO  82           HA       PRO  82   9.354  -9.396 -10.427
  648    HB2  PRO  82           HB2      PRO  82   9.905  -9.919 -13.219
  649    HB3  PRO  82           HB3      PRO  82  10.555  -8.640 -12.189
  650    HG2  PRO  82           HG2      PRO  82  12.073 -10.674 -13.165
  651    HG3  PRO  82           HG3      PRO  82  12.427  -9.824 -11.649
  652    HD2  PRO  82           HD2      PRO  82  11.110 -12.478 -12.057
  653    HD3  PRO  82           HD3      PRO  82  12.311 -11.981 -10.845
  654    H    HIS  83           H        HIS  83   8.945 -12.504 -12.083
  655    HA   HIS  83           HA       HIS  83   6.391 -11.740 -13.218
  656    HB2  HIS  83           HB2      HIS  83   8.179 -13.311 -14.247
  657    HB3  HIS  83           HB3      HIS  83   7.491 -14.536 -13.189
  658    HD1  HIS  83           HD1      HIS  83   6.598 -12.352 -16.129
  659    HD2  HIS  83           HD2      HIS  83   5.098 -15.624 -14.052
  660    HE1  HIS  83           HE1      HIS  83   4.675 -13.201 -17.510
  661    HE2  HIS  83           HE2      HIS  83   3.782 -15.182 -16.235
  662    H    HIS  84           H        HIS  84   4.495 -11.970 -12.291
  663    HA   HIS  84           HA       HIS  84   4.017 -14.009 -10.250
  664    HB2  HIS  84           HB2      HIS  84   4.405 -11.393  -9.578
  665    HB3  HIS  84           HB3      HIS  84   2.662 -11.424  -9.813
  666    HD1  HIS  84           HD1      HIS  84   1.345 -13.226  -8.312
  667    HD2  HIS  84           HD2      HIS  84   5.263 -12.414  -7.190
  668    HE1  HIS  84           HE1      HIS  84   1.570 -14.103  -5.967
  669    HE2  HIS  84           HE2      HIS  84   3.948 -13.603  -5.307
  670    H    GLU  85           H        GLU  85   2.284 -15.138 -10.848
  671    HA   GLU  85           HA       GLU  85   0.388 -13.967 -12.653
  672    HB2  GLU  85           HB2      GLU  85   1.937 -16.053 -13.250
  673    HB3  GLU  85           HB3      GLU  85   0.625 -16.917 -12.461
  674    HG2  GLU  85           HG2      GLU  85  -0.969 -16.000 -14.028
  675    HG3  GLU  85           HG3      GLU  85   0.294 -15.027 -14.780
  676    H    LEU  86           H        LEU  86  -1.608 -13.990 -12.209
  677    HA   LEU  86           HA       LEU  86  -2.834 -15.557 -10.137
  678    HB2  LEU  86           HB2      LEU  86  -2.263 -13.577  -8.930
  679    HB3  LEU  86           HB3      LEU  86  -2.689 -12.559 -10.279
  680    HG   LEU  86           HG       LEU  86  -5.075 -13.505  -9.885
  681   HD11  LEU  86          HD11      LEU  86  -5.548 -13.826  -7.477
  682   HD12  LEU  86          HD12      LEU  86  -3.811 -13.839  -7.168
  683   HD13  LEU  86          HD13      LEU  86  -4.540 -15.103  -8.159
  684   HD21  LEU  86          HD21      LEU  86  -5.488 -11.611  -8.293
  685   HD22  LEU  86          HD22      LEU  86  -4.619 -11.185  -9.764
  686   HD23  LEU  86          HD23      LEU  86  -3.741 -11.368  -8.244
  687    H    ASP  87           H        ASP  87  -4.806 -16.096 -10.743
  688    HA   ASP  87           HA       ASP  87  -6.555 -16.651 -12.072
  689    HB2  ASP  87           HB2      ASP  87  -7.035 -14.400 -11.128
  690    HB3  ASP  87           HB3      ASP  87  -6.579 -13.733 -12.668
  691    H    SER  88           H        SER  88  -4.102 -16.865 -13.205
  692    HA   SER  88           HA       SER  88  -3.080 -17.515 -15.133
  693    HB2  SER  88           HB2      SER  88  -5.767 -16.981 -16.432
  694    HB3  SER  88           HB3      SER  88  -4.400 -17.755 -17.232
  695    HG   SER  88           HG       SER  88  -4.627 -19.504 -15.973
  696    H    LYS  89           H        LYS  89  -3.633 -14.507 -14.321
  697    HA   LYS  89           HA       LYS  89  -2.344 -13.428 -16.698
  698    HB2  LYS  89           HB2      LYS  89  -3.446 -11.182 -15.934
  699    HB3  LYS  89           HB3      LYS  89  -4.320 -12.303 -16.950
  700    HG2  LYS  89           HG2      LYS  89  -5.433 -13.163 -14.856
  701    HG3  LYS  89           HG3      LYS  89  -4.679 -11.815 -14.000
  702    HD2  LYS  89           HD2      LYS  89  -5.762 -10.287 -15.687
  703    HD3  LYS  89           HD3      LYS  89  -6.668 -11.687 -16.261
  704    HE2  LYS  89           HE2      LYS  89  -8.086 -10.567 -14.741
  705    HE3  LYS  89           HE3      LYS  89  -7.475 -11.982 -13.886
  706    HZ1  LYS  89           HZ1      LYS  89  -6.386  -9.231 -13.619
  707    HZ2  LYS  89           HZ2      LYS  89  -5.882 -10.592 -12.750
  708    HZ3  LYS  89           HZ3      LYS  89  -7.437  -9.970 -12.519
  709    H    THR  90           H        THR  90  -0.993 -11.771 -16.381
  710    HA   THR  90           HA       THR  90   0.696 -12.005 -14.051
  711    HB   THR  90           HB       THR  90   1.165 -10.088 -16.329
  712    HG1  THR  90           HG1      THR  90   2.182 -12.692 -16.481
  713   HG21  THR  90          HG21      THR  90   3.531 -10.630 -15.899
  714   HG22  THR  90          HG22      THR  90   3.040 -11.715 -14.599
  715   HG23  THR  90          HG23      THR  90   2.743  -9.982 -14.461
  716    H    ILE  91           H        ILE  91   0.676 -10.701 -12.328
  717    HA   ILE  91           HA       ILE  91  -0.656  -8.088 -12.530
  718    HB   ILE  91           HB       ILE  91  -1.109  -8.222 -10.130
  719   HG12  ILE  91          HG12      ILE  91  -0.168 -11.052 -10.211
  720   HG13  ILE  91          HG13      ILE  91   0.755  -9.761  -9.476
  721   HG21  ILE  91          HG21      ILE  91  -2.783  -8.917 -11.700
  722   HG22  ILE  91          HG22      ILE  91  -2.849  -9.950 -10.274
  723   HG23  ILE  91          HG23      ILE  91  -2.094 -10.541 -11.755
  724   HD11  ILE  91          HD11      ILE  91  -1.098 -11.385  -8.228
  725   HD12  ILE  91          HD12      ILE  91  -1.973  -9.871  -8.495
  726   HD13  ILE  91          HD13      ILE  91  -0.444  -9.871  -7.603
  727    H    ASP  92           H        ASP  92   0.254  -6.438 -10.751
  728    HA   ASP  92           HA       ASP  92   3.166  -6.535 -11.178
  729    HB2  ASP  92           HB2      ASP  92   1.713  -4.805 -12.381
  730    HB3  ASP  92           HB3      ASP  92   1.558  -4.021 -10.817
  731    HA   PRO  93           HA       PRO  93   2.952  -6.191  -6.573
  732    HB2  PRO  93           HB2      PRO  93   4.796  -8.384  -6.334
  733    HB3  PRO  93           HB3      PRO  93   3.102  -8.342  -5.836
  734    HG2  PRO  93           HG2      PRO  93   4.044  -9.913  -7.869
  735    HG3  PRO  93           HG3      PRO  93   2.367  -9.350  -7.741
  736    HD2  PRO  93           HD2      PRO  93   4.596  -8.265  -9.421
  737    HD3  PRO  93           HD3      PRO  93   2.880  -8.493  -9.830
  738    H    LYS  94           H        LYS  94   4.226  -4.603  -5.858
  739    HA   LYS  94           HA       LYS  94   7.133  -4.783  -6.224
  740    HB2  LYS  94           HB2      LYS  94   5.723  -2.170  -6.762
  741    HB3  LYS  94           HB3      LYS  94   7.391  -2.590  -7.103
  742    HG2  LYS  94           HG2      LYS  94   5.112  -3.956  -8.489
  743    HG3  LYS  94           HG3      LYS  94   5.760  -2.417  -9.067
  744    HD2  LYS  94           HD2      LYS  94   8.023  -3.519  -9.146
  745    HD3  LYS  94           HD3      LYS  94   7.211  -5.049  -8.806
  746    HE2  LYS  94           HE2      LYS  94   5.883  -4.806 -10.834
  747    HE3  LYS  94           HE3      LYS  94   6.649  -3.254 -11.165
  748    HZ1  LYS  94           HZ1      LYS  94   8.786  -4.421 -11.326
  749    HZ2  LYS  94           HZ2      LYS  94   7.673  -4.972 -12.475
  750    HZ3  LYS  94           HZ3      LYS  94   7.996  -5.900 -11.098
  751    H    VAL  95           H        VAL  95   8.376  -3.499  -4.765
  752    HA   VAL  95           HA       VAL  95   7.109  -3.089  -2.200
  753    HB   VAL  95           HB       VAL  95   9.960  -2.511  -2.834
  754   HG11  VAL  95          HG11      VAL  95  10.327  -3.008  -0.448
  755   HG12  VAL  95          HG12      VAL  95   8.587  -3.226  -0.257
  756   HG13  VAL  95          HG13      VAL  95   9.234  -1.646  -0.696
  757   HG21  VAL  95          HG21      VAL  95   8.857  -5.151  -1.896
  758   HG22  VAL  95          HG22      VAL  95  10.556  -4.764  -2.164
  759   HG23  VAL  95          HG23      VAL  95   9.441  -4.822  -3.528
  760    H    ALA  96           H        ALA  96   6.906  -1.135  -1.094
  761    HA   ALA  96           HA       ALA  96   6.219   1.123  -2.553
  762    HB1  ALA  96           HB1      ALA  96   6.019   2.272  -0.427
  763    HB2  ALA  96           HB2      ALA  96   6.924   0.981   0.366
  764    HB3  ALA  96           HB3      ALA  96   5.342   0.646  -0.340
  765    H    PHE  97           H        PHE  97   7.110   3.104  -2.929
  766    HA   PHE  97           HA       PHE  97  10.011   3.369  -2.587
  767    HB2  PHE  97           HB2      PHE  97   8.157   3.849  -4.818
  768    HB3  PHE  97           HB3      PHE  97   9.337   5.121  -4.560
  769    HD1  PHE  97           HD1      PHE  97   8.845   1.605  -5.424
  770    HD2  PHE  97           HD2      PHE  97  11.679   4.745  -4.968
  771    HE1  PHE  97           HE1      PHE  97  10.533   0.249  -6.602
  772    HE2  PHE  97           HE2      PHE  97  13.371   3.399  -6.143
  773    HZ   PHE  97           HZ       PHE  97  12.799   1.147  -6.960
  774    HA   PRO  98           HA       PRO  98   8.945   7.034  -0.124
  775    HB2  PRO  98           HB2      PRO  98  11.763   7.806  -0.237
  776    HB3  PRO  98           HB3      PRO  98  10.821   7.245   1.150
  777    HG2  PRO  98           HG2      PRO  98  12.759   5.730   0.095
  778    HG3  PRO  98           HG3      PRO  98  11.265   5.019   0.744
  779    HD2  PRO  98           HD2      PRO  98  11.958   5.617  -2.116
  780    HD3  PRO  98           HD3      PRO  98  11.307   4.124  -1.403
  781    H    ARG  99           H        ARG  99   9.071   9.376  -0.182
  782    HA   ARG  99           HA       ARG  99   9.043  10.418  -2.900
  783    HB2  ARG  99           HB2      ARG  99   8.187  11.549  -0.237
  784    HB3  ARG  99           HB3      ARG  99   8.190  12.511  -1.708
  785    HG2  ARG  99           HG2      ARG  99   6.566  11.068  -2.726
  786    HG3  ARG  99           HG3      ARG  99   6.659   9.939  -1.373
  787    HD2  ARG  99           HD2      ARG  99   5.775  11.663   0.124
  788    HD3  ARG  99           HD3      ARG  99   5.687  12.793  -1.227
  789    HE   ARG  99           HE       ARG  99   4.221  10.605  -2.011
  790   HH11  ARG  99          HH11      ARG  99   4.026  12.877   0.664
  791   HH12  ARG  99          HH12      ARG  99   2.306  12.727   0.812
  792   HH21  ARG  99          HH21      ARG  99   1.147  11.341  -0.578
  793   HH22  ARG  99          HH22      ARG  99   1.974  10.426  -1.794
  794    H    ARG 100           H        ARG 100  10.181  12.274  -3.592
  795    HA   ARG 100           HA       ARG 100  12.708  12.756  -2.150
  796    HB2  ARG 100           HB2      ARG 100  12.402  11.844  -4.679
  797    HB3  ARG 100           HB3      ARG 100  12.470  13.573  -4.984
  798    HG2  ARG 100           HG2      ARG 100  14.617  13.688  -3.799
  799    HG3  ARG 100           HG3      ARG 100  14.550  11.946  -3.531
  800    HD2  ARG 100           HD2      ARG 100  14.493  13.217  -6.263
  801    HD3  ARG 100           HD3      ARG 100  15.975  12.691  -5.468
  802    HE   ARG 100           HE       ARG 100  13.943  10.651  -5.677
  803   HH11  ARG 100          HH11      ARG 100  17.033  10.711  -8.243
  804   HH12  ARG 100          HH12      ARG 100  16.712  12.109  -7.272
  805   HH21  ARG 100          HH21      ARG 100  14.382   8.834  -6.960
  806   HH22  ARG 100          HH22      ARG 100  15.715   8.860  -8.066
  807    H    ALA 101           H        ALA 101  13.646  14.932  -2.312
  808    HA   ALA 101           HA       ALA 101  11.720  16.964  -1.779
  809    HB1  ALA 101           HB1      ALA 101  13.362  17.981  -0.627
  810    HB2  ALA 101           HB2      ALA 101  14.526  17.782  -1.934
  811    HB3  ALA 101           HB3      ALA 101  14.209  16.446  -0.827
  812    H    GLN 102           H        GLN 102  12.372  19.298  -2.646
  813    HA   GLN 102           HA       GLN 102  12.381  19.116  -5.584
  814    HB2  GLN 102           HB2      GLN 102  11.171  21.105  -3.680
  815    HB3  GLN 102           HB3      GLN 102  11.403  21.488  -5.380
  816    HG2  GLN 102           HG2      GLN 102   9.994  19.604  -6.009
  817    HG3  GLN 102           HG3      GLN 102   9.780  19.190  -4.309
  818   HE21  GLN 102          HE21      GLN 102   8.468  20.467  -3.018
  819   HE22  GLN 102          HE22      GLN 102   7.362  21.619  -3.676
  820    HA   PRO 103           HA       PRO 103  16.282  21.339  -5.581
  821    HB2  PRO 103           HB2      PRO 103  16.515  21.882  -8.204
  822    HB3  PRO 103           HB3      PRO 103  16.651  20.232  -7.579
  823    HG2  PRO 103           HG2      PRO 103  14.333  21.548  -8.920
  824    HG3  PRO 103           HG3      PRO 103  14.963  19.901  -9.123
  825    HD2  PRO 103           HD2      PRO 103  12.791  20.527  -7.568
  826    HD3  PRO 103           HD3      PRO 103  13.818  19.103  -7.321
  827    H    LYS 104           H        LYS 104  17.244  23.437  -6.495
  828    HA   LYS 104           HA       LYS 104  15.485  25.643  -5.812
  829    HB2  LYS 104           HB2      LYS 104  18.437  25.444  -6.390
  830    HB3  LYS 104           HB3      LYS 104  17.631  26.988  -6.165
  831    HG2  LYS 104           HG2      LYS 104  16.981  26.344  -3.913
  832    HG3  LYS 104           HG3      LYS 104  17.735  24.763  -4.137
  833    HD2  LYS 104           HD2      LYS 104  19.910  25.806  -4.399
  834    HD3  LYS 104           HD3      LYS 104  19.181  27.409  -4.285
  835    HE2  LYS 104           HE2      LYS 104  18.484  26.950  -2.001
  836    HE3  LYS 104           HE3      LYS 104  19.141  25.317  -2.111
  837    HZ1  LYS 104           HZ1      LYS 104  20.722  27.824  -2.322
  838    HZ2  LYS 104           HZ2      LYS 104  21.344  26.252  -2.390
  839    HZ3  LYS 104           HZ3      LYS 104  20.647  26.823  -0.959
  840    H    MET 105           H        MET 105  15.211  27.527  -7.093
  841    HA   MET 105           HA       MET 105  14.563  28.677  -8.920
  842    HB2  MET 105           HB2      MET 105  17.085  27.418  -9.960
  843    HB3  MET 105           HB3      MET 105  16.137  28.537 -10.932
  844    HG2  MET 105           HG2      MET 105  17.162  29.198  -8.188
  845    HG3  MET 105           HG3      MET 105  18.063  29.538  -9.669
  846    HE1  MET 105           HE1      MET 105  17.360  31.782  -7.555
  847    HE2  MET 105           HE2      MET 105  16.805  33.091  -8.599
  848    HE3  MET 105           HE3      MET 105  18.204  32.124  -9.065
  849    H    VAL 106           H        VAL 106  13.108  28.613 -10.477
  850    HA   VAL 106           HA       VAL 106  12.596  26.047 -11.819
  851    HB   VAL 106           HB       VAL 106  10.492  28.085 -11.028
  852   HG11  VAL 106          HG11      VAL 106  10.207  25.299 -12.156
  853   HG12  VAL 106          HG12      VAL 106   9.842  26.811 -12.988
  854   HG13  VAL 106          HG13      VAL 106   8.876  26.314 -11.598
  855   HG21  VAL 106          HG21      VAL 106  11.379  27.030  -9.028
  856   HG22  VAL 106          HG22      VAL 106  11.132  25.434  -9.736
  857   HG23  VAL 106          HG23      VAL 106   9.745  26.451  -9.350
  858    H    THR 107           H        THR 107  11.916  29.537 -12.075
  859    HA   THR 107           HA       THR 107  12.096  29.388 -14.950
  860    HB   THR 107           HB       THR 107  11.115  31.787 -13.422
  861    HG1  THR 107           HG1      THR 107   9.878  29.957 -12.752
  862   HG21  THR 107          HG21      THR 107  11.528  32.064 -15.834
  863   HG22  THR 107          HG22      THR 107   9.812  32.208 -15.455
  864   HG23  THR 107          HG23      THR 107  10.434  30.722 -16.171
  865    H    ARG 108           H        ARG 108  14.118  29.670 -15.567
  866    HA   ARG 108           HA       ARG 108  15.839  31.601 -14.192
  867    HB2  ARG 108           HB2      ARG 108  16.380  29.258 -15.987
  868    HB3  ARG 108           HB3      ARG 108  17.614  30.480 -15.718
  869    HG2  ARG 108           HG2      ARG 108  17.639  30.020 -13.363
  870    HG3  ARG 108           HG3      ARG 108  16.268  28.920 -13.522
  871    HD2  ARG 108           HD2      ARG 108  18.806  28.458 -15.051
  872    HD3  ARG 108           HD3      ARG 108  18.649  27.927 -13.377
  873    HE   ARG 108           HE       ARG 108  16.536  26.758 -14.325
  874   HH11  ARG 108          HH11      ARG 108  19.596  27.086 -16.020
  875   HH12  ARG 108          HH12      ARG 108  19.368  25.639 -16.944
  876   HH21  ARG 108          HH21      ARG 108  17.487  24.381 -16.668
  877   HH22  ARG 108          HH22      ARG 108  16.269  24.859 -15.533
  878    H    THR 109           H        THR 109  14.491  30.899 -17.384
  879    HA   THR 109           HA       THR 109  15.792  33.309 -18.454
  880    HB   THR 109           HB       THR 109  14.924  32.431 -20.692
  881    HG1  THR 109           HG1      THR 109  13.490  30.861 -19.556
  882   HG21  THR 109          HG21      THR 109  16.785  30.853 -20.931
  883   HG22  THR 109          HG22      THR 109  16.952  30.783 -19.176
  884   HG23  THR 109          HG23      THR 109  17.274  32.290 -20.034
  885    H    LYS 110           H        LYS 110  14.581  35.035 -17.986
  886    HA   LYS 110           HA       LYS 110  11.719  34.959 -18.426
  887    HB2  LYS 110           HB2      LYS 110  13.489  36.727 -16.787
  888    HB3  LYS 110           HB3      LYS 110  11.889  37.278 -17.263
  889    HG2  LYS 110           HG2      LYS 110  10.932  35.254 -16.192
  890    HG3  LYS 110           HG3      LYS 110  12.550  34.851 -15.612
  891    HD2  LYS 110           HD2      LYS 110  12.649  36.902 -14.341
  892    HD3  LYS 110           HD3      LYS 110  11.098  37.424 -15.002
  893    HE2  LYS 110           HE2      LYS 110  10.007  35.510 -13.927
  894    HE3  LYS 110           HE3      LYS 110  11.558  35.007 -13.257
  895    HZ1  LYS 110           HZ1      LYS 110  11.658  37.087 -12.029
  896    HZ2  LYS 110           HZ2      LYS 110  10.253  36.231 -11.638
  897    HZ3  LYS 110           HZ3      LYS 110  10.168  37.567 -12.672
  898    H    LYS 111           H        LYS 111  10.697  36.305 -19.867
  899    HA   LYS 111           HA       LYS 111  12.354  37.520 -21.874
  900    HB2  LYS 111           HB2      LYS 111  10.192  36.008 -22.168
  901    HB3  LYS 111           HB3      LYS 111   9.379  37.560 -22.051
  902    HG2  LYS 111           HG2      LYS 111  11.633  37.257 -23.984
  903    HG3  LYS 111           HG3      LYS 111  10.060  36.568 -24.379
  904    HD2  LYS 111           HD2      LYS 111   9.015  38.755 -24.092
  905    HD3  LYS 111           HD3      LYS 111  10.572  39.454 -23.645
  906    HE2  LYS 111           HE2      LYS 111  10.187  40.000 -25.929
  907    HE3  LYS 111           HE3      LYS 111  11.428  38.750 -25.896
  908    HZ1  LYS 111           HZ1      LYS 111   9.785  38.323 -27.613
  909    HZ2  LYS 111           HZ2      LYS 111   8.544  38.308 -26.464
  910    HZ3  LYS 111           HZ3      LYS 111   9.736  37.108 -26.436
  Start of MODEL    2
    1    H1   MET  -3           H1       MET  -3  17.524 -26.875  14.182
    2    H2   MET  -3           H2       MET  -3  17.099 -25.404  14.902
    3    H3   MET  -3           H3       MET  -3  16.106 -26.759  15.098
    4    HA   MET  -3           HA       MET  -3  17.376 -26.342  17.090
    5    HB2  MET  -3           HB2      MET  -3  17.895 -28.813  15.476
    6    HB3  MET  -3           HB3      MET  -3  18.654 -28.627  17.051
    7    HG2  MET  -3           HG2      MET  -3  16.448 -28.356  18.075
    8    HG3  MET  -3           HG3      MET  -3  15.697 -28.570  16.494
    9    HE1  MET  -3           HE1      MET  -3  15.097 -30.268  19.207
   10    HE2  MET  -3           HE2      MET  -3  14.913 -31.887  18.532
   11    HE3  MET  -3           HE3      MET  -3  14.195 -30.503  17.709
   12    H    HIS  -2           H        HIS  -2  19.432 -26.883  14.243
   13    HA   HIS  -2           HA       HIS  -2  21.583 -25.407  15.593
   14    HB2  HIS  -2           HB2      HIS  -2  21.852 -28.075  14.213
   15    HB3  HIS  -2           HB3      HIS  -2  23.229 -27.013  14.489
   16    HD1  HIS  -2           HD1      HIS  -2  21.146 -29.551  16.108
   17    HD2  HIS  -2           HD2      HIS  -2  23.802 -26.586  17.300
   18    HE1  HIS  -2           HE1      HIS  -2  21.752 -30.106  18.486
   19    HE2  HIS  -2           HE2      HIS  -2  23.361 -28.299  19.188
   20    H    HIS  -1           H        HIS  -1  20.220 -26.578  12.544
   21    HA   HIS  -1           HA       HIS  -1  21.925 -24.817  10.979
   22    HB2  HIS  -1           HB2      HIS  -1  19.841 -26.863  10.232
   23    HB3  HIS  -1           HB3      HIS  -1  20.587 -25.802   9.041
   24    HD1  HIS  -1           HD1      HIS  -1  21.319 -28.721  11.264
   25    HD2  HIS  -1           HD2      HIS  -1  23.231 -26.423   8.379
   26    HE1  HIS  -1           HE1      HIS  -1  23.421 -29.976  10.690
   27    HE2  HIS  -1           HE2      HIS  -1  24.565 -28.566   8.943
   28    H    HIS   0           H        HIS   0  18.464 -25.143  11.736
   29    HA   HIS   0           HA       HIS   0  17.923 -22.609  10.377
   30    HB2  HIS   0           HB2      HIS   0  16.132 -24.795  11.417
   31    HB3  HIS   0           HB3      HIS   0  15.497 -23.228  10.927
   32    HD1  HIS   0           HD1      HIS   0  15.887 -22.586   8.356
   33    HD2  HIS   0           HD2      HIS   0  16.587 -26.556   9.369
   34    HE1  HIS   0           HE1      HIS   0  15.894 -23.845   6.179
   35    HE2  HIS   0           HE2      HIS   0  16.319 -26.246   6.814
   36    H    HIS   1           H        HIS   1  17.672 -24.102  13.581
   37    HA   HIS   1           HA       HIS   1  17.000 -21.470  14.713
   38    HB2  HIS   1           HB2      HIS   1  15.617 -23.721  15.083
   39    HB3  HIS   1           HB3      HIS   1  16.809 -23.944  16.359
   40    HD1  HIS   1           HD1      HIS   1  13.773 -22.040  15.481
   41    HD2  HIS   1           HD2      HIS   1  16.705 -21.962  18.424
   42    HE1  HIS   1           HE1      HIS   1  12.856 -20.570  17.304
   43    HE2  HIS   1           HE2      HIS   1  14.647 -20.537  19.076
   44    H    HIS   2           H        HIS   2  18.271 -20.521  16.204
   45    HA   HIS   2           HA       HIS   2  20.690 -21.951  17.096
   46    HB2  HIS   2           HB2      HIS   2  20.426 -19.157  16.001
   47    HB3  HIS   2           HB3      HIS   2  21.782 -19.619  17.024
   48    HD1  HIS   2           HD1      HIS   2  20.140 -20.926  13.841
   49    HD2  HIS   2           HD2      HIS   2  23.887 -20.493  15.585
   50    HE1  HIS   2           HE1      HIS   2  21.782 -21.748  12.121
   51    HE2  HIS   2           HE2      HIS   2  24.044 -21.477  13.198
   52    H    HIS   3           H        HIS   3  21.076 -21.903  19.218
   53    HA   HIS   3           HA       HIS   3  19.545 -20.008  20.876
   54    HB2  HIS   3           HB2      HIS   3  20.036 -22.930  21.183
   55    HB3  HIS   3           HB3      HIS   3  19.971 -21.954  22.646
   56    HD1  HIS   3           HD1      HIS   3  17.689 -20.724  23.132
   57    HD2  HIS   3           HD2      HIS   3  17.598 -23.452  19.998
   58    HE1  HIS   3           HE1      HIS   3  15.251 -21.154  22.685
   59    HE2  HIS   3           HE2      HIS   3  15.219 -22.808  20.784
   60    H    SER   4           H        SER   4  20.758 -18.561  21.824
   61    HA   SER   4           HA       SER   4  23.433 -19.301  22.816
   62    HB2  SER   4           HB2      SER   4  22.685 -16.715  21.420
   63    HB3  SER   4           HB3      SER   4  24.246 -17.052  22.169
   64    HG   SER   4           HG       SER   4  24.432 -17.514  20.009
   65    H    THR   5           H        THR   5  24.198 -17.993  24.626
   66    HA   THR   5           HA       THR   5  22.116 -17.360  26.487
   67    HB   THR   5           HB       THR   5  24.193 -16.747  27.901
   68    HG1  THR   5           HG1      THR   5  25.395 -18.085  25.709
   69   HG21  THR   5          HG21      THR   5  22.914 -18.762  28.289
   70   HG22  THR   5          HG22      THR   5  24.635 -19.136  28.379
   71   HG23  THR   5          HG23      THR   5  23.715 -19.555  26.933
   72    H    SER   6           H        SER   6  21.198 -15.441  26.680
   73    HA   SER   6           HA       SER   6  22.482 -13.073  25.542
   74    HB2  SER   6           HB2      SER   6  19.661 -13.480  26.557
   75    HB3  SER   6           HB3      SER   6  20.267 -12.018  25.778
   76    HG   SER   6           HG       SER   6  20.535 -13.150  23.889
   77    H    VAL   7           H        VAL   7  22.969 -11.256  26.653
   78    HA   VAL   7           HA       VAL   7  22.793 -11.379  29.595
   79    HB   VAL   7           HB       VAL   7  24.860  -9.831  28.001
   80   HG11  VAL   7          HG11      VAL   7  24.470  -8.964  30.253
   81   HG12  VAL   7          HG12      VAL   7  26.070  -9.698  30.130
   82   HG13  VAL   7          HG13      VAL   7  24.761 -10.566  30.931
   83   HG21  VAL   7          HG21      VAL   7  26.479 -11.561  28.563
   84   HG22  VAL   7          HG22      VAL   7  25.151 -12.242  27.620
   85   HG23  VAL   7          HG23      VAL   7  25.220 -12.502  29.363
   86    H    ASP   8           H        ASP   8  22.875  -9.145  26.817
   87    HA   ASP   8           HA       ASP   8  21.600  -7.023  28.346
   88    HB2  ASP   8           HB2      ASP   8  22.689  -7.194  25.539
   89    HB3  ASP   8           HB3      ASP   8  21.779  -5.798  26.105
   90    H    LEU   9           H        LEU   9  19.596  -6.109  27.866
   91    HA   LEU   9           HA       LEU   9  17.665  -7.952  26.707
   92    HB2  LEU   9           HB2      LEU   9  17.557  -6.455  28.935
   93    HB3  LEU   9           HB3      LEU   9  16.816  -5.331  27.813
   94    HG   LEU   9           HG       LEU   9  15.717  -8.069  27.733
   95   HD11  LEU   9          HD11      LEU   9  15.299  -6.292  30.129
   96   HD12  LEU   9          HD12      LEU   9  16.112  -7.858  30.122
   97   HD13  LEU   9          HD13      LEU   9  14.389  -7.756  29.758
   98   HD21  LEU   9          HD21      LEU   9  14.421  -5.359  27.976
   99   HD22  LEU   9          HD22      LEU   9  13.635  -6.875  27.535
  100   HD23  LEU   9          HD23      LEU   9  14.821  -6.149  26.450
  101    H    GLY  10           H        GLY  10  15.883  -7.043  25.330
  102    HA2  GLY  10           HA2      GLY  10  16.903  -4.978  23.484
  103    HA3  GLY  10           HA3      GLY  10  16.179  -6.466  22.892
  104    H    THR  11           H        THR  11  15.488  -3.709  25.001
  105    HA   THR  11           HA       THR  11  12.709  -3.719  24.012
  106    HB   THR  11           HB       THR  11  12.678  -4.348  26.357
  107    HG1  THR  11           HG1      THR  11  11.023  -2.924  25.617
  108   HG21  THR  11          HG21      THR  11  14.847  -3.284  27.017
  109   HG22  THR  11          HG22      THR  11  13.529  -2.984  28.150
  110   HG23  THR  11          HG23      THR  11  14.024  -1.723  27.021
  111    H    GLU  12           H        GLU  12  15.578  -2.106  23.931
  112    HA   GLU  12           HA       GLU  12  14.452   0.577  23.787
  113    HB2  GLU  12           HB2      GLU  12  16.508   0.152  25.134
  114    HB3  GLU  12           HB3      GLU  12  17.338  -0.303  23.656
  115    HG2  GLU  12           HG2      GLU  12  17.144   1.910  22.792
  116    HG3  GLU  12           HG3      GLU  12  16.123   2.402  24.142
  117    H    ASN  13           H        ASN  13  16.637  -1.422  21.916
  118    HA   ASN  13           HA       ASN  13  16.283   0.056  19.492
  119    HB2  ASN  13           HB2      ASN  13  18.360  -1.257  20.376
  120    HB3  ASN  13           HB3      ASN  13  17.579  -2.644  19.645
  121   HD21  ASN  13          HD21      ASN  13  20.034  -1.198  19.188
  122   HD22  ASN  13          HD22      ASN  13  20.006  -0.789  17.536
  123    H    LEU  14           H        LEU  14  14.030  -1.650  20.853
  124    HA   LEU  14           HA       LEU  14  13.314  -3.564  18.808
  125    HB2  LEU  14           HB2      LEU  14  12.830  -3.610  21.382
  126    HB3  LEU  14           HB3      LEU  14  11.444  -2.634  20.946
  127    HG   LEU  14           HG       LEU  14  10.979  -4.582  19.241
  128   HD11  LEU  14          HD11      LEU  14  12.996  -5.843  19.613
  129   HD12  LEU  14          HD12      LEU  14  11.616  -6.772  20.199
  130   HD13  LEU  14          HD13      LEU  14  12.664  -5.934  21.344
  131   HD21  LEU  14          HD21      LEU  14   9.479  -3.922  21.027
  132   HD22  LEU  14          HD22      LEU  14  10.461  -4.795  22.203
  133   HD23  LEU  14          HD23      LEU  14   9.596  -5.680  20.947
  134    H    TYR  15           H        TYR  15  11.493  -3.490  17.495
  135    HA   TYR  15           HA       TYR  15  10.748  -0.816  16.590
  136    HB2  TYR  15           HB2      TYR  15  10.429  -3.579  15.421
  137    HB3  TYR  15           HB3      TYR  15   9.618  -2.178  14.724
  138    HD1  TYR  15           HD1      TYR  15  10.839  -0.528  13.486
  139    HD2  TYR  15           HD2      TYR  15  12.888  -3.744  15.373
  140    HE1  TYR  15           HE1      TYR  15  12.875   0.039  12.230
  141    HE2  TYR  15           HE2      TYR  15  14.929  -3.186  14.121
  142    HH   TYR  15           HH       TYR  15  15.322  -0.277  12.449
  143    H    PHE  16           H        PHE  16   8.555  -0.187  16.249
  144    HA   PHE  16           HA       PHE  16   6.446  -1.756  17.417
  145    HB2  PHE  16           HB2      PHE  16   7.639   0.405  18.846
  146    HB3  PHE  16           HB3      PHE  16   6.013   0.891  18.377
  147    HD1  PHE  16           HD1      PHE  16   8.005  -1.366  20.425
  148    HD2  PHE  16           HD2      PHE  16   4.065  -0.320  19.205
  149    HE1  PHE  16           HE1      PHE  16   7.082  -2.697  22.278
  150    HE2  PHE  16           HE2      PHE  16   3.135  -1.646  21.057
  151    HZ   PHE  16           HZ       PHE  16   4.644  -2.837  22.595
  152    H    GLN  17           H        GLN  17   7.362   1.262  15.807
  153    HA   GLN  17           HA       GLN  17   4.714   1.619  14.661
  154    HB2  GLN  17           HB2      GLN  17   7.290   3.180  14.450
  155    HB3  GLN  17           HB3      GLN  17   5.863   3.584  13.506
  156    HG2  GLN  17           HG2      GLN  17   4.604   4.050  15.486
  157    HG3  GLN  17           HG3      GLN  17   5.907   3.452  16.513
  158   HE21  GLN  17          HE21      GLN  17   4.822   6.048  14.471
  159   HE22  GLN  17          HE22      GLN  17   5.997   7.208  14.976
  160    H    SER  18           H        SER  18   4.082   0.768  12.791
  161    HA   SER  18           HA       SER  18   6.086  -0.391  10.989
  162    HB2  SER  18           HB2      SER  18   3.095  -0.839  11.129
  163    HB3  SER  18           HB3      SER  18   4.203  -1.667  10.034
  164    HG   SER  18           HG       SER  18   5.311  -2.383  11.989
  165    H    ASN  19           H        ASN  19   6.572   0.542   9.128
  166    HA   ASN  19           HA       ASN  19   4.583   2.133   7.699
  167    HB2  ASN  19           HB2      ASN  19   7.214   3.177   8.718
  168    HB3  ASN  19           HB3      ASN  19   6.508   3.844   7.253
  169   HD21  ASN  19          HD21      ASN  19   7.008   4.489  10.211
  170   HD22  ASN  19          HD22      ASN  19   5.573   5.305  10.639
  171    H    ALA  20           H        ALA  20   7.999   1.096   7.581
  172    HA   ALA  20           HA       ALA  20   7.830   0.665   4.697
  173    HB1  ALA  20           HB1      ALA  20  10.256   0.233   4.866
  174    HB2  ALA  20           HB2      ALA  20  10.149   0.450   6.614
  175    HB3  ALA  20           HB3      ALA  20   9.793   1.799   5.534
  176    H    GLY  21           H        GLY  21   8.235  -1.330   3.683
  177    HA2  GLY  21           HA2      GLY  21   8.930  -3.681   3.936
  178    HA3  GLY  21           HA3      GLY  21   8.038  -3.696   5.445
  179    H    LYS  22           H        LYS  22   6.138  -1.923   3.455
  180    HA   LYS  22           HA       LYS  22   4.384  -4.155   2.928
  181    HB2  LYS  22           HB2      LYS  22   4.161  -1.193   2.841
  182    HB3  LYS  22           HB3      LYS  22   3.019  -2.139   1.896
  183    HG2  LYS  22           HG2      LYS  22   1.996  -3.008   3.730
  184    HG3  LYS  22           HG3      LYS  22   3.457  -2.898   4.720
  185    HD2  LYS  22           HD2      LYS  22   3.222  -0.443   4.743
  186    HD3  LYS  22           HD3      LYS  22   1.700  -0.609   3.859
  187    HE2  LYS  22           HE2      LYS  22   0.786  -1.936   5.716
  188    HE3  LYS  22           HE3      LYS  22   2.298  -1.728   6.597
  189    HZ1  LYS  22           HZ1      LYS  22   0.454   0.449   5.777
  190    HZ2  LYS  22           HZ2      LYS  22   1.919   0.663   6.595
  191    HZ3  LYS  22           HZ3      LYS  22   0.644  -0.154   7.346
  192    H    MET  23           H        MET  23   3.476  -4.669   0.971
  193    HA   MET  23           HA       MET  23   4.953  -3.828  -1.410
  194    HB2  MET  23           HB2      MET  23   4.684  -6.450  -0.300
  195    HB3  MET  23           HB3      MET  23   3.850  -6.402  -1.847
  196    HG2  MET  23           HG2      MET  23   5.899  -5.463  -2.865
  197    HG3  MET  23           HG3      MET  23   6.707  -5.664  -1.312
  198    HE1  MET  23           HE1      MET  23   7.699  -9.161  -1.040
  199    HE2  MET  23           HE2      MET  23   7.395  -7.605  -0.269
  200    HE3  MET  23           HE3      MET  23   8.577  -7.727  -1.578
  201    H    PHE  24           H        PHE  24   3.803  -3.045  -2.910
  202    HA   PHE  24           HA       PHE  24   0.934  -2.804  -2.765
  203    HB2  PHE  24           HB2      PHE  24   2.309  -0.779  -3.024
  204    HB3  PHE  24           HB3      PHE  24   3.032  -1.423  -4.482
  205    HD1  PHE  24           HD1      PHE  24   2.501   0.578  -5.690
  206    HD2  PHE  24           HD2      PHE  24  -0.612  -1.756  -3.954
  207    HE1  PHE  24           HE1      PHE  24   0.842   1.783  -7.045
  208    HE2  PHE  24           HE2      PHE  24  -2.261  -0.551  -5.310
  209    HZ   PHE  24           HZ       PHE  24  -1.544   1.219  -6.854
  210    H    ILE  25           H        ILE  25  -0.074  -4.417  -3.704
  211    HA   ILE  25           HA       ILE  25   0.956  -5.779  -6.032
  212    HB   ILE  25           HB       ILE  25  -1.561  -6.558  -4.781
  213   HG12  ILE  25          HG12      ILE  25  -0.131  -5.995  -2.839
  214   HG13  ILE  25          HG13      ILE  25  -0.573  -7.681  -2.894
  215   HG21  ILE  25          HG21      ILE  25  -0.551  -8.862  -5.125
  216   HG22  ILE  25          HG22      ILE  25   0.749  -8.039  -5.981
  217   HG23  ILE  25          HG23      ILE  25  -0.909  -7.921  -6.571
  218   HD11  ILE  25          HD11      ILE  25   1.769  -7.224  -2.188
  219   HD12  ILE  25          HD12      ILE  25   2.087  -6.626  -3.817
  220   HD13  ILE  25          HD13      ILE  25   1.631  -8.311  -3.569
  221    H    GLY  26           H        GLY  26   0.388  -5.073  -7.906
  222    HA2  GLY  26           HA2      GLY  26  -2.153  -3.753  -8.270
  223    HA3  GLY  26           HA3      GLY  26  -0.768  -3.452  -9.261
  224    H    GLY  27           H        GLY  27  -3.298  -3.915 -10.221
  225    HA2  GLY  27           HA2      GLY  27  -4.242  -4.984 -12.019
  226    HA3  GLY  27           HA3      GLY  27  -2.757  -5.896 -12.181
  227    H    LEU  28           H        LEU  28  -4.516  -6.104  -9.161
  228    HA   LEU  28           HA       LEU  28  -4.683  -8.867  -9.147
  229    HB2  LEU  28           HB2      LEU  28  -6.534  -6.947  -7.708
  230    HB3  LEU  28           HB3      LEU  28  -6.230  -8.614  -7.272
  231    HG   LEU  28           HG       LEU  28  -4.060  -6.519  -7.233
  232   HD11  LEU  28          HD11      LEU  28  -4.470  -6.307  -4.839
  233   HD12  LEU  28          HD12      LEU  28  -5.866  -7.377  -4.973
  234   HD13  LEU  28          HD13      LEU  28  -5.880  -5.803  -5.769
  235   HD21  LEU  28          HD21      LEU  28  -3.249  -8.794  -7.233
  236   HD22  LEU  28          HD22      LEU  28  -4.360  -9.229  -5.936
  237   HD23  LEU  28          HD23      LEU  28  -3.037  -8.106  -5.624
  238    H    SER  29           H        SER  29  -6.907 -10.081  -8.958
  239    HA   SER  29           HA       SER  29  -8.438  -9.459 -11.339
  240    HB2  SER  29           HB2      SER  29  -7.247 -11.724 -10.936
  241    HB3  SER  29           HB3      SER  29  -8.546 -12.044  -9.787
  242    HG   SER  29           HG       SER  29  -9.372 -11.113 -12.244
  243    H    TRP  30           H        TRP  30 -10.709 -10.340 -11.105
  244    HA   TRP  30           HA       TRP  30 -12.156  -8.745  -9.287
  245    HB2  TRP  30           HB2      TRP  30 -14.098  -9.667 -10.461
  246    HB3  TRP  30           HB3      TRP  30 -12.884  -9.134 -11.596
  247    HD1  TRP  30           HD1      TRP  30 -11.067 -11.698 -11.773
  248    HE1  TRP  30           HE1      TRP  30 -11.937 -13.867 -12.798
  249    HE3  TRP  30           HE3      TRP  30 -16.110 -10.877 -11.330
  250    HZ2  TRP  30           HZ2      TRP  30 -14.377 -15.076 -13.381
  251    HZ3  TRP  30           HZ3      TRP  30 -17.643 -12.614 -12.164
  252    HH2  TRP  30           HH2      TRP  30 -16.793 -14.671 -13.170
  253    H    GLN  31           H        GLN  31 -10.900 -11.878  -9.183
  254    HA   GLN  31           HA       GLN  31 -12.795 -12.890  -7.215
  255    HB2  GLN  31           HB2      GLN  31 -10.593 -14.148  -8.818
  256    HB3  GLN  31           HB3      GLN  31 -11.472 -15.018  -7.565
  257    HG2  GLN  31           HG2      GLN  31 -13.574 -14.562  -8.828
  258    HG3  GLN  31           HG3      GLN  31 -12.584 -13.874 -10.116
  259   HE21  GLN  31          HE21      GLN  31 -13.383 -16.769  -8.361
  260   HE22  GLN  31          HE22      GLN  31 -12.803 -17.890  -9.540
  261    H    THR  32           H        THR  32  -9.572 -11.720  -7.537
  262    HA   THR  32           HA       THR  32  -8.421 -12.872  -5.242
  263    HB   THR  32           HB       THR  32  -7.530 -10.267  -6.267
  264    HG1  THR  32           HG1      THR  32  -7.371 -11.031  -8.223
  265   HG21  THR  32          HG21      THR  32  -5.302 -11.290  -5.988
  266   HG22  THR  32          HG22      THR  32  -6.080 -12.782  -5.461
  267   HG23  THR  32          HG23      THR  32  -6.236 -11.318  -4.493
  268    H    SER  33           H        SER  33  -9.035 -12.602  -3.258
  269    HA   SER  33           HA       SER  33 -10.080 -10.042  -2.265
  270    HB2  SER  33           HB2      SER  33 -10.314 -12.878  -1.240
  271    HB3  SER  33           HB3      SER  33 -10.870 -11.478  -0.330
  272    HG   SER  33           HG       SER  33 -12.446 -11.140  -1.777
  273    HA   PRO  34           HA       PRO  34  -6.476  -9.249   0.264
  274    HB2  PRO  34           HB2      PRO  34  -7.542  -8.898   2.805
  275    HB3  PRO  34           HB3      PRO  34  -7.428  -7.633   1.572
  276    HG2  PRO  34           HG2      PRO  34  -9.763  -9.350   2.289
  277    HG3  PRO  34           HG3      PRO  34  -9.717  -7.626   1.869
  278    HD2  PRO  34           HD2      PRO  34 -10.533  -9.421   0.090
  279    HD3  PRO  34           HD3      PRO  34  -9.527  -8.048  -0.404
  280    H    ASP  35           H        ASP  35  -8.726 -11.640   1.276
  281    HA   ASP  35           HA       ASP  35  -6.973 -13.021   3.079
  282    HB2  ASP  35           HB2      ASP  35  -9.686 -13.332   2.097
  283    HB3  ASP  35           HB3      ASP  35  -8.893 -14.801   2.580
  284    H    SER  36           H        SER  36  -8.021 -13.208  -0.193
  285    HA   SER  36           HA       SER  36  -6.843 -15.709  -0.892
  286    HB2  SER  36           HB2      SER  36  -8.719 -14.595  -2.159
  287    HB3  SER  36           HB3      SER  36  -7.544 -13.420  -2.749
  288    HG   SER  36           HG       SER  36  -6.357 -15.342  -3.531
  289    H    LEU  37           H        LEU  37  -5.822 -12.322  -0.929
  290    HA   LEU  37           HA       LEU  37  -3.398 -12.685  -2.319
  291    HB2  LEU  37           HB2      LEU  37  -5.027 -10.663  -1.067
  292    HB3  LEU  37           HB3      LEU  37  -3.361 -10.438  -0.680
  293    HG   LEU  37           HG       LEU  37  -4.361 -10.703  -3.489
  294   HD11  LEU  37          HD11      LEU  37  -3.890  -8.208  -1.876
  295   HD12  LEU  37          HD12      LEU  37  -5.438  -8.802  -2.486
  296   HD13  LEU  37          HD13      LEU  37  -4.199  -8.253  -3.613
  297   HD21  LEU  37          HD21      LEU  37  -1.925 -11.087  -3.030
  298   HD22  LEU  37          HD22      LEU  37  -1.836  -9.412  -2.503
  299   HD23  LEU  37          HD23      LEU  37  -2.284  -9.792  -4.165
  300    H    ARG  38           H        ARG  38  -4.420 -12.634   1.039
  301    HA   ARG  38           HA       ARG  38  -1.878 -12.745   2.236
  302    HB2  ARG  38           HB2      ARG  38  -4.346 -12.193   3.176
  303    HB3  ARG  38           HB3      ARG  38  -4.219 -13.875   3.670
  304    HG2  ARG  38           HG2      ARG  38  -2.200 -13.386   4.920
  305    HG3  ARG  38           HG3      ARG  38  -2.245 -11.711   4.373
  306    HD2  ARG  38           HD2      ARG  38  -4.500 -12.969   5.916
  307    HD3  ARG  38           HD3      ARG  38  -3.134 -12.188   6.709
  308    HE   ARG  38           HE       ARG  38  -4.028 -10.317   4.948
  309   HH11  ARG  38          HH11      ARG  38  -5.580 -12.118   7.530
  310   HH12  ARG  38          HH12      ARG  38  -6.727 -10.865   7.869
  311   HH21  ARG  38          HH21      ARG  38  -6.706  -8.929   6.663
  312   HH22  ARG  38          HH22      ARG  38  -5.545  -8.696   5.400
  313    H    ASP  39           H        ASP  39  -4.363 -15.103   1.341
  314    HA   ASP  39           HA       ASP  39  -3.040 -17.407   2.261
  315    HB2  ASP  39           HB2      ASP  39  -5.373 -16.806   0.570
  316    HB3  ASP  39           HB3      ASP  39  -4.600 -18.353   0.243
  317    H    TYR  40           H        TYR  40  -2.989 -15.732  -0.885
  318    HA   TYR  40           HA       TYR  40  -1.536 -17.740  -2.265
  319    HB2  TYR  40           HB2      TYR  40  -3.040 -15.731  -3.124
  320    HB3  TYR  40           HB3      TYR  40  -1.490 -14.899  -3.174
  321    HD1  TYR  40           HD1      TYR  40   0.021 -15.275  -4.949
  322    HD2  TYR  40           HD2      TYR  40  -3.305 -17.873  -4.436
  323    HE1  TYR  40           HE1      TYR  40   0.504 -16.313  -7.126
  324    HE2  TYR  40           HE2      TYR  40  -2.836 -18.917  -6.613
  325    HH   TYR  40           HH       TYR  40  -1.685 -18.332  -8.726
  326    H    PHE  41           H        PHE  41  -0.637 -14.568  -0.917
  327    HA   PHE  41           HA       PHE  41   2.087 -14.758  -1.589
  328    HB2  PHE  41           HB2      PHE  41   0.367 -12.885  -0.153
  329    HB3  PHE  41           HB3      PHE  41   2.090 -12.737   0.074
  330    HD1  PHE  41           HD1      PHE  41  -0.611 -12.764  -2.425
  331    HD2  PHE  41           HD2      PHE  41   3.472 -11.833  -1.673
  332    HE1  PHE  41           HE1      PHE  41  -0.443 -11.662  -4.631
  333    HE2  PHE  41           HE2      PHE  41   3.638 -10.727  -3.852
  334    HZ   PHE  41           HZ       PHE  41   1.680 -10.642  -5.339
  335    H    SER  42           H        SER  42   0.284 -15.835   1.195
  336    HA   SER  42           HA       SER  42   2.359 -15.901   3.120
  337    HB2  SER  42           HB2      SER  42  -0.259 -17.315   2.843
  338    HB3  SER  42           HB3      SER  42   0.900 -17.913   4.031
  339    HG   SER  42           HG       SER  42   0.012 -16.414   5.223
  340    H    LYS  43           H        LYS  43   1.819 -17.480   0.353
  341    HA   LYS  43           HA       LYS  43   3.130 -19.976   0.874
  342    HB2  LYS  43           HB2      LYS  43   1.833 -18.661  -1.458
  343    HB3  LYS  43           HB3      LYS  43   2.893 -20.016  -1.735
  344    HG2  LYS  43           HG2      LYS  43   1.094 -20.692   0.367
  345    HG3  LYS  43           HG3      LYS  43   0.180 -20.057  -1.000
  346    HD2  LYS  43           HD2      LYS  43   1.292 -21.660  -2.484
  347    HD3  LYS  43           HD3      LYS  43   2.206 -22.291  -1.112
  348    HE2  LYS  43           HE2      LYS  43   0.130 -22.984  -0.035
  349    HE3  LYS  43           HE3      LYS  43  -0.798 -22.323  -1.381
  350    HZ1  LYS  43           HZ1      LYS  43   0.270 -23.919  -2.851
  351    HZ2  LYS  43           HZ2      LYS  43  -0.527 -24.712  -1.587
  352    HZ3  LYS  43           HZ3      LYS  43   1.156 -24.553  -1.557
  353    H    PHE  44           H        PHE  44   4.097 -16.839   0.103
  354    HA   PHE  44           HA       PHE  44   6.647 -17.631  -1.117
  355    HB2  PHE  44           HB2      PHE  44   4.912 -15.435  -1.446
  356    HB3  PHE  44           HB3      PHE  44   6.414 -14.831  -0.775
  357    HD1  PHE  44           HD1      PHE  44   4.766 -16.202  -3.676
  358    HD2  PHE  44           HD2      PHE  44   8.539 -15.166  -1.997
  359    HE1  PHE  44           HE1      PHE  44   5.780 -16.280  -5.914
  360    HE2  PHE  44           HE2      PHE  44   9.559 -15.243  -4.236
  361    HZ   PHE  44           HZ       PHE  44   8.178 -15.801  -6.198
  362    H    GLY  45           H        GLY  45   5.200 -16.183   1.681
  363    HA2  GLY  45           HA2      GLY  45   7.320 -16.735   3.419
  364    HA3  GLY  45           HA3      GLY  45   7.280 -15.026   3.012
  365    H    GLU  46           H        GLU  46   6.762 -14.687   5.237
  366    HA   GLU  46           HA       GLU  46   4.090 -15.384   5.999
  367    HB2  GLU  46           HB2      GLU  46   6.033 -15.933   7.542
  368    HB3  GLU  46           HB3      GLU  46   6.137 -14.200   7.841
  369    HG2  GLU  46           HG2      GLU  46   3.945 -14.135   8.745
  370    HG3  GLU  46           HG3      GLU  46   3.608 -15.777   8.218
  371    H    ILE  47           H        ILE  47   2.642 -13.999   6.253
  372    HA   ILE  47           HA       ILE  47   3.147 -11.189   5.676
  373    HB   ILE  47           HB       ILE  47   0.630 -12.721   5.324
  374   HG12  ILE  47          HG12      ILE  47   1.780 -11.393   3.052
  375   HG13  ILE  47          HG13      ILE  47   2.865 -12.566   3.775
  376   HG21  ILE  47          HG21      ILE  47   1.182  -9.813   4.865
  377   HG22  ILE  47          HG22      ILE  47  -0.078 -10.521   5.875
  378   HG23  ILE  47          HG23      ILE  47  -0.173 -10.660   4.119
  379   HD11  ILE  47          HD11      ILE  47   0.670 -14.078   3.620
  380   HD12  ILE  47          HD12      ILE  47   1.790 -13.934   2.265
  381   HD13  ILE  47          HD13      ILE  47   0.319 -12.960   2.307
  382    H    ARG  48           H        ARG  48   2.531  -9.590   6.921
  383    HA   ARG  48           HA       ARG  48   1.794 -10.115   9.670
  384    HB2  ARG  48           HB2      ARG  48   3.509  -8.389   8.557
  385    HB3  ARG  48           HB3      ARG  48   2.084  -7.381   8.528
  386    HG2  ARG  48           HG2      ARG  48   1.874  -7.422  10.874
  387    HG3  ARG  48           HG3      ARG  48   3.070  -8.709  11.032
  388    HD2  ARG  48           HD2      ARG  48   4.806  -7.200  10.210
  389    HD3  ARG  48           HD3      ARG  48   3.612  -5.915  10.028
  390    HE   ARG  48           HE       ARG  48   3.393  -6.583  12.637
  391   HH11  ARG  48          HH11      ARG  48   7.034  -5.020  11.981
  392   HH12  ARG  48          HH12      ARG  48   6.158  -5.714  10.659
  393   HH21  ARG  48          HH21      ARG  48   6.128  -4.994  14.075
  394   HH22  ARG  48          HH22      ARG  48   4.557  -5.666  14.358
  395    H    GLU  49           H        GLU  49   0.577  -8.441   6.821
  396    HA   GLU  49           HA       GLU  49  -2.159  -8.701   7.520
  397    HB2  GLU  49           HB2      GLU  49  -1.212  -6.654   8.889
  398    HB3  GLU  49           HB3      GLU  49  -1.304  -5.826   7.342
  399    HG2  GLU  49           HG2      GLU  49  -3.706  -6.377   7.229
  400    HG3  GLU  49           HG3      GLU  49  -3.586  -7.118   8.824
  401    H    CYS  50           H        CYS  50  -3.502  -7.869   5.818
  402    HA   CYS  50           HA       CYS  50  -2.225  -7.115   3.376
  403    HB2  CYS  50           HB2      CYS  50  -2.521  -9.532   3.206
  404    HB3  CYS  50           HB3      CYS  50  -4.232  -9.356   3.579
  405    HG   CYS  50           HG       CYS  50  -3.114  -9.705   0.716
  406    H    MET  51           H        MET  51  -3.540  -6.046   1.955
  407    HA   MET  51           HA       MET  51  -6.130  -5.123   2.816
  408    HB2  MET  51           HB2      MET  51  -4.591  -3.605   3.895
  409    HB3  MET  51           HB3      MET  51  -3.849  -3.284   2.356
  410    HG2  MET  51           HG2      MET  51  -5.829  -2.174   1.563
  411    HG3  MET  51           HG3      MET  51  -6.679  -2.586   3.053
  412    HE1  MET  51           HE1      MET  51  -7.178   0.176   2.741
  413    HE2  MET  51           HE2      MET  51  -5.930   0.405   1.516
  414    HE3  MET  51           HE3      MET  51  -5.917   1.385   2.982
  415    H    VAL  52           H        VAL  52  -7.443  -4.836   1.257
  416    HA   VAL  52           HA       VAL  52  -6.562  -4.274  -1.468
  417    HB   VAL  52           HB       VAL  52  -8.793  -6.095  -0.730
  418   HG11  VAL  52          HG11      VAL  52  -8.958  -6.634  -3.108
  419   HG12  VAL  52          HG12      VAL  52  -7.687  -5.457  -3.448
  420   HG13  VAL  52          HG13      VAL  52  -9.244  -4.915  -2.821
  421   HG21  VAL  52          HG21      VAL  52  -6.503  -6.997  -0.335
  422   HG22  VAL  52          HG22      VAL  52  -6.230  -6.833  -2.069
  423   HG23  VAL  52          HG23      VAL  52  -7.478  -7.929  -1.474
  424    H    MET  53           H        MET  53  -7.431  -2.560  -2.256
  425    HA   MET  53           HA       MET  53  -9.156  -0.857  -0.784
  426    HB2  MET  53           HB2      MET  53  -7.554  -0.689  -3.202
  427    HB3  MET  53           HB3      MET  53  -9.072   0.181  -3.356
  428    HG2  MET  53           HG2      MET  53  -7.061   0.559  -1.150
  429    HG3  MET  53           HG3      MET  53  -7.252   1.603  -2.554
  430    HE1  MET  53           HE1      MET  53  -7.530   3.761  -1.094
  431    HE2  MET  53           HE2      MET  53  -7.257   2.786   0.351
  432    HE3  MET  53           HE3      MET  53  -8.635   3.885   0.276
  433    H    ARG  54           H        ARG  54 -11.249  -0.794  -0.687
  434    HA   ARG  54           HA       ARG  54 -12.896  -1.616  -2.969
  435    HB2  ARG  54           HB2      ARG  54 -12.846  -2.786  -0.244
  436    HB3  ARG  54           HB3      ARG  54 -14.437  -2.511  -0.943
  437    HG2  ARG  54           HG2      ARG  54 -13.896  -3.909  -2.829
  438    HG3  ARG  54           HG3      ARG  54 -12.236  -4.092  -2.257
  439    HD2  ARG  54           HD2      ARG  54 -12.989  -5.280  -0.303
  440    HD3  ARG  54           HD3      ARG  54 -14.675  -4.978  -0.721
  441    HE   ARG  54           HE       ARG  54 -13.536  -6.330  -2.861
  442   HH11  ARG  54          HH11      ARG  54 -14.395  -8.700   0.267
  443   HH12  ARG  54          HH12      ARG  54 -14.215  -6.995   0.519
  444   HH21  ARG  54          HH21      ARG  54 -13.782  -8.565  -3.170
  445   HH22  ARG  54          HH22      ARG  54 -14.150  -9.586  -1.820
  446    H    ASP  55           H        ASP  55 -15.044  -0.687  -2.954
  447    HA   ASP  55           HA       ASP  55 -15.171   1.832  -1.589
  448    HB2  ASP  55           HB2      ASP  55 -16.161   0.799  -4.120
  449    HB3  ASP  55           HB3      ASP  55 -17.180   1.966  -3.326
  450    HA   PRO  56           HA       PRO  56 -18.219  -0.143   1.177
  451    HB2  PRO  56           HB2      PRO  56 -18.636   2.664   2.034
  452    HB3  PRO  56           HB3      PRO  56 -18.271   1.233   3.006
  453    HG2  PRO  56           HG2      PRO  56 -16.408   3.075   2.568
  454    HG3  PRO  56           HG3      PRO  56 -16.003   1.346   2.598
  455    HD2  PRO  56           HD2      PRO  56 -16.309   3.170   0.253
  456    HD3  PRO  56           HD3      PRO  56 -15.145   1.854   0.522
  457    H    THR  57           H        THR  57 -18.816   2.112  -1.321
  458    HA   THR  57           HA       THR  57 -21.594   2.537  -0.776
  459    HB   THR  57           HB       THR  57 -21.603   3.550  -3.109
  460    HG1  THR  57           HG1      THR  57 -18.890   2.812  -2.833
  461   HG21  THR  57          HG21      THR  57 -19.718   4.648  -1.023
  462   HG22  THR  57          HG22      THR  57 -21.455   4.938  -1.127
  463   HG23  THR  57          HG23      THR  57 -20.378   5.568  -2.374
  464    H    THR  58           H        THR  58 -19.758   0.651  -3.159
  465    HA   THR  58           HA       THR  58 -22.178  -0.953  -3.666
  466    HB   THR  58           HB       THR  58 -21.498  -1.219  -6.016
  467    HG1  THR  58           HG1      THR  58 -19.651  -0.411  -6.751
  468   HG21  THR  58          HG21      THR  58 -21.892   1.147  -6.746
  469   HG22  THR  58          HG22      THR  58 -21.765   1.620  -5.048
  470   HG23  THR  58          HG23      THR  58 -23.062   0.542  -5.570
  471    H    LYS  59           H        LYS  59 -19.027  -0.955  -2.596
  472    HA   LYS  59           HA       LYS  59 -17.446  -2.474  -2.099
  473    HB2  LYS  59           HB2      LYS  59 -19.891  -4.218  -2.049
  474    HB3  LYS  59           HB3      LYS  59 -18.294  -4.846  -1.642
  475    HG2  LYS  59           HG2      LYS  59 -18.492  -4.015   0.406
  476    HG3  LYS  59           HG3      LYS  59 -18.617  -2.395  -0.295
  477    HD2  LYS  59           HD2      LYS  59 -21.057  -2.792  -0.608
  478    HD3  LYS  59           HD3      LYS  59 -20.881  -4.309   0.276
  479    HE2  LYS  59           HE2      LYS  59 -20.110  -1.621   1.394
  480    HE3  LYS  59           HE3      LYS  59 -21.690  -2.359   1.637
  481    HZ1  LYS  59           HZ1      LYS  59 -20.655  -4.199   2.763
  482    HZ2  LYS  59           HZ2      LYS  59 -20.158  -2.757   3.494
  483    HZ3  LYS  59           HZ3      LYS  59 -19.110  -3.582   2.455
  484    H    ARG  60           H        ARG  60 -17.161  -1.761  -4.429
  485    HA   ARG  60           HA       ARG  60 -16.658  -4.123  -6.137
  486    HB2  ARG  60           HB2      ARG  60 -16.855  -1.202  -6.914
  487    HB3  ARG  60           HB3      ARG  60 -16.505  -2.521  -8.021
  488    HG2  ARG  60           HG2      ARG  60 -18.708  -3.481  -7.576
  489    HG3  ARG  60           HG3      ARG  60 -19.051  -2.161  -6.455
  490    HD2  ARG  60           HD2      ARG  60 -20.077  -1.423  -8.392
  491    HD3  ARG  60           HD3      ARG  60 -18.500  -0.642  -8.490
  492    HE   ARG  60           HE       ARG  60 -18.416  -3.142  -9.797
  493   HH11  ARG  60          HH11      ARG  60 -19.693  -0.018 -11.974
  494   HH12  ARG  60          HH12      ARG  60 -19.708   0.091 -10.247
  495   HH21  ARG  60          HH21      ARG  60 -18.417  -3.269 -12.059
  496   HH22  ARG  60          HH22      ARG  60 -18.962  -1.921 -13.000
  497    H    SER  61           H        SER  61 -14.596  -4.608  -6.746
  498    HA   SER  61           HA       SER  61 -12.434  -3.151  -5.440
  499    HB2  SER  61           HB2      SER  61 -12.478  -5.761  -6.969
  500    HB3  SER  61           HB3      SER  61 -11.025  -5.060  -6.257
  501    HG   SER  61           HG       SER  61 -11.707  -5.582  -4.314
  502    H    ARG  62           H        ARG  62 -10.591  -2.349  -6.530
  503    HA   ARG  62           HA       ARG  62 -11.137  -1.503  -9.278
  504    HB2  ARG  62           HB2      ARG  62  -9.397  -0.407  -7.096
  505    HB3  ARG  62           HB3      ARG  62  -9.108   0.042  -8.772
  506    HG2  ARG  62           HG2      ARG  62 -11.379   0.907  -8.945
  507    HG3  ARG  62           HG3      ARG  62 -11.691   0.437  -7.274
  508    HD2  ARG  62           HD2      ARG  62 -10.021   1.986  -6.480
  509    HD3  ARG  62           HD3      ARG  62  -9.549   2.378  -8.133
  510    HE   ARG  62           HE       ARG  62 -12.196   2.991  -8.050
  511   HH11  ARG  62          HH11      ARG  62 -10.131   5.539  -5.732
  512   HH12  ARG  62          HH12      ARG  62  -9.449   3.991  -6.102
  513   HH21  ARG  62          HH21      ARG  62 -13.067   5.022  -7.548
  514   HH22  ARG  62          HH22      ARG  62 -12.176   6.121  -6.551
  515    H    GLY  63           H        GLY  63  -9.314  -3.794  -7.642
  516    HA2  GLY  63           HA2      GLY  63  -8.044  -5.468  -8.694
  517    HA3  GLY  63           HA3      GLY  63  -7.808  -4.401 -10.065
  518    H    PHE  64           H        PHE  64  -7.181  -3.439  -6.728
  519    HA   PHE  64           HA       PHE  64  -4.345  -3.929  -6.943
  520    HB2  PHE  64           HB2      PHE  64  -3.550  -1.720  -6.867
  521    HB3  PHE  64           HB3      PHE  64  -4.762  -1.734  -8.135
  522    HD1  PHE  64           HD1      PHE  64  -6.488  -0.177  -8.112
  523    HD2  PHE  64           HD2      PHE  64  -4.251  -0.893  -4.590
  524    HE1  PHE  64           HE1      PHE  64  -7.573   1.767  -7.046
  525    HE2  PHE  64           HE2      PHE  64  -5.308   1.054  -3.500
  526    HZ   PHE  64           HZ       PHE  64  -6.982   2.385  -4.733
  527    H    GLY  65           H        GLY  65  -3.201  -3.796  -4.968
  528    HA2  GLY  65           HA2      GLY  65  -4.477  -2.958  -2.596
  529    HA3  GLY  65           HA3      GLY  65  -4.409  -4.707  -2.742
  530    H    PHE  66           H        PHE  66  -3.110  -4.277  -0.785
  531    HA   PHE  66           HA       PHE  66  -0.313  -4.149  -1.335
  532    HB2  PHE  66           HB2      PHE  66  -1.845  -2.893   0.881
  533    HB3  PHE  66           HB3      PHE  66  -0.125  -3.045   0.878
  534    HD1  PHE  66           HD1      PHE  66   1.245  -1.495  -0.334
  535    HD2  PHE  66           HD2      PHE  66  -2.987  -1.484  -0.783
  536    HE1  PHE  66           HE1      PHE  66   1.382   0.651  -1.538
  537    HE2  PHE  66           HE2      PHE  66  -2.858   0.657  -1.992
  538    HZ   PHE  66           HZ       PHE  66  -0.672   1.724  -2.374
  539    H    VAL  67           H        VAL  67   0.914  -5.207   0.352
  540    HA   VAL  67           HA       VAL  67  -0.394  -7.028   2.160
  541    HB   VAL  67           HB       VAL  67   1.383  -8.121  -0.058
  542   HG11  VAL  67          HG11      VAL  67   2.160  -9.542   1.513
  543   HG12  VAL  67          HG12      VAL  67   0.587 -10.323   1.351
  544   HG13  VAL  67          HG13      VAL  67   0.860  -9.149   2.640
  545   HG21  VAL  67          HG21      VAL  67  -1.032  -7.886  -0.630
  546   HG22  VAL  67          HG22      VAL  67  -1.410  -8.967   0.711
  547   HG23  VAL  67          HG23      VAL  67  -0.462  -9.559  -0.654
  548    H    THR  68           H        THR  68   0.658  -7.193   3.862
  549    HA   THR  68           HA       THR  68   3.247  -5.899   4.032
  550    HB   THR  68           HB       THR  68   1.514  -6.457   6.344
  551    HG1  THR  68           HG1      THR  68   0.494  -5.282   4.397
  552   HG21  THR  68          HG21      THR  68   3.127  -5.329   7.412
  553   HG22  THR  68          HG22      THR  68   2.804  -3.925   6.401
  554   HG23  THR  68          HG23      THR  68   3.986  -5.140   5.877
  555    H    PHE  69           H        PHE  69   4.779  -7.296   3.888
  556    HA   PHE  69           HA       PHE  69   4.606  -9.911   4.992
  557    HB2  PHE  69           HB2      PHE  69   6.595  -8.417   3.375
  558    HB3  PHE  69           HB3      PHE  69   7.081  -9.885   4.199
  559    HD1  PHE  69           HD1      PHE  69   5.249  -8.486   1.446
  560    HD2  PHE  69           HD2      PHE  69   5.909 -12.027   3.709
  561    HE1  PHE  69           HE1      PHE  69   4.230  -9.830  -0.354
  562    HE2  PHE  69           HE2      PHE  69   4.901 -13.370   1.920
  563    HZ   PHE  69           HZ       PHE  69   4.074 -12.278  -0.104
  564    H    ALA  70           H        ALA  70   5.131 -10.476   7.004
  565    HA   ALA  70           HA       ALA  70   6.307  -8.627   8.787
  566    HB1  ALA  70           HB1      ALA  70   5.577 -11.472   9.362
  567    HB2  ALA  70           HB2      ALA  70   4.451 -10.121   9.456
  568    HB3  ALA  70           HB3      ALA  70   5.834 -10.191  10.546
  569    H    ASP  71           H        ASP  71   7.757 -10.393   6.672
  570    HA   ASP  71           HA       ASP  71  10.152 -10.754   8.250
  571    HB2  ASP  71           HB2      ASP  71   8.845 -12.838   7.419
  572    HB3  ASP  71           HB3      ASP  71   9.592 -12.471   5.897
  573    HA   PRO  72           HA       PRO  72  11.938  -8.244   4.953
  574    HB2  PRO  72           HB2      PRO  72  14.530  -8.996   5.951
  575    HB3  PRO  72           HB3      PRO  72  13.775  -7.426   5.938
  576    HG2  PRO  72           HG2      PRO  72  14.224  -8.762   8.227
  577    HG3  PRO  72           HG3      PRO  72  12.846  -7.665   8.013
  578    HD2  PRO  72           HD2      PRO  72  12.916 -10.649   7.893
  579    HD3  PRO  72           HD3      PRO  72  11.694  -9.566   8.595
  580    H    ALA  73           H        ALA  73  12.526 -11.499   5.666
  581    HA   ALA  73           HA       ALA  73  14.325 -12.064   3.527
  582    HB1  ALA  73           HB1      ALA  73  14.329 -13.423   5.561
  583    HB2  ALA  73           HB2      ALA  73  14.071 -14.402   4.118
  584    HB3  ALA  73           HB3      ALA  73  12.710 -13.995   5.163
  585    H    SER  74           H        SER  74  10.917 -12.095   3.964
  586    HA   SER  74           HA       SER  74  10.249 -13.622   1.645
  587    HB2  SER  74           HB2      SER  74   8.771 -13.156   3.708
  588    HB3  SER  74           HB3      SER  74   8.386 -11.636   2.898
  589    HG   SER  74           HG       SER  74   6.900 -13.280   2.350
  590    H    VAL  75           H        VAL  75  10.815 -10.304   2.299
  591    HA   VAL  75           HA       VAL  75   9.852  -9.219  -0.120
  592    HB   VAL  75           HB       VAL  75  12.014  -8.004   1.608
  593   HG11  VAL  75          HG11      VAL  75  11.188  -5.855   0.840
  594   HG12  VAL  75          HG12      VAL  75   9.905  -6.646  -0.073
  595   HG13  VAL  75          HG13      VAL  75  11.589  -6.873  -0.545
  596   HG21  VAL  75          HG21      VAL  75  10.281  -6.878   2.912
  597   HG22  VAL  75          HG22      VAL  75  10.150  -8.630   3.059
  598   HG23  VAL  75          HG23      VAL  75   9.034  -7.748   2.018
  599    H    ASP  76           H        ASP  76  12.808 -10.581   0.960
  600    HA   ASP  76           HA       ASP  76  14.465  -9.872  -1.203
  601    HB2  ASP  76           HB2      ASP  76  14.971 -10.784   1.216
  602    HB3  ASP  76           HB3      ASP  76  14.907 -12.332   0.407
  603    H    LYS  77           H        LYS  77  12.561 -12.633  -0.363
  604    HA   LYS  77           HA       LYS  77  13.172 -14.297  -2.521
  605    HB2  LYS  77           HB2      LYS  77  10.770 -14.262  -0.714
  606    HB3  LYS  77           HB3      LYS  77  11.071 -15.523  -1.899
  607    HG2  LYS  77           HG2      LYS  77  13.312 -15.852  -0.701
  608    HG3  LYS  77           HG3      LYS  77  12.603 -14.893   0.599
  609    HD2  LYS  77           HD2      LYS  77  10.777 -16.475   0.812
  610    HD3  LYS  77           HD3      LYS  77  11.401 -17.412  -0.548
  611    HE2  LYS  77           HE2      LYS  77  13.442 -17.883   0.723
  612    HE3  LYS  77           HE3      LYS  77  12.808 -16.954   2.081
  613    HZ1  LYS  77           HZ1      LYS  77  11.561 -19.401   0.948
  614    HZ2  LYS  77           HZ2      LYS  77  10.999 -18.526   2.283
  615    HZ3  LYS  77           HZ3      LYS  77  12.479 -19.340   2.368
  616    H    VAL  78           H        VAL  78  10.598 -11.978  -2.042
  617    HA   VAL  78           HA       VAL  78   9.297 -12.505  -4.530
  618    HB   VAL  78           HB       VAL  78   8.933 -10.175  -2.628
  619   HG11  VAL  78          HG11      VAL  78   7.158 -11.030  -4.920
  620   HG12  VAL  78          HG12      VAL  78   8.168  -9.585  -4.890
  621   HG13  VAL  78          HG13      VAL  78   6.818  -9.740  -3.766
  622   HG21  VAL  78          HG21      VAL  78   8.320 -12.251  -1.577
  623   HG22  VAL  78          HG22      VAL  78   7.387 -12.740  -2.991
  624   HG23  VAL  78          HG23      VAL  78   6.845 -11.383  -2.004
  625    H    LEU  79           H        LEU  79  11.782 -10.288  -3.421
  626    HA   LEU  79           HA       LEU  79  11.803  -8.398  -5.456
  627    HB2  LEU  79           HB2      LEU  79  13.059  -8.942  -3.097
  628    HB3  LEU  79           HB3      LEU  79  14.336  -9.206  -4.241
  629    HG   LEU  79           HG       LEU  79  14.351  -6.982  -3.231
  630   HD11  LEU  79          HD11      LEU  79  15.395  -7.261  -5.396
  631   HD12  LEU  79          HD12      LEU  79  14.641  -5.670  -5.285
  632   HD13  LEU  79          HD13      LEU  79  13.853  -6.957  -6.198
  633   HD21  LEU  79          HD21      LEU  79  11.758  -6.886  -3.222
  634   HD22  LEU  79          HD22      LEU  79  11.965  -6.178  -4.827
  635   HD23  LEU  79          HD23      LEU  79  12.690  -5.401  -3.421
  636    H    GLY  80           H        GLY  80  13.373 -11.561  -5.165
  637    HA2  GLY  80           HA2      GLY  80  14.913 -11.315  -7.532
  638    HA3  GLY  80           HA3      GLY  80  14.700 -12.773  -6.600
  639    H    GLN  81           H        GLN  81  11.775 -12.519  -6.783
  640    HA   GLN  81           HA       GLN  81  11.406 -13.536  -9.485
  641    HB2  GLN  81           HB2      GLN  81   9.992 -13.962  -6.863
  642    HB3  GLN  81           HB3      GLN  81   9.310 -14.483  -8.382
  643    HG2  GLN  81           HG2      GLN  81  11.282 -15.881  -8.791
  644    HG3  GLN  81           HG3      GLN  81  11.946 -15.346  -7.247
  645   HE21  GLN  81          HE21      GLN  81   9.467 -17.248  -8.801
  646   HE22  GLN  81          HE22      GLN  81   9.039 -18.185  -7.416
  647    HA   PRO  82           HA       PRO  82   9.170  -9.473  -9.659
  648    HB2  PRO  82           HB2      PRO  82   9.884  -9.369 -12.465
  649    HB3  PRO  82           HB3      PRO  82  10.394  -8.296 -11.157
  650    HG2  PRO  82           HG2      PRO  82  12.098  -9.988 -12.427
  651    HG3  PRO  82           HG3      PRO  82  12.310  -9.467 -10.744
  652    HD2  PRO  82           HD2      PRO  82  11.194 -12.036 -11.797
  653    HD3  PRO  82           HD3      PRO  82  12.296 -11.756 -10.431
  654    H    HIS  83           H        HIS  83   8.904 -12.351 -11.606
  655    HA   HIS  83           HA       HIS  83   6.468 -11.480 -12.930
  656    HB2  HIS  83           HB2      HIS  83   8.356 -12.995 -13.893
  657    HB3  HIS  83           HB3      HIS  83   7.546 -14.280 -13.006
  658    HD1  HIS  83           HD1      HIS  83   5.337 -15.156 -13.960
  659    HD2  HIS  83           HD2      HIS  83   6.882 -11.925 -16.068
  660    HE1  HIS  83           HE1      HIS  83   3.955 -14.996 -16.056
  661    HE2  HIS  83           HE2      HIS  83   4.907 -13.032 -17.315
  662    H    HIS  84           H        HIS  84   4.495 -11.765 -12.130
  663    HA   HIS  84           HA       HIS  84   3.938 -13.940 -10.254
  664    HB2  HIS  84           HB2      HIS  84   4.249 -11.396  -9.374
  665    HB3  HIS  84           HB3      HIS  84   2.537 -11.370  -9.782
  666    HD1  HIS  84           HD1      HIS  84   4.941 -12.697  -7.298
  667    HD2  HIS  84           HD2      HIS  84   0.920 -13.144  -8.246
  668    HE1  HIS  84           HE1      HIS  84   3.914 -13.879  -5.330
  669    HE2  HIS  84           HE2      HIS  84   1.480 -14.138  -5.924
  670    H    GLU  85           H        GLU  85   2.277 -15.061 -10.990
  671    HA   GLU  85           HA       GLU  85   0.442 -13.850 -12.832
  672    HB2  GLU  85           HB2      GLU  85   2.056 -15.893 -13.427
  673    HB3  GLU  85           HB3      GLU  85   0.727 -16.803 -12.724
  674    HG2  GLU  85           HG2      GLU  85  -0.814 -15.868 -14.334
  675    HG3  GLU  85           HG3      GLU  85   0.464 -14.853 -15.001
  676    H    LEU  86           H        LEU  86  -1.579 -13.906 -12.428
  677    HA   LEU  86           HA       LEU  86  -2.796 -15.585 -10.427
  678    HB2  LEU  86           HB2      LEU  86  -2.332 -13.613  -9.169
  679    HB3  LEU  86           HB3      LEU  86  -2.766 -12.587 -10.510
  680    HG   LEU  86           HG       LEU  86  -5.124 -13.556 -10.210
  681   HD11  LEU  86          HD11      LEU  86  -4.662 -15.286  -8.610
  682   HD12  LEU  86          HD12      LEU  86  -5.653 -14.053  -7.828
  683   HD13  LEU  86          HD13      LEU  86  -3.920 -14.127  -7.506
  684   HD21  LEU  86          HD21      LEU  86  -3.809 -11.522  -8.447
  685   HD22  LEU  86          HD22      LEU  86  -5.546 -11.816  -8.393
  686   HD23  LEU  86          HD23      LEU  86  -4.791 -11.263  -9.889
  687    H    ASP  87           H        ASP  87  -4.671 -16.241 -11.111
  688    HA   ASP  87           HA       ASP  87  -6.360 -16.858 -12.487
  689    HB2  ASP  87           HB2      ASP  87  -7.030 -14.714 -11.432
  690    HB3  ASP  87           HB3      ASP  87  -6.593 -13.916 -12.915
  691    H    SER  88           H        SER  88  -3.883 -16.822 -13.586
  692    HA   SER  88           HA       SER  88  -2.798 -17.310 -15.527
  693    HB2  SER  88           HB2      SER  88  -5.522 -16.926 -16.790
  694    HB3  SER  88           HB3      SER  88  -4.096 -17.475 -17.671
  695    HG   SER  88           HG       SER  88  -5.755 -18.869 -16.056
  696    H    LYS  89           H        LYS  89  -3.595 -14.373 -14.596
  697    HA   LYS  89           HA       LYS  89  -2.369 -13.117 -16.921
  698    HB2  LYS  89           HB2      LYS  89  -3.537 -10.961 -16.000
  699    HB3  LYS  89           HB3      LYS  89  -4.394 -12.056 -17.059
  700    HG2  LYS  89           HG2      LYS  89  -5.433 -13.072 -15.007
  701    HG3  LYS  89           HG3      LYS  89  -4.691 -11.769 -14.076
  702    HD2  LYS  89           HD2      LYS  89  -5.862 -10.142 -15.570
  703    HD3  LYS  89           HD3      LYS  89  -6.713 -11.505 -16.297
  704    HE2  LYS  89           HE2      LYS  89  -7.653 -12.085 -14.117
  705    HE3  LYS  89           HE3      LYS  89  -6.795 -10.730 -13.384
  706    HZ1  LYS  89           HZ1      LYS  89  -8.055  -9.236 -14.854
  707    HZ2  LYS  89           HZ2      LYS  89  -9.059 -10.113 -13.813
  708    HZ3  LYS  89           HZ3      LYS  89  -8.932 -10.559 -15.439
  709    H    THR  90           H        THR  90  -1.085 -11.422 -16.551
  710    HA   THR  90           HA       THR  90   0.677 -11.722 -14.282
  711    HB   THR  90           HB       THR  90   1.027  -9.663 -16.448
  712    HG1  THR  90           HG1      THR  90   1.891 -11.246 -17.772
  713   HG21  THR  90          HG21      THR  90   3.409 -10.117 -16.098
  714   HG22  THR  90          HG22      THR  90   3.007 -11.357 -14.909
  715   HG23  THR  90          HG23      THR  90   2.633  -9.666 -14.578
  716    H    ILE  91           H        ILE  91   0.635 -10.533 -12.490
  717    HA   ILE  91           HA       ILE  91  -0.749  -7.936 -12.529
  718    HB   ILE  91           HB       ILE  91  -1.190  -8.229 -10.134
  719   HG12  ILE  91          HG12      ILE  91  -0.292 -11.055 -10.387
  720   HG13  ILE  91          HG13      ILE  91   0.730  -9.824  -9.678
  721   HG21  ILE  91          HG21      ILE  91  -2.144 -10.504 -11.845
  722   HG22  ILE  91          HG22      ILE  91  -2.831  -8.879 -11.807
  723   HG23  ILE  91          HG23      ILE  91  -2.933  -9.913 -10.382
  724   HD11  ILE  91          HD11      ILE  91  -2.021 -10.090  -8.601
  725   HD12  ILE  91          HD12      ILE  91  -0.498  -9.731  -7.771
  726   HD13  ILE  91          HD13      ILE  91  -0.875 -11.389  -8.232
  727    H    ASP  92           H        ASP  92   0.164  -6.375 -10.656
  728    HA   ASP  92           HA       ASP  92   3.080  -6.475 -11.048
  729    HB2  ASP  92           HB2      ASP  92   1.683  -4.738 -12.284
  730    HB3  ASP  92           HB3      ASP  92   1.479  -3.957 -10.724
  731    HA   PRO  93           HA       PRO  93   2.834  -6.088  -6.456
  732    HB2  PRO  93           HB2      PRO  93   4.742  -8.246  -6.223
  733    HB3  PRO  93           HB3      PRO  93   3.064  -8.218  -5.670
  734    HG2  PRO  93           HG2      PRO  93   3.928  -9.822  -7.693
  735    HG3  PRO  93           HG3      PRO  93   2.267  -9.212  -7.569
  736    HD2  PRO  93           HD2      PRO  93   4.526  -8.180  -9.251
  737    HD3  PRO  93           HD3      PRO  93   2.818  -8.423  -9.685
  738    H    LYS  94           H        LYS  94   4.067  -4.474  -5.723
  739    HA   LYS  94           HA       LYS  94   6.961  -4.497  -6.301
  740    HB2  LYS  94           HB2      LYS  94   5.316  -1.971  -6.429
  741    HB3  LYS  94           HB3      LYS  94   6.995  -2.175  -6.889
  742    HG2  LYS  94           HG2      LYS  94   4.743  -3.568  -8.308
  743    HG3  LYS  94           HG3      LYS  94   5.298  -1.955  -8.761
  744    HD2  LYS  94           HD2      LYS  94   7.647  -3.377  -8.670
  745    HD3  LYS  94           HD3      LYS  94   6.506  -4.576  -9.281
  746    HE2  LYS  94           HE2      LYS  94   5.805  -2.977 -11.020
  747    HE3  LYS  94           HE3      LYS  94   7.008  -1.833 -10.427
  748    HZ1  LYS  94           HZ1      LYS  94   7.885  -3.006 -12.303
  749    HZ2  LYS  94           HZ2      LYS  94   7.537  -4.506 -11.603
  750    HZ3  LYS  94           HZ3      LYS  94   8.723  -3.511 -10.922
  751    H    VAL  95           H        VAL  95   8.313  -3.551  -4.795
  752    HA   VAL  95           HA       VAL  95   7.192  -3.180  -2.134
  753    HB   VAL  95           HB       VAL  95  10.083  -3.038  -2.710
  754   HG11  VAL  95          HG11      VAL  95   8.697  -4.314  -0.378
  755   HG12  VAL  95          HG12      VAL  95   9.082  -2.595  -0.433
  756   HG13  VAL  95          HG13      VAL  95  10.379  -3.791  -0.491
  757   HG21  VAL  95          HG21      VAL  95  10.116  -5.568  -2.229
  758   HG22  VAL  95          HG22      VAL  95   9.713  -5.026  -3.857
  759   HG23  VAL  95          HG23      VAL  95   8.434  -5.527  -2.753
  760    H    ALA  96           H        ALA  96   6.796  -1.210  -1.338
  761    HA   ALA  96           HA       ALA  96   6.652   1.038  -1.064
  762    HB1  ALA  96           HB1      ALA  96   8.951   0.476  -0.207
  763    HB2  ALA  96           HB2      ALA  96   8.666   2.168  -0.616
  764    HB3  ALA  96           HB3      ALA  96   9.582   1.138  -1.715
  765    H    PHE  97           H        PHE  97   7.099   3.275  -1.984
  766    HA   PHE  97           HA       PHE  97   6.612   3.238  -4.873
  767    HB2  PHE  97           HB2      PHE  97   5.689   4.829  -2.607
  768    HB3  PHE  97           HB3      PHE  97   6.194   5.821  -3.966
  769    HD1  PHE  97           HD1      PHE  97   4.925   5.898  -5.980
  770    HD2  PHE  97           HD2      PHE  97   3.859   3.209  -2.859
  771    HE1  PHE  97           HE1      PHE  97   2.769   5.476  -7.087
  772    HE2  PHE  97           HE2      PHE  97   1.699   2.781  -3.960
  773    HZ   PHE  97           HZ       PHE  97   1.153   3.915  -6.077
  774    HA   PRO  98           HA       PRO  98  10.863   4.961  -5.054
  775    HB2  PRO  98           HB2      PRO  98  10.974   4.316  -7.846
  776    HB3  PRO  98           HB3      PRO  98  11.796   3.506  -6.511
  777    HG2  PRO  98           HG2      PRO  98   9.807   2.361  -8.021
  778    HG3  PRO  98           HG3      PRO  98  10.246   1.855  -6.379
  779    HD2  PRO  98           HD2      PRO  98   7.972   3.566  -7.283
  780    HD3  PRO  98           HD3      PRO  98   8.034   2.341  -5.999
  781    H    ARG  99           H        ARG  99  11.812   6.783  -5.936
  782    HA   ARG  99           HA       ARG  99  10.036   8.562  -7.486
  783    HB2  ARG  99           HB2      ARG  99  12.134   9.113  -5.403
  784    HB3  ARG  99           HB3      ARG  99  11.642  10.360  -6.540
  785    HG2  ARG  99           HG2      ARG  99   9.302  10.069  -5.756
  786    HG3  ARG  99           HG3      ARG  99   9.902   8.952  -4.529
  787    HD2  ARG  99           HD2      ARG  99  11.313  10.715  -3.604
  788    HD3  ARG  99           HD3      ARG  99  10.743  11.830  -4.844
  789    HE   ARG  99           HE       ARG  99   8.564  10.765  -3.381
  790   HH11  ARG  99          HH11      ARG  99  11.159  13.112  -3.086
  791   HH12  ARG  99          HH12      ARG  99  10.300  14.090  -1.944
  792   HH21  ARG  99          HH21      ARG  99   8.204  13.494  -1.266
  793   HH22  ARG  99          HH22      ARG  99   7.456  12.060  -1.886
  794    H    ARG 100           H        ARG 100  10.687   9.269  -9.438
  795    HA   ARG 100           HA       ARG 100  13.492   8.814 -10.246
  796    HB2  ARG 100           HB2      ARG 100  10.942   8.334 -11.769
  797    HB3  ARG 100           HB3      ARG 100  12.471   8.571 -12.602
  798    HG2  ARG 100           HG2      ARG 100  12.306   6.511 -10.452
  799    HG3  ARG 100           HG3      ARG 100  11.594   6.163 -12.027
  800    HD2  ARG 100           HD2      ARG 100  13.755   5.317 -12.214
  801    HD3  ARG 100           HD3      ARG 100  13.874   6.897 -12.983
  802    HE   ARG 100           HE       ARG 100  14.539   6.982 -10.202
  803   HH11  ARG 100          HH11      ARG 100  17.487   6.522 -12.893
  804   HH12  ARG 100          HH12      ARG 100  15.849   6.229 -13.373
  805   HH21  ARG 100          HH21      ARG 100  16.695   7.345  -9.593
  806   HH22  ARG 100          HH22      ARG 100  17.964   7.154 -10.755
  807    H    ALA 101           H        ALA 101  14.541  10.467 -11.198
  808    HA   ALA 101           HA       ALA 101  13.213  13.015 -11.362
  809    HB1  ALA 101           HB1      ALA 101  15.183  13.909 -10.795
  810    HB2  ALA 101           HB2      ALA 101  16.033  13.010 -12.049
  811    HB3  ALA 101           HB3      ALA 101  15.709  12.253 -10.488
  812    H    GLN 102           H        GLN 102  14.057  14.505 -13.198
  813    HA   GLN 102           HA       GLN 102  13.734  13.074 -15.755
  814    HB2  GLN 102           HB2      GLN 102  12.870  15.795 -14.833
  815    HB3  GLN 102           HB3      GLN 102  13.093  15.474 -16.546
  816    HG2  GLN 102           HG2      GLN 102  11.466  13.644 -16.400
  817    HG3  GLN 102           HG3      GLN 102  11.223  14.014 -14.694
  818   HE21  GLN 102          HE21      GLN 102  10.687  15.059 -17.963
  819   HE22  GLN 102          HE22      GLN 102   9.507  16.268 -17.601
  820    HA   PRO 103           HA       PRO 103  17.842  14.463 -16.871
  821    HB2  PRO 103           HB2      PRO 103  17.782  14.115 -19.549
  822    HB3  PRO 103           HB3      PRO 103  17.812  12.750 -18.425
  823    HG2  PRO 103           HG2      PRO 103  15.493  13.919 -19.894
  824    HG3  PRO 103           HG3      PRO 103  15.899  12.215 -19.608
  825    HD2  PRO 103           HD2      PRO 103  14.041  13.573 -18.144
  826    HD3  PRO 103           HD3      PRO 103  14.983  12.210 -17.511
  827    H    LYS 104           H        LYS 104  18.953  15.965 -18.531
  828    HA   LYS 104           HA       LYS 104  17.571  18.531 -18.483
  829    HB2  LYS 104           HB2      LYS 104  20.412  17.750 -19.141
  830    HB3  LYS 104           HB3      LYS 104  19.807  19.389 -19.319
  831    HG2  LYS 104           HG2      LYS 104  19.416  19.578 -16.972
  832    HG3  LYS 104           HG3      LYS 104  19.766  17.865 -16.725
  833    HD2  LYS 104           HD2      LYS 104  22.071  18.227 -17.446
  834    HD3  LYS 104           HD3      LYS 104  21.724  19.934 -17.721
  835    HE2  LYS 104           HE2      LYS 104  21.308  20.279 -15.378
  836    HE3  LYS 104           HE3      LYS 104  21.462  18.552 -15.057
  837    HZ1  LYS 104           HZ1      LYS 104  23.644  20.275 -16.099
  838    HZ2  LYS 104           HZ2      LYS 104  23.771  18.646 -15.662
  839    HZ3  LYS 104           HZ3      LYS 104  23.469  19.817 -14.480
  840    H    MET 105           H        MET 105  16.628  19.447 -20.182
  841    HA   MET 105           HA       MET 105  17.024  18.252 -22.835
  842    HB2  MET 105           HB2      MET 105  14.878  19.474 -23.422
  843    HB3  MET 105           HB3      MET 105  14.730  18.153 -22.279
  844    HG2  MET 105           HG2      MET 105  14.690  19.823 -20.437
  845    HG3  MET 105           HG3      MET 105  14.691  21.100 -21.652
  846    HE1  MET 105           HE1      MET 105  12.554  20.737 -19.320
  847    HE2  MET 105           HE2      MET 105  11.020  21.022 -20.143
  848    HE3  MET 105           HE3      MET 105  12.404  22.064 -20.473
  849    H    VAL 106           H        VAL 106  18.311  19.257 -24.185
  850    HA   VAL 106           HA       VAL 106  18.703  22.155 -23.910
  851    HB   VAL 106           HB       VAL 106  20.508  20.205 -25.375
  852   HG11  VAL 106          HG11      VAL 106  22.169  22.020 -25.270
  853   HG12  VAL 106          HG12      VAL 106  20.953  23.074 -24.547
  854   HG13  VAL 106          HG13      VAL 106  20.736  22.476 -26.193
  855   HG21  VAL 106          HG21      VAL 106  22.046  20.413 -23.468
  856   HG22  VAL 106          HG22      VAL 106  20.514  19.675 -23.000
  857   HG23  VAL 106          HG23      VAL 106  20.835  21.363 -22.605
  858    H    THR 107           H        THR 107  18.585  19.675 -26.478
  859    HA   THR 107           HA       THR 107  17.614  21.631 -28.352
  860    HB   THR 107           HB       THR 107  18.223  18.765 -29.033
  861    HG1  THR 107           HG1      THR 107  20.012  20.828 -28.404
  862   HG21  THR 107          HG21      THR 107  18.856  19.764 -31.220
  863   HG22  THR 107          HG22      THR 107  18.360  21.343 -30.611
  864   HG23  THR 107          HG23      THR 107  17.170  20.056 -30.797
  865    H    ARG 108           H        ARG 108  15.508  21.942 -27.855
  866    HA   ARG 108           HA       ARG 108  13.703  19.710 -27.419
  867    HB2  ARG 108           HB2      ARG 108  13.357  22.701 -27.342
  868    HB3  ARG 108           HB3      ARG 108  11.987  21.605 -27.232
  869    HG2  ARG 108           HG2      ARG 108  12.922  20.603 -25.223
  870    HG3  ARG 108           HG3      ARG 108  14.334  21.653 -25.344
  871    HD2  ARG 108           HD2      ARG 108  12.923  22.656 -23.742
  872    HD3  ARG 108           HD3      ARG 108  12.729  23.606 -25.214
  873    HE   ARG 108           HE       ARG 108  10.665  22.081 -25.526
  874   HH11  ARG 108          HH11      ARG 108  11.814  23.280 -22.433
  875   HH12  ARG 108          HH12      ARG 108  10.241  23.253 -21.708
  876   HH21  ARG 108          HH21      ARG 108   8.432  22.560 -22.911
  877   HH22  ARG 108          HH22      ARG 108   8.615  22.056 -24.558
  878    H    THR 109           H        THR 109  12.205  18.946 -28.788
  879    HA   THR 109           HA       THR 109  12.113  20.101 -31.498
  880    HB   THR 109           HB       THR 109  11.260  17.778 -32.160
  881    HG1  THR 109           HG1      THR 109  11.680  17.419 -29.492
  882   HG21  THR 109          HG21      THR 109  13.485  18.548 -32.762
  883   HG22  THR 109          HG22      THR 109  13.542  16.847 -32.296
  884   HG23  THR 109          HG23      THR 109  14.098  18.088 -31.173
  885    H    LYS 110           H        LYS 110  10.132  18.494 -29.023
  886    HA   LYS 110           HA       LYS 110   7.679  19.165 -30.335
  887    HB2  LYS 110           HB2      LYS 110   8.391  17.669 -27.843
  888    HB3  LYS 110           HB3      LYS 110   6.729  18.169 -28.127
  889    HG2  LYS 110           HG2      LYS 110   6.653  16.889 -30.175
  890    HG3  LYS 110           HG3      LYS 110   8.357  16.461 -30.001
  891    HD2  LYS 110           HD2      LYS 110   7.901  15.176 -28.032
  892    HD3  LYS 110           HD3      LYS 110   6.234  15.754 -27.981
  893    HE2  LYS 110           HE2      LYS 110   5.696  14.566 -29.991
  894    HE3  LYS 110           HE3      LYS 110   7.385  14.130 -30.242
  895    HZ1  LYS 110           HZ1      LYS 110   7.327  12.735 -28.322
  896    HZ2  LYS 110           HZ2      LYS 110   6.010  12.322 -29.302
  897    HZ3  LYS 110           HZ3      LYS 110   5.770  13.254 -27.910
  898    H    LYS 111           H        LYS 111   6.157  20.661 -29.663
  899    HA   LYS 111           HA       LYS 111   6.656  22.250 -27.321
  900    HB2  LYS 111           HB2      LYS 111   6.332  24.401 -28.581
  901    HB3  LYS 111           HB3      LYS 111   7.850  23.583 -28.900
  902    HG2  LYS 111           HG2      LYS 111   6.970  22.753 -31.022
  903    HG3  LYS 111           HG3      LYS 111   5.425  23.539 -30.693
  904    HD2  LYS 111           HD2      LYS 111   6.591  25.720 -30.631
  905    HD3  LYS 111           HD3      LYS 111   8.094  24.899 -31.060
  906    HE2  LYS 111           HE2      LYS 111   7.031  24.110 -33.141
  907    HE3  LYS 111           HE3      LYS 111   5.574  25.008 -32.714
  908    HZ1  LYS 111           HZ1      LYS 111   6.867  27.053 -32.774
  909    HZ2  LYS 111           HZ2      LYS 111   6.944  26.248 -34.261
  910    HZ3  LYS 111           HZ3      LYS 111   8.258  26.186 -33.198
  Start of MODEL    3
    1    H1   MET  -3           H1       MET  -3  11.090  34.751  28.301
    2    H2   MET  -3           H2       MET  -3  11.418  35.847  27.055
    3    H3   MET  -3           H3       MET  -3  11.011  34.248  26.687
    4    HA   MET  -3           HA       MET  -3   9.151  35.713  26.278
    5    HB2  MET  -3           HB2      MET  -3   9.081  33.308  27.491
    6    HB3  MET  -3           HB3      MET  -3   8.295  34.273  28.731
    7    HG2  MET  -3           HG2      MET  -3   6.612  34.996  27.149
    8    HG3  MET  -3           HG3      MET  -3   7.428  34.127  25.851
    9    HE1  MET  -3           HE1      MET  -3   6.667  30.441  26.499
   10    HE2  MET  -3           HE2      MET  -3   8.134  31.421  26.488
   11    HE3  MET  -3           HE3      MET  -3   6.909  31.652  25.240
   12    H    HIS  -2           H        HIS  -2   7.903  37.423  26.862
   13    HA   HIS  -2           HA       HIS  -2   8.608  38.767  29.384
   14    HB2  HIS  -2           HB2      HIS  -2   7.727  39.818  26.708
   15    HB3  HIS  -2           HB3      HIS  -2   7.616  40.806  28.161
   16    HD1  HIS  -2           HD1      HIS  -2  10.008  39.538  25.649
   17    HD2  HIS  -2           HD2      HIS  -2  10.132  41.511  29.303
   18    HE1  HIS  -2           HE1      HIS  -2  12.346  40.441  25.845
   19    HE2  HIS  -2           HE2      HIS  -2  12.400  41.631  28.066
   20    H    HIS  -1           H        HIS  -1   7.124  39.295  30.845
   21    HA   HIS  -1           HA       HIS  -1   5.208  39.361  32.040
   22    HB2  HIS  -1           HB2      HIS  -1   4.118  40.041  29.319
   23    HB3  HIS  -1           HB3      HIS  -1   3.085  39.979  30.743
   24    HD1  HIS  -1           HD1      HIS  -1   5.905  41.943  29.228
   25    HD2  HIS  -1           HD2      HIS  -1   3.337  42.126  32.489
   26    HE1  HIS  -1           HE1      HIS  -1   6.217  44.242  30.202
   27    HE2  HIS  -1           HE2      HIS  -1   4.652  44.331  32.175
   28    H    HIS   0           H        HIS   0   4.009  37.906  33.006
   29    HA   HIS   0           HA       HIS   0   3.131  35.546  31.476
   30    HB2  HIS   0           HB2      HIS   0   4.300  35.827  34.214
   31    HB3  HIS   0           HB3      HIS   0   3.158  34.521  33.910
   32    HD1  HIS   0           HD1      HIS   0   6.629  35.637  33.165
   33    HD2  HIS   0           HD2      HIS   0   4.082  32.511  32.161
   34    HE1  HIS   0           HE1      HIS   0   8.091  33.897  32.088
   35    HE2  HIS   0           HE2      HIS   0   6.529  32.013  31.489
   36    H    HIS   1           H        HIS   1   1.115  34.637  31.953
   37    HA   HIS   1           HA       HIS   1  -0.747  36.445  33.353
   38    HB2  HIS   1           HB2      HIS   1  -0.846  35.851  30.730
   39    HB3  HIS   1           HB3      HIS   1  -1.795  34.509  31.360
   40    HD1  HIS   1           HD1      HIS   1  -4.069  35.095  32.486
   41    HD2  HIS   1           HD2      HIS   1  -2.072  38.346  30.839
   42    HE1  HIS   1           HE1      HIS   1  -5.763  36.952  32.401
   43    HE2  HIS   1           HE2      HIS   1  -4.532  38.911  31.402
   44    H    HIS   2           H        HIS   2  -2.451  35.515  34.560
   45    HA   HIS   2           HA       HIS   2  -1.812  32.866  35.638
   46    HB2  HIS   2           HB2      HIS   2  -3.418  35.187  36.694
   47    HB3  HIS   2           HB3      HIS   2  -3.507  33.591  37.429
   48    HD1  HIS   2           HD1      HIS   2  -0.959  36.301  36.698
   49    HD2  HIS   2           HD2      HIS   2  -1.530  33.056  39.229
   50    HE1  HIS   2           HE1      HIS   2   0.939  36.392  38.346
   51    HE2  HIS   2           HE2      HIS   2   0.573  34.420  39.870
   52    H    HIS   3           H        HIS   3  -3.108  31.154  35.409
   53    HA   HIS   3           HA       HIS   3  -5.758  31.549  34.181
   54    HB2  HIS   3           HB2      HIS   3  -3.655  29.476  33.576
   55    HB3  HIS   3           HB3      HIS   3  -5.344  29.245  33.139
   56    HD1  HIS   3           HD1      HIS   3  -6.263  30.634  31.182
   57    HD2  HIS   3           HD2      HIS   3  -2.271  31.395  32.053
   58    HE1  HIS   3           HE1      HIS   3  -5.391  31.962  29.232
   59    HE2  HIS   3           HE2      HIS   3  -2.973  32.411  29.780
   60    H    SER   4           H        SER   4  -7.431  30.273  34.886
   61    HA   SER   4           HA       SER   4  -6.930  28.742  37.353
   62    HB2  SER   4           HB2      SER   4  -9.366  29.150  37.828
   63    HB3  SER   4           HB3      SER   4  -8.392  30.618  37.763
   64    HG   SER   4           HG       SER   4 -10.263  30.938  36.575
   65    H    THR   5           H        THR   5  -9.033  28.754  34.466
   66    HA   THR   5           HA       THR   5  -9.286  25.837  34.705
   67    HB   THR   5           HB       THR   5 -11.462  26.831  34.709
   68    HG1  THR   5           HG1      THR   5 -10.673  25.464  32.409
   69   HG21  THR   5          HG21      THR   5 -10.752  28.274  32.146
   70   HG22  THR   5          HG22      THR   5 -10.943  29.023  33.730
   71   HG23  THR   5          HG23      THR   5 -12.330  28.279  32.934
   72    H    SER   6           H        SER   6  -7.674  24.905  33.633
   73    HA   SER   6           HA       SER   6  -6.872  25.950  31.010
   74    HB2  SER   6           HB2      SER   6  -5.465  23.970  32.814
   75    HB3  SER   6           HB3      SER   6  -4.840  24.597  31.288
   76    HG   SER   6           HG       SER   6  -4.062  26.154  32.449
   77    H    VAL   7           H        VAL   7  -6.933  24.765  29.175
   78    HA   VAL   7           HA       VAL   7  -8.448  22.246  29.253
   79    HB   VAL   7           HB       VAL   7  -7.790  23.849  26.767
   80   HG11  VAL   7          HG11      VAL   7  -9.754  22.709  25.830
   81   HG12  VAL   7          HG12      VAL   7  -9.967  21.837  27.348
   82   HG13  VAL   7          HG13      VAL   7  -8.527  21.561  26.367
   83   HG21  VAL   7          HG21      VAL   7  -9.987  24.896  26.913
   84   HG22  VAL   7          HG22      VAL   7  -9.002  25.317  28.313
   85   HG23  VAL   7          HG23      VAL   7 -10.274  24.106  28.464
   86    H    ASP   8           H        ASP   8  -7.534  20.343  28.658
   87    HA   ASP   8           HA       ASP   8  -4.668  20.273  28.247
   88    HB2  ASP   8           HB2      ASP   8  -6.747  18.143  28.702
   89    HB3  ASP   8           HB3      ASP   8  -5.081  17.745  28.297
   90    H    LEU   9           H        LEU   9  -3.702  20.225  26.362
   91    HA   LEU   9           HA       LEU   9  -5.199  19.585  23.929
   92    HB2  LEU   9           HB2      LEU   9  -3.439  21.590  24.491
   93    HB3  LEU   9           HB3      LEU   9  -2.379  20.424  23.726
   94    HG   LEU   9           HG       LEU   9  -4.169  20.405  21.829
   95   HD11  LEU   9          HD11      LEU   9  -4.738  23.095  23.071
   96   HD12  LEU   9          HD12      LEU   9  -5.837  21.717  23.098
   97   HD13  LEU   9          HD13      LEU   9  -5.400  22.466  21.563
   98   HD21  LEU   9          HD21      LEU   9  -1.822  21.330  21.757
   99   HD22  LEU   9          HD22      LEU   9  -2.519  22.901  22.152
  100   HD23  LEU   9          HD23      LEU   9  -2.976  22.083  20.658
  101    H    GLY  10           H        GLY  10  -4.321  18.124  22.327
  102    HA2  GLY  10           HA2      GLY  10  -2.250  16.272  23.263
  103    HA3  GLY  10           HA3      GLY  10  -3.834  15.609  22.896
  104    H    THR  11           H        THR  11  -1.171  17.482  21.498
  105    HA   THR  11           HA       THR  11  -1.586  16.061  18.968
  106    HB   THR  11           HB       THR  11  -2.641  18.168  18.533
  107    HG1  THR  11           HG1      THR  11  -0.408  18.928  17.223
  108   HG21  THR  11          HG21      THR  11  -0.126  19.492  19.562
  109   HG22  THR  11          HG22      THR  11  -1.740  19.585  20.264
  110   HG23  THR  11          HG23      THR  11  -1.416  20.332  18.700
  111    H    GLU  12           H        GLU  12   0.502  17.059  21.398
  112    HA   GLU  12           HA       GLU  12   2.891  16.910  19.763
  113    HB2  GLU  12           HB2      GLU  12   4.102  17.627  21.790
  114    HB3  GLU  12           HB3      GLU  12   2.822  18.735  21.332
  115    HG2  GLU  12           HG2      GLU  12   1.398  17.868  23.085
  116    HG3  GLU  12           HG3      GLU  12   2.625  16.682  23.521
  117    H    ASN  13           H        ASN  13   1.524  15.330  22.566
  118    HA   ASN  13           HA       ASN  13   3.458  13.209  22.609
  119    HB2  ASN  13           HB2      ASN  13   2.123  14.314  24.569
  120    HB3  ASN  13           HB3      ASN  13   0.873  13.167  24.129
  121   HD21  ASN  13          HD21      ASN  13   2.685  13.658  26.399
  122   HD22  ASN  13          HD22      ASN  13   3.376  12.135  26.716
  123    H    LEU  14           H        LEU  14   1.587  13.625  20.233
  124    HA   LEU  14           HA       LEU  14  -0.159  11.348  20.153
  125    HB2  LEU  14           HB2      LEU  14  -0.271  13.636  18.870
  126    HB3  LEU  14           HB3      LEU  14   0.740  12.807  17.704
  127    HG   LEU  14           HG       LEU  14  -1.150  10.981  17.802
  128   HD11  LEU  14          HD11      LEU  14  -2.448  11.934  19.591
  129   HD12  LEU  14          HD12      LEU  14  -3.378  12.018  18.094
  130   HD13  LEU  14          HD13      LEU  14  -2.589  13.464  18.725
  131   HD21  LEU  14          HD21      LEU  14  -1.451  13.615  16.366
  132   HD22  LEU  14          HD22      LEU  14  -2.287  12.121  15.945
  133   HD23  LEU  14          HD23      LEU  14  -0.531  12.217  15.811
  134    H    TYR  15           H        TYR  15  -0.001   9.545  18.788
  135    HA   TYR  15           HA       TYR  15   2.692   8.491  18.542
  136    HB2  TYR  15           HB2      TYR  15  -0.055   7.282  18.211
  137    HB3  TYR  15           HB3      TYR  15   1.416   6.394  17.823
  138    HD1  TYR  15           HD1      TYR  15   2.913   5.643  19.573
  139    HD2  TYR  15           HD2      TYR  15  -0.605   7.839  20.520
  140    HE1  TYR  15           HE1      TYR  15   3.164   5.014  21.937
  141    HE2  TYR  15           HE2      TYR  15  -0.365   7.215  22.886
  142    HH   TYR  15           HH       TYR  15   0.698   5.464  24.230
  143    H    PHE  16           H        PHE  16   3.802   8.242  16.699
  144    HA   PHE  16           HA       PHE  16   2.517   8.255  14.119
  145    HB2  PHE  16           HB2      PHE  16   3.366  10.651  14.989
  146    HB3  PHE  16           HB3      PHE  16   4.889  10.045  14.347
  147    HD1  PHE  16           HD1      PHE  16   5.196   9.709  11.977
  148    HD2  PHE  16           HD2      PHE  16   1.488  11.112  13.528
  149    HE1  PHE  16           HE1      PHE  16   4.493  10.351   9.708
  150    HE2  PHE  16           HE2      PHE  16   0.780  11.756  11.261
  151    HZ   PHE  16           HZ       PHE  16   2.282  11.375   9.348
  152    H    GLN  17           H        GLN  17   3.388   6.040  15.061
  153    HA   GLN  17           HA       GLN  17   6.207   5.557  14.585
  154    HB2  GLN  17           HB2      GLN  17   3.929   3.785  15.459
  155    HB3  GLN  17           HB3      GLN  17   5.551   3.174  15.165
  156    HG2  GLN  17           HG2      GLN  17   6.442   4.582  16.911
  157    HG3  GLN  17           HG3      GLN  17   4.861   5.323  17.158
  158   HE21  GLN  17          HE21      GLN  17   3.248   4.161  18.197
  159   HE22  GLN  17          HE22      GLN  17   3.582   2.734  19.110
  160    H    SER  18           H        SER  18   7.104   4.736  12.825
  161    HA   SER  18           HA       SER  18   5.382   3.911  10.592
  162    HB2  SER  18           HB2      SER  18   8.248   4.883  10.644
  163    HB3  SER  18           HB3      SER  18   7.425   4.313   9.193
  164    HG   SER  18           HG       SER  18   7.086   6.450   9.154
  165    H    ASN  19           H        ASN  19   5.667   1.959   9.550
  166    HA   ASN  19           HA       ASN  19   7.405   0.028  10.928
  167    HB2  ASN  19           HB2      ASN  19   4.841  -0.385   9.382
  168    HB3  ASN  19           HB3      ASN  19   5.880  -1.709   9.863
  169   HD21  ASN  19          HD21      ASN  19   4.523  -2.679  11.102
  170   HD22  ASN  19          HD22      ASN  19   3.967  -2.044  12.583
  171    H    ALA  20           H        ALA  20   6.107   0.657   7.652
  172    HA   ALA  20           HA       ALA  20   6.879   0.278   5.552
  173    HB1  ALA  20           HB1      ALA  20   9.554   1.049   6.700
  174    HB2  ALA  20           HB2      ALA  20   8.267   2.192   6.319
  175    HB3  ALA  20           HB3      ALA  20   9.004   1.234   5.034
  176    H    GLY  21           H        GLY  21   7.133  -1.480   4.441
  177    HA2  GLY  21           HA2      GLY  21   9.187  -3.136   4.066
  178    HA3  GLY  21           HA3      GLY  21   8.551  -3.750   5.581
  179    H    LYS  22           H        LYS  22   6.024  -2.495   3.804
  180    HA   LYS  22           HA       LYS  22   5.163  -5.167   3.035
  181    HB2  LYS  22           HB2      LYS  22   2.937  -4.231   2.801
  182    HB3  LYS  22           HB3      LYS  22   3.628  -3.776   4.345
  183    HG2  LYS  22           HG2      LYS  22   4.308  -1.608   2.990
  184    HG3  LYS  22           HG3      LYS  22   2.921  -2.097   2.012
  185    HD2  LYS  22           HD2      LYS  22   1.555  -2.190   4.075
  186    HD3  LYS  22           HD3      LYS  22   2.943  -1.590   4.986
  187    HE2  LYS  22           HE2      LYS  22   2.941   0.458   3.675
  188    HE3  LYS  22           HE3      LYS  22   1.595  -0.144   2.707
  189    HZ1  LYS  22           HZ1      LYS  22   0.201  -0.133   4.652
  190    HZ2  LYS  22           HZ2      LYS  22   0.889   1.400   4.456
  191    HZ3  LYS  22           HZ3      LYS  22   1.492   0.348   5.634
  192    H    MET  23           H        MET  23   3.742  -5.183   0.925
  193    HA   MET  23           HA       MET  23   5.208  -3.888  -1.196
  194    HB2  MET  23           HB2      MET  23   4.487  -6.725  -0.752
  195    HB3  MET  23           HB3      MET  23   4.364  -6.117  -2.386
  196    HG2  MET  23           HG2      MET  23   6.734  -5.299  -2.150
  197    HG3  MET  23           HG3      MET  23   6.801  -6.197  -0.637
  198    HE1  MET  23           HE1      MET  23   8.194  -6.577  -4.127
  199    HE2  MET  23           HE2      MET  23   6.494  -6.158  -4.357
  200    HE3  MET  23           HE3      MET  23   7.092  -7.728  -4.886
  201    H    PHE  24           H        PHE  24   4.093  -3.513  -3.027
  202    HA   PHE  24           HA       PHE  24   1.237  -2.922  -2.781
  203    HB2  PHE  24           HB2      PHE  24   2.971  -1.062  -3.148
  204    HB3  PHE  24           HB3      PHE  24   3.254  -1.751  -4.732
  205    HD1  PHE  24           HD1      PHE  24   2.581   1.044  -4.370
  206    HD2  PHE  24           HD2      PHE  24  -0.015  -2.302  -4.815
  207    HE1  PHE  24           HE1      PHE  24   0.840   2.516  -5.287
  208    HE2  PHE  24           HE2      PHE  24  -1.745  -0.827  -5.731
  209    HZ   PHE  24           HZ       PHE  24  -1.330   1.579  -5.969
  210    H    ILE  25           H        ILE  25   0.160  -4.597  -3.715
  211    HA   ILE  25           HA       ILE  25   1.209  -5.987  -6.019
  212    HB   ILE  25           HB       ILE  25  -1.331  -6.744  -4.822
  213   HG12  ILE  25          HG12      ILE  25  -0.002  -6.166  -2.820
  214   HG13  ILE  25          HG13      ILE  25  -0.406  -7.860  -2.891
  215   HG21  ILE  25          HG21      ILE  25  -0.637  -8.145  -6.542
  216   HG22  ILE  25          HG22      ILE  25  -0.257  -9.051  -5.079
  217   HG23  ILE  25          HG23      ILE  25   1.021  -8.209  -5.946
  218   HD11  ILE  25          HD11      ILE  25   1.828  -8.468  -3.402
  219   HD12  ILE  25          HD12      ILE  25   1.913  -7.292  -2.089
  220   HD13  ILE  25          HD13      ILE  25   2.272  -6.795  -3.743
  221    H    GLY  26           H        GLY  26   0.643  -5.290  -7.926
  222    HA2  GLY  26           HA2      GLY  26  -1.873  -3.913  -8.287
  223    HA3  GLY  26           HA3      GLY  26  -0.484  -3.658  -9.286
  224    H    GLY  27           H        GLY  27  -3.018  -4.044 -10.246
  225    HA2  GLY  27           HA2      GLY  27  -3.996  -5.077 -12.044
  226    HA3  GLY  27           HA3      GLY  27  -2.558  -6.064 -12.191
  227    H    LEU  28           H        LEU  28  -4.296  -6.174  -9.166
  228    HA   LEU  28           HA       LEU  28  -4.607  -8.917  -9.121
  229    HB2  LEU  28           HB2      LEU  28  -6.332  -6.869  -7.702
  230    HB3  LEU  28           HB3      LEU  28  -6.158  -8.550  -7.253
  231    HG   LEU  28           HG       LEU  28  -3.831  -6.625  -7.232
  232   HD11  LEU  28          HD11      LEU  28  -5.641  -7.359  -4.932
  233   HD12  LEU  28          HD12      LEU  28  -5.628  -5.802  -5.761
  234   HD13  LEU  28          HD13      LEU  28  -4.209  -6.333  -4.860
  235   HD21  LEU  28          HD21      LEU  28  -3.288  -9.026  -7.234
  236   HD22  LEU  28          HD22      LEU  28  -4.301  -9.252  -5.809
  237   HD23  LEU  28          HD23      LEU  28  -2.848  -8.255  -5.713
  238    H    SER  29           H        SER  29  -6.887 -10.020  -8.882
  239    HA   SER  29           HA       SER  29  -8.413  -9.377 -11.267
  240    HB2  SER  29           HB2      SER  29  -7.279 -11.661 -10.916
  241    HB3  SER  29           HB3      SER  29  -8.527 -11.960  -9.707
  242    HG   SER  29           HG       SER  29  -9.440 -12.711 -11.507
  243    H    TRP  30           H        TRP  30 -10.703 -10.199 -11.014
  244    HA   TRP  30           HA       TRP  30 -12.091  -8.587  -9.169
  245    HB2  TRP  30           HB2      TRP  30 -14.071  -9.446 -10.328
  246    HB3  TRP  30           HB3      TRP  30 -12.859  -8.940 -11.477
  247    HD1  TRP  30           HD1      TRP  30 -11.121 -11.417 -11.888
  248    HE1  TRP  30           HE1      TRP  30 -12.023 -13.622 -12.812
  249    HE3  TRP  30           HE3      TRP  30 -16.104 -10.776 -10.876
  250    HZ2  TRP  30           HZ2      TRP  30 -14.471 -14.915 -13.123
  251    HZ3  TRP  30           HZ3      TRP  30 -17.661 -12.564 -11.537
  252    HH2  TRP  30           HH2      TRP  30 -16.864 -14.593 -12.639
  253    H    GLN  31           H        GLN  31 -10.929 -11.756  -9.137
  254    HA   GLN  31           HA       GLN  31 -12.811 -12.745  -7.149
  255    HB2  GLN  31           HB2      GLN  31 -10.688 -14.028  -8.835
  256    HB3  GLN  31           HB3      GLN  31 -11.547 -14.903  -7.572
  257    HG2  GLN  31           HG2      GLN  31 -13.676 -14.372  -8.754
  258    HG3  GLN  31           HG3      GLN  31 -12.713 -13.672 -10.058
  259   HE21  GLN  31          HE21      GLN  31 -13.519 -16.595  -8.349
  260   HE22  GLN  31          HE22      GLN  31 -13.006 -17.697  -9.575
  261    H    THR  32           H        THR  32  -9.558 -11.672  -7.512
  262    HA   THR  32           HA       THR  32  -8.419 -12.882  -5.229
  263    HB   THR  32           HB       THR  32  -7.434 -10.322  -6.302
  264    HG1  THR  32           HG1      THR  32  -8.050 -12.378  -7.826
  265   HG21  THR  32          HG21      THR  32  -5.234 -11.407  -5.984
  266   HG22  THR  32          HG22      THR  32  -6.061 -12.851  -5.401
  267   HG23  THR  32          HG23      THR  32  -6.168 -11.346  -4.489
  268    H    SER  33           H        SER  33  -8.989 -12.579  -3.243
  269    HA   SER  33           HA       SER  33  -9.946  -9.981  -2.259
  270    HB2  SER  33           HB2      SER  33 -10.217 -12.800  -1.192
  271    HB3  SER  33           HB3      SER  33 -10.744 -11.376  -0.302
  272    HG   SER  33           HG       SER  33 -11.712 -11.311  -2.809
  273    HA   PRO  34           HA       PRO  34  -6.294  -9.248   0.210
  274    HB2  PRO  34           HB2      PRO  34  -7.305  -8.845   2.765
  275    HB3  PRO  34           HB3      PRO  34  -7.189  -7.597   1.515
  276    HG2  PRO  34           HG2      PRO  34  -9.541  -9.256   2.302
  277    HG3  PRO  34           HG3      PRO  34  -9.472  -7.539   1.854
  278    HD2  PRO  34           HD2      PRO  34 -10.357  -9.353   0.123
  279    HD3  PRO  34           HD3      PRO  34  -9.351  -8.001  -0.417
  280    H    ASP  35           H        ASP  35  -8.583 -11.585   1.262
  281    HA   ASP  35           HA       ASP  35  -6.835 -13.007   3.045
  282    HB2  ASP  35           HB2      ASP  35  -9.572 -13.221   2.138
  283    HB3  ASP  35           HB3      ASP  35  -8.820 -14.740   2.521
  284    H    SER  36           H        SER  36  -7.894 -13.144  -0.226
  285    HA   SER  36           HA       SER  36  -6.799 -15.678  -0.947
  286    HB2  SER  36           HB2      SER  36  -8.625 -14.473  -2.214
  287    HB3  SER  36           HB3      SER  36  -7.399 -13.340  -2.782
  288    HG   SER  36           HG       SER  36  -8.016 -15.757  -3.745
  289    H    LEU  37           H        LEU  37  -5.689 -12.323  -0.977
  290    HA   LEU  37           HA       LEU  37  -3.246 -12.741  -2.312
  291    HB2  LEU  37           HB2      LEU  37  -4.875 -10.689  -1.119
  292    HB3  LEU  37           HB3      LEU  37  -3.220 -10.476  -0.681
  293    HG   LEU  37           HG       LEU  37  -4.168 -10.735  -3.517
  294   HD11  LEU  37          HD11      LEU  37  -3.638  -8.254  -1.897
  295   HD12  LEU  37          HD12      LEU  37  -5.192  -8.796  -2.537
  296   HD13  LEU  37          HD13      LEU  37  -3.914  -8.290  -3.641
  297   HD21  LEU  37          HD21      LEU  37  -2.024  -9.677  -4.066
  298   HD22  LEU  37          HD22      LEU  37  -1.810 -11.224  -3.253
  299   HD23  LEU  37          HD23      LEU  37  -1.578  -9.722  -2.365
  300    H    ARG  38           H        ARG  38  -4.352 -12.700   1.012
  301    HA   ARG  38           HA       ARG  38  -1.828 -12.826   2.262
  302    HB2  ARG  38           HB2      ARG  38  -4.271 -12.169   3.156
  303    HB3  ARG  38           HB3      ARG  38  -4.253 -13.855   3.650
  304    HG2  ARG  38           HG2      ARG  38  -2.538 -13.536   5.171
  305    HG3  ARG  38           HG3      ARG  38  -1.955 -12.083   4.365
  306    HD2  ARG  38           HD2      ARG  38  -2.963 -11.300   6.325
  307    HD3  ARG  38           HD3      ARG  38  -4.163 -11.010   5.074
  308    HE   ARG  38           HE       ARG  38  -4.839 -13.443   6.060
  309   HH11  ARG  38          HH11      ARG  38  -4.345 -10.302   7.549
  310   HH12  ARG  38          HH12      ARG  38  -5.471 -10.601   8.830
  311   HH21  ARG  38          HH21      ARG  38  -6.580 -12.591   8.943
  312   HH22  ARG  38          HH22      ARG  38  -6.307 -13.818   7.751
  313    H    ASP  39           H        ASP  39  -4.310 -15.132   1.271
  314    HA   ASP  39           HA       ASP  39  -3.056 -17.457   2.267
  315    HB2  ASP  39           HB2      ASP  39  -5.384 -16.813   0.627
  316    HB3  ASP  39           HB3      ASP  39  -4.609 -18.322   0.158
  317    H    TYR  40           H        TYR  40  -2.923 -15.798  -0.880
  318    HA   TYR  40           HA       TYR  40  -1.500 -17.838  -2.246
  319    HB2  TYR  40           HB2      TYR  40  -2.955 -15.847  -3.146
  320    HB3  TYR  40           HB3      TYR  40  -1.431 -14.969  -3.102
  321    HD1  TYR  40           HD1      TYR  40   0.189 -15.270  -4.798
  322    HD2  TYR  40           HD2      TYR  40  -3.113 -17.938  -4.540
  323    HE1  TYR  40           HE1      TYR  40   0.804 -16.231  -6.976
  324    HE2  TYR  40           HE2      TYR  40  -2.512 -18.905  -6.722
  325    HH   TYR  40           HH       TYR  40   0.476 -18.292  -8.241
  326    H    PHE  41           H        PHE  41  -0.542 -14.682  -0.909
  327    HA   PHE  41           HA       PHE  41   2.192 -14.952  -1.507
  328    HB2  PHE  41           HB2      PHE  41   0.485 -13.029  -0.115
  329    HB3  PHE  41           HB3      PHE  41   2.208 -12.917   0.137
  330    HD1  PHE  41           HD1      PHE  41   3.624 -12.021  -1.575
  331    HD2  PHE  41           HD2      PHE  41  -0.448 -12.921  -2.428
  332    HE1  PHE  41           HE1      PHE  41   3.855 -10.927  -3.755
  333    HE2  PHE  41           HE2      PHE  41  -0.215 -11.820  -4.626
  334    HZ   PHE  41           HZ       PHE  41   1.932 -10.824  -5.285
  335    H    SER  42           H        SER  42   0.289 -15.965   1.240
  336    HA   SER  42           HA       SER  42   2.346 -16.097   3.197
  337    HB2  SER  42           HB2      SER  42  -0.169 -16.277   3.637
  338    HB3  SER  42           HB3      SER  42  -0.035 -17.949   3.100
  339    HG   SER  42           HG       SER  42   0.293 -18.113   5.225
  340    H    LYS  43           H        LYS  43   1.704 -17.697   0.460
  341    HA   LYS  43           HA       LYS  43   2.828 -20.267   1.045
  342    HB2  LYS  43           HB2      LYS  43   1.666 -18.922  -1.344
  343    HB3  LYS  43           HB3      LYS  43   2.613 -20.368  -1.559
  344    HG2  LYS  43           HG2      LYS  43   0.736 -20.826   0.533
  345    HG3  LYS  43           HG3      LYS  43  -0.106 -20.160  -0.864
  346    HD2  LYS  43           HD2      LYS  43   0.872 -21.895  -2.285
  347    HD3  LYS  43           HD3      LYS  43   1.737 -22.552  -0.895
  348    HE2  LYS  43           HE2      LYS  43  -0.157 -23.920  -1.145
  349    HE3  LYS  43           HE3      LYS  43  -0.541 -22.840   0.194
  350    HZ1  LYS  43           HZ1      LYS  43  -2.393 -23.079  -1.357
  351    HZ2  LYS  43           HZ2      LYS  43  -1.440 -22.468  -2.614
  352    HZ3  LYS  43           HZ3      LYS  43  -1.843 -21.480  -1.302
  353    H    PHE  44           H        PHE  44   4.046 -17.232   0.254
  354    HA   PHE  44           HA       PHE  44   6.564 -18.277  -0.854
  355    HB2  PHE  44           HB2      PHE  44   5.045 -16.218  -1.760
  356    HB3  PHE  44           HB3      PHE  44   6.181 -15.395  -0.707
  357    HD1  PHE  44           HD1      PHE  44   5.808 -17.345  -3.759
  358    HD2  PHE  44           HD2      PHE  44   8.544 -15.307  -1.211
  359    HE1  PHE  44           HE1      PHE  44   7.530 -17.472  -5.510
  360    HE2  PHE  44           HE2      PHE  44  10.260 -15.431  -2.972
  361    HZ   PHE  44           HZ       PHE  44   9.762 -16.526  -5.106
  362    H    GLY  45           H        GLY  45   5.137 -16.434   1.728
  363    HA2  GLY  45           HA2      GLY  45   7.254 -16.948   3.523
  364    HA3  GLY  45           HA3      GLY  45   7.172 -15.258   3.044
  365    H    GLU  46           H        GLU  46   6.647 -14.913   5.309
  366    HA   GLU  46           HA       GLU  46   3.951 -15.587   6.004
  367    HB2  GLU  46           HB2      GLU  46   5.865 -16.207   7.572
  368    HB3  GLU  46           HB3      GLU  46   5.964 -14.486   7.928
  369    HG2  GLU  46           HG2      GLU  46   3.760 -14.441   8.789
  370    HG3  GLU  46           HG3      GLU  46   3.416 -16.053   8.182
  371    H    ILE  47           H        ILE  47   2.532 -14.174   6.275
  372    HA   ILE  47           HA       ILE  47   3.113 -11.360   5.765
  373    HB   ILE  47           HB       ILE  47   0.567 -12.813   5.322
  374   HG12  ILE  47          HG12      ILE  47   1.815 -11.544   3.075
  375   HG13  ILE  47          HG13      ILE  47   2.848 -12.745   3.826
  376   HG21  ILE  47          HG21      ILE  47  -0.058 -10.586   5.858
  377   HG22  ILE  47          HG22      ILE  47  -0.127 -10.727   4.103
  378   HG23  ILE  47          HG23      ILE  47   1.248  -9.934   4.870
  379   HD11  ILE  47          HD11      ILE  47   0.550 -14.142   3.642
  380   HD12  ILE  47          HD12      ILE  47   1.765 -14.136   2.363
  381   HD13  ILE  47          HD13      ILE  47   0.365 -13.065   2.264
  382    H    ARG  48           H        ARG  48   2.511  -9.787   7.051
  383    HA   ARG  48           HA       ARG  48   1.632 -10.390   9.736
  384    HB2  ARG  48           HB2      ARG  48   3.426  -8.679   8.731
  385    HB3  ARG  48           HB3      ARG  48   2.033  -7.625   8.721
  386    HG2  ARG  48           HG2      ARG  48   1.775  -7.749  11.045
  387    HG3  ARG  48           HG3      ARG  48   2.880  -9.116  11.179
  388    HD2  ARG  48           HD2      ARG  48   4.618  -7.446  10.172
  389    HD3  ARG  48           HD3      ARG  48   3.486  -6.219  10.739
  390    HE   ARG  48           HE       ARG  48   4.717  -8.234  12.510
  391   HH11  ARG  48          HH11      ARG  48   4.131  -4.388  13.506
  392   HH12  ARG  48          HH12      ARG  48   3.660  -4.930  11.931
  393   HH21  ARG  48          HH21      ARG  48   5.069  -5.841  14.991
  394   HH22  ARG  48          HH22      ARG  48   5.319  -7.500  14.558
  395    H    GLU  49           H        GLU  49   0.557  -8.649   6.879
  396    HA   GLU  49           HA       GLU  49  -2.210  -8.891   7.461
  397    HB2  GLU  49           HB2      GLU  49  -1.291  -6.858   8.877
  398    HB3  GLU  49           HB3      GLU  49  -1.336  -6.022   7.335
  399    HG2  GLU  49           HG2      GLU  49  -3.733  -6.548   7.148
  400    HG3  GLU  49           HG3      GLU  49  -3.667  -7.321   8.731
  401    H    CYS  50           H        CYS  50  -3.477  -8.083   5.712
  402    HA   CYS  50           HA       CYS  50  -2.102  -7.292   3.326
  403    HB2  CYS  50           HB2      CYS  50  -2.448  -9.657   3.029
  404    HB3  CYS  50           HB3      CYS  50  -4.137  -9.509   3.501
  405    HG   CYS  50           HG       CYS  50  -2.730  -8.328   0.613
  406    H    MET  51           H        MET  51  -3.347  -6.173   1.874
  407    HA   MET  51           HA       MET  51  -5.917  -5.156   2.689
  408    HB2  MET  51           HB2      MET  51  -4.285  -3.685   3.747
  409    HB3  MET  51           HB3      MET  51  -3.606  -3.362   2.178
  410    HG2  MET  51           HG2      MET  51  -5.577  -2.215   1.471
  411    HG3  MET  51           HG3      MET  51  -6.426  -2.689   2.942
  412    HE1  MET  51           HE1      MET  51  -4.138  -0.110   1.225
  413    HE2  MET  51           HE2      MET  51  -2.900  -1.063   2.045
  414    HE3  MET  51           HE3      MET  51  -3.218   0.596   2.554
  415    H    VAL  52           H        VAL  52  -7.202  -4.813   1.117
  416    HA   VAL  52           HA       VAL  52  -6.268  -4.355  -1.610
  417    HB   VAL  52           HB       VAL  52  -8.573  -6.066  -0.844
  418   HG11  VAL  52          HG11      VAL  52  -8.685  -6.648  -3.263
  419   HG12  VAL  52          HG12      VAL  52  -7.516  -5.358  -3.564
  420   HG13  VAL  52          HG13      VAL  52  -9.108  -4.970  -2.913
  421   HG21  VAL  52          HG21      VAL  52  -6.051  -6.886  -2.208
  422   HG22  VAL  52          HG22      VAL  52  -7.328  -7.945  -1.603
  423   HG23  VAL  52          HG23      VAL  52  -6.318  -7.037  -0.474
  424    H    MET  53           H        MET  53  -7.032  -2.627  -2.447
  425    HA   MET  53           HA       MET  53  -8.697  -0.816  -1.036
  426    HB2  MET  53           HB2      MET  53  -7.046  -0.761  -3.443
  427    HB3  MET  53           HB3      MET  53  -8.487   0.237  -3.574
  428    HG2  MET  53           HG2      MET  53  -6.403   0.401  -1.408
  429    HG3  MET  53           HG3      MET  53  -6.603   1.521  -2.753
  430    HE1  MET  53           HE1      MET  53  -7.698   3.482   0.527
  431    HE2  MET  53           HE2      MET  53  -6.424   3.272  -0.675
  432    HE3  MET  53           HE3      MET  53  -6.631   2.081   0.610
  433    H    ARG  54           H        ARG  54 -10.762  -0.990  -0.845
  434    HA   ARG  54           HA       ARG  54 -12.449  -1.438  -3.204
  435    HB2  ARG  54           HB2      ARG  54 -12.523  -2.930  -0.597
  436    HB3  ARG  54           HB3      ARG  54 -13.990  -2.725  -1.542
  437    HG2  ARG  54           HG2      ARG  54 -12.893  -3.833  -3.443
  438    HG3  ARG  54           HG3      ARG  54 -11.456  -4.079  -2.447
  439    HD2  ARG  54           HD2      ARG  54 -12.770  -5.409  -0.875
  440    HD3  ARG  54           HD3      ARG  54 -14.213  -5.148  -1.850
  441    HE   ARG  54           HE       ARG  54 -12.138  -6.320  -3.393
  442   HH11  ARG  54          HH11      ARG  54 -14.662  -8.785  -1.469
  443   HH12  ARG  54          HH12      ARG  54 -14.556  -7.127  -0.978
  444   HH21  ARG  54          HH21      ARG  54 -12.289  -8.497  -4.018
  445   HH22  ARG  54          HH22      ARG  54 -13.379  -9.558  -3.188
  446    H    ASP  55           H        ASP  55 -14.593  -0.501  -2.994
  447    HA   ASP  55           HA       ASP  55 -14.667   1.719  -1.172
  448    HB2  ASP  55           HB2      ASP  55 -15.697   1.208  -3.845
  449    HB3  ASP  55           HB3      ASP  55 -16.666   2.237  -2.834
  450    HA   PRO  56           HA       PRO  56 -17.742  -0.750   1.132
  451    HB2  PRO  56           HB2      PRO  56 -18.065   1.796   2.615
  452    HB3  PRO  56           HB3      PRO  56 -17.734   0.170   3.228
  453    HG2  PRO  56           HG2      PRO  56 -15.824   2.015   3.197
  454    HG3  PRO  56           HG3      PRO  56 -15.467   0.316   2.826
  455    HD2  PRO  56           HD2      PRO  56 -15.741   2.634   0.961
  456    HD3  PRO  56           HD3      PRO  56 -14.611   1.263   0.910
  457    H    THR  57           H        THR  57 -18.258   2.047  -0.766
  458    HA   THR  57           HA       THR  57 -21.029   2.402  -0.133
  459    HB   THR  57           HB       THR  57 -20.992   3.941  -2.165
  460    HG1  THR  57           HG1      THR  57 -18.388   2.959  -2.161
  461   HG21  THR  57          HG21      THR  57 -19.728   5.698  -0.949
  462   HG22  THR  57          HG22      THR  57 -19.150   4.463   0.170
  463   HG23  THR  57          HG23      THR  57 -20.872   4.832   0.076
  464    H    THR  58           H        THR  58 -19.206   1.086  -2.868
  465    HA   THR  58           HA       THR  58 -21.669  -0.221  -3.822
  466    HB   THR  58           HB       THR  58 -20.791  -0.054  -6.124
  467    HG1  THR  58           HG1      THR  58 -18.514   0.274  -5.187
  468   HG21  THR  58          HG21      THR  58 -21.023   2.436  -6.359
  469   HG22  THR  58          HG22      THR  58 -21.043   2.530  -4.594
  470   HG23  THR  58          HG23      THR  58 -22.321   1.661  -5.448
  471    H    LYS  59           H        LYS  59 -18.601  -0.707  -2.592
  472    HA   LYS  59           HA       LYS  59 -17.160  -2.407  -2.367
  473    HB2  LYS  59           HB2      LYS  59 -19.754  -3.878  -2.677
  474    HB3  LYS  59           HB3      LYS  59 -18.240  -4.755  -2.439
  475    HG2  LYS  59           HG2      LYS  59 -18.375  -4.363  -0.257
  476    HG3  LYS  59           HG3      LYS  59 -18.275  -2.631  -0.601
  477    HD2  LYS  59           HD2      LYS  59 -20.749  -2.636  -0.948
  478    HD3  LYS  59           HD3      LYS  59 -20.774  -4.306  -0.378
  479    HE2  LYS  59           HE2      LYS  59 -19.903  -3.643   1.763
  480    HE3  LYS  59           HE3      LYS  59 -19.670  -1.990   1.200
  481    HZ1  LYS  59           HZ1      LYS  59 -22.290  -3.358   1.493
  482    HZ2  LYS  59           HZ2      LYS  59 -22.062  -1.768   0.966
  483    HZ3  LYS  59           HZ3      LYS  59 -21.659  -2.198   2.552
  484    H    ARG  60           H        ARG  60 -16.709  -1.286  -4.492
  485    HA   ARG  60           HA       ARG  60 -16.393  -3.238  -6.677
  486    HB2  ARG  60           HB2      ARG  60 -16.078  -0.232  -6.635
  487    HB3  ARG  60           HB3      ARG  60 -15.718  -1.238  -8.028
  488    HG2  ARG  60           HG2      ARG  60 -18.037  -1.922  -8.172
  489    HG3  ARG  60           HG3      ARG  60 -18.413  -0.998  -6.712
  490    HD2  ARG  60           HD2      ARG  60 -17.899   1.065  -7.805
  491    HD3  ARG  60           HD3      ARG  60 -17.265   0.222  -9.216
  492    HE   ARG  60           HE       ARG  60 -19.778  -0.642  -9.206
  493   HH11  ARG  60          HH11      ARG  60 -19.953   3.363  -9.480
  494   HH12  ARG  60          HH12      ARG  60 -18.547   2.621  -8.794
  495   HH21  ARG  60          HH21      ARG  60 -21.607   0.351 -10.115
  496   HH22  ARG  60          HH22      ARG  60 -21.683   2.078 -10.226
  497    H    SER  61           H        SER  61 -14.436  -3.950  -7.304
  498    HA   SER  61           HA       SER  61 -12.096  -3.150  -5.734
  499    HB2  SER  61           HB2      SER  61 -12.507  -5.487  -7.620
  500    HB3  SER  61           HB3      SER  61 -11.045  -5.184  -6.682
  501    HG   SER  61           HG       SER  61 -12.142  -6.502  -5.385
  502    H    ARG  62           H        ARG  62 -10.325  -2.161  -6.624
  503    HA   ARG  62           HA       ARG  62 -10.632  -1.176  -9.354
  504    HB2  ARG  62           HB2      ARG  62  -9.010  -0.293  -6.997
  505    HB3  ARG  62           HB3      ARG  62  -8.587   0.258  -8.613
  506    HG2  ARG  62           HG2      ARG  62 -10.433   1.577  -8.805
  507    HG3  ARG  62           HG3      ARG  62 -11.427   0.518  -7.806
  508    HD2  ARG  62           HD2      ARG  62 -11.169   2.447  -6.519
  509    HD3  ARG  62           HD3      ARG  62  -9.989   1.327  -5.844
  510    HE   ARG  62           HE       ARG  62  -8.976   3.118  -7.882
  511   HH11  ARG  62          HH11      ARG  62  -8.196   3.739  -3.990
  512   HH12  ARG  62          HH12      ARG  62  -9.430   2.609  -4.437
  513   HH21  ARG  62          HH21      ARG  62  -7.364   4.594  -7.274
  514   HH22  ARG  62          HH22      ARG  62  -7.027   4.861  -5.596
  515    H    GLY  63           H        GLY  63  -9.033  -3.671  -7.809
  516    HA2  GLY  63           HA2      GLY  63  -7.773  -5.327  -8.874
  517    HA3  GLY  63           HA3      GLY  63  -7.466  -4.215 -10.194
  518    H    PHE  64           H        PHE  64  -6.842  -3.353  -6.835
  519    HA   PHE  64           HA       PHE  64  -4.053  -4.049  -6.986
  520    HB2  PHE  64           HB2      PHE  64  -3.083  -1.915  -6.946
  521    HB3  PHE  64           HB3      PHE  64  -4.261  -1.866  -8.242
  522    HD1  PHE  64           HD1      PHE  64  -5.928  -0.243  -8.270
  523    HD2  PHE  64           HD2      PHE  64  -3.688  -0.918  -4.744
  524    HE1  PHE  64           HE1      PHE  64  -6.894   1.803  -7.285
  525    HE2  PHE  64           HE2      PHE  64  -4.626   1.131  -3.732
  526    HZ   PHE  64           HZ       PHE  64  -6.241   2.492  -5.007
  527    H    GLY  65           H        GLY  65  -2.928  -3.944  -5.009
  528    HA2  GLY  65           HA2      GLY  65  -4.190  -3.000  -2.661
  529    HA3  GLY  65           HA3      GLY  65  -4.165  -4.751  -2.777
  530    H    PHE  66           H        PHE  66  -2.859  -4.384  -0.828
  531    HA   PHE  66           HA       PHE  66  -0.062  -4.320  -1.373
  532    HB2  PHE  66           HB2      PHE  66  -1.561  -3.004   0.829
  533    HB3  PHE  66           HB3      PHE  66   0.151  -3.219   0.844
  534    HD1  PHE  66           HD1      PHE  66  -2.632  -1.579  -0.885
  535    HD2  PHE  66           HD2      PHE  66   1.582  -1.695  -0.307
  536    HE1  PHE  66           HE1      PHE  66  -2.414   0.567  -2.078
  537    HE2  PHE  66           HE2      PHE  66   1.810   0.448  -1.499
  538    HZ   PHE  66           HZ       PHE  66  -0.190   1.580  -2.388
  539    H    VAL  67           H        VAL  67   1.144  -5.421   0.291
  540    HA   VAL  67           HA       VAL  67  -0.258  -7.184   2.115
  541    HB   VAL  67           HB       VAL  67   1.642  -8.287   0.012
  542   HG11  VAL  67          HG11      VAL  67   0.720 -10.474   1.372
  543   HG12  VAL  67          HG12      VAL  67   0.941  -9.298   2.671
  544   HG13  VAL  67          HG13      VAL  67   2.296  -9.720   1.622
  545   HG21  VAL  67          HG21      VAL  67  -0.138  -9.653  -0.764
  546   HG22  VAL  67          HG22      VAL  67  -0.780  -8.010  -0.649
  547   HG23  VAL  67          HG23      VAL  67  -1.166  -9.199   0.594
  548    H    THR  68           H        THR  68   0.701  -7.326   3.881
  549    HA   THR  68           HA       THR  68   3.292  -6.059   4.173
  550    HB   THR  68           HB       THR  68   1.483  -6.606   6.420
  551    HG1  THR  68           HG1      THR  68   0.500  -5.481   4.418
  552   HG21  THR  68          HG21      THR  68   2.772  -4.032   6.357
  553   HG22  THR  68          HG22      THR  68   3.949  -5.328   6.065
  554   HG23  THR  68          HG23      THR  68   2.961  -5.337   7.532
  555    H    PHE  69           H        PHE  69   4.804  -7.459   4.092
  556    HA   PHE  69           HA       PHE  69   4.604 -10.078   5.176
  557    HB2  PHE  69           HB2      PHE  69   6.598  -8.563   3.582
  558    HB3  PHE  69           HB3      PHE  69   7.098 -10.023   4.414
  559    HD1  PHE  69           HD1      PHE  69   6.066 -12.187   3.859
  560    HD2  PHE  69           HD2      PHE  69   5.198  -8.647   1.664
  561    HE1  PHE  69           HE1      PHE  69   5.122 -13.550   2.049
  562    HE2  PHE  69           HE2      PHE  69   4.257 -10.010  -0.159
  563    HZ   PHE  69           HZ       PHE  69   4.232 -12.467   0.046
  564    H    ALA  70           H        ALA  70   5.143 -10.653   7.188
  565    HA   ALA  70           HA       ALA  70   6.218  -8.801   9.007
  566    HB1  ALA  70           HB1      ALA  70   5.822 -11.705   9.578
  567    HB2  ALA  70           HB2      ALA  70   4.492 -10.548   9.545
  568    HB3  ALA  70           HB3      ALA  70   5.792 -10.364  10.723
  569    H    ASP  71           H        ASP  71   7.806 -10.394   6.847
  570    HA   ASP  71           HA       ASP  71  10.247 -10.524   8.388
  571    HB2  ASP  71           HB2      ASP  71   9.161 -12.729   7.549
  572    HB3  ASP  71           HB3      ASP  71   9.834 -12.261   6.022
  573    HA   PRO  72           HA       PRO  72  11.691  -7.807   5.095
  574    HB2  PRO  72           HB2      PRO  72  14.380  -8.286   5.977
  575    HB3  PRO  72           HB3      PRO  72  13.444  -6.819   6.053
  576    HG2  PRO  72           HG2      PRO  72  14.149  -8.195   8.268
  577    HG3  PRO  72           HG3      PRO  72  12.669  -7.221   8.161
  578    HD2  PRO  72           HD2      PRO  72  12.998 -10.179   7.935
  579    HD3  PRO  72           HD3      PRO  72  11.710  -9.231   8.710
  580    H    ALA  73           H        ALA  73  12.644 -10.996   5.704
  581    HA   ALA  73           HA       ALA  73  14.392 -11.293   3.459
  582    HB1  ALA  73           HB1      ALA  73  14.436 -13.672   4.012
  583    HB2  ALA  73           HB2      ALA  73  13.155 -13.408   5.194
  584    HB3  ALA  73           HB3      ALA  73  14.739 -12.670   5.431
  585    H    SER  74           H        SER  74  11.063 -11.756   4.118
  586    HA   SER  74           HA       SER  74  10.446 -13.341   1.828
  587    HB2  SER  74           HB2      SER  74   9.082 -13.084   4.012
  588    HB3  SER  74           HB3      SER  74   8.409 -11.653   3.231
  589    HG   SER  74           HG       SER  74   7.585 -12.920   1.625
  590    H    VAL  75           H        VAL  75  10.589  -9.969   2.499
  591    HA   VAL  75           HA       VAL  75   9.329  -9.023   0.149
  592    HB   VAL  75           HB       VAL  75  11.395  -7.489   1.715
  593   HG11  VAL  75          HG11      VAL  75   8.923  -6.564   0.242
  594   HG12  VAL  75          HG12      VAL  75  10.586  -6.409  -0.324
  595   HG13  VAL  75          HG13      VAL  75  10.055  -5.524   1.106
  596   HG21  VAL  75          HG21      VAL  75   8.492  -7.840   2.461
  597   HG22  VAL  75          HG22      VAL  75   9.583  -6.660   3.184
  598   HG23  VAL  75          HG23      VAL  75   9.894  -8.386   3.381
  599    H    ASP  76           H        ASP  76  12.523  -9.933   1.031
  600    HA   ASP  76           HA       ASP  76  13.891  -8.941  -1.232
  601    HB2  ASP  76           HB2      ASP  76  14.715  -9.737   1.139
  602    HB3  ASP  76           HB3      ASP  76  14.862 -11.280   0.328
  603    H    LYS  77           H        LYS  77  12.560 -11.980  -0.278
  604    HA   LYS  77           HA       LYS  77  13.300 -13.523  -2.492
  605    HB2  LYS  77           HB2      LYS  77  11.153 -13.915  -0.429
  606    HB3  LYS  77           HB3      LYS  77  11.509 -15.099  -1.670
  607    HG2  LYS  77           HG2      LYS  77  13.926 -14.981  -0.747
  608    HG3  LYS  77           HG3      LYS  77  13.149 -14.291   0.679
  609    HD2  LYS  77           HD2      LYS  77  11.744 -16.242   0.917
  610    HD3  LYS  77           HD3      LYS  77  12.363 -16.916  -0.589
  611    HE2  LYS  77           HE2      LYS  77  14.135 -16.308   1.762
  612    HE3  LYS  77           HE3      LYS  77  13.319 -17.858   1.563
  613    HZ1  LYS  77           HZ1      LYS  77  14.465 -18.187  -0.513
  614    HZ2  LYS  77           HZ2      LYS  77  15.599 -17.872   0.702
  615    HZ3  LYS  77           HZ3      LYS  77  15.193 -16.663  -0.409
  616    H    VAL  78           H        VAL  78  10.420 -11.666  -1.802
  617    HA   VAL  78           HA       VAL  78   9.040 -12.571  -4.154
  618    HB   VAL  78           HB       VAL  78   8.271 -10.478  -2.104
  619   HG11  VAL  78          HG11      VAL  78   6.059 -10.419  -3.092
  620   HG12  VAL  78          HG12      VAL  78   6.546 -11.578  -4.328
  621   HG13  VAL  78          HG13      VAL  78   7.255  -9.964  -4.306
  622   HG21  VAL  78          HG21      VAL  78   7.200 -13.254  -2.612
  623   HG22  VAL  78          HG22      VAL  78   6.642 -12.136  -1.367
  624   HG23  VAL  78          HG23      VAL  78   8.277 -12.794  -1.293
  625    H    LEU  79           H        LEU  79  10.960  -9.768  -3.222
  626    HA   LEU  79           HA       LEU  79  10.233  -8.054  -5.343
  627    HB2  LEU  79           HB2      LEU  79  11.662  -7.826  -3.069
  628    HB3  LEU  79           HB3      LEU  79  12.959  -7.941  -4.223
  629    HG   LEU  79           HG       LEU  79  10.781  -5.856  -4.174
  630   HD11  LEU  79          HD11      LEU  79  12.494  -4.305  -3.541
  631   HD12  LEU  79          HD12      LEU  79  13.732  -5.554  -3.681
  632   HD13  LEU  79          HD13      LEU  79  12.508  -5.665  -2.416
  633   HD21  LEU  79          HD21      LEU  79  12.252  -4.724  -5.911
  634   HD22  LEU  79          HD22      LEU  79  11.283  -6.097  -6.449
  635   HD23  LEU  79          HD23      LEU  79  13.010  -6.302  -6.137
  636    H    GLY  80           H        GLY  80  12.573 -10.651  -5.000
  637    HA2  GLY  80           HA2      GLY  80  13.999 -10.135  -7.387
  638    HA3  GLY  80           HA3      GLY  80  14.087 -11.599  -6.439
  639    H    GLN  81           H        GLN  81  10.978 -11.589  -6.795
  640    HA   GLN  81           HA       GLN  81  10.986 -13.123  -9.253
  641    HB2  GLN  81           HB2      GLN  81   9.081 -12.818  -6.947
  642    HB3  GLN  81           HB3      GLN  81   8.653 -13.679  -8.403
  643    HG2  GLN  81           HG2      GLN  81  11.166 -14.428  -7.040
  644    HG3  GLN  81           HG3      GLN  81   9.640 -14.908  -6.304
  645   HE21  GLN  81          HE21      GLN  81  11.706 -15.243  -9.090
  646   HE22  GLN  81          HE22      GLN  81  10.973 -16.678  -9.712
  647    HA   PRO  82           HA       PRO  82   9.118  -9.308 -11.015
  648    HB2  PRO  82           HB2      PRO  82   9.922 -10.262 -13.624
  649    HB3  PRO  82           HB3      PRO  82  10.531  -8.867 -12.728
  650    HG2  PRO  82           HG2      PRO  82  12.027 -11.088 -13.232
  651    HG3  PRO  82           HG3      PRO  82  12.284 -10.020 -11.840
  652    HD2  PRO  82           HD2      PRO  82  10.890 -12.663 -11.957
  653    HD3  PRO  82           HD3      PRO  82  11.979 -12.006 -10.716
  654    H    HIS  83           H        HIS  83   8.784 -12.605 -12.302
  655    HA   HIS  83           HA       HIS  83   6.280 -11.931 -13.627
  656    HB2  HIS  83           HB2      HIS  83   8.184 -13.502 -14.499
  657    HB3  HIS  83           HB3      HIS  83   7.414 -14.701 -13.469
  658    HD1  HIS  83           HD1      HIS  83   6.832 -12.645 -16.554
  659    HD2  HIS  83           HD2      HIS  83   4.990 -15.707 -14.432
  660    HE1  HIS  83           HE1      HIS  83   4.977 -13.467 -18.036
  661    HE2  HIS  83           HE2      HIS  83   3.875 -15.322 -16.734
  662    H    HIS  84           H        HIS  84   4.388 -12.115 -12.670
  663    HA   HIS  84           HA       HIS  84   3.906 -14.158 -10.642
  664    HB2  HIS  84           HB2      HIS  84   4.311 -11.510  -9.976
  665    HB3  HIS  84           HB3      HIS  84   2.557 -11.630 -10.059
  666    HD1  HIS  84           HD1      HIS  84   1.380 -12.986  -8.238
  667    HD2  HIS  84           HD2      HIS  84   5.525 -13.065  -7.945
  668    HE1  HIS  84           HE1      HIS  84   1.877 -14.022  -6.000
  669    HE2  HIS  84           HE2      HIS  84   4.391 -14.061  -5.845
  670    H    GLU  85           H        GLU  85   2.138 -15.240 -11.215
  671    HA   GLU  85           HA       GLU  85   0.221 -13.987 -12.945
  672    HB2  GLU  85           HB2      GLU  85   1.709 -16.102 -13.629
  673    HB3  GLU  85           HB3      GLU  85   0.388 -16.945 -12.832
  674    HG2  GLU  85           HG2      GLU  85  -1.210 -15.899 -14.341
  675    HG3  GLU  85           HG3      GLU  85   0.100 -15.017 -15.127
  676    H    LEU  86           H        LEU  86  -1.758 -13.969 -12.422
  677    HA   LEU  86           HA       LEU  86  -2.932 -15.598 -10.360
  678    HB2  LEU  86           HB2      LEU  86  -2.341 -13.656  -9.110
  679    HB3  LEU  86           HB3      LEU  86  -2.780 -12.601 -10.426
  680    HG   LEU  86           HG       LEU  86  -5.167 -13.474 -10.043
  681   HD11  LEU  86          HD11      LEU  86  -3.893 -14.111  -7.387
  682   HD12  LEU  86          HD12      LEU  86  -4.726 -15.228  -8.467
  683   HD13  LEU  86          HD13      LEU  86  -5.631 -13.955  -7.646
  684   HD21  LEU  86          HD21      LEU  86  -5.499 -11.715  -8.280
  685   HD22  LEU  86          HD22      LEU  86  -4.647 -11.192  -9.729
  686   HD23  LEU  86          HD23      LEU  86  -3.747 -11.528  -8.249
  687    H    ASP  87           H        ASP  87  -4.895 -16.143 -10.937
  688    HA   ASP  87           HA       ASP  87  -6.664 -16.684 -12.242
  689    HB2  ASP  87           HB2      ASP  87  -7.171 -14.492 -11.182
  690    HB3  ASP  87           HB3      ASP  87  -6.770 -13.739 -12.699
  691    H    SER  88           H        SER  88  -4.234 -16.783 -13.430
  692    HA   SER  88           HA       SER  88  -3.240 -17.345 -15.398
  693    HB2  SER  88           HB2      SER  88  -5.505 -18.259 -16.015
  694    HB3  SER  88           HB3      SER  88  -5.842 -16.724 -16.816
  695    HG   SER  88           HG       SER  88  -3.446 -17.896 -17.511
  696    H    LYS  89           H        LYS  89  -3.865 -14.357 -14.486
  697    HA   LYS  89           HA       LYS  89  -2.663 -13.188 -16.871
  698    HB2  LYS  89           HB2      LYS  89  -3.695 -10.969 -15.922
  699    HB3  LYS  89           HB3      LYS  89  -4.629 -12.023 -16.958
  700    HG2  LYS  89           HG2      LYS  89  -5.794 -12.926 -15.013
  701    HG3  LYS  89           HG3      LYS  89  -4.808 -11.918 -13.949
  702    HD2  LYS  89           HD2      LYS  89  -5.725  -9.909 -14.963
  703    HD3  LYS  89           HD3      LYS  89  -6.659 -10.884 -16.097
  704    HE2  LYS  89           HE2      LYS  89  -7.885 -11.873 -14.208
  705    HE3  LYS  89           HE3      LYS  89  -6.971 -10.853 -13.098
  706    HZ1  LYS  89           HZ1      LYS  89  -7.912  -8.903 -14.166
  707    HZ2  LYS  89           HZ2      LYS  89  -9.142  -9.912 -13.590
  708    HZ3  LYS  89           HZ3      LYS  89  -8.781  -9.878 -15.242
  709    H    THR  90           H        THR  90  -1.278 -11.563 -16.573
  710    HA   THR  90           HA       THR  90   0.544 -11.906 -14.367
  711    HB   THR  90           HB       THR  90   0.897  -9.863 -16.544
  712    HG1  THR  90           HG1      THR  90   1.509 -12.635 -16.786
  713   HG21  THR  90          HG21      THR  90   2.828 -11.630 -15.025
  714   HG22  THR  90          HG22      THR  90   2.601  -9.895 -14.804
  715   HG23  THR  90          HG23      THR  90   3.280 -10.511 -16.310
  716    H    ILE  91           H        ILE  91   0.602 -10.719 -12.580
  717    HA   ILE  91           HA       ILE  91  -0.675  -8.069 -12.570
  718    HB   ILE  91           HB       ILE  91  -1.101  -8.376 -10.175
  719   HG12  ILE  91          HG12      ILE  91  -0.395 -11.248 -10.435
  720   HG13  ILE  91          HG13      ILE  91   0.782 -10.099  -9.832
  721   HG21  ILE  91          HG21      ILE  91  -2.777  -8.960 -11.848
  722   HG22  ILE  91          HG22      ILE  91  -2.908  -9.979 -10.418
  723   HG23  ILE  91          HG23      ILE  91  -2.155 -10.611 -11.884
  724   HD11  ILE  91          HD11      ILE  91  -0.357  -9.785  -7.872
  725   HD12  ILE  91          HD12      ILE  91  -0.775 -11.464  -8.202
  726   HD13  ILE  91          HD13      ILE  91  -1.929 -10.171  -8.589
  727    H    ASP  92           H        ASP  92   0.343  -6.546 -10.736
  728    HA   ASP  92           HA       ASP  92   3.246  -6.799 -11.159
  729    HB2  ASP  92           HB2      ASP  92   1.893  -5.006 -12.396
  730    HB3  ASP  92           HB3      ASP  92   1.816  -4.188 -10.842
  731    HA   PRO  93           HA       PRO  93   3.088  -6.368  -6.569
  732    HB2  PRO  93           HB2      PRO  93   5.031  -8.487  -6.363
  733    HB3  PRO  93           HB3      PRO  93   3.348  -8.504  -5.823
  734    HG2  PRO  93           HG2      PRO  93   4.284 -10.056  -7.869
  735    HG3  PRO  93           HG3      PRO  93   2.598  -9.523  -7.721
  736    HD2  PRO  93           HD2      PRO  93   4.788  -8.388  -9.422
  737    HD3  PRO  93           HD3      PRO  93   3.078  -8.674  -9.823
  738    H    LYS  94           H        LYS  94   4.318  -4.749  -5.810
  739    HA   LYS  94           HA       LYS  94   7.206  -4.838  -6.054
  740    HB2  LYS  94           HB2      LYS  94   7.317  -2.460  -6.938
  741    HB3  LYS  94           HB3      LYS  94   6.879  -3.706  -8.091
  742    HG2  LYS  94           HG2      LYS  94   5.300  -2.202  -8.677
  743    HG3  LYS  94           HG3      LYS  94   4.422  -2.919  -7.326
  744    HD2  LYS  94           HD2      LYS  94   5.145  -1.153  -5.855
  745    HD3  LYS  94           HD3      LYS  94   6.188  -0.482  -7.112
  746    HE2  LYS  94           HE2      LYS  94   4.235   0.005  -8.487
  747    HE3  LYS  94           HE3      LYS  94   3.182  -0.690  -7.255
  748    HZ1  LYS  94           HZ1      LYS  94   3.316   1.763  -7.194
  749    HZ2  LYS  94           HZ2      LYS  94   4.957   1.645  -6.801
  750    HZ3  LYS  94           HZ3      LYS  94   3.789   1.035  -5.742
  751    H    VAL  95           H        VAL  95   8.315  -3.635  -4.532
  752    HA   VAL  95           HA       VAL  95   6.917  -3.055  -2.132
  753    HB   VAL  95           HB       VAL  95   9.734  -2.284  -2.624
  754   HG11  VAL  95          HG11      VAL  95   9.989  -2.856  -0.219
  755   HG12  VAL  95          HG12      VAL  95   8.249  -3.128  -0.151
  756   HG13  VAL  95          HG13      VAL  95   8.876  -1.521  -0.513
  757   HG21  VAL  95          HG21      VAL  95   9.156  -4.692  -3.320
  758   HG22  VAL  95          HG22      VAL  95   9.006  -4.994  -1.588
  759   HG23  VAL  95          HG23      VAL  95  10.540  -4.436  -2.260
  760    H    ALA  96           H        ALA  96   6.450  -1.176  -1.118
  761    HA   ALA  96           HA       ALA  96   6.131   1.153  -2.733
  762    HB1  ALA  96           HB1      ALA  96   4.853   2.041  -0.903
  763    HB2  ALA  96           HB2      ALA  96   5.458   0.780   0.173
  764    HB3  ALA  96           HB3      ALA  96   4.397   0.358  -1.171
  765    H    PHE  97           H        PHE  97   6.780   3.307  -2.109
  766    HA   PHE  97           HA       PHE  97   9.379   3.404  -0.764
  767    HB2  PHE  97           HB2      PHE  97   8.227   4.690  -3.164
  768    HB3  PHE  97           HB3      PHE  97   9.218   5.721  -2.151
  769    HD1  PHE  97           HD1      PHE  97  11.584   5.495  -2.110
  770    HD2  PHE  97           HD2      PHE  97   9.190   2.625  -4.150
  771    HE1  PHE  97           HE1      PHE  97  13.607   4.539  -3.134
  772    HE2  PHE  97           HE2      PHE  97  11.210   1.667  -5.177
  773    HZ   PHE  97           HZ       PHE  97  13.420   2.622  -4.668
  774    HA   PRO  98           HA       PRO  98   7.158   5.856   2.344
  775    HB2  PRO  98           HB2      PRO  98   9.796   6.639   3.380
  776    HB3  PRO  98           HB3      PRO  98   8.526   5.686   4.160
  777    HG2  PRO  98           HG2      PRO  98  10.799   4.535   3.381
  778    HG3  PRO  98           HG3      PRO  98   9.239   3.696   3.232
  779    HD2  PRO  98           HD2      PRO  98  10.788   5.153   1.116
  780    HD3  PRO  98           HD3      PRO  98  10.039   3.542   1.059
  781    H    ARG  99           H        ARG  99   7.244   8.112   3.293
  782    HA   ARG  99           HA       ARG  99   7.738  10.011   1.132
  783    HB2  ARG  99           HB2      ARG  99   5.924   9.879   3.461
  784    HB3  ARG  99           HB3      ARG  99   6.495  11.484   3.021
  785    HG2  ARG  99           HG2      ARG  99   5.581  11.292   0.829
  786    HG3  ARG  99           HG3      ARG  99   5.212   9.583   1.073
  787    HD2  ARG  99           HD2      ARG  99   4.032  11.657   2.880
  788    HD3  ARG  99           HD3      ARG  99   3.317  11.350   1.298
  789    HE   ARG  99           HE       ARG  99   3.628   8.889   2.547
  790   HH11  ARG  99          HH11      ARG  99   1.770  11.822   3.091
  791   HH12  ARG  99          HH12      ARG  99   0.478  10.990   3.892
  792   HH21  ARG  99          HH21      ARG  99   0.564   8.727   4.170
  793   HH22  ARG  99          HH22      ARG  99   1.920   7.822   3.585
  794    H    ARG 100           H        ARG 100   9.250   9.034   4.020
  795    HA   ARG 100           HA       ARG 100  10.561  11.627   4.431
  796    HB2  ARG 100           HB2      ARG 100   9.607   9.959   6.284
  797    HB3  ARG 100           HB3      ARG 100  11.209   9.256   6.121
  798    HG2  ARG 100           HG2      ARG 100  11.597  10.740   7.812
  799    HG3  ARG 100           HG3      ARG 100  11.977  11.760   6.424
  800    HD2  ARG 100           HD2      ARG 100   9.766  12.754   6.510
  801    HD3  ARG 100           HD3      ARG 100   9.305  11.676   7.827
  802    HE   ARG 100           HE       ARG 100  11.598  13.132   8.568
  803   HH11  ARG 100          HH11      ARG 100   8.076  14.966   9.180
  804   HH12  ARG 100          HH12      ARG 100   8.158  13.645   8.064
  805   HH21  ARG 100          HH21      ARG 100  11.463  14.861  10.027
  806   HH22  ARG 100          HH22      ARG 100   9.945  15.653  10.290
  807    H    ALA 101           H        ALA 101  12.513  12.028   3.620
  808    HA   ALA 101           HA       ALA 101  13.955   9.963   2.247
  809    HB1  ALA 101           HB1      ALA 101  14.614  11.578   0.864
  810    HB2  ALA 101           HB2      ALA 101  15.205  12.567   2.195
  811    HB3  ALA 101           HB3      ALA 101  13.503  12.636   1.738
  812    H    GLN 102           H        GLN 102  16.404  10.102   2.294
  813    HA   GLN 102           HA       GLN 102  17.385  10.317   5.069
  814    HB2  GLN 102           HB2      GLN 102  17.930   8.236   2.964
  815    HB3  GLN 102           HB3      GLN 102  19.048   8.496   4.294
  816    HG2  GLN 102           HG2      GLN 102  17.262   7.992   5.888
  817    HG3  GLN 102           HG3      GLN 102  16.149   7.721   4.547
  818   HE21  GLN 102          HE21      GLN 102  18.912   6.507   6.277
  819   HE22  GLN 102          HE22      GLN 102  18.876   4.909   5.620
  820    HA   PRO 103           HA       PRO 103  20.547  12.980   3.377
  821    HB2  PRO 103           HB2      PRO 103  22.523  12.782   5.205
  822    HB3  PRO 103           HB3      PRO 103  20.989  13.588   5.557
  823    HG2  PRO 103           HG2      PRO 103  21.917  10.879   6.364
  824    HG3  PRO 103           HG3      PRO 103  20.947  12.055   7.270
  825    HD2  PRO 103           HD2      PRO 103  19.917   9.861   5.946
  826    HD3  PRO 103           HD3      PRO 103  18.993  11.312   6.377
  827    H    LYS 104           H        LYS 104  23.027  13.042   2.916
  828    HA   LYS 104           HA       LYS 104  23.655  10.736   1.285
  829    HB2  LYS 104           HB2      LYS 104  24.939  13.431   1.670
  830    HB3  LYS 104           HB3      LYS 104  25.715  12.167   0.725
  831    HG2  LYS 104           HG2      LYS 104  23.831  12.112  -0.800
  832    HG3  LYS 104           HG3      LYS 104  22.988  13.321   0.173
  833    HD2  LYS 104           HD2      LYS 104  24.730  14.948  -0.298
  834    HD3  LYS 104           HD3      LYS 104  25.640  13.739  -1.207
  835    HE2  LYS 104           HE2      LYS 104  23.850  13.582  -2.837
  836    HE3  LYS 104           HE3      LYS 104  22.877  14.721  -1.908
  837    HZ1  LYS 104           HZ1      LYS 104  24.018  15.748  -3.809
  838    HZ2  LYS 104           HZ2      LYS 104  25.512  15.355  -3.119
  839    HZ3  LYS 104           HZ3      LYS 104  24.478  16.438  -2.334
  840    H    MET 105           H        MET 105  25.312   9.316   1.522
  841    HA   MET 105           HA       MET 105  26.578   9.183   4.156
  842    HB2  MET 105           HB2      MET 105  26.280   7.168   1.926
  843    HB3  MET 105           HB3      MET 105  27.244   6.870   3.364
  844    HG2  MET 105           HG2      MET 105  24.326   7.573   3.458
  845    HG3  MET 105           HG3      MET 105  24.922   5.916   3.373
  846    HE1  MET 105           HE1      MET 105  23.851   5.941   7.064
  847    HE2  MET 105           HE2      MET 105  23.635   5.264   5.450
  848    HE3  MET 105           HE3      MET 105  23.003   6.867   5.827
  849    H    VAL 106           H        VAL 106  28.720   9.388   4.497
  850    HA   VAL 106           HA       VAL 106  30.433   9.857   2.152
  851    HB   VAL 106           HB       VAL 106  30.906  10.918   4.957
  852   HG11  VAL 106          HG11      VAL 106  32.250  11.609   2.342
  853   HG12  VAL 106          HG12      VAL 106  32.958  10.668   3.655
  854   HG13  VAL 106          HG13      VAL 106  32.573  12.372   3.899
  855   HG21  VAL 106          HG21      VAL 106  28.893  11.918   3.884
  856   HG22  VAL 106          HG22      VAL 106  29.925  12.474   2.566
  857   HG23  VAL 106          HG23      VAL 106  30.180  13.081   4.202
  858    H    THR 107           H        THR 107  30.676   8.749   5.542
  859    HA   THR 107           HA       THR 107  32.774   6.916   4.784
  860    HB   THR 107           HB       THR 107  31.923   7.450   7.618
  861    HG1  THR 107           HG1      THR 107  32.851   9.292   5.946
  862   HG21  THR 107          HG21      THR 107  34.261   6.923   8.127
  863   HG22  THR 107          HG22      THR 107  34.602   6.732   6.407
  864   HG23  THR 107          HG23      THR 107  33.512   5.609   7.220
  865    H    ARG 108           H        ARG 108  31.706   5.210   3.897
  866    HA   ARG 108           HA       ARG 108  29.482   3.977   5.335
  867    HB2  ARG 108           HB2      ARG 108  30.608   3.606   2.571
  868    HB3  ARG 108           HB3      ARG 108  29.450   2.473   3.255
  869    HG2  ARG 108           HG2      ARG 108  27.845   4.303   3.546
  870    HG3  ARG 108           HG3      ARG 108  29.005   5.420   2.825
  871    HD2  ARG 108           HD2      ARG 108  28.906   4.283   0.730
  872    HD3  ARG 108           HD3      ARG 108  27.964   2.964   1.426
  873    HE   ARG 108           HE       ARG 108  26.315   4.969   1.866
  874   HH11  ARG 108          HH11      ARG 108  28.172   4.323  -1.045
  875   HH12  ARG 108          HH12      ARG 108  27.011   5.075  -2.088
  876   HH21  ARG 108          HH21      ARG 108  25.112   5.992  -1.223
  877   HH22  ARG 108          HH22      ARG 108  24.812   5.945   0.483
  878    H    THR 109           H        THR 109  29.439   1.848   5.990
  879    HA   THR 109           HA       THR 109  32.052   0.700   6.628
  880    HB   THR 109           HB       THR 109  30.624  -0.875   8.063
  881    HG1  THR 109           HG1      THR 109  28.687   0.604   6.872
  882   HG21  THR 109          HG21      THR 109  30.664   2.084   8.668
  883   HG22  THR 109          HG22      THR 109  31.930   0.916   9.049
  884   HG23  THR 109          HG23      THR 109  30.362   0.812   9.851
  885    H    LYS 110           H        LYS 110  32.614  -1.419   6.148
  886    HA   LYS 110           HA       LYS 110  31.077  -2.677   4.032
  887    HB2  LYS 110           HB2      LYS 110  34.012  -2.596   4.605
  888    HB3  LYS 110           HB3      LYS 110  33.339  -3.898   3.634
  889    HG2  LYS 110           HG2      LYS 110  32.407  -2.206   2.087
  890    HG3  LYS 110           HG3      LYS 110  33.216  -0.952   3.030
  891    HD2  LYS 110           HD2      LYS 110  35.379  -1.955   2.542
  892    HD3  LYS 110           HD3      LYS 110  34.590  -3.259   1.651
  893    HE2  LYS 110           HE2      LYS 110  33.749  -1.672   0.022
  894    HE3  LYS 110           HE3      LYS 110  34.441  -0.332   0.936
  895    HZ1  LYS 110           HZ1      LYS 110  35.958  -2.515  -0.390
  896    HZ2  LYS 110           HZ2      LYS 110  36.646  -1.277   0.535
  897    HZ3  LYS 110           HZ3      LYS 110  35.854  -0.909  -0.914
  898    H    LYS 111           H        LYS 111  32.910  -3.355   6.977
  899    HA   LYS 111           HA       LYS 111  32.245  -6.118   7.041
  900    HB2  LYS 111           HB2      LYS 111  33.556  -4.282   9.033
  901    HB3  LYS 111           HB3      LYS 111  33.231  -5.973   9.386
  902    HG2  LYS 111           HG2      LYS 111  34.659  -6.659   7.550
  903    HG3  LYS 111           HG3      LYS 111  34.938  -4.972   7.113
  904    HD2  LYS 111           HD2      LYS 111  35.935  -4.613   9.361
  905    HD3  LYS 111           HD3      LYS 111  35.757  -6.339   9.676
  906    HE2  LYS 111           HE2      LYS 111  37.278  -5.276   7.310
  907    HE3  LYS 111           HE3      LYS 111  38.037  -5.540   8.879
  908    HZ1  LYS 111           HZ1      LYS 111  37.416  -7.868   8.753
  909    HZ2  LYS 111           HZ2      LYS 111  38.339  -7.434   7.405
  910    HZ3  LYS 111           HZ3      LYS 111  36.664  -7.618   7.259
  Start of MODEL    4
    1    H1   MET  -3           H1       MET  -3  21.279  13.808  47.502
    2    H2   MET  -3           H2       MET  -3  21.836  12.890  46.196
    3    H3   MET  -3           H3       MET  -3  20.880  12.168  47.390
    4    HA   MET  -3           HA       MET  -3  20.006  14.307  45.538
    5    HB2  MET  -3           HB2      MET  -3  19.530  11.329  45.577
    6    HB3  MET  -3           HB3      MET  -3  18.469  12.434  44.715
    7    HG2  MET  -3           HG2      MET  -3  20.369  13.195  43.368
    8    HG3  MET  -3           HG3      MET  -3  21.415  12.061  44.220
    9    HE1  MET  -3           HE1      MET  -3  21.039  10.516  40.614
   10    HE2  MET  -3           HE2      MET  -3  22.184  11.071  41.836
   11    HE3  MET  -3           HE3      MET  -3  21.112  12.225  41.043
   12    H    HIS  -2           H        HIS  -2  18.023  15.165  45.897
   13    HA   HIS  -2           HA       HIS  -2  16.780  14.540  48.475
   14    HB2  HIS  -2           HB2      HIS  -2  15.572  16.731  48.130
   15    HB3  HIS  -2           HB3      HIS  -2  17.317  16.857  48.291
   16    HD1  HIS  -2           HD1      HIS  -2  14.531  17.716  46.070
   17    HD2  HIS  -2           HD2      HIS  -2  18.664  17.399  45.773
   18    HE1  HIS  -2           HE1      HIS  -2  15.148  18.935  43.960
   19    HE2  HIS  -2           HE2      HIS  -2  17.655  18.732  43.799
   20    H    HIS  -1           H        HIS  -1  14.495  14.366  48.691
   21    HA   HIS  -1           HA       HIS  -1  13.218  13.183  46.323
   22    HB2  HIS  -1           HB2      HIS  -1  13.456  12.276  48.961
   23    HB3  HIS  -1           HB3      HIS  -1  11.778  12.787  48.806
   24    HD1  HIS  -1           HD1      HIS  -1  10.276  11.446  47.185
   25    HD2  HIS  -1           HD2      HIS  -1  14.171  10.027  47.458
   26    HE1  HIS  -1           HE1      HIS  -1  10.244   9.182  46.094
   27    HE2  HIS  -1           HE2      HIS  -1  12.613   8.340  46.271
   28    H    HIS   0           H        HIS   0  11.345  13.951  45.512
   29    HA   HIS   0           HA       HIS   0   9.949  16.096  46.952
   30    HB2  HIS   0           HB2      HIS   0   9.607  17.237  44.694
   31    HB3  HIS   0           HB3      HIS   0  11.213  17.354  45.397
   32    HD1  HIS   0           HD1      HIS   0   9.358  15.429  42.706
   33    HD2  HIS   0           HD2      HIS   0  13.232  16.486  43.772
   34    HE1  HIS   0           HE1      HIS   0  10.807  14.701  40.784
   35    HE2  HIS   0           HE2      HIS   0  13.148  15.351  41.451
   36    H    HIS   1           H        HIS   1   7.774  16.060  46.854
   37    HA   HIS   1           HA       HIS   1   6.535  13.860  45.338
   38    HB2  HIS   1           HB2      HIS   1   6.441  14.181  47.989
   39    HB3  HIS   1           HB3      HIS   1   5.086  15.218  47.559
   40    HD1  HIS   1           HD1      HIS   1   6.015  11.721  48.061
   41    HD2  HIS   1           HD2      HIS   1   2.972  13.801  46.142
   42    HE1  HIS   1           HE1      HIS   1   4.193  10.034  47.666
   43    HE2  HIS   1           HE2      HIS   1   2.360  11.314  46.503
   44    H    HIS   2           H        HIS   2   4.904  14.248  43.934
   45    HA   HIS   2           HA       HIS   2   3.826  16.979  43.742
   46    HB2  HIS   2           HB2      HIS   2   5.679  16.171  41.993
   47    HB3  HIS   2           HB3      HIS   2   4.268  15.461  41.216
   48    HD1  HIS   2           HD1      HIS   2   2.271  17.266  40.714
   49    HD2  HIS   2           HD2      HIS   2   6.078  18.787  41.397
   50    HE1  HIS   2           HE1      HIS   2   2.233  19.608  39.800
   51    HE2  HIS   2           HE2      HIS   2   4.547  20.510  40.223
   52    H    HIS   3           H        HIS   3   1.714  17.156  42.947
   53    HA   HIS   3           HA       HIS   3   0.149  14.678  43.109
   54    HB2  HIS   3           HB2      HIS   3  -0.565  17.581  43.482
   55    HB3  HIS   3           HB3      HIS   3  -1.799  16.342  43.283
   56    HD1  HIS   3           HD1      HIS   3  -2.018  14.577  45.209
   57    HD2  HIS   3           HD2      HIS   3   0.622  17.692  45.983
   58    HE1  HIS   3           HE1      HIS   3  -1.583  14.491  47.685
   59    HE2  HIS   3           HE2      HIS   3   0.018  16.383  48.132
   60    H    SER   4           H        SER   4  -0.873  13.852  41.412
   61    HA   SER   4           HA       SER   4  -0.699  15.237  38.837
   62    HB2  SER   4           HB2      SER   4   0.121  12.874  39.093
   63    HB3  SER   4           HB3      SER   4  -1.547  12.383  39.388
   64    HG   SER   4           HG       SER   4  -0.347  13.308  37.026
   65    H    THR   5           H        THR   5  -2.431  15.973  37.737
   66    HA   THR   5           HA       THR   5  -5.103  15.294  38.743
   67    HB   THR   5           HB       THR   5  -4.707  17.491  39.594
   68    HG1  THR   5           HG1      THR   5  -6.656  16.961  37.921
   69   HG21  THR   5          HG21      THR   5  -4.147  19.431  38.206
   70   HG22  THR   5          HG22      THR   5  -4.001  18.386  36.792
   71   HG23  THR   5          HG23      THR   5  -2.873  18.214  38.136
   72    H    SER   6           H        SER   6  -3.345  16.683  35.970
   73    HA   SER   6           HA       SER   6  -5.473  15.802  34.160
   74    HB2  SER   6           HB2      SER   6  -3.050  17.555  33.683
   75    HB3  SER   6           HB3      SER   6  -4.240  17.133  32.450
   76    HG   SER   6           HG       SER   6  -5.802  18.052  34.064
   77    H    VAL   7           H        VAL   7  -5.280  14.107  32.841
   78    HA   VAL   7           HA       VAL   7  -2.782  12.569  32.888
   79    HB   VAL   7           HB       VAL   7  -5.418  11.634  31.729
   80   HG11  VAL   7          HG11      VAL   7  -3.470  10.307  31.105
   81   HG12  VAL   7          HG12      VAL   7  -4.522   9.394  32.186
   82   HG13  VAL   7          HG13      VAL   7  -3.038  10.118  32.804
   83   HG21  VAL   7          HG21      VAL   7  -5.835  12.278  34.047
   84   HG22  VAL   7          HG22      VAL   7  -4.473  11.290  34.575
   85   HG23  VAL   7          HG23      VAL   7  -5.892  10.525  33.860
   86    H    ASP   8           H        ASP   8  -1.433  12.639  31.225
   87    HA   ASP   8           HA       ASP   8  -2.216  13.898  28.721
   88    HB2  ASP   8           HB2      ASP   8   0.440  12.983  29.828
   89    HB3  ASP   8           HB3      ASP   8   0.256  13.590  28.185
   90    H    LEU   9           H        LEU   9  -2.318  12.918  26.745
   91    HA   LEU   9           HA       LEU   9  -2.513  10.017  26.733
   92    HB2  LEU   9           HB2      LEU   9  -3.373  12.198  24.878
   93    HB3  LEU   9           HB3      LEU   9  -3.221  10.566  24.261
   94    HG   LEU   9           HG       LEU   9  -4.928  11.181  26.665
   95   HD11  LEU   9          HD11      LEU   9  -6.836  11.269  25.101
   96   HD12  LEU   9          HD12      LEU   9  -5.694  11.277  23.756
   97   HD13  LEU   9          HD13      LEU   9  -5.718  12.618  24.900
   98   HD21  LEU   9          HD21      LEU   9  -4.442   8.835  26.337
   99   HD22  LEU   9          HD22      LEU   9  -4.892   8.945  24.636
  100   HD23  LEU   9          HD23      LEU   9  -6.120   9.144  25.885
  101    H    GLY  10           H        GLY  10  -1.877   9.137  24.349
  102    HA2  GLY  10           HA2      GLY  10  -0.032   9.480  22.663
  103    HA3  GLY  10           HA3      GLY  10   1.006   9.733  24.061
  104    H    THR  11           H        THR  11  -1.237   7.348  22.669
  105    HA   THR  11           HA       THR  11   0.591   5.206  23.556
  106    HB   THR  11           HB       THR  11  -1.331   3.736  23.956
  107    HG1  THR  11           HG1      THR  11  -3.450   4.665  23.917
  108   HG21  THR  11          HG21      THR  11  -1.445   6.379  25.401
  109   HG22  THR  11          HG22      THR  11  -0.539   4.939  25.878
  110   HG23  THR  11          HG23      THR  11  -2.302   4.930  25.933
  111    H    GLU  12           H        GLU  12  -1.290   6.619  21.086
  112    HA   GLU  12           HA       GLU  12  -1.147   4.317  19.298
  113    HB2  GLU  12           HB2      GLU  12  -2.262   6.992  18.547
  114    HB3  GLU  12           HB3      GLU  12  -2.716   5.408  17.934
  115    HG2  GLU  12           HG2      GLU  12  -3.754   4.916  20.119
  116    HG3  GLU  12           HG3      GLU  12  -3.342   6.552  20.637
  117    H    ASN  13           H        ASN  13  -0.097   7.607  19.587
  118    HA   ASN  13           HA       ASN  13   1.478   7.639  17.183
  119    HB2  ASN  13           HB2      ASN  13   0.255   9.587  18.417
  120    HB3  ASN  13           HB3      ASN  13   1.710   9.661  19.389
  121   HD21  ASN  13          HD21      ASN  13   0.343  11.383  17.469
  122   HD22  ASN  13          HD22      ASN  13   1.553  11.825  16.356
  123    H    LEU  14           H        LEU  14   2.245   5.517  18.914
  124    HA   LEU  14           HA       LEU  14   4.697   6.241  20.267
  125    HB2  LEU  14           HB2      LEU  14   2.930   4.374  20.840
  126    HB3  LEU  14           HB3      LEU  14   3.877   3.417  19.722
  127    HG   LEU  14           HG       LEU  14   5.902   4.004  21.197
  128   HD11  LEU  14          HD11      LEU  14   4.891   5.824  22.472
  129   HD12  LEU  14          HD12      LEU  14   5.383   4.511  23.540
  130   HD13  LEU  14          HD13      LEU  14   3.683   4.713  23.118
  131   HD21  LEU  14          HD21      LEU  14   3.827   2.353  22.598
  132   HD22  LEU  14          HD22      LEU  14   5.571   2.102  22.515
  133   HD23  LEU  14          HD23      LEU  14   4.569   1.819  21.094
  134    H    TYR  15           H        TYR  15   6.770   5.208  19.789
  135    HA   TYR  15           HA       TYR  15   7.347   5.322  16.946
  136    HB2  TYR  15           HB2      TYR  15   9.021   5.257  19.437
  137    HB3  TYR  15           HB3      TYR  15   9.753   5.001  17.857
  138    HD1  TYR  15           HD1      TYR  15   9.912   6.812  16.251
  139    HD2  TYR  15           HD2      TYR  15   8.117   7.434  20.058
  140    HE1  TYR  15           HE1      TYR  15  10.039   9.242  15.907
  141    HE2  TYR  15           HE2      TYR  15   8.241   9.867  19.725
  142    HH   TYR  15           HH       TYR  15   8.946  11.276  16.709
  143    H    PHE  16           H        PHE  16   6.686   2.801  19.152
  144    HA   PHE  16           HA       PHE  16   8.405   0.827  18.039
  145    HB2  PHE  16           HB2      PHE  16   6.180   0.788  20.029
  146    HB3  PHE  16           HB3      PHE  16   6.791  -0.725  19.378
  147    HD1  PHE  16           HD1      PHE  16   7.640   2.248  21.374
  148    HD2  PHE  16           HD2      PHE  16   8.913  -1.580  20.017
  149    HE1  PHE  16           HE1      PHE  16   9.485   2.288  23.001
  150    HE2  PHE  16           HE2      PHE  16  10.759  -1.547  21.643
  151    HZ   PHE  16           HZ       PHE  16  11.047   0.390  23.137
  152    H    GLN  17           H        GLN  17   5.706   2.243  16.760
  153    HA   GLN  17           HA       GLN  17   4.495  -0.124  15.593
  154    HB2  GLN  17           HB2      GLN  17   3.917   2.826  15.348
  155    HB3  GLN  17           HB3      GLN  17   3.088   1.624  14.370
  156    HG2  GLN  17           HG2      GLN  17   3.120   1.462  17.366
  157    HG3  GLN  17           HG3      GLN  17   1.942   2.445  16.505
  158   HE21  GLN  17          HE21      GLN  17   0.210   1.237  17.211
  159   HE22  GLN  17          HE22      GLN  17  -0.117  -0.360  16.641
  160    H    SER  18           H        SER  18   4.844  -0.924  13.616
  161    HA   SER  18           HA       SER  18   6.981   0.213  12.001
  162    HB2  SER  18           HB2      SER  18   5.453  -2.384  11.712
  163    HB3  SER  18           HB3      SER  18   6.850  -1.910  10.744
  164    HG   SER  18           HG       SER  18   7.595  -1.621  13.226
  165    H    ASN  19           H        ASN  19   6.811   0.787   9.842
  166    HA   ASN  19           HA       ASN  19   4.092   1.066   8.749
  167    HB2  ASN  19           HB2      ASN  19   5.353   3.213   9.702
  168    HB3  ASN  19           HB3      ASN  19   6.119   3.168   8.124
  169   HD21  ASN  19          HD21      ASN  19   4.338   5.002   9.454
  170   HD22  ASN  19          HD22      ASN  19   3.026   5.205   8.384
  171    H    ALA  20           H        ALA  20   7.570   1.007   8.029
  172    HA   ALA  20           HA       ALA  20   7.208   0.581   5.203
  173    HB1  ALA  20           HB1      ALA  20   9.693   0.377   6.901
  174    HB2  ALA  20           HB2      ALA  20   9.133   1.818   6.051
  175    HB3  ALA  20           HB3      ALA  20   9.641   0.396   5.138
  176    H    GLY  21           H        GLY  21   7.845  -1.293   4.027
  177    HA2  GLY  21           HA2      GLY  21   8.712  -3.598   4.113
  178    HA3  GLY  21           HA3      GLY  21   7.811  -3.791   5.607
  179    H    LYS  22           H        LYS  22   5.841  -1.986   3.720
  180    HA   LYS  22           HA       LYS  22   4.149  -4.209   3.064
  181    HB2  LYS  22           HB2      LYS  22   3.928  -1.247   3.003
  182    HB3  LYS  22           HB3      LYS  22   2.836  -2.172   1.980
  183    HG2  LYS  22           HG2      LYS  22   1.716  -3.069   3.742
  184    HG3  LYS  22           HG3      LYS  22   3.119  -2.982   4.808
  185    HD2  LYS  22           HD2      LYS  22   2.885  -0.565   4.948
  186    HD3  LYS  22           HD3      LYS  22   1.488  -0.632   3.868
  187    HE2  LYS  22           HE2      LYS  22   0.243  -1.917   5.496
  188    HE3  LYS  22           HE3      LYS  22   1.651  -1.997   6.552
  189    HZ1  LYS  22           HZ1      LYS  22   1.555   0.409   6.794
  190    HZ2  LYS  22           HZ2      LYS  22   0.109  -0.310   7.298
  191    HZ3  LYS  22           HZ3      LYS  22   0.187   0.473   5.801
  192    H    MET  23           H        MET  23   3.381  -4.786   1.082
  193    HA   MET  23           HA       MET  23   4.912  -3.913  -1.238
  194    HB2  MET  23           HB2      MET  23   4.248  -6.591  -0.198
  195    HB3  MET  23           HB3      MET  23   4.023  -6.379  -1.920
  196    HG2  MET  23           HG2      MET  23   6.428  -5.351  -1.807
  197    HG3  MET  23           HG3      MET  23   6.524  -6.273  -0.309
  198    HE1  MET  23           HE1      MET  23   5.593  -6.509  -4.110
  199    HE2  MET  23           HE2      MET  23   6.678  -7.815  -4.584
  200    HE3  MET  23           HE3      MET  23   7.337  -6.314  -3.936
  201    H    PHE  24           H        PHE  24   3.822  -3.166  -2.802
  202    HA   PHE  24           HA       PHE  24   0.950  -2.907  -2.758
  203    HB2  PHE  24           HB2      PHE  24   2.382  -0.903  -3.005
  204    HB3  PHE  24           HB3      PHE  24   3.097  -1.576  -4.455
  205    HD1  PHE  24           HD1      PHE  24  -0.540  -1.917  -4.016
  206    HD2  PHE  24           HD2      PHE  24   2.594   0.502  -5.593
  207    HE1  PHE  24           HE1      PHE  24  -2.167  -0.675  -5.370
  208    HE2  PHE  24           HE2      PHE  24   0.961   1.734  -6.954
  209    HZ   PHE  24           HZ       PHE  24  -1.424   1.147  -6.842
  210    H    ILE  25           H        ILE  25  -0.006  -4.598  -3.681
  211    HA   ILE  25           HA       ILE  25   1.102  -5.946  -5.995
  212    HB   ILE  25           HB       ILE  25  -1.387  -6.814  -4.737
  213   HG12  ILE  25          HG12      ILE  25   0.054  -6.211  -2.804
  214   HG13  ILE  25          HG13      ILE  25  -0.347  -7.906  -2.860
  215   HG21  ILE  25          HG21      ILE  25  -0.661  -8.116  -6.563
  216   HG22  ILE  25          HG22      ILE  25  -0.355  -9.079  -5.119
  217   HG23  ILE  25          HG23      ILE  25   0.973  -8.239  -5.915
  218   HD11  ILE  25          HD11      ILE  25   1.886  -8.436  -3.663
  219   HD12  ILE  25          HD12      ILE  25   1.968  -7.505  -2.167
  220   HD13  ILE  25          HD13      ILE  25   2.284  -6.718  -3.713
  221    H    GLY  26           H        GLY  26   0.550  -5.140  -7.871
  222    HA2  GLY  26           HA2      GLY  26  -2.027  -3.900  -8.229
  223    HA3  GLY  26           HA3      GLY  26  -0.653  -3.596  -9.232
  224    H    GLY  27           H        GLY  27  -3.215  -4.062 -10.118
  225    HA2  GLY  27           HA2      GLY  27  -4.199  -5.082 -11.919
  226    HA3  GLY  27           HA3      GLY  27  -2.725  -5.998 -12.137
  227    H    LEU  28           H        LEU  28  -4.529  -6.213  -9.120
  228    HA   LEU  28           HA       LEU  28  -4.661  -8.988  -9.140
  229    HB2  LEU  28           HB2      LEU  28  -6.467  -7.078  -7.638
  230    HB3  LEU  28           HB3      LEU  28  -6.203  -8.763  -7.248
  231    HG   LEU  28           HG       LEU  28  -3.929  -6.789  -7.215
  232   HD11  LEU  28          HD11      LEU  28  -4.325  -6.439  -4.853
  233   HD12  LEU  28          HD12      LEU  28  -5.759  -7.463  -4.914
  234   HD13  LEU  28          HD13      LEU  28  -5.737  -5.927  -5.779
  235   HD21  LEU  28          HD21      LEU  28  -2.826  -8.372  -5.879
  236   HD22  LEU  28          HD22      LEU  28  -3.613  -9.338  -7.125
  237   HD23  LEU  28          HD23      LEU  28  -4.315  -9.236  -5.512
  238    H    SER  29           H        SER  29  -6.915 -10.179  -8.891
  239    HA   SER  29           HA       SER  29  -8.434  -9.592 -11.288
  240    HB2  SER  29           HB2      SER  29  -7.251 -11.854 -10.849
  241    HB3  SER  29           HB3      SER  29  -8.553 -12.152  -9.698
  242    HG   SER  29           HG       SER  29  -9.472 -12.894 -11.462
  243    H    TRP  30           H        TRP  30 -10.707 -10.478 -11.047
  244    HA   TRP  30           HA       TRP  30 -12.167  -8.846  -9.280
  245    HB2  TRP  30           HB2      TRP  30 -14.103  -9.808 -10.432
  246    HB3  TRP  30           HB3      TRP  30 -12.887  -9.312 -11.583
  247    HD1  TRP  30           HD1      TRP  30 -11.067 -11.793 -11.802
  248    HE1  TRP  30           HE1      TRP  30 -11.907 -14.037 -12.685
  249    HE3  TRP  30           HE3      TRP  30 -16.101 -11.162 -11.056
  250    HZ2  TRP  30           HZ2      TRP  30 -14.323 -15.366 -13.058
  251    HZ3  TRP  30           HZ3      TRP  30 -17.608 -12.991 -11.722
  252    HH2  TRP  30           HH2      TRP  30 -16.738 -15.053 -12.704
  253    H    GLN  31           H        GLN  31 -10.922 -11.984  -9.116
  254    HA   GLN  31           HA       GLN  31 -12.803 -12.958  -7.117
  255    HB2  GLN  31           HB2      GLN  31 -10.591 -14.232  -8.694
  256    HB3  GLN  31           HB3      GLN  31 -11.460 -15.082  -7.421
  257    HG2  GLN  31           HG2      GLN  31 -13.567 -14.686  -8.686
  258    HG3  GLN  31           HG3      GLN  31 -12.595 -14.000  -9.990
  259   HE21  GLN  31          HE21      GLN  31 -13.344 -16.883  -8.191
  260   HE22  GLN  31          HE22      GLN  31 -12.742 -18.011  -9.353
  261    H    THR  32           H        THR  32  -9.596 -11.763  -7.455
  262    HA   THR  32           HA       THR  32  -8.381 -12.861  -5.181
  263    HB   THR  32           HB       THR  32  -7.623 -10.203  -6.175
  264    HG1  THR  32           HG1      THR  32  -7.555 -10.950  -8.146
  265   HG21  THR  32          HG21      THR  32  -6.204 -11.110  -4.472
  266   HG22  THR  32          HG22      THR  32  -5.331 -11.218  -6.000
  267   HG23  THR  32          HG23      THR  32  -6.098 -12.651  -5.321
  268    H    SER  33           H        SER  33  -8.964 -12.645  -3.183
  269    HA   SER  33           HA       SER  33 -10.097 -10.143  -2.130
  270    HB2  SER  33           HB2      SER  33 -10.224 -13.003  -1.159
  271    HB3  SER  33           HB3      SER  33 -10.807 -11.639  -0.212
  272    HG   SER  33           HG       SER  33 -12.120 -11.164  -2.166
  273    HA   PRO  34           HA       PRO  34  -6.482  -9.295   0.351
  274    HB2  PRO  34           HB2      PRO  34  -7.519  -8.956   2.903
  275    HB3  PRO  34           HB3      PRO  34  -7.445  -7.696   1.665
  276    HG2  PRO  34           HG2      PRO  34  -9.737  -9.449   2.425
  277    HG3  PRO  34           HG3      PRO  34  -9.731  -7.726   1.994
  278    HD2  PRO  34           HD2      PRO  34 -10.538  -9.555   0.240
  279    HD3  PRO  34           HD3      PRO  34  -9.580  -8.157  -0.278
  280    H    ASP  35           H        ASP  35  -8.679 -11.725   1.393
  281    HA   ASP  35           HA       ASP  35  -6.854 -13.079   3.158
  282    HB2  ASP  35           HB2      ASP  35  -9.600 -13.376   2.330
  283    HB3  ASP  35           HB3      ASP  35  -8.792 -14.888   2.630
  284    H    SER  36           H        SER  36  -7.933 -13.233  -0.101
  285    HA   SER  36           HA       SER  36  -6.774 -15.735  -0.835
  286    HB2  SER  36           HB2      SER  36  -8.650 -14.592  -2.080
  287    HB3  SER  36           HB3      SER  36  -7.468 -13.419  -2.660
  288    HG   SER  36           HG       SER  36  -7.992 -15.902  -3.571
  289    H    LEU  37           H        LEU  37  -5.756 -12.350  -0.849
  290    HA   LEU  37           HA       LEU  37  -3.328 -12.692  -2.234
  291    HB2  LEU  37           HB2      LEU  37  -4.979 -10.698  -0.986
  292    HB3  LEU  37           HB3      LEU  37  -3.328 -10.465  -0.535
  293    HG   LEU  37           HG       LEU  37  -4.255 -10.679  -3.377
  294   HD11  LEU  37          HD11      LEU  37  -5.340  -8.795  -2.364
  295   HD12  LEU  37          HD12      LEU  37  -4.064  -8.221  -3.435
  296   HD13  LEU  37          HD13      LEU  37  -3.813  -8.228  -1.688
  297   HD21  LEU  37          HD21      LEU  37  -1.708  -9.574  -2.205
  298   HD22  LEU  37          HD22      LEU  37  -2.139  -9.588  -3.912
  299   HD23  LEU  37          HD23      LEU  37  -1.869 -11.105  -3.059
  300    H    ARG  38           H        ARG  38  -4.354 -12.653   1.127
  301    HA   ARG  38           HA       ARG  38  -1.828 -12.769   2.343
  302    HB2  ARG  38           HB2      ARG  38  -4.291 -12.264   3.277
  303    HB3  ARG  38           HB3      ARG  38  -4.192 -13.966   3.698
  304    HG2  ARG  38           HG2      ARG  38  -2.042 -13.447   4.889
  305    HG3  ARG  38           HG3      ARG  38  -2.392 -11.739   4.620
  306    HD2  ARG  38           HD2      ARG  38  -4.282 -13.626   6.018
  307    HD3  ARG  38           HD3      ARG  38  -3.083 -12.650   6.865
  308    HE   ARG  38           HE       ARG  38  -4.728 -11.052   5.174
  309   HH11  ARG  38          HH11      ARG  38  -4.728 -12.656   8.301
  310   HH12  ARG  38          HH12      ARG  38  -5.900 -11.577   8.980
  311   HH21  ARG  38          HH21      ARG  38  -6.766  -9.881   7.727
  312   HH22  ARG  38          HH22      ARG  38  -6.261  -9.657   6.085
  313    H    ASP  39           H        ASP  39  -4.287 -15.166   1.446
  314    HA   ASP  39           HA       ASP  39  -2.916 -17.456   2.316
  315    HB2  ASP  39           HB2      ASP  39  -5.240 -16.886   0.579
  316    HB3  ASP  39           HB3      ASP  39  -4.467 -18.452   0.354
  317    H    TYR  40           H        TYR  40  -2.917 -15.758  -0.814
  318    HA   TYR  40           HA       TYR  40  -1.427 -17.723  -2.217
  319    HB2  TYR  40           HB2      TYR  40  -2.986 -15.808  -3.093
  320    HB3  TYR  40           HB3      TYR  40  -1.514 -14.848  -3.057
  321    HD1  TYR  40           HD1      TYR  40   0.098 -15.039  -4.770
  322    HD2  TYR  40           HD2      TYR  40  -3.036 -17.900  -4.502
  323    HE1  TYR  40           HE1      TYR  40   0.749 -15.947  -6.960
  324    HE2  TYR  40           HE2      TYR  40  -2.398 -18.816  -6.695
  325    HH   TYR  40           HH       TYR  40   0.533 -18.009  -8.237
  326    H    PHE  41           H        PHE  41  -0.574 -14.546  -0.837
  327    HA   PHE  41           HA       PHE  41   2.154 -14.694  -1.512
  328    HB2  PHE  41           HB2      PHE  41   0.406 -12.855  -0.062
  329    HB3  PHE  41           HB3      PHE  41   2.128 -12.686   0.172
  330    HD1  PHE  41           HD1      PHE  41  -0.509 -12.866  -2.425
  331    HD2  PHE  41           HD2      PHE  41   3.439 -11.592  -1.477
  332    HE1  PHE  41           HE1      PHE  41  -0.336 -11.735  -4.611
  333    HE2  PHE  41           HE2      PHE  41   3.609 -10.456  -3.641
  334    HZ   PHE  41           HZ       PHE  41   1.720 -10.530  -5.217
  335    H    SER  42           H        SER  42   0.359 -15.822   1.257
  336    HA   SER  42           HA       SER  42   2.435 -15.890   3.183
  337    HB2  SER  42           HB2      SER  42  -0.182 -17.311   2.902
  338    HB3  SER  42           HB3      SER  42   0.979 -17.898   4.092
  339    HG   SER  42           HG       SER  42   0.380 -16.318   5.321
  340    H    LYS  43           H        LYS  43   1.894 -17.452   0.407
  341    HA   LYS  43           HA       LYS  43   3.168 -19.966   0.915
  342    HB2  LYS  43           HB2      LYS  43   1.934 -18.602  -1.422
  343    HB3  LYS  43           HB3      LYS  43   2.985 -19.964  -1.702
  344    HG2  LYS  43           HG2      LYS  43   1.153 -20.671   0.354
  345    HG3  LYS  43           HG3      LYS  43   0.254 -19.981  -0.997
  346    HD2  LYS  43           HD2      LYS  43   1.327 -21.556  -2.524
  347    HD3  LYS  43           HD3      LYS  43   2.264 -22.228  -1.190
  348    HE2  LYS  43           HE2      LYS  43   0.449 -23.707  -1.540
  349    HE3  LYS  43           HE3      LYS  43   0.068 -22.790  -0.084
  350    HZ1  LYS  43           HZ1      LYS  43  -1.392 -21.383  -1.373
  351    HZ2  LYS  43           HZ2      LYS  43  -1.842 -23.001  -1.568
  352    HZ3  LYS  43           HZ3      LYS  43  -0.994 -22.207  -2.797
  353    H    PHE  44           H        PHE  44   4.217 -16.841   0.270
  354    HA   PHE  44           HA       PHE  44   6.781 -17.661  -0.908
  355    HB2  PHE  44           HB2      PHE  44   5.108 -15.368  -1.168
  356    HB3  PHE  44           HB3      PHE  44   6.700 -14.884  -0.614
  357    HD1  PHE  44           HD1      PHE  44   4.734 -16.147  -3.364
  358    HD2  PHE  44           HD2      PHE  44   8.691 -15.389  -1.990
  359    HE1  PHE  44           HE1      PHE  44   5.564 -16.334  -5.670
  360    HE2  PHE  44           HE2      PHE  44   9.531 -15.574  -4.297
  361    HZ   PHE  44           HZ       PHE  44   7.960 -16.048  -6.140
  362    H    GLY  45           H        GLY  45   5.287 -16.162   1.847
  363    HA2  GLY  45           HA2      GLY  45   7.352 -16.780   3.640
  364    HA3  GLY  45           HA3      GLY  45   7.337 -15.065   3.255
  365    H    GLU  46           H        GLU  46   6.767 -14.768   5.479
  366    HA   GLU  46           HA       GLU  46   4.076 -15.461   6.167
  367    HB2  GLU  46           HB2      GLU  46   5.973 -16.025   7.756
  368    HB3  GLU  46           HB3      GLU  46   6.089 -14.296   8.062
  369    HG2  GLU  46           HG2      GLU  46   3.869 -14.213   8.912
  370    HG3  GLU  46           HG3      GLU  46   3.545 -15.860   8.394
  371    H    ILE  47           H        ILE  47   2.621 -14.088   6.401
  372    HA   ILE  47           HA       ILE  47   3.121 -11.266   5.871
  373    HB   ILE  47           HB       ILE  47   0.630 -12.814   5.435
  374   HG12  ILE  47          HG12      ILE  47   1.842 -11.419   3.230
  375   HG13  ILE  47          HG13      ILE  47   2.884 -12.636   3.939
  376   HG21  ILE  47          HG21      ILE  47  -0.215 -10.761   4.288
  377   HG22  ILE  47          HG22      ILE  47   1.145  -9.894   5.000
  378   HG23  ILE  47          HG23      ILE  47  -0.082 -10.615   6.040
  379   HD11  ILE  47          HD11      ILE  47   0.348 -12.933   2.419
  380   HD12  ILE  47          HD12      ILE  47   0.691 -14.115   3.676
  381   HD13  ILE  47          HD13      ILE  47   1.817 -13.911   2.333
  382    H    ARG  48           H        ARG  48   2.504  -9.703   7.136
  383    HA   ARG  48           HA       ARG  48   1.684 -10.269   9.851
  384    HB2  ARG  48           HB2      ARG  48   3.441  -8.547   8.793
  385    HB3  ARG  48           HB3      ARG  48   2.033  -7.517   8.771
  386    HG2  ARG  48           HG2      ARG  48   1.835  -7.514  11.089
  387    HG3  ARG  48           HG3      ARG  48   2.883  -8.921  11.274
  388    HD2  ARG  48           HD2      ARG  48   4.791  -7.600  10.496
  389    HD3  ARG  48           HD3      ARG  48   3.744  -6.194  10.309
  390    HE   ARG  48           HE       ARG  48   3.370  -6.496  12.821
  391   HH11  ARG  48          HH11      ARG  48   7.355  -6.990  12.650
  392   HH12  ARG  48          HH12      ARG  48   6.405  -7.279  11.231
  393   HH21  ARG  48          HH21      ARG  48   6.354  -6.332  14.590
  394   HH22  ARG  48          HH22      ARG  48   4.637  -6.115  14.664
  395    H    GLU  49           H        GLU  49   0.544  -8.554   6.996
  396    HA   GLU  49           HA       GLU  49  -2.213  -8.781   7.660
  397    HB2  GLU  49           HB2      GLU  49  -1.248  -6.721   8.994
  398    HB3  GLU  49           HB3      GLU  49  -1.303  -5.926   7.430
  399    HG2  GLU  49           HG2      GLU  49  -3.712  -6.424   7.293
  400    HG3  GLU  49           HG3      GLU  49  -3.632  -7.147   8.899
  401    H    CYS  50           H        CYS  50  -3.522  -7.969   5.919
  402    HA   CYS  50           HA       CYS  50  -2.218  -7.261   3.479
  403    HB2  CYS  50           HB2      CYS  50  -2.469  -9.662   3.291
  404    HB3  CYS  50           HB3      CYS  50  -4.169  -9.548   3.726
  405    HG   CYS  50           HG       CYS  50  -4.570  -9.937   1.161
  406    H    MET  51           H        MET  51  -3.525  -6.214   2.021
  407    HA   MET  51           HA       MET  51  -6.139  -5.325   2.828
  408    HB2  MET  51           HB2      MET  51  -4.654  -3.770   3.940
  409    HB3  MET  51           HB3      MET  51  -3.880  -3.441   2.416
  410    HG2  MET  51           HG2      MET  51  -5.846  -2.374   1.560
  411    HG3  MET  51           HG3      MET  51  -6.755  -2.824   3.005
  412    HE1  MET  51           HE1      MET  51  -3.583   0.498   2.672
  413    HE2  MET  51           HE2      MET  51  -4.528  -0.143   1.328
  414    HE3  MET  51           HE3      MET  51  -3.303  -1.148   2.101
  415    H    VAL  52           H        VAL  52  -7.423  -4.949   1.244
  416    HA   VAL  52           HA       VAL  52  -6.465  -4.486  -1.474
  417    HB   VAL  52           HB       VAL  52  -8.821  -6.117  -0.689
  418   HG11  VAL  52          HG11      VAL  52  -8.919  -6.690  -3.146
  419   HG12  VAL  52          HG12      VAL  52  -7.821  -5.331  -3.401
  420   HG13  VAL  52          HG13      VAL  52  -9.423  -5.052  -2.721
  421   HG21  VAL  52          HG21      VAL  52  -7.650  -8.025  -1.505
  422   HG22  VAL  52          HG22      VAL  52  -6.602  -7.169  -0.369
  423   HG23  VAL  52          HG23      VAL  52  -6.349  -6.996  -2.104
  424    H    MET  53           H        MET  53  -7.129  -2.708  -2.268
  425    HA   MET  53           HA       MET  53  -8.759  -0.882  -0.800
  426    HB2  MET  53           HB2      MET  53  -6.888  -0.739  -3.019
  427    HB3  MET  53           HB3      MET  53  -8.270   0.322  -3.246
  428    HG2  MET  53           HG2      MET  53  -6.450   0.269  -0.846
  429    HG3  MET  53           HG3      MET  53  -6.438   1.472  -2.130
  430    HE1  MET  53           HE1      MET  53  -6.449   3.150  -0.044
  431    HE2  MET  53           HE2      MET  53  -6.809   1.944   1.191
  432    HE3  MET  53           HE3      MET  53  -7.827   3.374   1.033
  433    H    ARG  54           H        ARG  54 -10.790  -0.509  -0.922
  434    HA   ARG  54           HA       ARG  54 -12.306  -1.026  -3.376
  435    HB2  ARG  54           HB2      ARG  54 -12.701  -2.224  -0.684
  436    HB3  ARG  54           HB3      ARG  54 -14.147  -1.758  -1.570
  437    HG2  ARG  54           HG2      ARG  54 -13.484  -3.182  -3.427
  438    HG3  ARG  54           HG3      ARG  54 -12.001  -3.617  -2.573
  439    HD2  ARG  54           HD2      ARG  54 -13.344  -4.597  -0.768
  440    HD3  ARG  54           HD3      ARG  54 -14.816  -4.181  -1.645
  441    HE   ARG  54           HE       ARG  54 -13.192  -5.717  -3.328
  442   HH11  ARG  54          HH11      ARG  54 -15.355  -7.823  -0.677
  443   HH12  ARG  54          HH12      ARG  54 -15.058  -6.142  -0.382
  444   HH21  ARG  54          HH21      ARG  54 -13.591  -7.919  -3.691
  445   HH22  ARG  54          HH22      ARG  54 -14.525  -8.827  -2.548
  446    H    ASP  55           H        ASP  55 -14.384   0.162  -3.424
  447    HA   ASP  55           HA       ASP  55 -14.219   2.646  -1.993
  448    HB2  ASP  55           HB2      ASP  55 -15.078   1.875  -4.660
  449    HB3  ASP  55           HB3      ASP  55 -16.006   3.140  -3.906
  450    HA   PRO  56           HA       PRO  56 -17.862   1.101   0.269
  451    HB2  PRO  56           HB2      PRO  56 -17.958   3.859   1.325
  452    HB3  PRO  56           HB3      PRO  56 -17.848   2.327   2.200
  453    HG2  PRO  56           HG2      PRO  56 -15.756   3.974   2.046
  454    HG3  PRO  56           HG3      PRO  56 -15.556   2.211   2.016
  455    HD2  PRO  56           HD2      PRO  56 -15.434   4.158  -0.247
  456    HD3  PRO  56           HD3      PRO  56 -14.448   2.712   0.059
  457    H    THR  57           H        THR  57 -17.697   3.597  -2.047
  458    HA   THR  57           HA       THR  57 -20.424   4.454  -1.865
  459    HB   THR  57           HB       THR  57 -19.879   5.660  -4.042
  460    HG1  THR  57           HG1      THR  57 -17.188   5.499  -3.516
  461   HG21  THR  57          HG21      THR  57 -19.879   6.811  -1.900
  462   HG22  THR  57          HG22      THR  57 -18.539   7.382  -2.893
  463   HG23  THR  57          HG23      THR  57 -18.240   6.250  -1.575
  464    H    THR  58           H        THR  58 -18.503   2.495  -4.103
  465    HA   THR  58           HA       THR  58 -21.000   1.526  -5.337
  466    HB   THR  58           HB       THR  58 -19.683   1.049  -7.378
  467    HG1  THR  58           HG1      THR  58 -17.610   0.981  -6.198
  468   HG21  THR  58          HG21      THR  58 -19.340   3.419  -8.062
  469   HG22  THR  58          HG22      THR  58 -19.588   3.894  -6.380
  470   HG23  THR  58          HG23      THR  58 -20.898   3.133  -7.284
  471    H    LYS  59           H        LYS  59 -18.416   0.617  -3.407
  472    HA   LYS  59           HA       LYS  59 -17.618  -1.321  -2.547
  473    HB2  LYS  59           HB2      LYS  59 -19.853  -2.886  -3.782
  474    HB3  LYS  59           HB3      LYS  59 -19.082  -3.105  -2.222
  475    HG2  LYS  59           HG2      LYS  59 -20.622  -0.619  -2.721
  476    HG3  LYS  59           HG3      LYS  59 -21.511  -2.116  -2.430
  477    HD2  LYS  59           HD2      LYS  59 -20.361  -2.397  -0.295
  478    HD3  LYS  59           HD3      LYS  59 -19.417  -0.936  -0.597
  479    HE2  LYS  59           HE2      LYS  59 -21.451   0.399  -0.591
  480    HE3  LYS  59           HE3      LYS  59 -22.422  -1.054  -0.353
  481    HZ1  LYS  59           HZ1      LYS  59 -21.363  -1.383   1.783
  482    HZ2  LYS  59           HZ2      LYS  59 -22.064   0.155   1.717
  483    HZ3  LYS  59           HZ3      LYS  59 -20.391  -0.018   1.551
  484    H    ARG  60           H        ARG  60 -17.342  -0.575  -5.536
  485    HA   ARG  60           HA       ARG  60 -16.488  -3.123  -6.686
  486    HB2  ARG  60           HB2      ARG  60 -16.679  -0.333  -7.823
  487    HB3  ARG  60           HB3      ARG  60 -15.991  -1.684  -8.714
  488    HG2  ARG  60           HG2      ARG  60 -18.128  -2.876  -8.540
  489    HG3  ARG  60           HG3      ARG  60 -18.814  -1.500  -7.677
  490    HD2  ARG  60           HD2      ARG  60 -19.512  -1.230  -9.900
  491    HD3  ARG  60           HD3      ARG  60 -18.166  -0.108  -9.707
  492    HE   ARG  60           HE       ARG  60 -17.195  -2.561 -10.681
  493   HH11  ARG  60          HH11      ARG  60 -18.646  -0.036 -13.447
  494   HH12  ARG  60          HH12      ARG  60 -19.101   0.173 -11.788
  495   HH21  ARG  60          HH21      ARG  60 -16.617  -2.817 -12.858
  496   HH22  ARG  60          HH22      ARG  60 -17.242  -1.728 -14.051
  497    H    SER  61           H        SER  61 -14.412  -3.649  -7.238
  498    HA   SER  61           HA       SER  61 -12.289  -2.164  -5.875
  499    HB2  SER  61           HB2      SER  61 -12.222  -4.893  -7.193
  500    HB3  SER  61           HB3      SER  61 -10.937  -4.182  -6.217
  501    HG   SER  61           HG       SER  61 -12.170  -5.562  -4.942
  502    H    ARG  62           H        ARG  62 -10.275  -1.691  -6.939
  503    HA   ARG  62           HA       ARG  62 -10.646  -1.016  -9.761
  504    HB2  ARG  62           HB2      ARG  62  -8.817   0.029  -7.625
  505    HB3  ARG  62           HB3      ARG  62  -8.492   0.344  -9.323
  506    HG2  ARG  62           HG2      ARG  62 -10.785   1.331  -9.493
  507    HG3  ARG  62           HG3      ARG  62 -10.912   1.174  -7.741
  508    HD2  ARG  62           HD2      ARG  62  -8.985   2.618  -7.445
  509    HD3  ARG  62           HD3      ARG  62  -8.769   2.723  -9.192
  510    HE   ARG  62           HE       ARG  62 -11.354   3.597  -8.271
  511   HH11  ARG  62          HH11      ARG  62  -8.495   6.292  -9.112
  512   HH12  ARG  62          HH12      ARG  62  -8.059   4.627  -8.920
  513   HH21  ARG  62          HH21      ARG  62 -11.901   5.783  -8.523
  514   HH22  ARG  62          HH22      ARG  62 -10.669   6.945  -8.887
  515    H    GLY  63           H        GLY  63  -9.147  -3.376  -7.913
  516    HA2  GLY  63           HA2      GLY  63  -8.070  -5.259  -8.813
  517    HA3  GLY  63           HA3      GLY  63  -7.656  -4.319 -10.234
  518    H    PHE  64           H        PHE  64  -7.020  -3.391  -6.863
  519    HA   PHE  64           HA       PHE  64  -4.260  -4.192  -7.013
  520    HB2  PHE  64           HB2      PHE  64  -3.243  -2.037  -6.746
  521    HB3  PHE  64           HB3      PHE  64  -4.197  -2.051  -8.216
  522    HD1  PHE  64           HD1      PHE  64  -5.813  -0.441  -8.584
  523    HD2  PHE  64           HD2      PHE  64  -4.231  -0.979  -4.696
  524    HE1  PHE  64           HE1      PHE  64  -6.935   1.635  -7.861
  525    HE2  PHE  64           HE2      PHE  64  -5.332   1.101  -3.945
  526    HZ   PHE  64           HZ       PHE  64  -6.694   2.409  -5.531
  527    H    GLY  65           H        GLY  65  -3.113  -4.086  -5.008
  528    HA2  GLY  65           HA2      GLY  65  -4.459  -3.203  -2.674
  529    HA3  GLY  65           HA3      GLY  65  -4.346  -4.951  -2.813
  530    H    PHE  66           H        PHE  66  -3.114  -4.488  -0.811
  531    HA   PHE  66           HA       PHE  66  -0.307  -4.287  -1.283
  532    HB2  PHE  66           HB2      PHE  66  -1.929  -3.043   0.873
  533    HB3  PHE  66           HB3      PHE  66  -0.203  -3.133   0.900
  534    HD1  PHE  66           HD1      PHE  66  -3.096  -1.691  -0.828
  535    HD2  PHE  66           HD2      PHE  66   1.129  -1.568  -0.321
  536    HE1  PHE  66           HE1      PHE  66  -3.017   0.437  -2.056
  537    HE2  PHE  66           HE2      PHE  66   1.216   0.561  -1.548
  538    HZ   PHE  66           HZ       PHE  66  -0.868   1.564  -2.420
  539    H    VAL  67           H        VAL  67   0.908  -5.314   0.410
  540    HA   VAL  67           HA       VAL  67  -0.414  -7.113   2.247
  541    HB   VAL  67           HB       VAL  67   1.469  -8.181   0.106
  542   HG11  VAL  67          HG11      VAL  67   0.776 -10.408   1.447
  543   HG12  VAL  67          HG12      VAL  67   0.802  -9.253   2.782
  544   HG13  VAL  67          HG13      VAL  67   2.242  -9.491   1.791
  545   HG21  VAL  67          HG21      VAL  67  -1.357  -8.989   0.790
  546   HG22  VAL  67          HG22      VAL  67  -0.335  -9.741  -0.437
  547   HG23  VAL  67          HG23      VAL  67  -0.860  -8.066  -0.628
  548    H    THR  68           H        THR  68   0.611  -7.304   3.987
  549    HA   THR  68           HA       THR  68   3.161  -5.941   4.238
  550    HB   THR  68           HB       THR  68   1.394  -6.565   6.505
  551    HG1  THR  68           HG1      THR  68   0.379  -5.402   4.550
  552   HG21  THR  68          HG21      THR  68   3.850  -5.233   6.126
  553   HG22  THR  68          HG22      THR  68   2.917  -5.360   7.626
  554   HG23  THR  68          HG23      THR  68   2.656  -3.995   6.548
  555    H    PHE  69           H        PHE  69   4.696  -7.323   4.074
  556    HA   PHE  69           HA       PHE  69   4.565  -9.958   5.128
  557    HB2  PHE  69           HB2      PHE  69   6.511  -8.389   3.539
  558    HB3  PHE  69           HB3      PHE  69   7.067  -9.831   4.369
  559    HD1  PHE  69           HD1      PHE  69   5.168  -8.519   1.620
  560    HD2  PHE  69           HD2      PHE  69   6.019 -12.030   3.865
  561    HE1  PHE  69           HE1      PHE  69   4.233  -9.904  -0.190
  562    HE2  PHE  69           HE2      PHE  69   5.091 -13.419   2.066
  563    HZ   PHE  69           HZ       PHE  69   4.209 -12.365   0.041
  564    H    ALA  70           H        ALA  70   5.121 -10.588   7.114
  565    HA   ALA  70           HA       ALA  70   6.277  -8.783   8.955
  566    HB1  ALA  70           HB1      ALA  70   5.660 -11.665   9.460
  567    HB2  ALA  70           HB2      ALA  70   4.452 -10.385   9.533
  568    HB3  ALA  70           HB3      ALA  70   5.810 -10.382  10.658
  569    H    ASP  71           H        ASP  71   7.742 -10.425   6.756
  570    HA   ASP  71           HA       ASP  71  10.180 -10.776   8.269
  571    HB2  ASP  71           HB2      ASP  71   8.968 -12.877   7.455
  572    HB3  ASP  71           HB3      ASP  71   9.528 -12.428   5.875
  573    HA   PRO  72           HA       PRO  72  11.795  -8.073   5.043
  574    HB2  PRO  72           HB2      PRO  72  14.436  -8.688   5.983
  575    HB3  PRO  72           HB3      PRO  72  13.568  -7.179   6.055
  576    HG2  PRO  72           HG2      PRO  72  14.155  -8.607   8.269
  577    HG3  PRO  72           HG3      PRO  72  12.722  -7.569   8.140
  578    HD2  PRO  72           HD2      PRO  72  12.932 -10.536   7.872
  579    HD3  PRO  72           HD3      PRO  72  11.672  -9.549   8.644
  580    H    ALA  73           H        ALA  73  12.563 -11.305   5.654
  581    HA   ALA  73           HA       ALA  73  14.360 -11.688   3.465
  582    HB1  ALA  73           HB1      ALA  73  14.247 -14.071   4.013
  583    HB2  ALA  73           HB2      ALA  73  12.964 -13.722   5.173
  584    HB3  ALA  73           HB3      ALA  73  14.586 -13.079   5.432
  585    H    SER  74           H        SER  74  10.980 -11.945   3.983
  586    HA   SER  74           HA       SER  74  10.367 -13.506   1.672
  587    HB2  SER  74           HB2      SER  74   8.915 -13.167   3.773
  588    HB3  SER  74           HB3      SER  74   8.403 -11.667   2.996
  589    HG   SER  74           HG       SER  74   6.987 -13.279   2.397
  590    H    VAL  75           H        VAL  75  10.737 -10.145   2.314
  591    HA   VAL  75           HA       VAL  75   9.621  -9.154  -0.085
  592    HB   VAL  75           HB       VAL  75  11.744  -7.750   1.532
  593   HG11  VAL  75          HG11      VAL  75  11.198  -6.554  -0.470
  594   HG12  VAL  75          HG12      VAL  75  10.449  -5.700   0.881
  595   HG13  VAL  75          HG13      VAL  75   9.469  -6.724  -0.169
  596   HG21  VAL  75          HG21      VAL  75  10.055  -8.545   3.108
  597   HG22  VAL  75          HG22      VAL  75   8.787  -7.786   2.145
  598   HG23  VAL  75          HG23      VAL  75   9.997  -6.789   2.951
  599    H    ASP  76           H        ASP  76  12.697 -10.301   0.904
  600    HA   ASP  76           HA       ASP  76  14.232  -9.497  -1.320
  601    HB2  ASP  76           HB2      ASP  76  14.879 -10.346   1.090
  602    HB3  ASP  76           HB3      ASP  76  14.899 -11.903   0.295
  603    H    LYS  77           H        LYS  77  12.533 -12.360  -0.394
  604    HA   LYS  77           HA       LYS  77  13.178 -14.023  -2.541
  605    HB2  LYS  77           HB2      LYS  77  10.852 -14.081  -0.640
  606    HB3  LYS  77           HB3      LYS  77  11.131 -15.330  -1.844
  607    HG2  LYS  77           HG2      LYS  77  13.460 -15.542  -0.758
  608    HG3  LYS  77           HG3      LYS  77  12.733 -14.673   0.593
  609    HD2  LYS  77           HD2      LYS  77  11.007 -16.381   0.788
  610    HD3  LYS  77           HD3      LYS  77  11.680 -17.238  -0.600
  611    HE2  LYS  77           HE2      LYS  77  13.779 -17.559   0.641
  612    HE3  LYS  77           HE3      LYS  77  13.066 -16.746   2.034
  613    HZ1  LYS  77           HZ1      LYS  77  11.383 -18.490   2.131
  614    HZ2  LYS  77           HZ2      LYS  77  12.940 -19.136   2.272
  615    HZ3  LYS  77           HZ3      LYS  77  12.098 -19.275   0.812
  616    H    VAL  78           H        VAL  78  10.477 -11.859  -2.028
  617    HA   VAL  78           HA       VAL  78   9.148 -12.548  -4.461
  618    HB   VAL  78           HB       VAL  78   8.645 -10.191  -2.622
  619   HG11  VAL  78          HG11      VAL  78   7.763  -9.833  -4.914
  620   HG12  VAL  78          HG12      VAL  78   6.490  -9.962  -3.701
  621   HG13  VAL  78          HG13      VAL  78   6.838 -11.326  -4.762
  622   HG21  VAL  78          HG21      VAL  78   7.270 -12.873  -2.828
  623   HG22  VAL  78          HG22      VAL  78   6.750 -11.534  -1.804
  624   HG23  VAL  78          HG23      VAL  78   8.298 -12.324  -1.503
  625    H    LEU  79           H        LEU  79  11.462 -10.066  -3.494
  626    HA   LEU  79           HA       LEU  79  11.242  -8.320  -5.656
  627    HB2  LEU  79           HB2      LEU  79  12.515  -8.418  -3.304
  628    HB3  LEU  79           HB3      LEU  79  13.841  -8.842  -4.350
  629    HG   LEU  79           HG       LEU  79  13.723  -6.473  -3.695
  630   HD11  LEU  79          HD11      LEU  79  13.539  -7.024  -6.646
  631   HD12  LEU  79          HD12      LEU  79  14.992  -7.073  -5.649
  632   HD13  LEU  79          HD13      LEU  79  14.170  -5.539  -5.936
  633   HD21  LEU  79          HD21      LEU  79  12.080  -4.989  -4.334
  634   HD22  LEU  79          HD22      LEU  79  11.143  -6.437  -3.958
  635   HD23  LEU  79          HD23      LEU  79  11.503  -6.029  -5.635
  636    H    GLY  80           H        GLY  80  13.076 -11.302  -5.192
  637    HA2  GLY  80           HA2      GLY  80  14.618 -11.087  -7.555
  638    HA3  GLY  80           HA3      GLY  80  14.454 -12.518  -6.569
  639    H    GLN  81           H        GLN  81  11.446 -12.199  -6.908
  640    HA   GLN  81           HA       GLN  81  11.238 -13.589  -9.445
  641    HB2  GLN  81           HB2      GLN  81   9.512 -13.390  -6.990
  642    HB3  GLN  81           HB3      GLN  81   8.944 -14.122  -8.470
  643    HG2  GLN  81           HG2      GLN  81  11.525 -15.054  -7.376
  644    HG3  GLN  81           HG3      GLN  81  10.056 -15.546  -6.542
  645   HE21  GLN  81          HE21      GLN  81   8.589 -16.899  -7.586
  646   HE22  GLN  81          HE22      GLN  81   9.017 -17.807  -8.993
  647    HA   PRO  82           HA       PRO  82   9.517  -9.534 -10.773
  648    HB2  PRO  82           HB2      PRO  82  10.150 -10.330 -13.487
  649    HB3  PRO  82           HB3      PRO  82  10.858  -9.028 -12.526
  650    HG2  PRO  82           HG2      PRO  82  12.241 -11.251 -13.246
  651    HG3  PRO  82           HG3      PRO  82  12.582 -10.319 -11.775
  652    HD2  PRO  82           HD2      PRO  82  11.062 -12.878 -12.077
  653    HD3  PRO  82           HD3      PRO  82  12.229 -12.390 -10.828
  654    H    HIS  83           H        HIS  83   8.901 -12.685 -12.302
  655    HA   HIS  83           HA       HIS  83   6.432 -11.738 -13.508
  656    HB2  HIS  83           HB2      HIS  83   8.177 -13.423 -14.483
  657    HB3  HIS  83           HB3      HIS  83   7.315 -14.599 -13.501
  658    HD1  HIS  83           HD1      HIS  83   6.606 -12.079 -16.251
  659    HD2  HIS  83           HD2      HIS  83   5.084 -15.622 -14.703
  660    HE1  HIS  83           HE1      HIS  83   4.746 -12.746 -17.804
  661    HE2  HIS  83           HE2      HIS  83   3.838 -14.893 -16.850
  662    H    HIS  84           H        HIS  84   4.508 -11.868 -12.587
  663    HA   HIS  84           HA       HIS  84   3.935 -13.894 -10.549
  664    HB2  HIS  84           HB2      HIS  84   4.391 -11.317  -9.859
  665    HB3  HIS  84           HB3      HIS  84   2.672 -11.228 -10.222
  666    HD1  HIS  84           HD1      HIS  84   5.072 -12.460  -7.695
  667    HD2  HIS  84           HD2      HIS  84   1.020 -12.841  -8.537
  668    HE1  HIS  84           HE1      HIS  84   4.043 -13.439  -5.620
  669    HE2  HIS  84           HE2      HIS  84   1.590 -13.662  -6.151
  670    H    GLU  85           H        GLU  85   2.242 -15.024 -11.224
  671    HA   GLU  85           HA       GLU  85   0.336 -13.817 -12.997
  672    HB2  GLU  85           HB2      GLU  85   1.912 -15.848 -13.690
  673    HB3  GLU  85           HB3      GLU  85   0.637 -16.770 -12.909
  674    HG2  GLU  85           HG2      GLU  85  -1.008 -15.829 -14.417
  675    HG3  GLU  85           HG3      GLU  85   0.231 -14.824 -15.168
  676    H    LEU  86           H        LEU  86  -1.664 -13.880 -12.517
  677    HA   LEU  86           HA       LEU  86  -2.830 -15.576 -10.512
  678    HB2  LEU  86           HB2      LEU  86  -2.277 -13.642  -9.216
  679    HB3  LEU  86           HB3      LEU  86  -2.760 -12.571 -10.503
  680    HG   LEU  86           HG       LEU  86  -5.108 -13.584 -10.116
  681   HD11  LEU  86          HD11      LEU  86  -4.535 -15.286  -8.517
  682   HD12  LEU  86          HD12      LEU  86  -5.519 -14.064  -7.711
  683   HD13  LEU  86          HD13      LEU  86  -3.773 -14.095  -7.462
  684   HD21  LEU  86          HD21      LEU  86  -3.758 -11.518  -8.407
  685   HD22  LEU  86          HD22      LEU  86  -5.494 -11.820  -8.337
  686   HD23  LEU  86          HD23      LEU  86  -4.756 -11.276  -9.842
  687    H    ASP  87           H        ASP  87  -4.797 -16.124 -11.115
  688    HA   ASP  87           HA       ASP  87  -6.549 -16.657 -12.446
  689    HB2  ASP  87           HB2      ASP  87  -7.072 -14.474 -11.378
  690    HB3  ASP  87           HB3      ASP  87  -6.658 -13.712 -12.886
  691    H    SER  88           H        SER  88  -4.110 -16.747 -13.625
  692    HA   SER  88           HA       SER  88  -3.098 -17.266 -15.598
  693    HB2  SER  88           HB2      SER  88  -5.831 -16.769 -16.807
  694    HB3  SER  88           HB3      SER  88  -4.451 -17.408 -17.699
  695    HG   SER  88           HG       SER  88  -4.662 -19.276 -16.715
  696    H    LYS  89           H        LYS  89  -3.734 -14.323 -14.627
  697    HA   LYS  89           HA       LYS  89  -2.535 -13.076 -16.968
  698    HB2  LYS  89           HB2      LYS  89  -3.645 -10.905 -16.002
  699    HB3  LYS  89           HB3      LYS  89  -4.529 -11.963 -17.075
  700    HG2  LYS  89           HG2      LYS  89  -5.612 -12.983 -15.071
  701    HG3  LYS  89           HG3      LYS  89  -4.793 -11.775 -14.076
  702    HD2  LYS  89           HD2      LYS  89  -5.910  -9.991 -15.329
  703    HD3  LYS  89           HD3      LYS  89  -6.725 -11.199 -16.324
  704    HE2  LYS  89           HE2      LYS  89  -7.817 -12.093 -14.310
  705    HE3  LYS  89           HE3      LYS  89  -7.028 -10.846 -13.343
  706    HZ1  LYS  89           HZ1      LYS  89  -9.294 -10.230 -13.901
  707    HZ2  LYS  89           HZ2      LYS  89  -8.955 -10.360 -15.552
  708    HZ3  LYS  89           HZ3      LYS  89  -8.199  -9.164 -14.626
  709    H    THR  90           H        THR  90  -1.196 -11.420 -16.593
  710    HA   THR  90           HA       THR  90   0.588 -11.789 -14.360
  711    HB   THR  90           HB       THR  90   0.930  -9.693 -16.495
  712    HG1  THR  90           HG1      THR  90   2.130 -11.559 -17.552
  713   HG21  THR  90          HG21      THR  90   2.942 -11.437 -15.057
  714   HG22  THR  90          HG22      THR  90   2.563  -9.769 -14.628
  715   HG23  THR  90          HG23      THR  90   3.303 -10.131 -16.188
  716    H    ILE  91           H        ILE  91   0.667 -10.602 -12.559
  717    HA   ILE  91           HA       ILE  91  -0.686  -7.987 -12.505
  718    HB   ILE  91           HB       ILE  91  -1.163  -8.321 -10.141
  719   HG12  ILE  91          HG12      ILE  91  -0.234 -11.138 -10.376
  720   HG13  ILE  91          HG13      ILE  91   0.766  -9.894  -9.657
  721   HG21  ILE  91          HG21      ILE  91  -2.845  -8.956 -11.708
  722   HG22  ILE  91          HG22      ILE  91  -2.833 -10.143 -10.404
  723   HG23  ILE  91          HG23      ILE  91  -2.083 -10.528 -11.953
  724   HD11  ILE  91          HD11      ILE  91  -0.384  -9.951  -7.732
  725   HD12  ILE  91          HD12      ILE  91  -0.994 -11.499  -8.310
  726   HD13  ILE  91          HD13      ILE  91  -1.949 -10.027  -8.558
  727    H    ASP  92           H        ASP  92   0.298  -6.442 -10.708
  728    HA   ASP  92           HA       ASP  92   3.210  -6.663 -11.105
  729    HB2  ASP  92           HB2      ASP  92   1.849  -4.872 -12.328
  730    HB3  ASP  92           HB3      ASP  92   1.741  -4.074 -10.766
  731    HA   PRO  93           HA       PRO  93   3.084  -6.317  -6.522
  732    HB2  PRO  93           HB2      PRO  93   5.211  -8.241  -6.362
  733    HB3  PRO  93           HB3      PRO  93   3.531  -8.450  -5.860
  734    HG2  PRO  93           HG2      PRO  93   4.687  -9.803  -7.953
  735    HG3  PRO  93           HG3      PRO  93   2.945  -9.514  -7.782
  736    HD2  PRO  93           HD2      PRO  93   4.942  -8.061  -9.469
  737    HD3  PRO  93           HD3      PRO  93   3.265  -8.518  -9.839
  738    H    LYS  94           H        LYS  94   4.171  -4.617  -5.717
  739    HA   LYS  94           HA       LYS  94   7.046  -4.387  -6.211
  740    HB2  LYS  94           HB2      LYS  94   6.771  -1.912  -6.715
  741    HB3  LYS  94           HB3      LYS  94   6.297  -3.028  -7.983
  742    HG2  LYS  94           HG2      LYS  94   3.911  -2.717  -6.864
  743    HG3  LYS  94           HG3      LYS  94   4.630  -1.189  -6.351
  744    HD2  LYS  94           HD2      LYS  94   5.204  -0.693  -8.688
  745    HD3  LYS  94           HD3      LYS  94   4.451  -2.209  -9.184
  746    HE2  LYS  94           HE2      LYS  94   2.307  -1.413  -8.266
  747    HE3  LYS  94           HE3      LYS  94   3.073   0.119  -7.849
  748    HZ1  LYS  94           HZ1      LYS  94   3.555   0.451 -10.212
  749    HZ2  LYS  94           HZ2      LYS  94   1.894   0.314  -9.925
  750    HZ3  LYS  94           HZ3      LYS  94   2.746  -0.988 -10.586
  751    H    VAL  95           H        VAL  95   8.231  -3.426  -4.641
  752    HA   VAL  95           HA       VAL  95   6.962  -3.073  -2.066
  753    HB   VAL  95           HB       VAL  95   9.854  -2.694  -2.546
  754   HG11  VAL  95          HG11      VAL  95   8.300  -3.749  -0.201
  755   HG12  VAL  95          HG12      VAL  95   9.084  -2.174  -0.324
  756   HG13  VAL  95          HG13      VAL  95  10.058  -3.643  -0.277
  757   HG21  VAL  95          HG21      VAL  95   9.148  -4.821  -3.660
  758   HG22  VAL  95          HG22      VAL  95   8.642  -5.398  -2.073
  759   HG23  VAL  95          HG23      VAL  95  10.334  -5.015  -2.372
  760    H    ALA  96           H        ALA  96   6.720  -1.227  -0.946
  761    HA   ALA  96           HA       ALA  96   6.434   0.968  -0.475
  762    HB1  ALA  96           HB1      ALA  96   8.410   2.249  -0.269
  763    HB2  ALA  96           HB2      ALA  96   9.220   1.331  -1.541
  764    HB3  ALA  96           HB3      ALA  96   8.850   0.562   0.004
  765    H    PHE  97           H        PHE  97   6.406   3.244  -1.172
  766    HA   PHE  97           HA       PHE  97   5.608   3.477  -3.974
  767    HB2  PHE  97           HB2      PHE  97   4.689   4.583  -1.457
  768    HB3  PHE  97           HB3      PHE  97   4.974   5.850  -2.646
  769    HD1  PHE  97           HD1      PHE  97   3.120   2.759  -1.951
  770    HD2  PHE  97           HD2      PHE  97   3.539   6.132  -4.505
  771    HE1  PHE  97           HE1      PHE  97   0.974   2.218  -3.026
  772    HE2  PHE  97           HE2      PHE  97   1.391   5.599  -5.579
  773    HZ   PHE  97           HZ       PHE  97   0.103   3.635  -4.837
  774    HA   PRO  98           HA       PRO  98   9.395   5.959  -4.545
  775    HB2  PRO  98           HB2      PRO  98   8.701   6.192  -7.349
  776    HB3  PRO  98           HB3      PRO  98  10.013   5.262  -6.616
  777    HG2  PRO  98           HG2      PRO  98   7.891   4.091  -7.832
  778    HG3  PRO  98           HG3      PRO  98   8.781   3.340  -6.493
  779    HD2  PRO  98           HD2      PRO  98   6.177   4.816  -6.425
  780    HD3  PRO  98           HD3      PRO  98   6.647   3.306  -5.613
  781    H    ARG  99           H        ARG  99   9.907   8.133  -5.079
  782    HA   ARG  99           HA       ARG  99   7.605   9.938  -5.027
  783    HB2  ARG  99           HB2      ARG  99  10.551  10.368  -4.519
  784    HB3  ARG  99           HB3      ARG  99   9.399  11.693  -4.602
  785    HG2  ARG  99           HG2      ARG  99   8.130  10.617  -2.745
  786    HG3  ARG  99           HG3      ARG  99   9.433   9.434  -2.611
  787    HD2  ARG  99           HD2      ARG  99   9.928  11.050  -0.986
  788    HD3  ARG  99           HD3      ARG  99  10.990  11.437  -2.339
  789    HE   ARG  99           HE       ARG  99   8.512  12.875  -2.417
  790   HH11  ARG  99          HH11      ARG  99  11.740  12.914  -1.028
  791   HH12  ARG  99          HH12      ARG  99  11.737  14.630  -0.785
  792   HH21  ARG  99          HH21      ARG  99   9.922  15.874  -1.387
  793   HH22  ARG  99          HH22      ARG  99   8.533  15.115  -2.090
  794    H    ARG 100           H        ARG 100   6.865  10.843  -6.824
  795    HA   ARG 100           HA       ARG 100   8.674  11.767  -8.910
  796    HB2  ARG 100           HB2      ARG 100   6.745   9.518  -9.268
  797    HB3  ARG 100           HB3      ARG 100   6.910  10.671 -10.585
  798    HG2  ARG 100           HG2      ARG 100   9.384   9.501  -9.416
  799    HG3  ARG 100           HG3      ARG 100   8.388   8.494 -10.470
  800    HD2  ARG 100           HD2      ARG 100   8.582  10.080 -12.264
  801    HD3  ARG 100           HD3      ARG 100   9.396  11.238 -11.213
  802    HE   ARG 100           HE       ARG 100  10.930   8.929 -11.203
  803   HH11  ARG 100          HH11      ARG 100  11.346  11.113 -14.549
  804   HH12  ARG 100          HH12      ARG 100   9.932  11.320 -13.572
  805   HH21  ARG 100          HH21      ARG 100  12.782   8.680 -12.495
  806   HH22  ARG 100          HH22      ARG 100  12.958   9.620 -13.938
  807    H    ALA 101           H        ALA 101   7.967  13.566  -9.918
  808    HA   ALA 101           HA       ALA 101   5.654  14.887  -8.909
  809    HB1  ALA 101           HB1      ALA 101   6.720  16.765  -9.495
  810    HB2  ALA 101           HB2      ALA 101   6.971  16.197 -11.144
  811    HB3  ALA 101           HB3      ALA 101   8.092  15.720  -9.869
  812    H    GLN 102           H        GLN 102   4.298  16.206 -10.575
  813    HA   GLN 102           HA       GLN 102   3.363  14.354 -12.671
  814    HB2  GLN 102           HB2      GLN 102   1.850  16.224 -10.868
  815    HB3  GLN 102           HB3      GLN 102   1.156  15.665 -12.383
  816    HG2  GLN 102           HG2      GLN 102   1.477  13.330 -11.602
  817    HG3  GLN 102           HG3      GLN 102   2.003  13.971 -10.047
  818   HE21  GLN 102          HE21      GLN 102   0.503  14.973  -8.700
  819   HE22  GLN 102          HE22      GLN 102  -1.200  14.779  -8.918
  820    HA   PRO 103           HA       PRO 103   4.442  17.800 -15.391
  821    HB2  PRO 103           HB2      PRO 103   4.086  16.561 -17.754
  822    HB3  PRO 103           HB3      PRO 103   5.464  16.196 -16.706
  823    HG2  PRO 103           HG2      PRO 103   2.960  14.641 -17.129
  824    HG3  PRO 103           HG3      PRO 103   4.620  14.062 -16.892
  825    HD2  PRO 103           HD2      PRO 103   2.683  14.141 -14.917
  826    HD3  PRO 103           HD3      PRO 103   4.432  14.082 -14.631
  827    H    LYS 104           H        LYS 104   3.378  18.719 -17.538
  828    HA   LYS 104           HA       LYS 104   0.648  19.418 -16.874
  829    HB2  LYS 104           HB2      LYS 104   2.579  20.346 -18.992
  830    HB3  LYS 104           HB3      LYS 104   0.900  20.866 -18.978
  831    HG2  LYS 104           HG2      LYS 104   1.221  21.816 -16.742
  832    HG3  LYS 104           HG3      LYS 104   2.912  21.314 -16.781
  833    HD2  LYS 104           HD2      LYS 104   3.288  22.734 -18.739
  834    HD3  LYS 104           HD3      LYS 104   1.594  23.230 -18.707
  835    HE2  LYS 104           HE2      LYS 104   1.937  24.193 -16.473
  836    HE3  LYS 104           HE3      LYS 104   3.635  23.724 -16.541
  837    HZ1  LYS 104           HZ1      LYS 104   3.881  25.155 -18.500
  838    HZ2  LYS 104           HZ2      LYS 104   3.390  26.028 -17.137
  839    HZ3  LYS 104           HZ3      LYS 104   2.270  25.648 -18.345
  840    H    MET 105           H        MET 105  -1.184  19.000 -18.061
  841    HA   MET 105           HA       MET 105  -1.056  16.703 -19.856
  842    HB2  MET 105           HB2      MET 105  -3.338  18.103 -18.464
  843    HB3  MET 105           HB3      MET 105  -3.590  16.827 -19.647
  844    HG2  MET 105           HG2      MET 105  -2.013  16.534 -17.102
  845    HG3  MET 105           HG3      MET 105  -3.689  16.031 -17.322
  846    HE1  MET 105           HE1      MET 105  -1.879  12.584 -17.195
  847    HE2  MET 105           HE2      MET 105  -3.225  13.547 -16.585
  848    HE3  MET 105           HE3      MET 105  -1.566  14.022 -16.223
  849    H    VAL 106           H        VAL 106  -1.364  16.773 -21.986
  850    HA   VAL 106           HA       VAL 106  -2.050  19.334 -23.231
  851    HB   VAL 106           HB       VAL 106  -1.009  16.941 -24.730
  852   HG11  VAL 106          HG11      VAL 106  -0.041  18.686 -26.213
  853   HG12  VAL 106          HG12      VAL 106  -0.829  19.913 -25.220
  854   HG13  VAL 106          HG13      VAL 106  -1.801  18.746 -26.116
  855   HG21  VAL 106          HG21      VAL 106   1.288  17.767 -24.453
  856   HG22  VAL 106          HG22      VAL 106   0.579  17.268 -22.917
  857   HG23  VAL 106          HG23      VAL 106   0.704  18.981 -23.314
  858    H    THR 107           H        THR 107  -3.423  19.202 -25.224
  859    HA   THR 107           HA       THR 107  -5.692  17.499 -24.748
  860    HB   THR 107           HB       THR 107  -5.618  19.706 -26.788
  861    HG1  THR 107           HG1      THR 107  -6.605  20.349 -24.283
  862   HG21  THR 107          HG21      THR 107  -8.009  19.892 -26.256
  863   HG22  THR 107          HG22      THR 107  -7.845  18.612 -25.055
  864   HG23  THR 107          HG23      THR 107  -7.602  18.254 -26.765
  865    H    ARG 108           H        ARG 108  -5.112  15.542 -25.589
  866    HA   ARG 108           HA       ARG 108  -4.313  15.390 -28.410
  867    HB2  ARG 108           HB2      ARG 108  -4.061  13.527 -26.080
  868    HB3  ARG 108           HB3      ARG 108  -4.031  12.880 -27.714
  869    HG2  ARG 108           HG2      ARG 108  -2.157  14.438 -28.224
  870    HG3  ARG 108           HG3      ARG 108  -2.139  14.889 -26.518
  871    HD2  ARG 108           HD2      ARG 108  -1.571  12.673 -25.858
  872    HD3  ARG 108           HD3      ARG 108  -1.853  12.053 -27.484
  873    HE   ARG 108           HE       ARG 108   0.252  14.046 -27.131
  874   HH11  ARG 108          HH11      ARG 108  -0.583  10.678 -27.667
  875   HH12  ARG 108          HH12      ARG 108   1.007  10.248 -28.201
  876   HH21  ARG 108          HH21      ARG 108   2.654  11.823 -28.296
  877   HH22  ARG 108          HH22      ARG 108   2.329  13.461 -27.834
  878    H    THR 109           H        THR 109  -5.587  14.580 -29.946
  879    HA   THR 109           HA       THR 109  -8.258  13.637 -29.174
  880    HB   THR 109           HB       THR 109  -8.342  15.560 -30.637
  881    HG1  THR 109           HG1      THR 109  -9.185  13.081 -31.629
  882   HG21  THR 109          HG21      THR 109  -7.493  15.504 -32.957
  883   HG22  THR 109          HG22      THR 109  -6.710  13.960 -32.619
  884   HG23  THR 109          HG23      THR 109  -6.193  15.416 -31.768
  885    H    LYS 110           H        LYS 110  -9.126  11.724 -29.989
  886    HA   LYS 110           HA       LYS 110  -7.386   9.994 -31.511
  887    HB2  LYS 110           HB2      LYS 110  -8.111   8.039 -30.052
  888    HB3  LYS 110           HB3      LYS 110  -6.943   9.148 -29.359
  889    HG2  LYS 110           HG2      LYS 110  -9.829   9.600 -28.770
  890    HG3  LYS 110           HG3      LYS 110  -9.007   8.257 -27.974
  891    HD2  LYS 110           HD2      LYS 110  -7.282   9.841 -27.168
  892    HD3  LYS 110           HD3      LYS 110  -8.191  11.164 -27.897
  893    HE2  LYS 110           HE2      LYS 110  -9.370   9.301 -25.849
  894    HE3  LYS 110           HE3      LYS 110  -8.532  10.790 -25.414
  895    HZ1  LYS 110           HZ1      LYS 110 -10.142  12.032 -26.725
  896    HZ2  LYS 110           HZ2      LYS 110 -10.920  11.123 -25.528
  897    HZ3  LYS 110           HZ3      LYS 110 -10.946  10.601 -27.137
  898    H    LYS 111           H        LYS 111 -10.663  10.338 -30.196
  899    HA   LYS 111           HA       LYS 111 -11.697   9.136 -32.633
  900    HB2  LYS 111           HB2      LYS 111 -12.601   8.914 -29.801
  901    HB3  LYS 111           HB3      LYS 111 -13.797   8.794 -31.083
  902    HG2  LYS 111           HG2      LYS 111 -12.397   6.973 -32.088
  903    HG3  LYS 111           HG3      LYS 111 -11.416   7.018 -30.620
  904    HD2  LYS 111           HD2      LYS 111 -13.314   6.428 -29.268
  905    HD3  LYS 111           HD3      LYS 111 -14.395   6.557 -30.657
  906    HE2  LYS 111           HE2      LYS 111 -13.180   4.702 -31.736
  907    HE3  LYS 111           HE3      LYS 111 -12.173   4.550 -30.296
  908    HZ1  LYS 111           HZ1      LYS 111 -14.156   4.042 -29.010
  909    HZ2  LYS 111           HZ2      LYS 111 -13.976   2.946 -30.286
  910    HZ3  LYS 111           HZ3      LYS 111 -15.120   4.187 -30.394
  Start of MODEL    5
    1    H1   MET  -3           H1       MET  -3   9.641  50.224   8.409
    2    H2   MET  -3           H2       MET  -3   8.181  50.199   9.263
    3    H3   MET  -3           H3       MET  -3   9.007  48.755   8.959
    4    HA   MET  -3           HA       MET  -3  10.833  49.451  10.345
    5    HB2  MET  -3           HB2      MET  -3   9.200  51.953  10.447
    6    HB3  MET  -3           HB3      MET  -3  10.192  51.529  11.835
    7    HG2  MET  -3           HG2      MET  -3  11.216  51.828   9.021
    8    HG3  MET  -3           HG3      MET  -3  11.299  53.074  10.264
    9    HE1  MET  -3           HE1      MET  -3  13.860  53.388  10.123
   10    HE2  MET  -3           HE2      MET  -3  13.934  52.243   8.783
   11    HE3  MET  -3           HE3      MET  -3  15.033  52.071  10.152
   12    H    HIS  -2           H        HIS  -2  10.893  48.728  12.433
   13    HA   HIS  -2           HA       HIS  -2  10.281  47.643  14.318
   14    HB2  HIS  -2           HB2      HIS  -2   7.882  49.449  14.071
   15    HB3  HIS  -2           HB3      HIS  -2   8.084  48.331  15.414
   16    HD1  HIS  -2           HD1      HIS  -2   9.222  51.600  14.118
   17    HD2  HIS  -2           HD2      HIS  -2  10.248  48.965  17.164
   18    HE1  HIS  -2           HE1      HIS  -2  10.705  52.911  15.670
   19    HE2  HIS  -2           HE2      HIS  -2  11.314  51.296  17.507
   20    H    HIS  -1           H        HIS  -1   9.438  45.741  14.938
   21    HA   HIS  -1           HA       HIS  -1   7.502  44.471  13.114
   22    HB2  HIS  -1           HB2      HIS  -1   9.820  43.381  14.687
   23    HB3  HIS  -1           HB3      HIS  -1   8.514  42.323  14.166
   24    HD1  HIS  -1           HD1      HIS  -1   8.489  41.603  11.745
   25    HD2  HIS  -1           HD2      HIS  -1  11.361  44.496  12.550
   26    HE1  HIS  -1           HE1      HIS  -1   9.913  41.728   9.677
   27    HE2  HIS  -1           HE2      HIS  -1  11.646  43.487  10.185
   28    H    HIS   0           H        HIS   0   5.790  43.302  13.929
   29    HA   HIS   0           HA       HIS   0   5.165  43.769  16.766
   30    HB2  HIS   0           HB2      HIS   0   3.424  43.469  14.330
   31    HB3  HIS   0           HB3      HIS   0   2.772  43.243  15.950
   32    HD1  HIS   0           HD1      HIS   0   2.237  45.313  17.284
   33    HD2  HIS   0           HD2      HIS   0   4.348  46.142  13.802
   34    HE1  HIS   0           HE1      HIS   0   2.208  47.818  17.060
   35    HE2  HIS   0           HE2      HIS   0   3.492  48.298  14.946
   36    H    HIS   1           H        HIS   1   4.421  42.107  18.063
   37    HA   HIS   1           HA       HIS   1   5.110  39.422  17.128
   38    HB2  HIS   1           HB2      HIS   1   5.916  40.615  19.354
   39    HB3  HIS   1           HB3      HIS   1   4.391  39.990  19.972
   40    HD1  HIS   1           HD1      HIS   1   4.305  37.546  20.575
   41    HD2  HIS   1           HD2      HIS   1   7.759  38.574  18.506
   42    HE1  HIS   1           HE1      HIS   1   5.790  35.519  20.696
   43    HE2  HIS   1           HE2      HIS   1   7.875  36.162  19.436
   44    H    HIS   2           H        HIS   2   3.522  38.283  16.285
   45    HA   HIS   2           HA       HIS   2   0.996  37.995  17.724
   46    HB2  HIS   2           HB2      HIS   2   1.223  38.858  14.838
   47    HB3  HIS   2           HB3      HIS   2  -0.233  38.114  15.489
   48    HD1  HIS   2           HD1      HIS   2   1.693  41.293  15.461
   49    HD2  HIS   2           HD2      HIS   2  -1.693  39.729  17.293
   50    HE1  HIS   2           HE1      HIS   2   0.501  43.265  16.469
   51    HE2  HIS   2           HE2      HIS   2  -1.545  42.296  17.574
   52    H    HIS   3           H        HIS   3   0.277  35.939  17.739
   53    HA   HIS   3           HA       HIS   3   1.403  34.042  15.792
   54    HB2  HIS   3           HB2      HIS   3   1.331  33.778  18.789
   55    HB3  HIS   3           HB3      HIS   3   1.421  32.364  17.744
   56    HD1  HIS   3           HD1      HIS   3   3.653  31.871  16.613
   57    HD2  HIS   3           HD2      HIS   3   3.655  35.398  18.810
   58    HE1  HIS   3           HE1      HIS   3   6.062  32.572  16.758
   59    HE2  HIS   3           HE2      HIS   3   6.042  34.709  18.091
   60    H    SER   4           H        SER   4   0.108  32.410  15.120
   61    HA   SER   4           HA       SER   4  -2.593  32.180  16.253
   62    HB2  SER   4           HB2      SER   4  -3.491  31.967  13.913
   63    HB3  SER   4           HB3      SER   4  -2.886  33.575  14.303
   64    HG   SER   4           HG       SER   4  -2.138  32.894  12.268
   65    H    THR   5           H        THR   5  -0.217  30.762  14.014
   66    HA   THR   5           HA       THR   5  -0.989  28.098  14.991
   67    HB   THR   5           HB       THR   5  -1.871  28.193  12.763
   68    HG1  THR   5           HG1      THR   5   0.210  26.559  13.375
   69   HG21  THR   5          HG21      THR   5  -0.577  30.076  11.861
   70   HG22  THR   5          HG22      THR   5  -0.541  28.691  10.769
   71   HG23  THR   5          HG23      THR   5   0.859  29.054  11.780
   72    H    SER   6           H        SER   6   0.605  27.490  16.281
   73    HA   SER   6           HA       SER   6   3.377  28.117  15.562
   74    HB2  SER   6           HB2      SER   6   2.483  28.824  17.808
   75    HB3  SER   6           HB3      SER   6   2.360  27.115  18.223
   76    HG   SER   6           HG       SER   6   4.487  28.685  18.385
   77    H    VAL   7           H        VAL   7   1.192  25.540  15.629
   78    HA   VAL   7           HA       VAL   7   3.276  23.492  15.850
   79    HB   VAL   7           HB       VAL   7   0.306  22.995  15.492
   80   HG11  VAL   7          HG11      VAL   7   2.581  21.256  16.440
   81   HG12  VAL   7          HG12      VAL   7   1.590  21.040  14.998
   82   HG13  VAL   7          HG13      VAL   7   0.880  20.818  16.597
   83   HG21  VAL   7          HG21      VAL   7   0.464  24.258  17.506
   84   HG22  VAL   7          HG22      VAL   7   1.875  23.347  18.042
   85   HG23  VAL   7          HG23      VAL   7   0.296  22.565  17.971
   86    H    ASP   8           H        ASP   8   4.365  23.132  14.044
   87    HA   ASP   8           HA       ASP   8   2.894  22.907  11.500
   88    HB2  ASP   8           HB2      ASP   8   5.608  24.098  12.051
   89    HB3  ASP   8           HB3      ASP   8   5.147  23.552  10.441
   90    H    LEU   9           H        LEU   9   5.778  21.833  13.293
   91    HA   LEU   9           HA       LEU   9   6.067  19.499  11.581
   92    HB2  LEU   9           HB2      LEU   9   8.044  19.002  13.060
   93    HB3  LEU   9           HB3      LEU   9   8.135  20.485  12.136
   94    HG   LEU   9           HG       LEU   9   7.185  21.495  14.436
   95   HD11  LEU   9          HD11      LEU   9   8.269  20.413  16.334
   96   HD12  LEU   9          HD12      LEU   9   8.830  19.114  15.283
   97   HD13  LEU   9          HD13      LEU   9   7.104  19.333  15.568
   98   HD21  LEU   9          HD21      LEU   9   9.514  22.052  14.997
   99   HD22  LEU   9          HD22      LEU   9   9.170  22.258  13.279
  100   HD23  LEU   9          HD23      LEU   9  10.067  20.845  13.835
  101    H    GLY  10           H        GLY  10   5.536  17.457  12.086
  102    HA2  GLY  10           HA2      GLY  10   4.818  16.742  14.822
  103    HA3  GLY  10           HA3      GLY  10   3.533  16.656  13.627
  104    H    THR  11           H        THR  11   6.841  15.507  14.262
  105    HA   THR  11           HA       THR  11   6.054  12.881  13.298
  106    HB   THR  11           HB       THR  11   6.961  13.860  11.280
  107    HG1  THR  11           HG1      THR  11   7.619  11.616  12.130
  108   HG21  THR  11          HG21      THR  11   9.519  14.359  12.816
  109   HG22  THR  11          HG22      THR  11   8.403  15.598  12.244
  110   HG23  THR  11          HG23      THR  11   9.286  14.606  11.085
  111    H    GLU  12           H        GLU  12   7.209  14.492  15.777
  112    HA   GLU  12           HA       GLU  12   9.347  12.639  16.495
  113    HB2  GLU  12           HB2      GLU  12   9.795  15.084  16.585
  114    HB3  GLU  12           HB3      GLU  12   8.544  15.237  17.804
  115    HG2  GLU  12           HG2      GLU  12  10.485  15.234  19.045
  116    HG3  GLU  12           HG3      GLU  12   9.951  13.559  19.149
  117    H    ASN  13           H        ASN  13   6.629  14.212  18.066
  118    HA   ASN  13           HA       ASN  13   6.503  12.309  20.201
  119    HB2  ASN  13           HB2      ASN  13   5.956  14.845  20.213
  120    HB3  ASN  13           HB3      ASN  13   4.379  14.344  19.634
  121   HD21  ASN  13          HD21      ASN  13   5.584  15.547  22.063
  122   HD22  ASN  13          HD22      ASN  13   4.911  14.642  23.338
  123    H    LEU  14           H        LEU  14   4.525  12.913  17.294
  124    HA   LEU  14           HA       LEU  14   2.658  10.841  18.089
  125    HB2  LEU  14           HB2      LEU  14   1.515  11.412  15.892
  126    HB3  LEU  14           HB3      LEU  14   1.490  12.614  17.161
  127    HG   LEU  14           HG       LEU  14   3.714  12.896  15.243
  128   HD11  LEU  14          HD11      LEU  14   2.375  13.804  13.468
  129   HD12  LEU  14          HD12      LEU  14   0.894  13.515  14.378
  130   HD13  LEU  14          HD13      LEU  14   1.840  12.153  13.783
  131   HD21  LEU  14          HD21      LEU  14   3.072  15.251  15.422
  132   HD22  LEU  14          HD22      LEU  14   3.275  14.517  17.014
  133   HD23  LEU  14          HD23      LEU  14   1.657  14.795  16.369
  134    H    TYR  15           H        TYR  15   4.932  11.377  15.484
  135    HA   TYR  15           HA       TYR  15   4.534   8.687  14.432
  136    HB2  TYR  15           HB2      TYR  15   5.838  11.146  13.482
  137    HB3  TYR  15           HB3      TYR  15   6.644   9.660  13.013
  138    HD1  TYR  15           HD1      TYR  15   5.542   8.065  11.534
  139    HD2  TYR  15           HD2      TYR  15   3.656  11.718  12.612
  140    HE1  TYR  15           HE1      TYR  15   3.918   7.756   9.713
  141    HE2  TYR  15           HE2      TYR  15   2.022  11.421  10.798
  142    HH   TYR  15           HH       TYR  15   1.839  10.229   8.663
  143    H    PHE  16           H        PHE  16   5.843   6.988  14.788
  144    HA   PHE  16           HA       PHE  16   8.506   7.336  15.835
  145    HB2  PHE  16           HB2      PHE  16   6.575   6.951  17.665
  146    HB3  PHE  16           HB3      PHE  16   6.894   5.273  17.240
  147    HD1  PHE  16           HD1      PHE  16   8.226   8.287  18.810
  148    HD2  PHE  16           HD2      PHE  16   9.029   4.242  17.755
  149    HE1  PHE  16           HE1      PHE  16  10.176   8.286  20.311
  150    HE2  PHE  16           HE2      PHE  16  10.978   4.234  19.256
  151    HZ   PHE  16           HZ       PHE  16  11.554   6.257  20.536
  152    H    GLN  17           H        GLN  17   6.004   5.082  14.739
  153    HA   GLN  17           HA       GLN  17   7.973   3.085  13.951
  154    HB2  GLN  17           HB2      GLN  17   4.958   3.159  13.877
  155    HB3  GLN  17           HB3      GLN  17   5.885   1.850  13.156
  156    HG2  GLN  17           HG2      GLN  17   6.896   1.395  15.360
  157    HG3  GLN  17           HG3      GLN  17   5.877   2.654  16.057
  158   HE21  GLN  17          HE21      GLN  17   3.669   2.299  16.268
  159   HE22  GLN  17          HE22      GLN  17   2.975   0.722  16.150
  160    H    SER  18           H        SER  18   8.224   2.298  11.825
  161    HA   SER  18           HA       SER  18   7.925   4.331   9.764
  162    HB2  SER  18           HB2      SER  18   9.373   1.672   9.770
  163    HB3  SER  18           HB3      SER  18   9.371   2.806   8.418
  164    HG   SER  18           HG       SER  18  10.330   4.345   9.831
  165    H    ASN  19           H        ASN  19   7.116   3.836   7.633
  166    HA   ASN  19           HA       ASN  19   4.819   2.012   7.719
  167    HB2  ASN  19           HB2      ASN  19   5.441   4.452   6.068
  168    HB3  ASN  19           HB3      ASN  19   4.157   3.346   5.614
  169   HD21  ASN  19          HD21      ASN  19   4.404   6.140   6.532
  170   HD22  ASN  19          HD22      ASN  19   3.255   6.262   7.787
  171    H    ALA  20           H        ALA  20   7.935   2.199   6.394
  172    HA   ALA  20           HA       ALA  20   7.436   0.787   3.935
  173    HB1  ALA  20           HB1      ALA  20  10.036   1.374   5.345
  174    HB2  ALA  20           HB2      ALA  20   9.279   2.372   4.104
  175    HB3  ALA  20           HB3      ALA  20   9.867   0.758   3.701
  176    H    GLY  21           H        GLY  21   8.015  -1.316   3.417
  177    HA2  GLY  21           HA2      GLY  21   9.242  -3.356   4.315
  178    HA3  GLY  21           HA3      GLY  21   8.209  -3.157   5.719
  179    H    LYS  22           H        LYS  22   6.121  -2.240   3.598
  180    HA   LYS  22           HA       LYS  22   5.146  -4.950   3.064
  181    HB2  LYS  22           HB2      LYS  22   2.916  -4.025   2.913
  182    HB3  LYS  22           HB3      LYS  22   3.677  -3.505   4.402
  183    HG2  LYS  22           HG2      LYS  22   4.278  -1.431   2.761
  184    HG3  LYS  22           HG3      LYS  22   2.707  -1.935   2.129
  185    HD2  LYS  22           HD2      LYS  22   1.743  -1.762   4.368
  186    HD3  LYS  22           HD3      LYS  22   3.315  -1.298   5.021
  187    HE2  LYS  22           HE2      LYS  22   3.298   0.706   3.604
  188    HE3  LYS  22           HE3      LYS  22   1.710   0.246   2.986
  189    HZ1  LYS  22           HZ1      LYS  22   2.306   0.786   5.845
  190    HZ2  LYS  22           HZ2      LYS  22   0.784   0.492   5.168
  191    HZ3  LYS  22           HZ3      LYS  22   1.622   1.911   4.783
  192    H    MET  23           H        MET  23   3.651  -5.009   0.988
  193    HA   MET  23           HA       MET  23   5.096  -3.786  -1.206
  194    HB2  MET  23           HB2      MET  23   4.391  -6.588  -0.627
  195    HB3  MET  23           HB3      MET  23   4.112  -6.063  -2.273
  196    HG2  MET  23           HG2      MET  23   6.488  -5.244  -2.307
  197    HG3  MET  23           HG3      MET  23   6.703  -6.050  -0.755
  198    HE1  MET  23           HE1      MET  23   5.905  -6.389  -4.495
  199    HE2  MET  23           HE2      MET  23   6.802  -7.853  -4.891
  200    HE3  MET  23           HE3      MET  23   7.655  -6.442  -4.266
  201    H    PHE  24           H        PHE  24   3.948  -3.406  -3.008
  202    HA   PHE  24           HA       PHE  24   1.086  -2.833  -2.755
  203    HB2  PHE  24           HB2      PHE  24   2.779  -0.942  -3.111
  204    HB3  PHE  24           HB3      PHE  24   3.093  -1.621  -4.694
  205    HD1  PHE  24           HD1      PHE  24   2.341   1.165  -4.262
  206    HD2  PHE  24           HD2      PHE  24  -0.147  -2.237  -4.879
  207    HE1  PHE  24           HE1      PHE  24   0.593   2.616  -5.197
  208    HE2  PHE  24           HE2      PHE  24  -1.890  -0.781  -5.817
  209    HZ   PHE  24           HZ       PHE  24  -1.526   1.643  -5.979
  210    H    ILE  25           H        ILE  25   0.009  -4.474  -3.702
  211    HA   ILE  25           HA       ILE  25   1.048  -5.871  -6.009
  212    HB   ILE  25           HB       ILE  25  -1.489  -6.605  -4.767
  213   HG12  ILE  25          HG12      ILE  25  -0.064  -6.053  -2.816
  214   HG13  ILE  25          HG13      ILE  25  -0.526  -7.733  -2.871
  215   HG21  ILE  25          HG21      ILE  25   0.784  -8.074  -6.023
  216   HG22  ILE  25          HG22      ILE  25  -0.915  -8.040  -6.486
  217   HG23  ILE  25          HG23      ILE  25  -0.408  -8.929  -5.052
  218   HD11  ILE  25          HD11      ILE  25   2.157  -6.699  -3.757
  219   HD12  ILE  25          HD12      ILE  25   1.683  -8.385  -3.551
  220   HD13  ILE  25          HD13      ILE  25   1.815  -7.328  -2.146
  221    H    GLY  26           H        GLY  26   0.423  -5.291  -7.924
  222    HA2  GLY  26           HA2      GLY  26  -2.075  -3.867  -8.267
  223    HA3  GLY  26           HA3      GLY  26  -0.687  -3.584  -9.259
  224    H    GLY  27           H        GLY  27  -3.234  -4.008 -10.205
  225    HA2  GLY  27           HA2      GLY  27  -4.189  -5.038 -12.017
  226    HA3  GLY  27           HA3      GLY  27  -2.733  -5.997 -12.174
  227    H    LEU  28           H        LEU  28  -4.485  -6.169  -9.152
  228    HA   LEU  28           HA       LEU  28  -4.748  -8.920  -9.157
  229    HB2  LEU  28           HB2      LEU  28  -6.542  -6.966  -7.697
  230    HB3  LEU  28           HB3      LEU  28  -6.274  -8.641  -7.277
  231    HG   LEU  28           HG       LEU  28  -4.032  -6.628  -7.238
  232   HD11  LEU  28          HD11      LEU  28  -5.842  -5.807  -5.805
  233   HD12  LEU  28          HD12      LEU  28  -4.455  -6.342  -4.856
  234   HD13  LEU  28          HD13      LEU  28  -5.888  -7.362  -4.975
  235   HD21  LEU  28          HD21      LEU  28  -3.039  -8.207  -5.663
  236   HD22  LEU  28          HD22      LEU  28  -3.414  -9.005  -7.188
  237   HD23  LEU  28          HD23      LEU  28  -4.457  -9.245  -5.790
  238    H    SER  29           H        SER  29  -6.960 -10.093  -8.982
  239    HA   SER  29           HA       SER  29  -8.556  -9.409 -11.306
  240    HB2  SER  29           HB2      SER  29  -7.348 -11.673 -11.056
  241    HB3  SER  29           HB3      SER  29  -8.563 -12.048  -9.835
  242    HG   SER  29           HG       SER  29  -8.890 -12.560 -12.250
  243    H    TRP  30           H        TRP  30 -10.823 -10.335 -11.016
  244    HA   TRP  30           HA       TRP  30 -12.213  -8.802  -9.106
  245    HB2  TRP  30           HB2      TRP  30 -14.194  -9.725 -10.211
  246    HB3  TRP  30           HB3      TRP  30 -13.037  -9.170 -11.395
  247    HD1  TRP  30           HD1      TRP  30 -11.218 -11.608 -11.828
  248    HE1  TRP  30           HE1      TRP  30 -12.078 -13.827 -12.755
  249    HE3  TRP  30           HE3      TRP  30 -16.204 -11.087 -10.762
  250    HZ2  TRP  30           HZ2      TRP  30 -14.497 -15.176 -13.046
  251    HZ3  TRP  30           HZ3      TRP  30 -17.727 -12.908 -11.417
  252    HH2  TRP  30           HH2      TRP  30 -16.891 -14.913 -12.536
  253    H    GLN  31           H        GLN  31 -10.936 -11.929  -9.150
  254    HA   GLN  31           HA       GLN  31 -12.729 -13.041  -7.150
  255    HB2  GLN  31           HB2      GLN  31 -10.526 -14.159  -8.847
  256    HB3  GLN  31           HB3      GLN  31 -11.306 -15.101  -7.582
  257    HG2  GLN  31           HG2      GLN  31 -13.476 -14.744  -8.741
  258    HG3  GLN  31           HG3      GLN  31 -12.594 -13.946 -10.045
  259   HE21  GLN  31          HE21      GLN  31 -13.135 -16.951  -8.376
  260   HE22  GLN  31          HE22      GLN  31 -12.536 -17.985  -9.621
  261    H    THR  32           H        THR  32  -9.563 -11.740  -7.490
  262    HA   THR  32           HA       THR  32  -8.356 -12.895  -5.209
  263    HB   THR  32           HB       THR  32  -7.481 -10.291  -6.239
  264    HG1  THR  32           HG1      THR  32  -6.611 -12.462  -7.696
  265   HG21  THR  32          HG21      THR  32  -6.167 -11.409  -4.503
  266   HG22  THR  32          HG22      THR  32  -5.257 -11.303  -6.009
  267   HG23  THR  32          HG23      THR  32  -6.011 -12.824  -5.542
  268    H    SER  33           H        SER  33  -8.950 -12.601  -3.211
  269    HA   SER  33           HA       SER  33  -9.993 -10.026  -2.240
  270    HB2  SER  33           HB2      SER  33 -10.213 -12.838  -1.136
  271    HB3  SER  33           HB3      SER  33 -10.819 -11.409  -0.306
  272    HG   SER  33           HG       SER  33 -12.124 -11.040  -2.211
  273    HA   PRO  34           HA       PRO  34  -6.368  -9.226   0.264
  274    HB2  PRO  34           HB2      PRO  34  -7.414  -8.826   2.805
  275    HB3  PRO  34           HB3      PRO  34  -7.297  -7.580   1.555
  276    HG2  PRO  34           HG2      PRO  34  -9.639  -9.259   2.321
  277    HG3  PRO  34           HG3      PRO  34  -9.582  -7.544   1.864
  278    HD2  PRO  34           HD2      PRO  34 -10.430  -9.378   0.133
  279    HD3  PRO  34           HD3      PRO  34  -9.432  -8.017  -0.402
  280    H    ASP  35           H        ASP  35  -8.647 -11.567   1.321
  281    HA   ASP  35           HA       ASP  35  -6.907 -12.952   3.137
  282    HB2  ASP  35           HB2      ASP  35  -9.633 -13.208   2.186
  283    HB3  ASP  35           HB3      ASP  35  -8.873 -14.704   2.640
  284    H    SER  36           H        SER  36  -7.953 -13.145  -0.134
  285    HA   SER  36           HA       SER  36  -6.819 -15.674  -0.815
  286    HB2  SER  36           HB2      SER  36  -8.678 -14.528  -2.086
  287    HB3  SER  36           HB3      SER  36  -7.477 -13.389  -2.693
  288    HG   SER  36           HG       SER  36  -7.286 -16.200  -3.016
  289    H    LEU  37           H        LEU  37  -5.749 -12.303  -0.902
  290    HA   LEU  37           HA       LEU  37  -3.327 -12.709  -2.279
  291    HB2  LEU  37           HB2      LEU  37  -4.946 -10.659  -1.059
  292    HB3  LEU  37           HB3      LEU  37  -3.281 -10.438  -0.658
  293    HG   LEU  37           HG       LEU  37  -4.265 -10.725  -3.475
  294   HD11  LEU  37          HD11      LEU  37  -3.748  -8.199  -1.922
  295   HD12  LEU  37          HD12      LEU  37  -5.324  -8.805  -2.437
  296   HD13  LEU  37          HD13      LEU  37  -4.141  -8.296  -3.639
  297   HD21  LEU  37          HD21      LEU  37  -2.166  -9.728  -4.107
  298   HD22  LEU  37          HD22      LEU  37  -1.862 -11.138  -3.101
  299   HD23  LEU  37          HD23      LEU  37  -1.715  -9.526  -2.417
  300    H    ARG  38           H        ARG  38  -4.370 -12.646   1.064
  301    HA   ARG  38           HA       ARG  38  -1.829 -12.759   2.275
  302    HB2  ARG  38           HB2      ARG  38  -4.241 -12.104   3.220
  303    HB3  ARG  38           HB3      ARG  38  -4.245 -13.799   3.681
  304    HG2  ARG  38           HG2      ARG  38  -2.220 -13.481   4.980
  305    HG3  ARG  38           HG3      ARG  38  -2.136 -11.798   4.465
  306    HD2  ARG  38           HD2      ARG  38  -4.519 -12.896   5.926
  307    HD3  ARG  38           HD3      ARG  38  -3.108 -12.274   6.779
  308    HE   ARG  38           HE       ARG  38  -4.041 -10.394   4.874
  309   HH11  ARG  38          HH11      ARG  38  -4.816 -11.653   8.061
  310   HH12  ARG  38          HH12      ARG  38  -5.628 -10.207   8.558
  311   HH21  ARG  38          HH21      ARG  38  -5.794  -8.433   7.137
  312   HH22  ARG  38          HH22      ARG  38  -5.111  -8.514   5.548
  313    H    ASP  39           H        ASP  39  -4.354 -15.085   1.405
  314    HA   ASP  39           HA       ASP  39  -3.065 -17.396   2.360
  315    HB2  ASP  39           HB2      ASP  39  -5.404 -16.789   0.682
  316    HB3  ASP  39           HB3      ASP  39  -4.655 -18.350   0.365
  317    H    TYR  40           H        TYR  40  -2.966 -15.746  -0.800
  318    HA   TYR  40           HA       TYR  40  -1.586 -17.823  -2.160
  319    HB2  TYR  40           HB2      TYR  40  -3.035 -15.835  -3.082
  320    HB3  TYR  40           HB3      TYR  40  -1.504 -14.968  -3.062
  321    HD1  TYR  40           HD1      TYR  40  -3.201 -17.966  -4.441
  322    HD2  TYR  40           HD2      TYR  40   0.081 -15.288  -4.766
  323    HE1  TYR  40           HE1      TYR  40  -2.614 -18.961  -6.615
  324    HE2  TYR  40           HE2      TYR  40   0.682 -16.271  -6.940
  325    HH   TYR  40           HH       TYR  40  -1.383 -18.292  -8.674
  326    H    PHE  41           H        PHE  41  -0.586 -14.658  -0.867
  327    HA   PHE  41           HA       PHE  41   2.130 -14.975  -1.493
  328    HB2  PHE  41           HB2      PHE  41   0.499 -12.985  -0.116
  329    HB3  PHE  41           HB3      PHE  41   2.237 -12.914   0.075
  330    HD1  PHE  41           HD1      PHE  41   3.669 -12.342  -1.793
  331    HD2  PHE  41           HD2      PHE  41  -0.542 -12.739  -2.308
  332    HE1  PHE  41           HE1      PHE  41   3.856 -11.302  -4.008
  333    HE2  PHE  41           HE2      PHE  41  -0.349 -11.696  -4.545
  334    HZ   PHE  41           HZ       PHE  41   1.846 -10.980  -5.388
  335    H    SER  42           H        SER  42   0.267 -15.929   1.295
  336    HA   SER  42           HA       SER  42   2.326 -16.025   3.237
  337    HB2  SER  42           HB2      SER  42  -0.324 -17.378   2.955
  338    HB3  SER  42           HB3      SER  42   0.812 -17.991   4.156
  339    HG   SER  42           HG       SER  42   0.108 -16.431   5.361
  340    H    LYS  43           H        LYS  43   1.751 -17.619   0.490
  341    HA   LYS  43           HA       LYS  43   3.064 -20.117   1.034
  342    HB2  LYS  43           HB2      LYS  43   1.689 -18.868  -1.297
  343    HB3  LYS  43           HB3      LYS  43   2.719 -20.250  -1.551
  344    HG2  LYS  43           HG2      LYS  43   0.997 -20.846   0.623
  345    HG3  LYS  43           HG3      LYS  43   0.026 -20.199  -0.697
  346    HD2  LYS  43           HD2      LYS  43   1.020 -21.839  -2.227
  347    HD3  LYS  43           HD3      LYS  43   1.983 -22.488  -0.900
  348    HE2  LYS  43           HE2      LYS  43  -1.018 -22.366  -0.784
  349    HE3  LYS  43           HE3      LYS  43  -0.166 -23.726  -1.516
  350    HZ1  LYS  43           HZ1      LYS  43  -0.774 -24.048   0.854
  351    HZ2  LYS  43           HZ2      LYS  43   0.292 -22.802   1.267
  352    HZ3  LYS  43           HZ3      LYS  43   0.882 -24.214   0.548
  353    H    PHE  44           H        PHE  44   3.934 -16.991   0.111
  354    HA   PHE  44           HA       PHE  44   6.463 -17.749  -1.176
  355    HB2  PHE  44           HB2      PHE  44   4.649 -15.715  -1.656
  356    HB3  PHE  44           HB3      PHE  44   5.978 -14.932  -0.826
  357    HD1  PHE  44           HD1      PHE  44   4.825 -16.376  -3.898
  358    HD2  PHE  44           HD2      PHE  44   8.285 -15.067  -1.790
  359    HE1  PHE  44           HE1      PHE  44   6.077 -16.288  -6.012
  360    HE2  PHE  44           HE2      PHE  44   9.543 -14.977  -3.903
  361    HZ   PHE  44           HZ       PHE  44   8.436 -15.588  -6.017
  362    H    GLY  45           H        GLY  45   5.077 -16.269   1.642
  363    HA2  GLY  45           HA2      GLY  45   7.311 -16.662   3.288
  364    HA3  GLY  45           HA3      GLY  45   7.142 -14.969   2.850
  365    H    GLU  46           H        GLU  46   6.710 -14.611   5.094
  366    HA   GLU  46           HA       GLU  46   4.100 -15.414   5.970
  367    HB2  GLU  46           HB2      GLU  46   6.127 -15.918   7.426
  368    HB3  GLU  46           HB3      GLU  46   6.186 -14.187   7.739
  369    HG2  GLU  46           HG2      GLU  46   4.039 -14.198   8.741
  370    HG3  GLU  46           HG3      GLU  46   3.721 -15.840   8.200
  371    H    ILE  47           H        ILE  47   2.632 -14.059   6.314
  372    HA   ILE  47           HA       ILE  47   3.062 -11.224   5.759
  373    HB   ILE  47           HB       ILE  47   0.571 -12.792   5.387
  374   HG12  ILE  47          HG12      ILE  47   1.725 -11.473   3.115
  375   HG13  ILE  47          HG13      ILE  47   2.816 -12.631   3.847
  376   HG21  ILE  47          HG21      ILE  47  -0.174 -10.705   4.128
  377   HG22  ILE  47          HG22      ILE  47   1.123  -9.881   4.992
  378   HG23  ILE  47          HG23      ILE  47  -0.199 -10.627   5.891
  379   HD11  ILE  47          HD11      ILE  47   0.563 -14.117   3.683
  380   HD12  ILE  47          HD12      ILE  47   1.771 -14.063   2.398
  381   HD13  ILE  47          HD13      ILE  47   0.333 -13.043   2.308
  382    H    ARG  48           H        ARG  48   2.390  -9.665   7.037
  383    HA   ARG  48           HA       ARG  48   1.607 -10.306   9.763
  384    HB2  ARG  48           HB2      ARG  48   3.413  -8.600   8.767
  385    HB3  ARG  48           HB3      ARG  48   2.029  -7.536   8.753
  386    HG2  ARG  48           HG2      ARG  48   1.781  -7.630  11.077
  387    HG3  ARG  48           HG3      ARG  48   2.865  -9.016  11.221
  388    HD2  ARG  48           HD2      ARG  48   4.743  -7.624  10.499
  389    HD3  ARG  48           HD3      ARG  48   3.663  -6.240  10.343
  390    HE   ARG  48           HE       ARG  48   3.372  -7.088  12.935
  391   HH11  ARG  48          HH11      ARG  48   6.946  -5.348  12.345
  392   HH12  ARG  48          HH12      ARG  48   6.085  -5.996  10.989
  393   HH21  ARG  48          HH21      ARG  48   6.058  -5.480  14.441
  394   HH22  ARG  48          HH22      ARG  48   4.518  -6.230  14.696
  395    H    GLU  49           H        GLU  49   0.528  -8.529   6.937
  396    HA   GLU  49           HA       GLU  49  -2.238  -8.669   7.600
  397    HB2  GLU  49           HB2      GLU  49  -1.158  -6.614   8.892
  398    HB3  GLU  49           HB3      GLU  49  -1.273  -5.844   7.319
  399    HG2  GLU  49           HG2      GLU  49  -3.693  -6.317   7.300
  400    HG3  GLU  49           HG3      GLU  49  -3.547  -7.002   8.918
  401    H    CYS  50           H        CYS  50  -3.520  -7.828   5.858
  402    HA   CYS  50           HA       CYS  50  -2.195  -7.142   3.423
  403    HB2  CYS  50           HB2      CYS  50  -2.522  -9.562   3.263
  404    HB3  CYS  50           HB3      CYS  50  -4.241  -9.353   3.584
  405    HG   CYS  50           HG       CYS  50  -4.004  -9.929   0.893
  406    H    MET  51           H        MET  51  -3.443  -6.034   1.996
  407    HA   MET  51           HA       MET  51  -6.048  -5.100   2.803
  408    HB2  MET  51           HB2      MET  51  -4.497  -3.589   3.890
  409    HB3  MET  51           HB3      MET  51  -3.756  -3.270   2.349
  410    HG2  MET  51           HG2      MET  51  -5.690  -2.126   1.556
  411    HG3  MET  51           HG3      MET  51  -6.609  -2.608   2.981
  412    HE1  MET  51           HE1      MET  51  -3.347   0.647   2.804
  413    HE2  MET  51           HE2      MET  51  -4.242   0.038   1.413
  414    HE3  MET  51           HE3      MET  51  -3.074  -0.999   2.230
  415    H    VAL  52           H        VAL  52  -7.337  -4.801   1.230
  416    HA   VAL  52           HA       VAL  52  -6.418  -4.280  -1.493
  417    HB   VAL  52           HB       VAL  52  -8.680  -6.058  -0.750
  418   HG11  VAL  52          HG11      VAL  52  -9.319  -5.114  -2.797
  419   HG12  VAL  52          HG12      VAL  52  -8.585  -6.661  -3.232
  420   HG13  VAL  52          HG13      VAL  52  -7.668  -5.163  -3.414
  421   HG21  VAL  52          HG21      VAL  52  -6.407  -6.988  -0.356
  422   HG22  VAL  52          HG22      VAL  52  -6.127  -6.830  -2.088
  423   HG23  VAL  52          HG23      VAL  52  -7.390  -7.910  -1.495
  424    H    MET  53           H        MET  53  -7.214  -2.535  -2.271
  425    HA   MET  53           HA       MET  53  -9.010  -0.859  -0.817
  426    HB2  MET  53           HB2      MET  53  -7.302  -0.588  -3.210
  427    HB3  MET  53           HB3      MET  53  -8.704   0.470  -3.145
  428    HG2  MET  53           HG2      MET  53  -6.614   0.234  -0.990
  429    HG3  MET  53           HG3      MET  53  -6.670   1.498  -2.217
  430    HE1  MET  53           HE1      MET  53  -6.534   3.242  -0.137
  431    HE2  MET  53           HE2      MET  53  -6.606   1.917   1.023
  432    HE3  MET  53           HE3      MET  53  -7.720   3.278   1.168
  433    H    ARG  54           H        ARG  54 -11.086  -0.615  -0.969
  434    HA   ARG  54           HA       ARG  54 -12.521  -1.442  -3.396
  435    HB2  ARG  54           HB2      ARG  54 -12.749  -2.522  -0.692
  436    HB3  ARG  54           HB3      ARG  54 -14.293  -1.964  -1.325
  437    HG2  ARG  54           HG2      ARG  54 -14.052  -3.404  -3.258
  438    HG3  ARG  54           HG3      ARG  54 -12.455  -3.912  -2.706
  439    HD2  ARG  54           HD2      ARG  54 -13.414  -4.948  -0.749
  440    HD3  ARG  54           HD3      ARG  54 -15.014  -4.335  -1.166
  441    HE   ARG  54           HE       ARG  54 -13.922  -5.944  -3.250
  442   HH11  ARG  54          HH11      ARG  54 -16.211  -7.734  -0.475
  443   HH12  ARG  54          HH12      ARG  54 -15.544  -6.171  -0.142
  444   HH21  ARG  54          HH21      ARG  54 -14.812  -7.989  -3.665
  445   HH22  ARG  54          HH22      ARG  54 -15.796  -8.760  -2.467
  446    H    ASP  55           H        ASP  55 -14.694  -0.415  -3.579
  447    HA   ASP  55           HA       ASP  55 -14.695   2.241  -2.483
  448    HB2  ASP  55           HB2      ASP  55 -15.513   1.069  -5.019
  449    HB3  ASP  55           HB3      ASP  55 -16.490   2.384  -4.433
  450    HA   PRO  56           HA       PRO  56 -18.245   0.765  -0.043
  451    HB2  PRO  56           HB2      PRO  56 -18.561   3.618   0.650
  452    HB3  PRO  56           HB3      PRO  56 -18.328   2.226   1.713
  453    HG2  PRO  56           HG2      PRO  56 -16.380   4.013   1.326
  454    HG3  PRO  56           HG3      PRO  56 -16.036   2.285   1.542
  455    HD2  PRO  56           HD2      PRO  56 -16.053   3.902  -0.969
  456    HD3  PRO  56           HD3      PRO  56 -14.958   2.594  -0.470
  457    H    THR  57           H        THR  57 -18.240   2.959  -2.659
  458    HA   THR  57           HA       THR  57 -21.027   3.614  -2.595
  459    HB   THR  57           HB       THR  57 -20.555   4.597  -4.892
  460    HG1  THR  57           HG1      THR  57 -18.277   4.908  -5.288
  461   HG21  THR  57          HG21      THR  57 -18.908   5.619  -2.575
  462   HG22  THR  57          HG22      THR  57 -20.624   5.940  -2.826
  463   HG23  THR  57          HG23      THR  57 -19.433   6.554  -3.975
  464    H    THR  58           H        THR  58 -18.933   1.558  -4.579
  465    HA   THR  58           HA       THR  58 -21.330   0.278  -5.720
  466    HB   THR  58           HB       THR  58 -19.912  -0.390  -7.643
  467    HG1  THR  58           HG1      THR  58 -17.872   0.910  -7.771
  468   HG21  THR  58          HG21      THR  58 -21.248   1.596  -7.894
  469   HG22  THR  58          HG22      THR  58 -19.671   1.894  -8.627
  470   HG23  THR  58          HG23      THR  58 -20.045   2.561  -7.036
  471    H    LYS  59           H        LYS  59 -18.751  -0.217  -3.637
  472    HA   LYS  59           HA       LYS  59 -17.875  -1.971  -2.501
  473    HB2  LYS  59           HB2      LYS  59 -20.032  -3.770  -3.566
  474    HB3  LYS  59           HB3      LYS  59 -19.231  -3.823  -2.006
  475    HG2  LYS  59           HG2      LYS  59 -20.897  -1.470  -2.729
  476    HG3  LYS  59           HG3      LYS  59 -21.685  -2.962  -2.212
  477    HD2  LYS  59           HD2      LYS  59 -20.488  -2.905  -0.102
  478    HD3  LYS  59           HD3      LYS  59 -19.571  -1.492  -0.630
  479    HE2  LYS  59           HE2      LYS  59 -21.661  -0.207  -0.767
  480    HE3  LYS  59           HE3      LYS  59 -22.555  -1.617  -0.203
  481    HZ1  LYS  59           HZ1      LYS  59 -22.082  -0.020   1.576
  482    HZ2  LYS  59           HZ2      LYS  59 -20.422  -0.239   1.337
  483    HZ3  LYS  59           HZ3      LYS  59 -21.376  -1.527   1.877
  484    H    ARG  60           H        ARG  60 -17.598  -1.633  -5.568
  485    HA   ARG  60           HA       ARG  60 -16.498  -4.240  -6.319
  486    HB2  ARG  60           HB2      ARG  60 -16.904  -1.677  -7.870
  487    HB3  ARG  60           HB3      ARG  60 -16.119  -3.098  -8.543
  488    HG2  ARG  60           HG2      ARG  60 -18.805  -3.466  -7.341
  489    HG3  ARG  60           HG3      ARG  60 -18.708  -2.606  -8.879
  490    HD2  ARG  60           HD2      ARG  60 -17.717  -4.455  -9.963
  491    HD3  ARG  60           HD3      ARG  60 -17.374  -5.266  -8.436
  492    HE   ARG  60           HE       ARG  60 -19.742  -5.691  -8.212
  493   HH11  ARG  60          HH11      ARG  60 -20.118  -5.299 -12.192
  494   HH12  ARG  60          HH12      ARG  60 -18.725  -4.635 -11.406
  495   HH21  ARG  60          HH21      ARG  60 -21.555  -6.548  -9.263
  496   HH22  ARG  60          HH22      ARG  60 -21.718  -6.380 -10.980
  497    H    SER  61           H        SER  61 -14.343  -4.597  -6.860
  498    HA   SER  61           HA       SER  61 -12.421  -2.856  -5.550
  499    HB2  SER  61           HB2      SER  61 -10.809  -4.694  -6.080
  500    HB3  SER  61           HB3      SER  61 -12.211  -5.233  -5.155
  501    HG   SER  61           HG       SER  61 -13.113  -5.991  -7.116
  502    H    ARG  62           H        ARG  62 -10.454  -2.121  -6.579
  503    HA   ARG  62           HA       ARG  62 -10.902  -1.320  -9.352
  504    HB2  ARG  62           HB2      ARG  62  -9.374  -0.216  -7.079
  505    HB3  ARG  62           HB3      ARG  62  -8.648   0.003  -8.665
  506    HG2  ARG  62           HG2      ARG  62 -10.733   1.053  -9.450
  507    HG3  ARG  62           HG3      ARG  62 -11.405   0.883  -7.829
  508    HD2  ARG  62           HD2      ARG  62 -10.607   3.118  -8.049
  509    HD3  ARG  62           HD3      ARG  62  -9.501   2.263  -6.980
  510    HE   ARG  62           HE       ARG  62  -8.023   2.048  -8.987
  511   HH11  ARG  62          HH11      ARG  62  -9.427   5.707  -9.870
  512   HH12  ARG  62          HH12      ARG  62 -10.342   4.683  -8.815
  513   HH21  ARG  62          HH21      ARG  62  -6.844   3.408 -10.365
  514   HH22  ARG  62          HH22      ARG  62  -7.450   4.986 -10.746
  515    H    GLY  63           H        GLY  63  -9.194  -3.674  -7.678
  516    HA2  GLY  63           HA2      GLY  63  -7.974  -5.406  -8.694
  517    HA3  GLY  63           HA3      GLY  63  -7.689  -4.365 -10.078
  518    H    PHE  64           H        PHE  64  -7.068  -3.410  -6.736
  519    HA   PHE  64           HA       PHE  64  -4.239  -3.958  -6.939
  520    HB2  PHE  64           HB2      PHE  64  -3.397  -1.797  -6.950
  521    HB3  PHE  64           HB3      PHE  64  -4.711  -1.713  -8.103
  522    HD1  PHE  64           HD1      PHE  64  -3.811  -0.980  -4.615
  523    HD2  PHE  64           HD2      PHE  64  -6.384  -0.111  -7.864
  524    HE1  PHE  64           HE1      PHE  64  -4.692   0.974  -3.375
  525    HE2  PHE  64           HE2      PHE  64  -7.288   1.834  -6.648
  526    HZ   PHE  64           HZ       PHE  64  -6.442   2.378  -4.398
  527    H    GLY  65           H        GLY  65  -3.077  -3.758  -4.954
  528    HA2  GLY  65           HA2      GLY  65  -4.345  -2.954  -2.577
  529    HA3  GLY  65           HA3      GLY  65  -4.297  -4.703  -2.732
  530    H    PHE  66           H        PHE  66  -2.994  -4.295  -0.772
  531    HA   PHE  66           HA       PHE  66  -0.197  -4.218  -1.321
  532    HB2  PHE  66           HB2      PHE  66  -1.702  -2.928   0.895
  533    HB3  PHE  66           HB3      PHE  66   0.014  -3.116   0.892
  534    HD1  PHE  66           HD1      PHE  66   1.413  -1.592  -0.310
  535    HD2  PHE  66           HD2      PHE  66  -2.818  -1.493  -0.754
  536    HE1  PHE  66           HE1      PHE  66   1.596   0.558  -1.496
  537    HE2  PHE  66           HE2      PHE  66  -2.646   0.662  -1.944
  538    HZ   PHE  66           HZ       PHE  66  -0.435   1.686  -2.318
  539    H    VAL  67           H        VAL  67   1.012  -5.319   0.354
  540    HA   VAL  67           HA       VAL  67  -0.383  -7.080   2.182
  541    HB   VAL  67           HB       VAL  67   1.483  -8.232   0.074
  542   HG11  VAL  67          HG11      VAL  67   0.939  -9.124   2.744
  543   HG12  VAL  67          HG12      VAL  67   2.004  -9.841   1.531
  544   HG13  VAL  67          HG13      VAL  67   0.301 -10.298   1.589
  545   HG21  VAL  67          HG21      VAL  67  -0.855  -7.926  -0.701
  546   HG22  VAL  67          HG22      VAL  67  -1.393  -8.951   0.627
  547   HG23  VAL  67          HG23      VAL  67  -0.359  -9.620  -0.637
  548    H    THR  68           H        THR  68   0.597  -7.183   3.928
  549    HA   THR  68           HA       THR  68   3.210  -5.957   4.177
  550    HB   THR  68           HB       THR  68   1.453  -6.521   6.460
  551    HG1  THR  68           HG1      THR  68   0.402  -5.401   4.485
  552   HG21  THR  68          HG21      THR  68   2.725  -3.930   6.325
  553   HG22  THR  68          HG22      THR  68   3.893  -5.239   6.075
  554   HG23  THR  68          HG23      THR  68   2.905  -5.197   7.541
  555    H    PHE  69           H        PHE  69   4.737  -7.355   4.104
  556    HA   PHE  69           HA       PHE  69   4.505 -10.008   5.079
  557    HB2  PHE  69           HB2      PHE  69   6.682  -8.464   3.716
  558    HB3  PHE  69           HB3      PHE  69   6.910 -10.103   4.290
  559    HD1  PHE  69           HD1      PHE  69   5.657 -11.972   3.292
  560    HD2  PHE  69           HD2      PHE  69   5.315  -7.990   1.824
  561    HE1  PHE  69           HE1      PHE  69   4.537 -12.813   1.271
  562    HE2  PHE  69           HE2      PHE  69   4.205  -8.830  -0.201
  563    HZ   PHE  69           HZ       PHE  69   3.808 -11.231  -0.467
  564    H    ALA  70           H        ALA  70   4.965 -10.666   7.081
  565    HA   ALA  70           HA       ALA  70   6.080  -8.926   8.995
  566    HB1  ALA  70           HB1      ALA  70   5.467 -11.828   9.389
  567    HB2  ALA  70           HB2      ALA  70   4.257 -10.551   9.484
  568    HB3  ALA  70           HB3      ALA  70   5.590 -10.588  10.636
  569    H    ASP  71           H        ASP  71   7.619 -10.488   6.795
  570    HA   ASP  71           HA       ASP  71  10.030 -10.836   8.350
  571    HB2  ASP  71           HB2      ASP  71   8.808 -12.935   7.417
  572    HB3  ASP  71           HB3      ASP  71   9.525 -12.452   5.912
  573    HA   PRO  72           HA       PRO  72  11.658  -8.077   5.151
  574    HB2  PRO  72           HB2      PRO  72  14.294  -8.801   6.060
  575    HB3  PRO  72           HB3      PRO  72  13.499  -7.251   6.111
  576    HG2  PRO  72           HG2      PRO  72  14.016  -8.625   8.352
  577    HG3  PRO  72           HG3      PRO  72  12.576  -7.602   8.181
  578    HD2  PRO  72           HD2      PRO  72  12.810 -10.574   7.944
  579    HD3  PRO  72           HD3      PRO  72  11.549  -9.592   8.722
  580    H    ALA  73           H        ALA  73  12.381 -11.340   5.663
  581    HA   ALA  73           HA       ALA  73  14.167 -11.703   3.469
  582    HB1  ALA  73           HB1      ALA  73  14.088 -14.066   3.976
  583    HB2  ALA  73           HB2      ALA  73  12.723 -13.798   5.059
  584    HB3  ALA  73           HB3      ALA  73  14.306 -13.127   5.452
  585    H    SER  74           H        SER  74  10.775 -11.861   3.939
  586    HA   SER  74           HA       SER  74  10.129 -13.375   1.609
  587    HB2  SER  74           HB2      SER  74   8.632 -13.008   3.656
  588    HB3  SER  74           HB3      SER  74   8.248 -11.442   2.938
  589    HG   SER  74           HG       SER  74   7.943 -13.931   1.606
  590    H    VAL  75           H        VAL  75  10.644 -10.035   2.266
  591    HA   VAL  75           HA       VAL  75   9.633  -9.015  -0.174
  592    HB   VAL  75           HB       VAL  75  11.749  -7.687   1.525
  593   HG11  VAL  75          HG11      VAL  75  11.330  -6.604  -0.626
  594   HG12  VAL  75          HG12      VAL  75  10.779  -5.587   0.706
  595   HG13  VAL  75          HG13      VAL  75   9.610  -6.498  -0.250
  596   HG21  VAL  75          HG21      VAL  75   9.935  -8.307   3.019
  597   HG22  VAL  75          HG22      VAL  75   8.757  -7.573   1.932
  598   HG23  VAL  75          HG23      VAL  75   9.936  -6.559   2.768
  599    H    ASP  76           H        ASP  76  12.627 -10.266   0.911
  600    HA   ASP  76           HA       ASP  76  14.264  -9.531  -1.261
  601    HB2  ASP  76           HB2      ASP  76  14.789 -10.389   1.179
  602    HB3  ASP  76           HB3      ASP  76  14.795 -11.948   0.385
  603    H    LYS  77           H        LYS  77  12.435 -12.324  -0.375
  604    HA   LYS  77           HA       LYS  77  13.102 -14.029  -2.477
  605    HB2  LYS  77           HB2      LYS  77  10.713 -13.979  -0.660
  606    HB3  LYS  77           HB3      LYS  77  10.977 -15.248  -1.846
  607    HG2  LYS  77           HG2      LYS  77  13.266 -15.539  -0.679
  608    HG3  LYS  77           HG3      LYS  77  12.520 -14.641   0.643
  609    HD2  LYS  77           HD2      LYS  77  10.753 -16.280   0.817
  610    HD3  LYS  77           HD3      LYS  77  11.375 -17.146  -0.588
  611    HE2  LYS  77           HE2      LYS  77  13.440 -17.634   0.636
  612    HE3  LYS  77           HE3      LYS  77  12.808 -16.776   2.041
  613    HZ1  LYS  77           HZ1      LYS  77  11.591 -19.196   0.819
  614    HZ2  LYS  77           HZ2      LYS  77  11.024 -18.386   2.191
  615    HZ3  LYS  77           HZ3      LYS  77  12.519 -19.176   2.235
  616    H    VAL  78           H        VAL  78  10.456 -11.760  -2.108
  617    HA   VAL  78           HA       VAL  78   9.244 -12.442  -4.613
  618    HB   VAL  78           HB       VAL  78   8.637 -10.020  -2.895
  619   HG11  VAL  78          HG11      VAL  78   6.965 -11.377  -5.016
  620   HG12  VAL  78          HG12      VAL  78   7.806  -9.841  -5.210
  621   HG13  VAL  78          HG13      VAL  78   6.487  -9.984  -4.046
  622   HG21  VAL  78          HG21      VAL  78   8.289 -12.029  -1.594
  623   HG22  VAL  78          HG22      VAL  78   7.383 -12.767  -2.915
  624   HG23  VAL  78          HG23      VAL  78   6.723 -11.367  -2.067
  625    H    LEU  79           H        LEU  79  11.568 -10.043  -3.524
  626    HA   LEU  79           HA       LEU  79  11.509  -8.228  -5.638
  627    HB2  LEU  79           HB2      LEU  79  12.688  -8.480  -3.235
  628    HB3  LEU  79           HB3      LEU  79  14.034  -8.889  -4.258
  629    HG   LEU  79           HG       LEU  79  13.980  -6.562  -3.482
  630   HD11  LEU  79          HD11      LEU  79  14.544  -5.513  -5.622
  631   HD12  LEU  79          HD12      LEU  79  13.827  -6.883  -6.468
  632   HD13  LEU  79          HD13      LEU  79  15.255  -7.119  -5.460
  633   HD21  LEU  79          HD21      LEU  79  11.440  -6.368  -3.724
  634   HD22  LEU  79          HD22      LEU  79  11.771  -5.980  -5.414
  635   HD23  LEU  79          HD23      LEU  79  12.426  -4.963  -4.132
  636    H    GLY  80           H        GLY  80  13.237 -11.284  -5.190
  637    HA2  GLY  80           HA2      GLY  80  14.866 -11.043  -7.493
  638    HA3  GLY  80           HA3      GLY  80  14.645 -12.493  -6.548
  639    H    GLN  81           H        GLN  81  11.726 -12.332  -6.883
  640    HA   GLN  81           HA       GLN  81  11.527 -13.412  -9.581
  641    HB2  GLN  81           HB2      GLN  81   9.995 -13.795  -7.023
  642    HB3  GLN  81           HB3      GLN  81   9.361 -14.332  -8.560
  643    HG2  GLN  81           HG2      GLN  81  11.300 -15.760  -8.891
  644    HG3  GLN  81           HG3      GLN  81  11.985 -15.165  -7.379
  645   HE21  GLN  81          HE21      GLN  81   9.462 -17.113  -8.816
  646   HE22  GLN  81          HE22      GLN  81   9.071 -18.006  -7.390
  647    HA   PRO  82           HA       PRO  82   9.301  -9.405 -10.115
  648    HB2  PRO  82           HB2      PRO  82   9.887  -9.598 -12.941
  649    HB3  PRO  82           HB3      PRO  82  10.497  -8.429 -11.766
  650    HG2  PRO  82           HG2      PRO  82  12.070 -10.308 -12.945
  651    HG3  PRO  82           HG3      PRO  82  12.391  -9.623 -11.341
  652    HD2  PRO  82           HD2      PRO  82  11.147 -12.247 -12.056
  653    HD3  PRO  82           HD3      PRO  82  12.317 -11.856 -10.776
  654    H    HIS  83           H        HIS  83   8.949 -12.320 -12.108
  655    HA   HIS  83           HA       HIS  83   6.404 -11.452 -13.183
  656    HB2  HIS  83           HB2      HIS  83   8.258 -12.927 -14.302
  657    HB3  HIS  83           HB3      HIS  83   7.462 -14.239 -13.445
  658    HD1  HIS  83           HD1      HIS  83   5.040 -14.855 -14.218
  659    HD2  HIS  83           HD2      HIS  83   6.876 -11.895 -16.485
  660    HE1  HIS  83           HE1      HIS  83   3.619 -14.605 -16.279
  661    HE2  HIS  83           HE2      HIS  83   4.749 -12.808 -17.637
  662    H    HIS  84           H        HIS  84   4.476 -11.855 -12.346
  663    HA   HIS  84           HA       HIS  84   4.049 -14.077 -10.499
  664    HB2  HIS  84           HB2      HIS  84   4.358 -11.522  -9.588
  665    HB3  HIS  84           HB3      HIS  84   2.617 -11.586  -9.832
  666    HD1  HIS  84           HD1      HIS  84   1.252 -12.954  -8.192
  667    HD2  HIS  84           HD2      HIS  84   5.349 -13.349  -7.627
  668    HE1  HIS  84           HE1      HIS  84   1.516 -14.186  -6.020
  669    HE2  HIS  84           HE2      HIS  84   4.001 -14.420  -5.696
  670    H    GLU  85           H        GLU  85   2.299 -15.160 -11.110
  671    HA   GLU  85           HA       GLU  85   0.429 -13.923 -12.901
  672    HB2  GLU  85           HB2      GLU  85   1.982 -16.012 -13.518
  673    HB3  GLU  85           HB3      GLU  85   0.640 -16.879 -12.785
  674    HG2  GLU  85           HG2      GLU  85  -0.899 -15.964 -14.376
  675    HG3  GLU  85           HG3      GLU  85   0.347 -14.905 -15.035
  676    H    LEU  86           H        LEU  86  -1.576 -13.935 -12.451
  677    HA   LEU  86           HA       LEU  86  -2.797 -15.562 -10.415
  678    HB2  LEU  86           HB2      LEU  86  -2.233 -13.605  -9.171
  679    HB3  LEU  86           HB3      LEU  86  -2.663 -12.564 -10.501
  680    HG   LEU  86           HG       LEU  86  -5.048 -13.470 -10.126
  681   HD11  LEU  86          HD11      LEU  86  -3.779 -14.005  -7.443
  682   HD12  LEU  86          HD12      LEU  86  -4.572 -15.175  -8.497
  683   HD13  LEU  86          HD13      LEU  86  -5.517 -13.905  -7.722
  684   HD21  LEU  86          HD21      LEU  86  -4.633 -11.181  -9.872
  685   HD22  LEU  86          HD22      LEU  86  -3.625 -11.435  -8.449
  686   HD23  LEU  86          HD23      LEU  86  -5.366 -11.670  -8.348
  687    H    ASP  87           H        ASP  87  -4.731 -16.133 -11.048
  688    HA   ASP  87           HA       ASP  87  -6.470 -16.686 -12.390
  689    HB2  ASP  87           HB2      ASP  87  -6.997 -14.475 -11.370
  690    HB3  ASP  87           HB3      ASP  87  -6.568 -13.751 -12.892
  691    H    SER  88           H        SER  88  -4.006 -16.795 -13.514
  692    HA   SER  88           HA       SER  88  -2.949 -17.350 -15.453
  693    HB2  SER  88           HB2      SER  88  -5.642 -16.876 -16.758
  694    HB3  SER  88           HB3      SER  88  -4.243 -17.591 -17.561
  695    HG   SER  88           HG       SER  88  -4.405 -19.055 -15.529
  696    H    LYS  89           H        LYS  89  -3.620 -14.379 -14.576
  697    HA   LYS  89           HA       LYS  89  -2.401 -13.202 -16.942
  698    HB2  LYS  89           HB2      LYS  89  -3.508 -11.001 -16.067
  699    HB3  LYS  89           HB3      LYS  89  -4.404 -12.102 -17.086
  700    HG2  LYS  89           HG2      LYS  89  -5.434 -13.041 -14.985
  701    HG3  LYS  89           HG3      LYS  89  -4.665 -11.713 -14.112
  702    HD2  LYS  89           HD2      LYS  89  -5.835 -10.113 -15.592
  703    HD3  LYS  89           HD3      LYS  89  -6.658 -11.470 -16.365
  704    HE2  LYS  89           HE2      LYS  89  -7.647 -12.081 -14.200
  705    HE3  LYS  89           HE3      LYS  89  -6.847 -10.696 -13.455
  706    HZ1  LYS  89           HZ1      LYS  89  -8.938 -10.620 -15.561
  707    HZ2  LYS  89           HZ2      LYS  89  -8.092  -9.261 -15.015
  708    HZ3  LYS  89           HZ3      LYS  89  -9.095 -10.115 -13.953
  709    H    THR  90           H        THR  90  -1.080 -11.528 -16.620
  710    HA   THR  90           HA       THR  90   0.700 -11.801 -14.362
  711    HB   THR  90           HB       THR  90   1.058  -9.812 -16.593
  712    HG1  THR  90           HG1      THR  90   0.790 -11.577 -17.813
  713   HG21  THR  90          HG21      THR  90   3.443 -10.336 -16.267
  714   HG22  THR  90          HG22      THR  90   3.013 -11.472 -14.989
  715   HG23  THR  90          HG23      THR  90   2.701  -9.749 -14.780
  716    H    ILE  91           H        ILE  91   0.638 -10.582 -12.583
  717    HA   ILE  91           HA       ILE  91  -0.712  -7.970 -12.690
  718    HB   ILE  91           HB       ILE  91  -1.217  -8.219 -10.309
  719   HG12  ILE  91          HG12      ILE  91  -0.442 -11.078 -10.421
  720   HG13  ILE  91          HG13      ILE  91   0.721  -9.886  -9.877
  721   HG21  ILE  91          HG21      ILE  91  -2.932  -9.952 -10.564
  722   HG22  ILE  91          HG22      ILE  91  -2.133 -10.498 -12.037
  723   HG23  ILE  91          HG23      ILE  91  -2.842  -8.886 -11.963
  724   HD11  ILE  91          HD11      ILE  91  -1.978  -9.855  -8.637
  725   HD12  ILE  91          HD12      ILE  91  -0.389  -9.520  -7.929
  726   HD13  ILE  91          HD13      ILE  91  -0.890 -11.185  -8.208
  727    H    ASP  92           H        ASP  92   0.174  -6.413 -10.777
  728    HA   ASP  92           HA       ASP  92   3.087  -6.472 -11.206
  729    HB2  ASP  92           HB2      ASP  92   1.613  -4.699 -12.331
  730    HB3  ASP  92           HB3      ASP  92   1.493  -3.978 -10.734
  731    HA   PRO  93           HA       PRO  93   2.902  -6.259  -6.589
  732    HB2  PRO  93           HB2      PRO  93   4.765  -8.448  -6.420
  733    HB3  PRO  93           HB3      PRO  93   3.077  -8.425  -5.901
  734    HG2  PRO  93           HG2      PRO  93   3.994  -9.949  -7.977
  735    HG3  PRO  93           HG3      PRO  93   2.320  -9.384  -7.825
  736    HD2  PRO  93           HD2      PRO  93   4.545  -8.258  -9.488
  737    HD3  PRO  93           HD3      PRO  93   2.830  -8.486  -9.902
  738    H    LYS  94           H        LYS  94   4.193  -4.697  -5.800
  739    HA   LYS  94           HA       LYS  94   7.075  -4.868  -6.145
  740    HB2  LYS  94           HB2      LYS  94   7.243  -2.474  -6.944
  741    HB3  LYS  94           HB3      LYS  94   6.655  -3.632  -8.122
  742    HG2  LYS  94           HG2      LYS  94   5.166  -1.959  -8.508
  743    HG3  LYS  94           HG3      LYS  94   4.298  -2.778  -7.208
  744    HD2  LYS  94           HD2      LYS  94   5.201  -1.210  -5.585
  745    HD3  LYS  94           HD3      LYS  94   6.157  -0.425  -6.843
  746    HE2  LYS  94           HE2      LYS  94   3.160  -0.618  -6.978
  747    HE3  LYS  94           HE3      LYS  94   3.983   0.712  -6.166
  748    HZ1  LYS  94           HZ1      LYS  94   3.421   1.290  -8.437
  749    HZ2  LYS  94           HZ2      LYS  94   4.295  -0.033  -9.025
  750    HZ3  LYS  94           HZ3      LYS  94   5.102   1.234  -8.250
  751    H    VAL  95           H        VAL  95   8.310  -3.583  -4.728
  752    HA   VAL  95           HA       VAL  95   7.034  -3.051  -2.208
  753    HB   VAL  95           HB       VAL  95   9.864  -2.409  -2.794
  754   HG11  VAL  95          HG11      VAL  95  10.216  -3.025  -0.447
  755   HG12  VAL  95          HG12      VAL  95   8.496  -3.391  -0.302
  756   HG13  VAL  95          HG13      VAL  95   9.023  -1.736  -0.615
  757   HG21  VAL  95          HG21      VAL  95   8.797  -5.151  -2.175
  758   HG22  VAL  95          HG22      VAL  95  10.503  -4.706  -2.173
  759   HG23  VAL  95          HG23      VAL  95   9.578  -4.645  -3.674
  760    H    ALA  96           H        ALA  96   6.721  -1.116  -1.191
  761    HA   ALA  96           HA       ALA  96   6.258   1.190  -2.693
  762    HB1  ALA  96           HB1      ALA  96   5.076   0.682  -0.623
  763    HB2  ALA  96           HB2      ALA  96   5.800   2.289  -0.574
  764    HB3  ALA  96           HB3      ALA  96   6.558   0.954   0.293
  765    H    PHE  97           H        PHE  97   7.234   3.251  -2.677
  766    HA   PHE  97           HA       PHE  97  10.132   3.223  -2.242
  767    HB2  PHE  97           HB2      PHE  97   8.299   4.424  -4.225
  768    HB3  PHE  97           HB3      PHE  97   9.669   5.410  -3.753
  769    HD1  PHE  97           HD1      PHE  97  11.871   4.890  -4.486
  770    HD2  PHE  97           HD2      PHE  97   8.661   2.199  -5.254
  771    HE1  PHE  97           HE1      PHE  97  13.305   3.625  -6.034
  772    HE2  PHE  97           HE2      PHE  97  10.091   0.933  -6.805
  773    HZ   PHE  97           HZ       PHE  97  12.415   1.644  -7.195
  774    HA   PRO  98           HA       PRO  98   9.116   6.192   1.103
  775    HB2  PRO  98           HB2      PRO  98  11.919   6.132   1.853
  776    HB3  PRO  98           HB3      PRO  98  10.531   5.483   2.730
  777    HG2  PRO  98           HG2      PRO  98  12.440   3.908   1.615
  778    HG3  PRO  98           HG3      PRO  98  10.757   3.396   1.839
  779    HD2  PRO  98           HD2      PRO  98  12.113   4.379  -0.639
  780    HD3  PRO  98           HD3      PRO  98  10.948   3.054  -0.431
  781    H    ARG  99           H        ARG  99  10.193   8.282   1.929
  782    HA   ARG  99           HA       ARG  99  11.067   9.843  -0.397
  783    HB2  ARG  99           HB2      ARG  99   9.756  10.566   2.209
  784    HB3  ARG  99           HB3      ARG  99  10.578  11.791   1.254
  785    HG2  ARG  99           HG2      ARG  99   9.103  11.269  -0.646
  786    HG3  ARG  99           HG3      ARG  99   8.256  10.092   0.359
  787    HD2  ARG  99           HD2      ARG  99   8.531  12.982   1.148
  788    HD3  ARG  99           HD3      ARG  99   7.206  12.406   0.137
  789    HE   ARG  99           HE       ARG  99   7.293  10.785   2.399
  790   HH11  ARG  99          HH11      ARG  99   6.629  14.159   1.673
  791   HH12  ARG  99          HH12      ARG  99   5.563  14.357   3.024
  792   HH21  ARG  99          HH21      ARG  99   5.149  12.608   4.429
  793   HH22  ARG  99          HH22      ARG  99   5.895  11.069   4.157
  794    H    ARG 100           H        ARG 100  12.012   9.051   2.922
  795    HA   ARG 100           HA       ARG 100  14.477  10.610   2.666
  796    HB2  ARG 100           HB2      ARG 100  12.837  10.363   4.775
  797    HB3  ARG 100           HB3      ARG 100  13.910   9.013   5.111
  798    HG2  ARG 100           HG2      ARG 100  15.835  10.599   4.943
  799    HG3  ARG 100           HG3      ARG 100  14.665  11.913   4.820
  800    HD2  ARG 100           HD2      ARG 100  14.656   9.959   7.104
  801    HD3  ARG 100           HD3      ARG 100  15.629  11.428   7.128
  802    HE   ARG 100           HE       ARG 100  13.416  12.608   6.768
  803   HH11  ARG 100          HH11      ARG 100  12.195   9.860   9.430
  804   HH12  ARG 100          HH12      ARG 100  13.617   9.553   8.491
  805   HH21  ARG 100          HH21      ARG 100  11.559  12.987   8.010
  806   HH22  ARG 100          HH22      ARG 100  11.031  11.802   9.158
  807    H    ALA 101           H        ALA 101  16.551   9.662   3.065
  808    HA   ALA 101           HA       ALA 101  16.835   7.047   1.950
  809    HB1  ALA 101           HB1      ALA 101  18.844   7.749   1.276
  810    HB2  ALA 101           HB2      ALA 101  19.293   8.251   2.903
  811    HB3  ALA 101           HB3      ALA 101  18.362   9.339   1.873
  812    H    GLN 102           H        GLN 102  18.604   5.598   2.924
  813    HA   GLN 102           HA       GLN 102  18.243   5.374   5.843
  814    HB2  GLN 102           HB2      GLN 102  18.103   3.245   3.723
  815    HB3  GLN 102           HB3      GLN 102  18.476   2.843   5.392
  816    HG2  GLN 102           HG2      GLN 102  16.349   3.809   6.103
  817    HG3  GLN 102           HG3      GLN 102  15.976   4.220   4.430
  818   HE21  GLN 102          HE21      GLN 102  15.469   2.573   2.975
  819   HE22  GLN 102          HE22      GLN 102  15.005   0.996   3.505
  820    HA   PRO 103           HA       PRO 103  22.733   5.262   5.840
  821    HB2  PRO 103           HB2      PRO 103  23.205   4.514   8.393
  822    HB3  PRO 103           HB3      PRO 103  22.594   6.122   7.979
  823    HG2  PRO 103           HG2      PRO 103  21.107   3.761   9.030
  824    HG3  PRO 103           HG3      PRO 103  20.928   5.478   9.441
  825    HD2  PRO 103           HD2      PRO 103  19.265   4.142   7.719
  826    HD3  PRO 103           HD3      PRO 103  19.548   5.891   7.671
  827    H    LYS 104           H        LYS 104  24.571   3.704   6.639
  828    HA   LYS 104           HA       LYS 104  24.066   1.115   5.445
  829    HB2  LYS 104           HB2      LYS 104  26.570   2.383   6.567
  830    HB3  LYS 104           HB3      LYS 104  26.530   0.765   5.886
  831    HG2  LYS 104           HG2      LYS 104  25.934   1.628   3.724
  832    HG3  LYS 104           HG3      LYS 104  25.771   3.259   4.377
  833    HD2  LYS 104           HD2      LYS 104  28.211   3.073   5.055
  834    HD3  LYS 104           HD3      LYS 104  28.278   1.626   4.050
  835    HE2  LYS 104           HE2      LYS 104  27.594   2.928   2.107
  836    HE3  LYS 104           HE3      LYS 104  27.472   4.375   3.107
  837    HZ1  LYS 104           HZ1      LYS 104  29.547   4.381   1.930
  838    HZ2  LYS 104           HZ2      LYS 104  29.946   2.844   2.514
  839    HZ3  LYS 104           HZ3      LYS 104  29.862   4.157   3.577
  840    H    MET 105           H        MET 105  23.656  -0.728   6.472
  841    HA   MET 105           HA       MET 105  23.675  -0.776   9.394
  842    HB2  MET 105           HB2      MET 105  22.442  -2.626   7.349
  843    HB3  MET 105           HB3      MET 105  22.403  -2.933   9.079
  844    HG2  MET 105           HG2      MET 105  21.221  -0.762   9.374
  845    HG3  MET 105           HG3      MET 105  21.151  -0.616   7.619
  846    HE1  MET 105           HE1      MET 105  20.453  -3.364  10.403
  847    HE2  MET 105           HE2      MET 105  18.696  -3.433  10.279
  848    HE3  MET 105           HE3      MET 105  19.486  -1.937  10.774
  849    H    VAL 106           H        VAL 106  24.711  -2.346  10.626
  850    HA   VAL 106           HA       VAL 106  27.016  -3.598   9.335
  851    HB   VAL 106           HB       VAL 106  26.571  -3.521  12.308
  852   HG11  VAL 106          HG11      VAL 106  29.005  -3.528  12.425
  853   HG12  VAL 106          HG12      VAL 106  29.104  -3.457  10.665
  854   HG13  VAL 106          HG13      VAL 106  28.427  -4.883  11.454
  855   HG21  VAL 106          HG21      VAL 106  26.261  -1.216  11.532
  856   HG22  VAL 106          HG22      VAL 106  27.816  -1.288  10.705
  857   HG23  VAL 106          HG23      VAL 106  27.747  -1.390  12.463
  858    H    THR 107           H        THR 107  27.649  -5.777  10.079
  859    HA   THR 107           HA       THR 107  25.369  -7.536  10.207
  860    HB   THR 107           HB       THR 107  28.197  -8.441   9.725
  861    HG1  THR 107           HG1      THR 107  26.421  -7.642   7.654
  862   HG21  THR 107          HG21      THR 107  26.561 -10.211  10.046
  863   HG22  THR 107          HG22      THR 107  27.062 -10.174   8.354
  864   HG23  THR 107          HG23      THR 107  25.506  -9.493   8.828
  865    H    ARG 108           H        ARG 108  24.808  -7.653  12.307
  866    HA   ARG 108           HA       ARG 108  26.798  -8.111  14.385
  867    HB2  ARG 108           HB2      ARG 108  23.852  -7.516  14.407
  868    HB3  ARG 108           HB3      ARG 108  24.679  -8.058  15.861
  869    HG2  ARG 108           HG2      ARG 108  26.130  -6.144  15.815
  870    HG3  ARG 108           HG3      ARG 108  25.473  -5.635  14.259
  871    HD2  ARG 108           HD2      ARG 108  23.262  -5.357  15.323
  872    HD3  ARG 108           HD3      ARG 108  23.980  -5.785  16.875
  873    HE   ARG 108           HE       ARG 108  25.477  -3.686  15.874
  874   HH11  ARG 108          HH11      ARG 108  22.140  -4.166  16.861
  875   HH12  ARG 108          HH12      ARG 108  21.922  -2.512  17.328
  876   HH21  ARG 108          HH21      ARG 108  23.635  -1.021  17.115
  877   HH22  ARG 108          HH22      ARG 108  25.167  -1.529  16.487
  878    H    THR 109           H        THR 109  26.809  -9.860  15.796
  879    HA   THR 109           HA       THR 109  25.152 -12.189  15.177
  880    HB   THR 109           HB       THR 109  27.240 -13.654  15.359
  881    HG1  THR 109           HG1      THR 109  28.441 -11.131  14.811
  882   HG21  THR 109          HG21      THR 109  25.980 -13.284  13.259
  883   HG22  THR 109          HG22      THR 109  27.705 -13.525  12.989
  884   HG23  THR 109          HG23      THR 109  27.018 -11.902  12.910
  885    H    LYS 110           H        LYS 110  27.448 -10.594  17.312
  886    HA   LYS 110           HA       LYS 110  27.119 -12.426  19.468
  887    HB2  LYS 110           HB2      LYS 110  28.530  -9.797  19.166
  888    HB3  LYS 110           HB3      LYS 110  28.382 -10.571  20.735
  889    HG2  LYS 110           HG2      LYS 110  29.646 -12.453  20.016
  890    HG3  LYS 110           HG3      LYS 110  29.605 -11.913  18.337
  891    HD2  LYS 110           HD2      LYS 110  30.927  -9.941  18.941
  892    HD3  LYS 110           HD3      LYS 110  30.966 -10.481  20.620
  893    HE2  LYS 110           HE2      LYS 110  31.993 -12.199  18.382
  894    HE3  LYS 110           HE3      LYS 110  33.007 -10.980  19.152
  895    HZ1  LYS 110           HZ1      LYS 110  32.742 -12.076  21.252
  896    HZ2  LYS 110           HZ2      LYS 110  33.261 -13.218  20.116
  897    HZ3  LYS 110           HZ3      LYS 110  31.641 -13.184  20.600
  898    H    LYS 111           H        LYS 111  25.730  -9.342  18.554
  899    HA   LYS 111           HA       LYS 111  24.404  -8.951  21.059
  900    HB2  LYS 111           HB2      LYS 111  24.446  -7.430  18.474
  901    HB3  LYS 111           HB3      LYS 111  23.305  -7.024  19.748
  902    HG2  LYS 111           HG2      LYS 111  25.148  -6.596  21.281
  903    HG3  LYS 111           HG3      LYS 111  26.305  -7.037  20.023
  904    HD2  LYS 111           HD2      LYS 111  25.522  -5.187  18.640
  905    HD3  LYS 111           HD3      LYS 111  24.332  -4.758  19.870
  906    HE2  LYS 111           HE2      LYS 111  26.120  -4.282  21.453
  907    HE3  LYS 111           HE3      LYS 111  27.323  -4.758  20.255
  908    HZ1  LYS 111           HZ1      LYS 111  26.611  -2.934  18.853
  909    HZ2  LYS 111           HZ2      LYS 111  27.066  -2.352  20.376
  910    HZ3  LYS 111           HZ3      LYS 111  25.428  -2.488  19.977
  Start of MODEL    6
    1    H1   MET  -3           H1       MET  -3  54.255 -27.691   9.068
    2    H2   MET  -3           H2       MET  -3  54.062 -28.789   7.797
    3    H3   MET  -3           H3       MET  -3  52.796 -28.529   8.888
    4    HA   MET  -3           HA       MET  -3  53.899 -26.524   7.010
    5    HB2  MET  -3           HB2      MET  -3  51.470 -28.289   6.924
    6    HB3  MET  -3           HB3      MET  -3  51.486 -26.748   6.078
    7    HG2  MET  -3           HG2      MET  -3  53.474 -27.480   4.830
    8    HG3  MET  -3           HG3      MET  -3  53.392 -29.038   5.649
    9    HE1  MET  -3           HE1      MET  -3  53.363 -28.434   2.399
   10    HE2  MET  -3           HE2      MET  -3  52.259 -29.718   1.911
   11    HE3  MET  -3           HE3      MET  -3  53.495 -30.034   3.128
   12    H    HIS  -2           H        HIS  -2  51.530 -27.303   9.522
   13    HA   HIS  -2           HA       HIS  -2  50.710 -24.499   9.681
   14    HB2  HIS  -2           HB2      HIS  -2  49.562 -27.077  10.645
   15    HB3  HIS  -2           HB3      HIS  -2  49.172 -25.609  11.534
   16    HD1  HIS  -2           HD1      HIS  -2  47.682 -23.863  10.350
   17    HD2  HIS  -2           HD2      HIS  -2  48.404 -27.285   8.104
   18    HE1  HIS  -2           HE1      HIS  -2  46.041 -23.778   8.447
   19    HE2  HIS  -2           HE2      HIS  -2  46.496 -25.858   7.099
   20    H    HIS  -1           H        HIS  -1  51.164 -23.183  11.334
   21    HA   HIS  -1           HA       HIS  -1  52.652 -24.259  13.635
   22    HB2  HIS  -1           HB2      HIS  -1  53.284 -21.846  11.946
   23    HB3  HIS  -1           HB3      HIS  -1  53.885 -22.000  13.594
   24    HD1  HIS  -1           HD1      HIS  -1  54.421 -23.231  10.139
   25    HD2  HIS  -1           HD2      HIS  -1  55.814 -24.051  13.967
   26    HE1  HIS  -1           HE1      HIS  -1  56.476 -24.644   9.817
   27    HE2  HIS  -1           HE2      HIS  -1  57.304 -25.130  12.147
   28    H    HIS   0           H        HIS   0  50.634 -21.638  12.375
   29    HA   HIS   0           HA       HIS   0  49.786 -21.005  15.125
   30    HB2  HIS   0           HB2      HIS   0  49.921 -19.303  12.639
   31    HB3  HIS   0           HB3      HIS   0  48.971 -18.829  14.042
   32    HD1  HIS   0           HD1      HIS   0  50.185 -17.636  15.866
   33    HD2  HIS   0           HD2      HIS   0  52.777 -19.531  13.226
   34    HE1  HIS   0           HE1      HIS   0  52.492 -16.893  16.539
   35    HE2  HIS   0           HE2      HIS   0  54.045 -18.054  14.929
   36    H    HIS   1           H        HIS   1  47.656 -21.025  15.651
   37    HA   HIS   1           HA       HIS   1  45.830 -22.196  13.673
   38    HB2  HIS   1           HB2      HIS   1  45.808 -22.149  16.689
   39    HB3  HIS   1           HB3      HIS   1  44.406 -22.648  15.750
   40    HD1  HIS   1           HD1      HIS   1  44.510 -24.941  14.595
   41    HD2  HIS   1           HD2      HIS   1  47.967 -23.959  16.683
   42    HE1  HIS   1           HE1      HIS   1  45.844 -27.069  14.727
   43    HE2  HIS   1           HE2      HIS   1  47.933 -26.452  15.994
   44    H    HIS   2           H        HIS   2  43.944 -21.256  13.099
   45    HA   HIS   2           HA       HIS   2  43.364 -18.586  14.208
   46    HB2  HIS   2           HB2      HIS   2  43.155 -19.603  11.376
   47    HB3  HIS   2           HB3      HIS   2  42.320 -18.150  11.913
   48    HD1  HIS   2           HD1      HIS   2  43.696 -16.032  12.158
   49    HD2  HIS   2           HD2      HIS   2  46.000 -19.386  11.312
   50    HE1  HIS   2           HE1      HIS   2  45.994 -15.154  11.635
   51    HE2  HIS   2           HE2      HIS   2  47.372 -17.201  11.125
   52    H    HIS   3           H        HIS   3  41.269 -18.076  14.694
   53    HA   HIS   3           HA       HIS   3  39.359 -20.314  14.659
   54    HB2  HIS   3           HB2      HIS   3  39.683 -17.958  16.507
   55    HB3  HIS   3           HB3      HIS   3  38.197 -18.901  16.465
   56    HD1  HIS   3           HD1      HIS   3  38.239 -21.222  17.535
   57    HD2  HIS   3           HD2      HIS   3  41.923 -19.299  17.597
   58    HE1  HIS   3           HE1      HIS   3  39.682 -22.583  19.081
   59    HE2  HIS   3           HE2      HIS   3  41.907 -21.403  19.103
   60    H    SER   4           H        SER   4  37.311 -20.075  13.890
   61    HA   SER   4           HA       SER   4  36.832 -17.755  12.170
   62    HB2  SER   4           HB2      SER   4  35.399 -20.418  12.335
   63    HB3  SER   4           HB3      SER   4  35.054 -19.146  11.163
   64    HG   SER   4           HG       SER   4  36.881 -21.062  11.012
   65    H    THR   5           H        THR   5  34.992 -16.487  12.288
   66    HA   THR   5           HA       THR   5  33.627 -16.520  14.875
   67    HB   THR   5           HB       THR   5  34.630 -14.390  14.348
   68    HG1  THR   5           HG1      THR   5  32.848 -13.862  15.400
   69   HG21  THR   5          HG21      THR   5  34.695 -14.523  11.900
   70   HG22  THR   5          HG22      THR   5  33.952 -13.015  12.433
   71   HG23  THR   5          HG23      THR   5  32.943 -14.334  11.838
   72    H    SER   6           H        SER   6  31.602 -17.164  15.110
   73    HA   SER   6           HA       SER   6  29.943 -17.514  12.708
   74    HB2  SER   6           HB2      SER   6  29.900 -19.080  15.291
   75    HB3  SER   6           HB3      SER   6  28.790 -19.326  13.943
   76    HG   SER   6           HG       SER   6  31.472 -19.365  13.287
   77    H    VAL   7           H        VAL   7  30.184 -15.938  15.703
   78    HA   VAL   7           HA       VAL   7  27.317 -15.379  15.910
   79    HB   VAL   7           HB       VAL   7  29.477 -14.320  17.754
   80   HG11  VAL   7          HG11      VAL   7  27.386 -13.161  18.007
   81   HG12  VAL   7          HG12      VAL   7  27.599 -14.234  19.391
   82   HG13  VAL   7          HG13      VAL   7  26.500 -14.684  18.087
   83   HG21  VAL   7          HG21      VAL   7  29.639 -16.758  17.733
   84   HG22  VAL   7          HG22      VAL   7  27.912 -16.884  18.065
   85   HG23  VAL   7          HG23      VAL   7  28.991 -16.181  19.269
   86    H    ASP   8           H        ASP   8  26.618 -13.864  14.555
   87    HA   ASP   8           HA       ASP   8  28.298 -11.629  13.755
   88    HB2  ASP   8           HB2      ASP   8  26.613 -13.070  12.301
   89    HB3  ASP   8           HB3      ASP   8  25.454 -11.881  12.884
   90    H    LEU   9           H        LEU   9  27.743  -9.446  13.999
   91    HA   LEU   9           HA       LEU   9  26.275  -8.840  16.441
   92    HB2  LEU   9           HB2      LEU   9  28.599  -7.896  15.590
   93    HB3  LEU   9           HB3      LEU   9  27.575  -6.740  14.762
   94    HG   LEU   9           HG       LEU   9  26.530  -6.511  17.216
   95   HD11  LEU   9          HD11      LEU   9  28.016  -8.186  18.200
   96   HD12  LEU   9          HD12      LEU   9  28.285  -6.590  18.901
   97   HD13  LEU   9          HD13      LEU   9  29.417  -7.231  17.710
   98   HD21  LEU   9          HD21      LEU   9  27.363  -4.663  15.911
   99   HD22  LEU   9          HD22      LEU   9  29.029  -5.163  16.203
  100   HD23  LEU   9          HD23      LEU   9  28.037  -4.576  17.538
  101    H    GLY  10           H        GLY  10  24.643  -7.206  16.559
  102    HA2  GLY  10           HA2      GLY  10  23.364  -6.423  14.033
  103    HA3  GLY  10           HA3      GLY  10  22.413  -7.326  15.203
  104    H    THR  11           H        THR  11  24.418  -4.401  14.910
  105    HA   THR  11           HA       THR  11  22.667  -3.063  16.877
  106    HB   THR  11           HB       THR  11  24.553  -1.497  17.276
  107    HG1  THR  11           HG1      THR  11  25.540  -2.567  15.093
  108   HG21  THR  11          HG21      THR  11  25.143  -4.423  17.694
  109   HG22  THR  11          HG22      THR  11  24.260  -3.358  18.790
  110   HG23  THR  11          HG23      THR  11  25.984  -3.106  18.515
  111    H    GLU  12           H        GLU  12  23.867  -3.052  13.665
  112    HA   GLU  12           HA       GLU  12  22.779  -0.381  13.147
  113    HB2  GLU  12           HB2      GLU  12  25.075  -0.454  12.544
  114    HB3  GLU  12           HB3      GLU  12  24.889  -2.006  11.747
  115    HG2  GLU  12           HG2      GLU  12  23.650  -0.989   9.959
  116    HG3  GLU  12           HG3      GLU  12  23.681   0.573  10.776
  117    H    ASN  13           H        ASN  13  22.795  -3.663  11.961
  118    HA   ASN  13           HA       ASN  13  20.937  -3.218   9.842
  119    HB2  ASN  13           HB2      ASN  13  22.802  -5.017  10.101
  120    HB3  ASN  13           HB3      ASN  13  21.576  -5.924  10.958
  121   HD21  ASN  13          HD21      ASN  13  23.026  -6.364   8.539
  122   HD22  ASN  13          HD22      ASN  13  21.849  -6.593   7.331
  123    H    LEU  14           H        LEU  14  20.241  -2.974  12.967
  124    HA   LEU  14           HA       LEU  14  17.947  -4.725  13.143
  125    HB2  LEU  14           HB2      LEU  14  17.525  -3.545  15.320
  126    HB3  LEU  14           HB3      LEU  14  19.050  -4.389  15.197
  127    HG   LEU  14           HG       LEU  14  19.969  -1.988  14.566
  128   HD11  LEU  14          HD11      LEU  14  17.498  -1.163  14.688
  129   HD12  LEU  14          HD12      LEU  14  18.796  -0.161  15.343
  130   HD13  LEU  14          HD13      LEU  14  17.796  -1.129  16.427
  131   HD21  LEU  14          HD21      LEU  14  20.468  -3.453  16.584
  132   HD22  LEU  14          HD22      LEU  14  19.231  -2.523  17.431
  133   HD23  LEU  14          HD23      LEU  14  20.665  -1.714  16.798
  134    H    TYR  15           H        TYR  15  15.767  -3.977  13.535
  135    HA   TYR  15           HA       TYR  15  14.994  -1.898  11.663
  136    HB2  TYR  15           HB2      TYR  15  13.597  -4.092  13.130
  137    HB3  TYR  15           HB3      TYR  15  12.635  -2.717  12.595
  138    HD1  TYR  15           HD1      TYR  15  14.691  -5.560  11.493
  139    HD2  TYR  15           HD2      TYR  15  12.200  -2.339  10.259
  140    HE1  TYR  15           HE1      TYR  15  14.564  -6.529   9.236
  141    HE2  TYR  15           HE2      TYR  15  12.064  -3.300   8.001
  142    HH   TYR  15           HH       TYR  15  13.380  -4.821   6.566
  143    H    PHE  16           H        PHE  16  13.328  -0.280  12.255
  144    HA   PHE  16           HA       PHE  16  13.241   0.511  15.031
  145    HB2  PHE  16           HB2      PHE  16  15.087   1.709  13.421
  146    HB3  PHE  16           HB3      PHE  16  13.705   2.781  13.208
  147    HD1  PHE  16           HD1      PHE  16  16.211   1.529  15.540
  148    HD2  PHE  16           HD2      PHE  16  12.827   4.068  15.073
  149    HE1  PHE  16           HE1      PHE  16  16.734   2.614  17.685
  150    HE2  PHE  16           HE2      PHE  16  13.346   5.159  17.216
  151    HZ   PHE  16           HZ       PHE  16  15.300   4.431  18.525
  152    H    GLN  17           H        GLN  17  12.132   1.116  11.725
  153    HA   GLN  17           HA       GLN  17   9.733   2.488  12.605
  154    HB2  GLN  17           HB2      GLN  17  10.802   1.697   9.899
  155    HB3  GLN  17           HB3      GLN  17   9.195   2.379  10.100
  156    HG2  GLN  17           HG2      GLN  17  10.176   4.387  11.097
  157    HG3  GLN  17           HG3      GLN  17  11.785   3.704  10.876
  158   HE21  GLN  17          HE21      GLN  17  12.657   3.578   8.811
  159   HE22  GLN  17          HE22      GLN  17  12.001   4.456   7.477
  160    H    SER  18           H        SER  18   7.576   1.771  12.085
  161    HA   SER  18           HA       SER  18   7.312  -1.166  12.077
  162    HB2  SER  18           HB2      SER  18   5.487   0.900  13.330
  163    HB3  SER  18           HB3      SER  18   5.218  -0.843  13.345
  164    HG   SER  18           HG       SER  18   6.264   0.089  15.256
  165    H    ASN  19           H        ASN  19   6.722   1.579  10.227
  166    HA   ASN  19           HA       ASN  19   4.347   0.468   8.922
  167    HB2  ASN  19           HB2      ASN  19   5.658   3.182   8.767
  168    HB3  ASN  19           HB3      ASN  19   4.367   2.696   7.686
  169   HD21  ASN  19          HD21      ASN  19   4.651   4.765   9.671
  170   HD22  ASN  19          HD22      ASN  19   3.330   4.557  10.728
  171    H    ALA  20           H        ALA  20   7.732   0.637   8.484
  172    HA   ALA  20           HA       ALA  20   7.726   0.464   5.595
  173    HB1  ALA  20           HB1      ALA  20  10.135   0.227   5.801
  174    HB2  ALA  20           HB2      ALA  20   9.984   0.015   7.546
  175    HB3  ALA  20           HB3      ALA  20   9.563   1.559   6.806
  176    H    GLY  21           H        GLY  21   8.378  -1.347   4.346
  177    HA2  GLY  21           HA2      GLY  21   9.118  -3.655   4.223
  178    HA3  GLY  21           HA3      GLY  21   8.290  -3.945   5.741
  179    H    LYS  22           H        LYS  22   6.256  -2.019   3.966
  180    HA   LYS  22           HA       LYS  22   4.481  -4.177   3.358
  181    HB2  LYS  22           HB2      LYS  22   4.404  -1.222   3.288
  182    HB3  LYS  22           HB3      LYS  22   3.293  -2.062   2.218
  183    HG2  LYS  22           HG2      LYS  22   2.078  -2.949   3.939
  184    HG3  LYS  22           HG3      LYS  22   3.441  -2.875   5.068
  185    HD2  LYS  22           HD2      LYS  22   3.285  -0.443   5.105
  186    HD3  LYS  22           HD3      LYS  22   1.910  -0.515   3.997
  187    HE2  LYS  22           HE2      LYS  22   0.664  -1.822   5.688
  188    HE3  LYS  22           HE3      LYS  22   2.024  -1.640   6.796
  189    HZ1  LYS  22           HZ1      LYS  22   0.308  -0.006   7.244
  190    HZ2  LYS  22           HZ2      LYS  22   0.406   0.576   5.659
  191    HZ3  LYS  22           HZ3      LYS  22   1.719   0.760   6.708
  192    H    MET  23           H        MET  23   3.396  -4.412   1.332
  193    HA   MET  23           HA       MET  23   4.965  -3.791  -1.034
  194    HB2  MET  23           HB2      MET  23   4.554  -6.361   0.060
  195    HB3  MET  23           HB3      MET  23   3.511  -6.256  -1.354
  196    HG2  MET  23           HG2      MET  23   5.421  -5.619  -2.722
  197    HG3  MET  23           HG3      MET  23   6.461  -5.684  -1.301
  198    HE1  MET  23           HE1      MET  23   8.210  -7.734  -1.579
  199    HE2  MET  23           HE2      MET  23   7.462  -9.164  -0.859
  200    HE3  MET  23           HE3      MET  23   7.220  -7.579  -0.124
  201    H    PHE  24           H        PHE  24   3.774  -3.616  -2.881
  202    HA   PHE  24           HA       PHE  24   0.917  -2.971  -2.643
  203    HB2  PHE  24           HB2      PHE  24   2.211  -0.931  -2.827
  204    HB3  PHE  24           HB3      PHE  24   3.125  -1.556  -4.180
  205    HD1  PHE  24           HD1      PHE  24   2.716   0.349  -5.529
  206    HD2  PHE  24           HD2      PHE  24  -0.567  -1.896  -4.009
  207    HE1  PHE  24           HE1      PHE  24   1.207   1.508  -7.083
  208    HE2  PHE  24           HE2      PHE  24  -2.070  -0.736  -5.565
  209    HZ   PHE  24           HZ       PHE  24  -1.192   0.966  -7.102
  210    H    ILE  25           H        ILE  25  -0.122  -4.574  -3.704
  211    HA   ILE  25           HA       ILE  25   1.078  -5.875  -6.003
  212    HB   ILE  25           HB       ILE  25  -1.470  -6.749  -4.885
  213   HG12  ILE  25          HG12      ILE  25  -0.091  -6.206  -2.878
  214   HG13  ILE  25          HG13      ILE  25  -0.560  -7.884  -2.980
  215   HG21  ILE  25          HG21      ILE  25   0.942  -8.205  -5.932
  216   HG22  ILE  25          HG22      ILE  25  -0.611  -7.986  -6.738
  217   HG23  ILE  25          HG23      ILE  25  -0.498  -9.009  -5.308
  218   HD11  ILE  25          HD11      ILE  25   1.762  -7.509  -2.187
  219   HD12  ILE  25          HD12      ILE  25   2.151  -6.835  -3.769
  220   HD13  ILE  25          HD13      ILE  25   1.666  -8.524  -3.625
  221    H    GLY  26           H        GLY  26   0.559  -5.130  -7.884
  222    HA2  GLY  26           HA2      GLY  26  -1.977  -3.827  -8.319
  223    HA3  GLY  26           HA3      GLY  26  -0.576  -3.568  -9.296
  224    H    GLY  27           H        GLY  27  -3.147  -4.045 -10.216
  225    HA2  GLY  27           HA2      GLY  27  -4.086  -5.121 -12.016
  226    HA3  GLY  27           HA3      GLY  27  -2.621  -6.067 -12.151
  227    H    LEU  28           H        LEU  28  -4.361  -6.201  -9.121
  228    HA   LEU  28           HA       LEU  28  -4.605  -8.953  -9.072
  229    HB2  LEU  28           HB2      LEU  28  -6.410  -6.975  -7.652
  230    HB3  LEU  28           HB3      LEU  28  -6.144  -8.643  -7.199
  231    HG   LEU  28           HG       LEU  28  -3.938  -6.583  -7.177
  232   HD11  LEU  28          HD11      LEU  28  -5.717  -7.435  -4.894
  233   HD12  LEU  28          HD12      LEU  28  -5.762  -5.867  -5.700
  234   HD13  LEU  28          HD13      LEU  28  -4.331  -6.349  -4.791
  235   HD21  LEU  28          HD21      LEU  28  -3.005  -8.217  -5.494
  236   HD22  LEU  28          HD22      LEU  28  -3.058  -8.789  -7.157
  237   HD23  LEU  28          HD23      LEU  28  -4.266  -9.335  -5.998
  238    H    SER  29           H        SER  29  -6.845 -10.122  -8.853
  239    HA   SER  29           HA       SER  29  -8.390  -9.497 -11.227
  240    HB2  SER  29           HB2      SER  29  -7.198 -11.768 -10.837
  241    HB3  SER  29           HB3      SER  29  -8.498 -12.087  -9.689
  242    HG   SER  29           HG       SER  29  -9.262 -11.151 -12.185
  243    H    TRP  30           H        TRP  30 -10.656 -10.377 -10.971
  244    HA   TRP  30           HA       TRP  30 -12.088  -8.792  -9.137
  245    HB2  TRP  30           HB2      TRP  30 -14.035  -9.693 -10.309
  246    HB3  TRP  30           HB3      TRP  30 -12.817  -9.191 -11.455
  247    HD1  TRP  30           HD1      TRP  30 -11.036 -11.661 -11.781
  248    HE1  TRP  30           HE1      TRP  30 -11.902 -13.889 -12.684
  249    HE3  TRP  30           HE3      TRP  30 -16.043 -11.046 -10.874
  250    HZ2  TRP  30           HZ2      TRP  30 -14.331 -15.212 -13.011
  251    HZ3  TRP  30           HZ3      TRP  30 -17.572 -12.861 -11.529
  252    HH2  TRP  30           HH2      TRP  30 -16.734 -14.902 -12.577
  253    H    GLN  31           H        GLN  31 -10.838 -11.924  -9.077
  254    HA   GLN  31           HA       GLN  31 -12.721 -12.986  -7.129
  255    HB2  GLN  31           HB2      GLN  31 -10.485 -14.172  -8.734
  256    HB3  GLN  31           HB3      GLN  31 -11.337 -15.078  -7.488
  257    HG2  GLN  31           HG2      GLN  31 -13.448 -14.705  -8.732
  258    HG3  GLN  31           HG3      GLN  31 -12.513 -13.918 -10.005
  259   HE21  GLN  31          HE21      GLN  31 -13.117 -16.915  -8.340
  260   HE22  GLN  31          HE22      GLN  31 -12.495 -17.956  -9.568
  261    H    THR  32           H        THR  32  -9.510 -11.756  -7.397
  262    HA   THR  32           HA       THR  32  -8.390 -12.919  -5.087
  263    HB   THR  32           HB       THR  32  -7.480 -10.308  -6.076
  264    HG1  THR  32           HG1      THR  32  -7.890 -11.380  -7.994
  265   HG21  THR  32          HG21      THR  32  -5.262 -11.316  -5.746
  266   HG22  THR  32          HG22      THR  32  -6.035 -12.833  -5.291
  267   HG23  THR  32          HG23      THR  32  -6.235 -11.404  -4.278
  268    H    SER  33           H        SER  33  -9.048 -12.659  -3.132
  269    HA   SER  33           HA       SER  33 -10.119 -10.117  -2.137
  270    HB2  SER  33           HB2      SER  33 -10.894 -11.560  -0.205
  271    HB3  SER  33           HB3      SER  33 -11.619 -11.969  -1.756
  272    HG   SER  33           HG       SER  33  -9.548 -13.318  -0.379
  273    HA   PRO  34           HA       PRO  34  -6.505  -9.275   0.351
  274    HB2  PRO  34           HB2      PRO  34  -7.552  -8.950   2.908
  275    HB3  PRO  34           HB3      PRO  34  -7.448  -7.676   1.684
  276    HG2  PRO  34           HG2      PRO  34  -9.772  -9.402   2.409
  277    HG3  PRO  34           HG3      PRO  34  -9.737  -7.679   1.982
  278    HD2  PRO  34           HD2      PRO  34 -10.556  -9.486   0.216
  279    HD3  PRO  34           HD3      PRO  34  -9.564  -8.109  -0.291
  280    H    ASP  35           H        ASP  35  -8.701 -11.708   1.385
  281    HA   ASP  35           HA       ASP  35  -6.893 -13.072   3.154
  282    HB2  ASP  35           HB2      ASP  35  -9.621 -13.401   2.240
  283    HB3  ASP  35           HB3      ASP  35  -8.805 -14.873   2.671
  284    H    SER  36           H        SER  36  -7.975 -13.245  -0.105
  285    HA   SER  36           HA       SER  36  -6.792 -15.737  -0.834
  286    HB2  SER  36           HB2      SER  36  -8.682 -14.635  -2.084
  287    HB3  SER  36           HB3      SER  36  -7.529 -13.435  -2.665
  288    HG   SER  36           HG       SER  36  -7.689 -16.183  -3.259
  289    H    LEU  37           H        LEU  37  -5.802 -12.344  -0.835
  290    HA   LEU  37           HA       LEU  37  -3.377 -12.663  -2.226
  291    HB2  LEU  37           HB2      LEU  37  -5.023 -10.681  -0.956
  292    HB3  LEU  37           HB3      LEU  37  -3.372 -10.458  -0.502
  293    HG   LEU  37           HG       LEU  37  -4.308 -10.632  -3.344
  294   HD11  LEU  37          HD11      LEU  37  -5.343  -8.738  -2.269
  295   HD12  LEU  37          HD12      LEU  37  -4.103  -8.192  -3.397
  296   HD13  LEU  37          HD13      LEU  37  -3.778  -8.192  -1.662
  297   HD21  LEU  37          HD21      LEU  37  -1.970 -11.103  -3.195
  298   HD22  LEU  37          HD22      LEU  37  -1.709  -9.737  -2.118
  299   HD23  LEU  37          HD23      LEU  37  -2.147  -9.458  -3.798
  300    H    ARG  38           H        ARG  38  -4.362 -12.599   1.172
  301    HA   ARG  38           HA       ARG  38  -1.810 -12.762   2.319
  302    HB2  ARG  38           HB2      ARG  38  -4.197 -12.214   3.368
  303    HB3  ARG  38           HB3      ARG  38  -4.169 -13.937   3.720
  304    HG2  ARG  38           HG2      ARG  38  -1.732 -13.260   4.625
  305    HG3  ARG  38           HG3      ARG  38  -2.581 -11.738   4.890
  306    HD2  ARG  38           HD2      ARG  38  -3.619 -14.399   5.849
  307    HD3  ARG  38           HD3      ARG  38  -2.580 -13.362   6.820
  308    HE   ARG  38           HE       ARG  38  -4.688 -11.777   6.018
  309   HH11  ARG  38          HH11      ARG  38  -4.326 -14.715   7.899
  310   HH12  ARG  38          HH12      ARG  38  -5.722 -14.404   8.875
  311   HH21  ARG  38          HH21      ARG  38  -6.957 -12.512   8.544
  312   HH22  ARG  38          HH22      ARG  38  -6.508 -11.376   7.316
  313    H    ASP  39           H        ASP  39  -4.288 -15.140   1.432
  314    HA   ASP  39           HA       ASP  39  -2.913 -17.437   2.278
  315    HB2  ASP  39           HB2      ASP  39  -5.254 -16.861   0.565
  316    HB3  ASP  39           HB3      ASP  39  -4.480 -18.425   0.329
  317    H    TYR  40           H        TYR  40  -2.942 -15.721  -0.846
  318    HA   TYR  40           HA       TYR  40  -1.445 -17.677  -2.260
  319    HB2  TYR  40           HB2      TYR  40  -3.010 -15.752  -3.130
  320    HB3  TYR  40           HB3      TYR  40  -1.524 -14.809  -3.114
  321    HD1  TYR  40           HD1      TYR  40  -3.114 -17.836  -4.521
  322    HD2  TYR  40           HD2      TYR  40   0.099 -15.068  -4.822
  323    HE1  TYR  40           HE1      TYR  40  -2.499 -18.799  -6.700
  324    HE2  TYR  40           HE2      TYR  40   0.727 -16.022  -7.001
  325    HH   TYR  40           HH       TYR  40  -1.291 -18.166  -8.719
  326    H    PHE  41           H        PHE  41  -0.625 -14.502  -0.867
  327    HA   PHE  41           HA       PHE  41   2.101 -14.610  -1.550
  328    HB2  PHE  41           HB2      PHE  41   0.322 -12.801  -0.108
  329    HB3  PHE  41           HB3      PHE  41   2.038 -12.615   0.163
  330    HD1  PHE  41           HD1      PHE  41  -0.542 -12.805  -2.496
  331    HD2  PHE  41           HD2      PHE  41   3.368 -11.500  -1.439
  332    HE1  PHE  41           HE1      PHE  41  -0.326 -11.647  -4.668
  333    HE2  PHE  41           HE2      PHE  41   3.579 -10.338  -3.586
  334    HZ   PHE  41           HZ       PHE  41   1.733 -10.413  -5.209
  335    H    SER  42           H        SER  42   0.327 -15.781   1.216
  336    HA   SER  42           HA       SER  42   2.400 -15.829   3.142
  337    HB2  SER  42           HB2      SER  42   1.056 -17.640   4.249
  338    HB3  SER  42           HB3      SER  42   0.132 -16.183   3.898
  339    HG   SER  42           HG       SER  42   0.124 -18.636   2.481
  340    H    LYS  43           H        LYS  43   1.896 -17.371   0.348
  341    HA   LYS  43           HA       LYS  43   3.214 -19.867   0.810
  342    HB2  LYS  43           HB2      LYS  43   1.986 -18.465  -1.507
  343    HB3  LYS  43           HB3      LYS  43   3.060 -19.803  -1.809
  344    HG2  LYS  43           HG2      LYS  43   1.193 -20.564   0.210
  345    HG3  LYS  43           HG3      LYS  43   0.326 -19.888  -1.169
  346    HD2  LYS  43           HD2      LYS  43   1.469 -21.439  -2.663
  347    HD3  LYS  43           HD3      LYS  43   2.387 -22.090  -1.303
  348    HE2  LYS  43           HE2      LYS  43   0.322 -22.864  -0.266
  349    HE3  LYS  43           HE3      LYS  43  -0.614 -22.181  -1.594
  350    HZ1  LYS  43           HZ1      LYS  43  -0.282 -24.560  -1.866
  351    HZ2  LYS  43           HZ2      LYS  43   1.398 -24.353  -1.839
  352    HZ3  LYS  43           HZ3      LYS  43   0.487 -23.706  -3.109
  353    H    PHE  44           H        PHE  44   4.213 -16.710   0.221
  354    HA   PHE  44           HA       PHE  44   6.798 -17.460  -0.946
  355    HB2  PHE  44           HB2      PHE  44   5.092 -15.164  -1.107
  356    HB3  PHE  44           HB3      PHE  44   6.709 -14.701  -0.612
  357    HD1  PHE  44           HD1      PHE  44   4.623 -15.945  -3.299
  358    HD2  PHE  44           HD2      PHE  44   8.623 -15.138  -2.089
  359    HE1  PHE  44           HE1      PHE  44   5.355 -16.081  -5.642
  360    HE2  PHE  44           HE2      PHE  44   9.362 -15.270  -4.430
  361    HZ   PHE  44           HZ       PHE  44   7.722 -15.742  -6.213
  362    H    GLY  45           H        GLY  45   5.271 -16.033   1.840
  363    HA2  GLY  45           HA2      GLY  45   7.322 -16.691   3.636
  364    HA3  GLY  45           HA3      GLY  45   7.317 -14.969   3.285
  365    H    GLU  46           H        GLU  46   6.728 -14.727   5.524
  366    HA   GLU  46           HA       GLU  46   4.017 -15.405   6.149
  367    HB2  GLU  46           HB2      GLU  46   5.879 -16.015   7.767
  368    HB3  GLU  46           HB3      GLU  46   5.995 -14.292   8.111
  369    HG2  GLU  46           HG2      GLU  46   3.753 -14.213   8.901
  370    HG3  GLU  46           HG3      GLU  46   3.434 -15.846   8.342
  371    H    ILE  47           H        ILE  47   2.573 -14.022   6.355
  372    HA   ILE  47           HA       ILE  47   3.119 -11.209   5.850
  373    HB   ILE  47           HB       ILE  47   0.625 -12.744   5.382
  374   HG12  ILE  47          HG12      ILE  47   1.858 -11.317   3.207
  375   HG13  ILE  47          HG13      ILE  47   2.901 -12.532   3.918
  376   HG21  ILE  47          HG21      ILE  47  -0.201 -10.674   4.238
  377   HG22  ILE  47          HG22      ILE  47   1.138  -9.816   5.003
  378   HG23  ILE  47          HG23      ILE  47  -0.115 -10.562   5.996
  379   HD11  ILE  47          HD11      ILE  47   0.431 -12.826   2.308
  380   HD12  ILE  47          HD12      ILE  47   0.673 -13.992   3.602
  381   HD13  ILE  47          HD13      ILE  47   1.880 -13.839   2.325
  382    H    ARG  48           H        ARG  48   2.525  -9.638   7.099
  383    HA   ARG  48           HA       ARG  48   1.710 -10.160   9.819
  384    HB2  ARG  48           HB2      ARG  48   3.455  -8.449   8.733
  385    HB3  ARG  48           HB3      ARG  48   2.041  -7.426   8.687
  386    HG2  ARG  48           HG2      ARG  48   1.781  -7.541  11.052
  387    HG3  ARG  48           HG3      ARG  48   3.063  -8.748  11.184
  388    HD2  ARG  48           HD2      ARG  48   4.678  -7.107  10.332
  389    HD3  ARG  48           HD3      ARG  48   3.392  -5.904  10.230
  390    HE   ARG  48           HE       ARG  48   3.753  -7.057  12.850
  391   HH11  ARG  48          HH11      ARG  48   5.220  -3.417  11.999
  392   HH12  ARG  48          HH12      ARG  48   4.711  -4.448  10.704
  393   HH21  ARG  48          HH21      ARG  48   5.062  -4.122  14.162
  394   HH22  ARG  48          HH22      ARG  48   4.434  -5.694  14.529
  395    H    GLU  49           H        GLU  49   0.551  -8.451   6.964
  396    HA   GLU  49           HA       GLU  49  -2.202  -8.659   7.660
  397    HB2  GLU  49           HB2      GLU  49  -1.164  -6.581   8.935
  398    HB3  GLU  49           HB3      GLU  49  -1.286  -5.817   7.361
  399    HG2  GLU  49           HG2      GLU  49  -3.271  -5.190   8.317
  400    HG3  GLU  49           HG3      GLU  49  -3.756  -6.654   7.463
  401    H    CYS  50           H        CYS  50  -3.524  -7.853   5.928
  402    HA   CYS  50           HA       CYS  50  -2.248  -7.161   3.470
  403    HB2  CYS  50           HB2      CYS  50  -2.496  -9.567   3.300
  404    HB3  CYS  50           HB3      CYS  50  -4.198  -9.447   3.731
  405    HG   CYS  50           HG       CYS  50  -4.854  -9.602   1.248
  406    H    MET  51           H        MET  51  -3.562  -6.099   2.037
  407    HA   MET  51           HA       MET  51  -6.182  -5.245   2.858
  408    HB2  MET  51           HB2      MET  51  -4.735  -3.692   3.996
  409    HB3  MET  51           HB3      MET  51  -3.933  -3.345   2.493
  410    HG2  MET  51           HG2      MET  51  -5.888  -2.275   1.610
  411    HG3  MET  51           HG3      MET  51  -6.816  -2.732   3.038
  412    HE1  MET  51           HE1      MET  51  -3.589   0.550   2.808
  413    HE2  MET  51           HE2      MET  51  -4.501  -0.059   1.428
  414    HE3  MET  51           HE3      MET  51  -3.326  -1.097   2.236
  415    H    VAL  52           H        VAL  52  -7.473  -4.895   1.283
  416    HA   VAL  52           HA       VAL  52  -6.536  -4.380  -1.434
  417    HB   VAL  52           HB       VAL  52  -8.828  -6.105  -0.663
  418   HG11  VAL  52          HG11      VAL  52  -7.817  -5.340  -3.379
  419   HG12  VAL  52          HG12      VAL  52  -9.418  -5.034  -2.710
  420   HG13  VAL  52          HG13      VAL  52  -8.926  -6.685  -3.097
  421   HG21  VAL  52          HG21      VAL  52  -7.576  -7.969  -1.488
  422   HG22  VAL  52          HG22      VAL  52  -6.595  -7.096  -0.307
  423   HG23  VAL  52          HG23      VAL  52  -6.294  -6.886  -2.030
  424    H    MET  53           H        MET  53  -7.288  -2.633  -2.238
  425    HA   MET  53           HA       MET  53  -9.105  -0.917  -0.828
  426    HB2  MET  53           HB2      MET  53  -7.405  -0.649  -3.267
  427    HB3  MET  53           HB3      MET  53  -8.703   0.505  -3.019
  428    HG2  MET  53           HG2      MET  53  -6.431  -0.047  -1.123
  429    HG3  MET  53           HG3      MET  53  -6.597   1.353  -2.178
  430    HE1  MET  53           HE1      MET  53  -7.136   3.164   1.131
  431    HE2  MET  53           HE2      MET  53  -6.113   2.881  -0.277
  432    HE3  MET  53           HE3      MET  53  -6.110   1.732   1.062
  433    H    ARG  54           H        ARG  54 -11.204  -0.988  -0.963
  434    HA   ARG  54           HA       ARG  54 -12.502  -1.488  -3.540
  435    HB2  ARG  54           HB2      ARG  54 -12.924  -2.971  -0.975
  436    HB3  ARG  54           HB3      ARG  54 -14.282  -2.752  -2.073
  437    HG2  ARG  54           HG2      ARG  54 -13.066  -3.867  -3.843
  438    HG3  ARG  54           HG3      ARG  54 -11.647  -4.018  -2.806
  439    HD2  ARG  54           HD2      ARG  54 -12.973  -5.404  -1.252
  440    HD3  ARG  54           HD3      ARG  54 -14.343  -5.296  -2.356
  441    HE   ARG  54           HE       ARG  54 -12.111  -6.270  -3.756
  442   HH11  ARG  54          HH11      ARG  54 -14.205  -9.012  -1.700
  443   HH12  ARG  54          HH12      ARG  54 -14.367  -7.337  -1.287
  444   HH21  ARG  54          HH21      ARG  54 -11.911  -8.467  -4.279
  445   HH22  ARG  54          HH22      ARG  54 -12.815  -9.650  -3.392
  446    H    ASP  55           H        ASP  55 -14.684  -0.619  -3.677
  447    HA   ASP  55           HA       ASP  55 -15.016   1.721  -2.064
  448    HB2  ASP  55           HB2      ASP  55 -15.780   0.921  -4.773
  449    HB3  ASP  55           HB3      ASP  55 -16.783   2.095  -3.965
  450    HA   PRO  56           HA       PRO  56 -18.369  -0.588   0.001
  451    HB2  PRO  56           HB2      PRO  56 -18.926   2.007   1.289
  452    HB3  PRO  56           HB3      PRO  56 -18.561   0.444   2.028
  453    HG2  PRO  56           HG2      PRO  56 -16.784   2.446   2.048
  454    HG3  PRO  56           HG3      PRO  56 -16.288   0.747   1.913
  455    HD2  PRO  56           HD2      PRO  56 -16.434   2.842  -0.208
  456    HD3  PRO  56           HD3      PRO  56 -15.250   1.537   0.019
  457    H    THR  57           H        THR  57 -18.561   2.109  -2.069
  458    HA   THR  57           HA       THR  57 -21.393   2.505  -1.924
  459    HB   THR  57           HB       THR  57 -20.987   3.989  -3.955
  460    HG1  THR  57           HG1      THR  57 -18.299   4.113  -3.300
  461   HG21  THR  57          HG21      THR  57 -19.946   5.776  -2.604
  462   HG22  THR  57          HG22      THR  57 -19.527   4.579  -1.377
  463   HG23  THR  57          HG23      THR  57 -21.220   4.926  -1.728
  464    H    THR  58           H        THR  58 -19.119   1.103  -4.249
  465    HA   THR  58           HA       THR  58 -21.381  -0.082  -5.712
  466    HB   THR  58           HB       THR  58 -19.824  -0.251  -7.658
  467    HG1  THR  58           HG1      THR  58 -17.898   1.048  -7.509
  468   HG21  THR  58          HG21      THR  58 -21.381   1.598  -7.558
  469   HG22  THR  58          HG22      THR  58 -19.836   2.184  -8.175
  470   HG23  THR  58          HG23      THR  58 -20.291   2.495  -6.499
  471    H    LYS  59           H        LYS  59 -18.758  -0.812  -3.727
  472    HA   LYS  59           HA       LYS  59 -17.790  -2.697  -2.927
  473    HB2  LYS  59           HB2      LYS  59 -19.884  -4.395  -4.240
  474    HB3  LYS  59           HB3      LYS  59 -19.085  -4.628  -2.696
  475    HG2  LYS  59           HG2      LYS  59 -20.826  -2.256  -3.073
  476    HG3  LYS  59           HG3      LYS  59 -21.583  -3.834  -2.833
  477    HD2  LYS  59           HD2      LYS  59 -20.377  -4.105  -0.725
  478    HD3  LYS  59           HD3      LYS  59 -19.569  -2.556  -0.977
  479    HE2  LYS  59           HE2      LYS  59 -21.723  -1.411  -0.897
  480    HE3  LYS  59           HE3      LYS  59 -22.545  -2.954  -0.676
  481    HZ1  LYS  59           HZ1      LYS  59 -20.596  -1.731   1.203
  482    HZ2  LYS  59           HZ2      LYS  59 -21.336  -3.238   1.413
  483    HZ3  LYS  59           HZ3      LYS  59 -22.270  -1.827   1.427
  484    H    ARG  60           H        ARG  60 -17.549  -1.864  -5.919
  485    HA   ARG  60           HA       ARG  60 -16.357  -4.335  -6.964
  486    HB2  ARG  60           HB2      ARG  60 -16.329  -3.247  -9.142
  487    HB3  ARG  60           HB3      ARG  60 -17.930  -3.180  -8.430
  488    HG2  ARG  60           HG2      ARG  60 -17.561  -0.832  -7.820
  489    HG3  ARG  60           HG3      ARG  60 -15.958  -0.903  -8.553
  490    HD2  ARG  60           HD2      ARG  60 -17.480   0.116 -10.111
  491    HD3  ARG  60           HD3      ARG  60 -17.023  -1.473 -10.718
  492    HE   ARG  60           HE       ARG  60 -19.409  -1.686  -9.234
  493   HH11  ARG  60          HH11      ARG  60 -19.819  -0.614 -13.082
  494   HH12  ARG  60          HH12      ARG  60 -18.282  -0.416 -12.308
  495   HH21  ARG  60          HH21      ARG  60 -21.406  -1.946 -10.270
  496   HH22  ARG  60          HH22      ARG  60 -21.585  -1.479 -11.929
  497    H    SER  61           H        SER  61 -14.240  -4.642  -7.213
  498    HA   SER  61           HA       SER  61 -12.404  -2.671  -6.118
  499    HB2  SER  61           HB2      SER  61 -12.320  -5.158  -5.581
  500    HB3  SER  61           HB3      SER  61 -11.721  -5.403  -7.220
  501    HG   SER  61           HG       SER  61  -9.968  -5.204  -5.853
  502    H    ARG  62           H        ARG  62 -10.419  -2.073  -7.222
  503    HA   ARG  62           HA       ARG  62 -10.842  -1.689 -10.094
  504    HB2  ARG  62           HB2      ARG  62  -9.112  -0.285  -8.070
  505    HB3  ARG  62           HB3      ARG  62  -8.874  -0.059  -9.797
  506    HG2  ARG  62           HG2      ARG  62 -11.173   0.751 -10.008
  507    HG3  ARG  62           HG3      ARG  62 -11.407   0.528  -8.273
  508    HD2  ARG  62           HD2      ARG  62  -9.586   2.134  -7.849
  509    HD3  ARG  62           HD3      ARG  62  -9.427   2.386  -9.587
  510    HE   ARG  62           HE       ARG  62 -12.088   2.866  -8.842
  511   HH11  ARG  62          HH11      ARG  62  -9.564   5.938  -8.279
  512   HH12  ARG  62          HH12      ARG  62  -8.925   4.336  -8.434
  513   HH21  ARG  62          HH21      ARG  62 -12.901   4.972  -8.632
  514   HH22  ARG  62          HH22      ARG  62 -11.813   6.297  -8.391
  515    H    GLY  63           H        GLY  63  -9.161  -3.708  -8.033
  516    HA2  GLY  63           HA2      GLY  63  -7.867  -5.540  -8.729
  517    HA3  GLY  63           HA3      GLY  63  -7.514  -4.700 -10.228
  518    H    PHE  64           H        PHE  64  -7.069  -3.580  -6.872
  519    HA   PHE  64           HA       PHE  64  -4.208  -3.933  -7.004
  520    HB2  PHE  64           HB2      PHE  64  -3.490  -1.735  -7.078
  521    HB3  PHE  64           HB3      PHE  64  -4.834  -1.714  -8.202
  522    HD1  PHE  64           HD1      PHE  64  -3.953  -0.991  -4.702
  523    HD2  PHE  64           HD2      PHE  64  -6.511  -0.118  -7.962
  524    HE1  PHE  64           HE1      PHE  64  -4.860   0.931  -3.451
  525    HE2  PHE  64           HE2      PHE  64  -7.457   1.794  -6.725
  526    HZ   PHE  64           HZ       PHE  64  -6.632   2.321  -4.462
  527    H    GLY  65           H        GLY  65  -3.177  -3.918  -5.004
  528    HA2  GLY  65           HA2      GLY  65  -4.498  -3.055  -2.655
  529    HA3  GLY  65           HA3      GLY  65  -4.428  -4.802  -2.805
  530    H    PHE  66           H        PHE  66  -3.156  -4.354  -0.791
  531    HA   PHE  66           HA       PHE  66  -0.352  -4.207  -1.314
  532    HB2  PHE  66           HB2      PHE  66  -1.930  -2.953   0.867
  533    HB3  PHE  66           HB3      PHE  66  -0.209  -3.110   0.916
  534    HD1  PHE  66           HD1      PHE  66  -3.016  -1.560  -0.849
  535    HD2  PHE  66           HD2      PHE  66   1.196  -1.556  -0.242
  536    HE1  PHE  66           HE1      PHE  66  -2.849   0.585  -2.052
  537    HE2  PHE  66           HE2      PHE  66   1.371   0.593  -1.438
  538    HZ   PHE  66           HZ       PHE  66  -0.653   1.659  -2.352
  539    H    VAL  67           H        VAL  67   0.850  -5.101   0.550
  540    HA   VAL  67           HA       VAL  67  -0.418  -7.025   2.254
  541    HB   VAL  67           HB       VAL  67   1.509  -8.024   0.115
  542   HG11  VAL  67          HG11      VAL  67   0.702 -10.254   1.515
  543   HG12  VAL  67          HG12      VAL  67   0.958  -9.061   2.791
  544   HG13  VAL  67          HG13      VAL  67   2.267  -9.455   1.674
  545   HG21  VAL  67          HG21      VAL  67  -1.296  -8.939   0.744
  546   HG22  VAL  67          HG22      VAL  67  -0.235  -9.604  -0.499
  547   HG23  VAL  67          HG23      VAL  67  -0.828  -7.946  -0.637
  548    H    THR  68           H        THR  68   0.630  -7.237   3.999
  549    HA   THR  68           HA       THR  68   3.159  -5.834   4.236
  550    HB   THR  68           HB       THR  68   1.420  -6.481   6.516
  551    HG1  THR  68           HG1      THR  68   0.370  -5.326   4.568
  552   HG21  THR  68          HG21      THR  68   2.549  -3.920   6.701
  553   HG22  THR  68          HG22      THR  68   3.806  -4.965   6.007
  554   HG23  THR  68          HG23      THR  68   3.066  -5.373   7.558
  555    H    PHE  69           H        PHE  69   4.714  -7.218   4.049
  556    HA   PHE  69           HA       PHE  69   4.576  -9.849   5.124
  557    HB2  PHE  69           HB2      PHE  69   6.516  -8.316   3.501
  558    HB3  PHE  69           HB3      PHE  69   7.079  -9.738   4.354
  559    HD1  PHE  69           HD1      PHE  69   5.199  -8.486   1.582
  560    HD2  PHE  69           HD2      PHE  69   5.985 -11.943   3.928
  561    HE1  PHE  69           HE1      PHE  69   4.251  -9.910  -0.195
  562    HE2  PHE  69           HE2      PHE  69   5.043 -13.371   2.168
  563    HZ   PHE  69           HZ       PHE  69   4.185 -12.364   0.107
  564    H    ALA  70           H        ALA  70   5.151 -10.477   7.096
  565    HA   ALA  70           HA       ALA  70   6.359  -8.668   8.904
  566    HB1  ALA  70           HB1      ALA  70   4.482 -10.217   9.506
  567    HB2  ALA  70           HB2      ALA  70   5.831 -10.197  10.638
  568    HB3  ALA  70           HB3      ALA  70   5.668 -11.519   9.483
  569    H    ASP  71           H        ASP  71   7.730 -10.423   6.718
  570    HA   ASP  71           HA       ASP  71  10.151 -10.883   8.238
  571    HB2  ASP  71           HB2      ASP  71   8.843 -12.917   7.390
  572    HB3  ASP  71           HB3      ASP  71   9.443 -12.481   5.823
  573    HA   PRO  72           HA       PRO  72  11.913  -8.213   5.063
  574    HB2  PRO  72           HB2      PRO  72  14.512  -8.980   6.014
  575    HB3  PRO  72           HB3      PRO  72  13.728  -7.426   6.094
  576    HG2  PRO  72           HG2      PRO  72  14.215  -8.897   8.300
  577    HG3  PRO  72           HG3      PRO  72  12.835  -7.790   8.164
  578    HD2  PRO  72           HD2      PRO  72  12.903 -10.762   7.877
  579    HD3  PRO  72           HD3      PRO  72  11.684  -9.719   8.641
  580    H    ALA  73           H        ALA  73  12.517 -11.487   5.632
  581    HA   ALA  73           HA       ALA  73  14.313 -11.927   3.453
  582    HB1  ALA  73           HB1      ALA  73  12.792 -13.958   5.057
  583    HB2  ALA  73           HB2      ALA  73  14.391 -13.331   5.460
  584    HB3  ALA  73           HB3      ALA  73  14.161 -14.281   3.992
  585    H    SER  74           H        SER  74  10.921 -12.031   3.945
  586    HA   SER  74           HA       SER  74  10.252 -13.521   1.602
  587    HB2  SER  74           HB2      SER  74   8.807 -13.123   3.710
  588    HB3  SER  74           HB3      SER  74   8.349 -11.617   2.911
  589    HG   SER  74           HG       SER  74   6.891 -13.150   2.274
  590    H    VAL  75           H        VAL  75  10.767 -10.195   2.316
  591    HA   VAL  75           HA       VAL  75   9.728  -9.074  -0.059
  592    HB   VAL  75           HB       VAL  75  11.946  -7.851   1.577
  593   HG11  VAL  75          HG11      VAL  75  11.352  -6.642  -0.461
  594   HG12  VAL  75          HG12      VAL  75  10.902  -5.712   0.971
  595   HG13  VAL  75          HG13      VAL  75   9.666  -6.577   0.057
  596   HG21  VAL  75          HG21      VAL  75  10.234  -8.592   3.157
  597   HG22  VAL  75          HG22      VAL  75   9.004  -7.718   2.241
  598   HG23  VAL  75          HG23      VAL  75  10.293  -6.832   3.057
  599    H    ASP  76           H        ASP  76  12.737 -10.426   0.900
  600    HA   ASP  76           HA       ASP  76  14.302  -9.656  -1.315
  601    HB2  ASP  76           HB2      ASP  76  14.928 -10.580   1.069
  602    HB3  ASP  76           HB3      ASP  76  14.848 -12.126   0.255
  603    H    LYS  77           H        LYS  77  12.486 -12.459  -0.425
  604    HA   LYS  77           HA       LYS  77  13.024 -14.115  -2.600
  605    HB2  LYS  77           HB2      LYS  77  10.675 -14.076  -0.724
  606    HB3  LYS  77           HB3      LYS  77  10.950 -15.346  -1.907
  607    HG2  LYS  77           HG2      LYS  77  13.207 -15.686  -0.773
  608    HG3  LYS  77           HG3      LYS  77  12.570 -14.679   0.528
  609    HD2  LYS  77           HD2      LYS  77  10.715 -16.216   0.846
  610    HD3  LYS  77           HD3      LYS  77  11.278 -17.203  -0.504
  611    HE2  LYS  77           HE2      LYS  77  13.354 -17.669   0.718
  612    HE3  LYS  77           HE3      LYS  77  12.769 -16.700   2.070
  613    HZ1  LYS  77           HZ1      LYS  77  10.937 -18.240   2.347
  614    HZ2  LYS  77           HZ2      LYS  77  12.411 -19.067   2.434
  615    HZ3  LYS  77           HZ3      LYS  77  11.470 -19.161   1.031
  616    H    VAL  78           H        VAL  78  10.427 -11.825  -2.052
  617    HA   VAL  78           HA       VAL  78   9.054 -12.402  -4.491
  618    HB   VAL  78           HB       VAL  78   8.709 -10.064  -2.589
  619   HG11  VAL  78          HG11      VAL  78   6.915 -10.956  -4.851
  620   HG12  VAL  78          HG12      VAL  78   7.845  -9.459  -4.787
  621   HG13  VAL  78          HG13      VAL  78   6.519  -9.721  -3.656
  622   HG21  VAL  78          HG21      VAL  78   6.695 -11.285  -1.848
  623   HG22  VAL  78          HG22      VAL  78   8.183 -12.176  -1.531
  624   HG23  VAL  78          HG23      VAL  78   7.155 -12.632  -2.890
  625    H    LEU  79           H        LEU  79  11.523 -10.124  -3.487
  626    HA   LEU  79           HA       LEU  79  11.423  -8.286  -5.581
  627    HB2  LEU  79           HB2      LEU  79  12.720  -8.707  -3.210
  628    HB3  LEU  79           HB3      LEU  79  13.999  -8.922  -4.363
  629    HG   LEU  79           HG       LEU  79  13.922  -6.683  -3.426
  630   HD11  LEU  79          HD11      LEU  79  13.244  -6.676  -6.359
  631   HD12  LEU  79          HD12      LEU  79  14.838  -6.991  -5.674
  632   HD13  LEU  79          HD13      LEU  79  14.095  -5.403  -5.483
  633   HD21  LEU  79          HD21      LEU  79  12.162  -5.191  -3.601
  634   HD22  LEU  79          HD22      LEU  79  11.352  -6.721  -3.250
  635   HD23  LEU  79          HD23      LEU  79  11.391  -6.098  -4.901
  636    H    GLY  80           H        GLY  80  13.004 -11.416  -5.226
  637    HA2  GLY  80           HA2      GLY  80  14.604 -11.173  -7.563
  638    HA3  GLY  80           HA3      GLY  80  14.409 -12.615  -6.600
  639    H    GLN  81           H        GLN  81  11.397 -12.185  -6.948
  640    HA   GLN  81           HA       GLN  81  11.171 -13.580  -9.482
  641    HB2  GLN  81           HB2      GLN  81   9.449 -13.283  -7.040
  642    HB3  GLN  81           HB3      GLN  81   8.821 -13.963  -8.522
  643    HG2  GLN  81           HG2      GLN  81  11.351 -15.062  -7.468
  644    HG3  GLN  81           HG3      GLN  81   9.864 -15.471  -6.620
  645   HE21  GLN  81          HE21      GLN  81   8.345 -16.774  -7.611
  646   HE22  GLN  81          HE22      GLN  81   8.680 -17.669  -9.051
  647    HA   PRO  82           HA       PRO  82   9.564  -9.520 -10.903
  648    HB2  PRO  82           HB2      PRO  82  10.182 -10.280 -13.606
  649    HB3  PRO  82           HB3      PRO  82  10.988  -9.074 -12.601
  650    HG2  PRO  82           HG2      PRO  82  12.155 -11.418 -13.418
  651    HG3  PRO  82           HG3      PRO  82  12.648 -10.495 -11.986
  652    HD2  PRO  82           HD2      PRO  82  10.961 -12.952 -12.158
  653    HD3  PRO  82           HD3      PRO  82  12.179 -12.489 -10.949
  654    H    HIS  83           H        HIS  83   8.912 -12.665 -12.449
  655    HA   HIS  83           HA       HIS  83   6.435 -11.664 -13.605
  656    HB2  HIS  83           HB2      HIS  83   8.172 -13.308 -14.679
  657    HB3  HIS  83           HB3      HIS  83   7.309 -14.522 -13.745
  658    HD1  HIS  83           HD1      HIS  83   6.659 -11.906 -16.406
  659    HD2  HIS  83           HD2      HIS  83   4.983 -15.405 -14.914
  660    HE1  HIS  83           HE1      HIS  83   4.739 -12.439 -17.939
  661    HE2  HIS  83           HE2      HIS  83   3.739 -14.561 -17.020
  662    H    HIS  84           H        HIS  84   4.489 -11.938 -12.744
  663    HA   HIS  84           HA       HIS  84   3.982 -14.031 -10.777
  664    HB2  HIS  84           HB2      HIS  84   4.386 -11.395 -10.042
  665    HB3  HIS  84           HB3      HIS  84   2.633 -11.526 -10.123
  666    HD1  HIS  84           HD1      HIS  84   5.591 -12.652  -8.172
  667    HD2  HIS  84           HD2      HIS  84   1.486 -13.291  -8.231
  668    HE1  HIS  84           HE1      HIS  84   5.063 -13.823  -6.012
  669    HE2  HIS  84           HE2      HIS  84   2.573 -14.206  -6.069
  670    H    GLU  85           H        GLU  85   2.194 -15.068 -11.345
  671    HA   GLU  85           HA       GLU  85   0.289 -13.774 -13.062
  672    HB2  GLU  85           HB2      GLU  85   1.814 -15.835 -13.822
  673    HB3  GLU  85           HB3      GLU  85   0.504 -16.731 -13.067
  674    HG2  GLU  85           HG2      GLU  85  -1.102 -15.714 -14.549
  675    HG3  GLU  85           HG3      GLU  85   0.151 -14.692 -15.250
  676    H    LEU  86           H        LEU  86  -1.701 -13.802 -12.535
  677    HA   LEU  86           HA       LEU  86  -2.833 -15.532 -10.531
  678    HB2  LEU  86           HB2      LEU  86  -2.273 -13.614  -9.223
  679    HB3  LEU  86           HB3      LEU  86  -2.759 -12.531 -10.501
  680    HG   LEU  86           HG       LEU  86  -5.114 -13.484 -10.128
  681   HD11  LEU  86          HD11      LEU  86  -3.779 -14.221  -7.531
  682   HD12  LEU  86          HD12      LEU  86  -4.644 -15.286  -8.638
  683   HD13  LEU  86          HD13      LEU  86  -5.524 -14.058  -7.727
  684   HD21  LEU  86          HD21      LEU  86  -5.408 -11.832  -8.187
  685   HD22  LEU  86          HD22      LEU  86  -4.786 -11.222  -9.719
  686   HD23  LEU  86          HD23      LEU  86  -3.682 -11.525  -8.378
  687    H    ASP  87           H        ASP  87  -4.785 -16.100 -11.101
  688    HA   ASP  87           HA       ASP  87  -6.576 -16.615 -12.379
  689    HB2  ASP  87           HB2      ASP  87  -7.090 -14.473 -11.242
  690    HB3  ASP  87           HB3      ASP  87  -6.717 -13.661 -12.736
  691    H    SER  88           H        SER  88  -4.183 -16.663 -13.636
  692    HA   SER  88           HA       SER  88  -3.255 -17.162 -15.654
  693    HB2  SER  88           HB2      SER  88  -5.531 -18.056 -16.232
  694    HB3  SER  88           HB3      SER  88  -5.914 -16.488 -16.942
  695    HG   SER  88           HG       SER  88  -3.954 -18.356 -17.765
  696    H    LYS  89           H        LYS  89  -3.827 -14.216 -14.604
  697    HA   LYS  89           HA       LYS  89  -2.683 -12.953 -16.969
  698    HB2  LYS  89           HB2      LYS  89  -3.732 -10.780 -15.913
  699    HB3  LYS  89           HB3      LYS  89  -4.648 -11.793 -17.007
  700    HG2  LYS  89           HG2      LYS  89  -5.866 -12.763 -15.174
  701    HG3  LYS  89           HG3      LYS  89  -4.833 -11.939 -14.001
  702    HD2  LYS  89           HD2      LYS  89  -5.642  -9.781 -14.767
  703    HD3  LYS  89           HD3      LYS  89  -6.620 -10.566 -16.009
  704    HE2  LYS  89           HE2      LYS  89  -6.962 -11.181 -13.090
  705    HE3  LYS  89           HE3      LYS  89  -7.794  -9.831 -13.859
  706    HZ1  LYS  89           HZ1      LYS  89  -7.995 -12.670 -14.711
  707    HZ2  LYS  89           HZ2      LYS  89  -8.835 -11.366 -15.386
  708    HZ3  LYS  89           HZ3      LYS  89  -9.153 -11.844 -13.795
  709    H    THR  90           H        THR  90  -1.313 -11.308 -16.621
  710    HA   THR  90           HA       THR  90   0.531 -11.708 -14.445
  711    HB   THR  90           HB       THR  90   0.829  -9.583 -16.555
  712    HG1  THR  90           HG1      THR  90   0.922 -11.080 -18.036
  713   HG21  THR  90          HG21      THR  90   2.513  -9.704 -14.747
  714   HG22  THR  90          HG22      THR  90   3.209 -10.078 -16.324
  715   HG23  THR  90          HG23      THR  90   2.846 -11.378 -15.189
  716    H    ILE  91           H        ILE  91   0.691 -10.543 -12.649
  717    HA   ILE  91           HA       ILE  91  -0.635  -7.916 -12.515
  718    HB   ILE  91           HB       ILE  91  -1.077  -8.298 -10.152
  719   HG12  ILE  91          HG12      ILE  91  -0.113 -11.098 -10.476
  720   HG13  ILE  91          HG13      ILE  91   0.842  -9.859  -9.694
  721   HG21  ILE  91          HG21      ILE  91  -2.790 -10.040 -10.401
  722   HG22  ILE  91          HG22      ILE  91  -2.038 -10.524 -11.922
  723   HG23  ILE  91          HG23      ILE  91  -2.759  -8.922 -11.766
  724   HD11  ILE  91          HD11      ILE  91  -0.321 -10.035  -7.785
  725   HD12  ILE  91          HD12      ILE  91  -0.901 -11.565  -8.444
  726   HD13  ILE  91          HD13      ILE  91  -1.877 -10.095  -8.632
  727    H    ASP  92           H        ASP  92   0.404  -6.447 -10.656
  728    HA   ASP  92           HA       ASP  92   3.312  -6.725 -11.048
  729    HB2  ASP  92           HB2      ASP  92   1.996  -4.858 -12.221
  730    HB3  ASP  92           HB3      ASP  92   1.914  -4.109 -10.635
  731    HA   PRO  93           HA       PRO  93   3.109  -6.517  -6.453
  732    HB2  PRO  93           HB2      PRO  93   5.127  -8.540  -6.274
  733    HB3  PRO  93           HB3      PRO  93   3.416  -8.693  -5.863
  734    HG2  PRO  93           HG2      PRO  93   4.638 -10.011  -7.955
  735    HG3  PRO  93           HG3      PRO  93   2.897  -9.701  -7.828
  736    HD2  PRO  93           HD2      PRO  93   4.963  -8.243  -9.419
  737    HD3  PRO  93           HD3      PRO  93   3.278  -8.631  -9.832
  738    H    LYS  94           H        LYS  94   4.264  -4.887  -5.569
  739    HA   LYS  94           HA       LYS  94   7.165  -4.827  -5.868
  740    HB2  LYS  94           HB2      LYS  94   7.207  -2.450  -6.592
  741    HB3  LYS  94           HB3      LYS  94   6.523  -3.531  -7.794
  742    HG2  LYS  94           HG2      LYS  94   4.245  -2.785  -6.692
  743    HG3  LYS  94           HG3      LYS  94   5.206  -1.391  -6.193
  744    HD2  LYS  94           HD2      LYS  94   5.926  -1.576  -8.794
  745    HD3  LYS  94           HD3      LYS  94   4.273  -2.190  -8.876
  746    HE2  LYS  94           HE2      LYS  94   4.055   0.113  -9.213
  747    HE3  LYS  94           HE3      LYS  94   3.633  -0.122  -7.520
  748    HZ1  LYS  94           HZ1      LYS  94   6.264   0.803  -8.540
  749    HZ2  LYS  94           HZ2      LYS  94   5.883   0.552  -6.913
  750    HZ3  LYS  94           HZ3      LYS  94   5.098   1.769  -7.787
  751    H    VAL  95           H        VAL  95   8.274  -3.422  -4.379
  752    HA   VAL  95           HA       VAL  95   6.982  -3.265  -1.822
  753    HB   VAL  95           HB       VAL  95   9.677  -2.176  -2.433
  754   HG11  VAL  95          HG11      VAL  95   8.534  -3.338   0.095
  755   HG12  VAL  95          HG12      VAL  95   8.786  -1.623  -0.229
  756   HG13  VAL  95          HG13      VAL  95  10.170  -2.709  -0.103
  757   HG21  VAL  95          HG21      VAL  95   9.025  -5.029  -1.719
  758   HG22  VAL  95          HG22      VAL  95  10.644  -4.350  -1.902
  759   HG23  VAL  95          HG23      VAL  95   9.574  -4.469  -3.299
  760    H    ALA  96           H        ALA  96   6.056  -1.553  -0.851
  761    HA   ALA  96           HA       ALA  96   6.003   0.990  -2.234
  762    HB1  ALA  96           HB1      ALA  96   3.870  -0.080  -1.763
  763    HB2  ALA  96           HB2      ALA  96   4.008   1.471  -0.941
  764    HB3  ALA  96           HB3      ALA  96   4.225  -0.029  -0.039
  765    H    PHE  97           H        PHE  97   6.137   2.994  -1.096
  766    HA   PHE  97           HA       PHE  97   7.747   2.913   1.356
  767    HB2  PHE  97           HB2      PHE  97   7.892   4.467  -1.136
  768    HB3  PHE  97           HB3      PHE  97   8.081   5.418   0.327
  769    HD1  PHE  97           HD1      PHE  97   9.460   2.701  -1.690
  770    HD2  PHE  97           HD2      PHE  97  10.021   5.177   1.724
  771    HE1  PHE  97           HE1      PHE  97  11.798   1.938  -1.526
  772    HE2  PHE  97           HE2      PHE  97  12.357   4.422   1.896
  773    HZ   PHE  97           HZ       PHE  97  13.248   2.799   0.270
  774    HA   PRO  98           HA       PRO  98   4.056   4.907   3.134
  775    HB2  PRO  98           HB2      PRO  98   5.610   5.272   5.584
  776    HB3  PRO  98           HB3      PRO  98   4.183   4.266   5.310
  777    HG2  PRO  98           HG2      PRO  98   6.605   3.189   5.742
  778    HG3  PRO  98           HG3      PRO  98   5.408   2.435   4.669
  779    HD2  PRO  98           HD2      PRO  98   7.793   4.098   3.948
  780    HD3  PRO  98           HD3      PRO  98   7.203   2.587   3.222
  781    H    ARG  99           H        ARG  99   3.385   6.954   3.219
  782    HA   ARG  99           HA       ARG  99   5.315   9.114   3.732
  783    HB2  ARG  99           HB2      ARG  99   3.446   8.876   1.377
  784    HB3  ARG  99           HB3      ARG  99   4.116  10.419   1.890
  785    HG2  ARG  99           HG2      ARG  99   6.312   9.765   1.371
  786    HG3  ARG  99           HG3      ARG  99   5.865   8.063   1.257
  787    HD2  ARG  99           HD2      ARG  99   6.152   8.819  -0.962
  788    HD3  ARG  99           HD3      ARG  99   4.413   8.703  -0.708
  789    HE   ARG  99           HE       ARG  99   5.183  11.315  -0.110
  790   HH11  ARG  99          HH11      ARG  99   5.053   9.229  -2.931
  791   HH12  ARG  99          HH12      ARG  99   4.837  10.544  -4.037
  792   HH21  ARG  99          HH21      ARG  99   4.751  12.691  -3.268
  793   HH22  ARG  99          HH22      ARG  99   4.899  13.023  -1.575
  794    H    ARG 100           H        ARG 100   4.519  10.895   4.769
  795    HA   ARG 100           HA       ARG 100   1.680  10.840   5.585
  796    HB2  ARG 100           HB2      ARG 100   4.155  11.282   7.236
  797    HB3  ARG 100           HB3      ARG 100   2.601  11.926   7.748
  798    HG2  ARG 100           HG2      ARG 100   2.691   9.056   7.023
  799    HG3  ARG 100           HG3      ARG 100   3.501   9.537   8.516
  800    HD2  ARG 100           HD2      ARG 100   1.389  10.667   9.213
  801    HD3  ARG 100           HD3      ARG 100   0.610   9.993   7.781
  802    HE   ARG 100           HE       ARG 100   1.654   7.817   9.004
  803   HH11  ARG 100          HH11      ARG 100  -1.229   9.379  11.323
  804   HH12  ARG 100          HH12      ARG 100  -0.446  10.387  10.152
  805   HH21  ARG 100          HH21      ARG 100   0.627   6.521  10.552
  806   HH22  ARG 100          HH22      ARG 100  -0.622   7.192  11.547
  807    H    ALA 101           H        ALA 101   0.583  12.700   5.306
  808    HA   ALA 101           HA       ALA 101   1.872  15.251   5.336
  809    HB1  ALA 101           HB1      ALA 101   1.933  15.729   3.153
  810    HB2  ALA 101           HB2      ALA 101   0.291  15.137   2.917
  811    HB3  ALA 101           HB3      ALA 101   1.647  14.009   2.867
  812    H    GLN 102           H        GLN 102   0.281  17.041   4.905
  813    HA   GLN 102           HA       GLN 102  -1.533  18.232   5.518
  814    HB2  GLN 102           HB2      GLN 102  -2.847  15.710   4.572
  815    HB3  GLN 102           HB3      GLN 102  -3.808  17.028   5.231
  816    HG2  GLN 102           HG2      GLN 102  -2.932  18.536   3.538
  817    HG3  GLN 102           HG3      GLN 102  -1.921  17.244   2.894
  818   HE21  GLN 102          HE21      GLN 102  -5.147  18.491   3.186
  819   HE22  GLN 102          HE22      GLN 102  -5.868  17.478   1.987
  820    HA   PRO 103           HA       PRO 103  -2.387  17.435   9.809
  821    HB2  PRO 103           HB2      PRO 103  -4.214  19.338  10.349
  822    HB3  PRO 103           HB3      PRO 103  -2.531  19.737   9.979
  823    HG2  PRO 103           HG2      PRO 103  -4.930  19.892   8.213
  824    HG3  PRO 103           HG3      PRO 103  -3.566  21.017   8.359
  825    HD2  PRO 103           HD2      PRO 103  -3.803  19.144   6.365
  826    HD3  PRO 103           HD3      PRO 103  -2.263  19.827   6.920
  827    H    LYS 104           H        LYS 104  -4.307  17.189  11.393
  828    HA   LYS 104           HA       LYS 104  -6.125  15.198  10.311
  829    HB2  LYS 104           HB2      LYS 104  -5.560  16.162  13.116
  830    HB3  LYS 104           HB3      LYS 104  -6.827  15.001  12.750
  831    HG2  LYS 104           HG2      LYS 104  -5.173  13.452  11.863
  832    HG3  LYS 104           HG3      LYS 104  -3.892  14.622  12.189
  833    HD2  LYS 104           HD2      LYS 104  -4.412  14.526  14.580
  834    HD3  LYS 104           HD3      LYS 104  -5.696  13.361  14.257
  835    HE2  LYS 104           HE2      LYS 104  -3.836  12.102  14.989
  836    HE3  LYS 104           HE3      LYS 104  -3.923  11.875  13.243
  837    HZ1  LYS 104           HZ1      LYS 104  -2.100  13.749  14.656
  838    HZ2  LYS 104           HZ2      LYS 104  -2.182  13.535  12.981
  839    HZ3  LYS 104           HZ3      LYS 104  -1.656  12.267  13.969
  840    H    MET 105           H        MET 105  -8.409  15.219  10.657
  841    HA   MET 105           HA       MET 105  -9.586  17.868  10.378
  842    HB2  MET 105           HB2      MET 105 -10.659  15.080   9.962
  843    HB3  MET 105           HB3      MET 105 -11.677  16.509   9.864
  844    HG2  MET 105           HG2      MET 105  -9.202  16.291   8.206
  845    HG3  MET 105           HG3      MET 105 -10.692  15.500   7.702
  846    HE1  MET 105           HE1      MET 105  -9.295  19.320   8.626
  847    HE2  MET 105           HE2      MET 105  -9.468  19.681   6.910
  848    HE3  MET 105           HE3      MET 105  -8.526  18.285   7.425
  849    H    VAL 106           H        VAL 106 -11.612  18.402  11.488
  850    HA   VAL 106           HA       VAL 106 -11.496  17.660  14.308
  851    HB   VAL 106           HB       VAL 106 -13.313  19.776  13.168
  852   HG11  VAL 106          HG11      VAL 106 -11.926  19.496  15.836
  853   HG12  VAL 106          HG12      VAL 106 -13.641  19.238  15.510
  854   HG13  VAL 106          HG13      VAL 106 -12.948  20.852  15.360
  855   HG21  VAL 106          HG21      VAL 106 -11.094  20.254  12.254
  856   HG22  VAL 106          HG22      VAL 106 -10.412  20.203  13.879
  857   HG23  VAL 106          HG23      VAL 106 -11.570  21.461  13.449
  858    H    THR 107           H        THR 107 -13.651  17.405  15.452
  859    HA   THR 107           HA       THR 107 -15.360  15.665  13.905
  860    HB   THR 107           HB       THR 107 -15.444  15.911  16.899
  861    HG1  THR 107           HG1      THR 107 -13.878  13.925  15.668
  862   HG21  THR 107          HG21      THR 107 -16.232  13.608  16.814
  863   HG22  THR 107          HG22      THR 107 -16.008  13.571  15.066
  864   HG23  THR 107          HG23      THR 107 -17.236  14.620  15.775
  865    H    ARG 108           H        ARG 108 -15.515  18.376  16.185
  866    HA   ARG 108           HA       ARG 108 -18.367  18.743  15.636
  867    HB2  ARG 108           HB2      ARG 108 -16.488  19.731  17.740
  868    HB3  ARG 108           HB3      ARG 108 -17.935  20.666  17.391
  869    HG2  ARG 108           HG2      ARG 108 -19.321  18.716  17.874
  870    HG3  ARG 108           HG3      ARG 108 -17.870  17.770  18.217
  871    HD2  ARG 108           HD2      ARG 108 -17.440  18.899  20.186
  872    HD3  ARG 108           HD3      ARG 108 -18.332  20.333  19.678
  873    HE   ARG 108           HE       ARG 108 -20.307  18.568  19.879
  874   HH11  ARG 108          HH11      ARG 108 -17.672  19.199  22.115
  875   HH12  ARG 108          HH12      ARG 108 -18.591  18.737  23.508
  876   HH21  ARG 108          HH21      ARG 108 -20.754  18.048  23.282
  877   HH22  ARG 108          HH22      ARG 108 -21.494  17.979  21.717
  878    H    THR 109           H        THR 109 -19.083  20.170  14.215
  879    HA   THR 109           HA       THR 109 -17.220  22.141  13.090
  880    HB   THR 109           HB       THR 109 -19.019  22.397  11.308
  881    HG1  THR 109           HG1      THR 109 -20.418  20.483  11.200
  882   HG21  THR 109          HG21      THR 109 -17.684  19.708  11.647
  883   HG22  THR 109          HG22      THR 109 -16.999  21.133  10.863
  884   HG23  THR 109          HG23      THR 109 -18.383  20.310  10.143
  885    H    LYS 110           H        LYS 110 -17.380  24.199  13.668
  886    HA   LYS 110           HA       LYS 110 -19.691  25.150  15.094
  887    HB2  LYS 110           HB2      LYS 110 -16.926  26.218  14.669
  888    HB3  LYS 110           HB3      LYS 110 -18.199  27.261  15.283
  889    HG2  LYS 110           HG2      LYS 110 -18.535  25.718  17.165
  890    HG3  LYS 110           HG3      LYS 110 -17.216  24.715  16.556
  891    HD2  LYS 110           HD2      LYS 110 -15.648  26.532  16.855
  892    HD3  LYS 110           HD3      LYS 110 -16.952  27.617  17.341
  893    HE2  LYS 110           HE2      LYS 110 -17.385  26.216  19.299
  894    HE3  LYS 110           HE3      LYS 110 -16.087  25.128  18.811
  895    HZ1  LYS 110           HZ1      LYS 110 -14.516  26.945  19.066
  896    HZ2  LYS 110           HZ2      LYS 110 -15.352  26.676  20.512
  897    HZ3  LYS 110           HZ3      LYS 110 -15.762  27.992  19.530
  898    H    LYS 111           H        LYS 111 -20.960  26.901  14.481
  899    HA   LYS 111           HA       LYS 111 -21.135  27.379  11.665
  900    HB2  LYS 111           HB2      LYS 111 -22.868  28.018  14.017
  901    HB3  LYS 111           HB3      LYS 111 -23.145  28.828  12.481
  902    HG2  LYS 111           HG2      LYS 111 -23.573  26.745  11.385
  903    HG3  LYS 111           HG3      LYS 111 -23.091  25.838  12.819
  904    HD2  LYS 111           HD2      LYS 111 -24.986  26.622  14.042
  905    HD3  LYS 111           HD3      LYS 111 -25.396  27.779  12.776
  906    HE2  LYS 111           HE2      LYS 111 -25.954  25.996  11.258
  907    HE3  LYS 111           HE3      LYS 111 -25.390  24.786  12.409
  908    HZ1  LYS 111           HZ1      LYS 111 -27.652  26.641  12.916
  909    HZ2  LYS 111           HZ2      LYS 111 -27.167  25.342  13.885
  910    HZ3  LYS 111           HZ3      LYS 111 -27.831  25.054  12.357
  Start of MODEL    7
    1    H1   MET  -3           H1       MET  -3  13.353 -21.601 -12.122
    2    H2   MET  -3           H2       MET  -3  12.480 -22.835 -11.364
    3    H3   MET  -3           H3       MET  -3  12.606 -22.802 -13.050
    4    HA   MET  -3           HA       MET  -3  14.057 -24.478 -12.122
    5    HB2  MET  -3           HB2      MET  -3  15.341 -22.059 -13.382
    6    HB3  MET  -3           HB3      MET  -3  16.249 -23.529 -13.059
    7    HG2  MET  -3           HG2      MET  -3  13.790 -23.357 -14.786
    8    HG3  MET  -3           HG3      MET  -3  15.450 -23.380 -15.377
    9    HE1  MET  -3           HE1      MET  -3  13.206 -25.419 -16.383
   10    HE2  MET  -3           HE2      MET  -3  14.128 -26.923 -16.402
   11    HE3  MET  -3           HE3      MET  -3  14.871 -25.425 -16.962
   12    H    HIS  -2           H        HIS  -2  15.384 -25.153 -10.539
   13    HA   HIS  -2           HA       HIS  -2  16.328 -23.143  -8.596
   14    HB2  HIS  -2           HB2      HIS  -2  15.281 -25.939  -8.164
   15    HB3  HIS  -2           HB3      HIS  -2  16.210 -25.086  -6.937
   16    HD1  HIS  -2           HD1      HIS  -2  15.098 -22.737  -6.138
   17    HD2  HIS  -2           HD2      HIS  -2  12.615 -25.410  -8.128
   18    HE1  HIS  -2           HE1      HIS  -2  12.753 -22.001  -5.606
   19    HE2  HIS  -2           HE2      HIS  -2  11.265 -23.630  -6.823
   20    H    HIS  -1           H        HIS  -1  18.347 -23.417  -7.656
   21    HA   HIS  -1           HA       HIS  -1  20.139 -25.308  -9.038
   22    HB2  HIS  -1           HB2      HIS  -1  20.587 -22.472  -8.132
   23    HB3  HIS  -1           HB3      HIS  -1  21.938 -23.565  -8.418
   24    HD1  HIS  -1           HD1      HIS  -1  19.000 -22.048 -10.273
   25    HD2  HIS  -1           HD2      HIS  -1  22.709 -23.764 -11.024
   26    HE1  HIS  -1           HE1      HIS  -1  19.399 -21.735 -12.737
   27    HE2  HIS  -1           HE2      HIS  -1  21.651 -22.781 -13.170
   28    H    HIS   0           H        HIS   0  19.487 -23.639  -5.973
   29    HA   HIS   0           HA       HIS   0  21.197 -25.571  -4.566
   30    HB2  HIS   0           HB2      HIS   0  20.177 -22.839  -3.820
   31    HB3  HIS   0           HB3      HIS   0  20.827 -23.939  -2.610
   32    HD1  HIS   0           HD1      HIS   0  21.822 -21.519  -5.178
   33    HD2  HIS   0           HD2      HIS   0  23.621 -24.572  -3.007
   34    HE1  HIS   0           HE1      HIS   0  24.297 -21.153  -5.428
   35    HE2  HIS   0           HE2      HIS   0  25.368 -23.011  -4.106
   36    H    HIS   1           H        HIS   1  20.436 -26.787  -2.860
   37    HA   HIS   1           HA       HIS   1  17.513 -27.061  -2.725
   38    HB2  HIS   1           HB2      HIS   1  19.756 -29.000  -2.189
   39    HB3  HIS   1           HB3      HIS   1  18.105 -29.321  -1.674
   40    HD1  HIS   1           HD1      HIS   1  20.192 -28.924  -4.783
   41    HD2  HIS   1           HD2      HIS   1  16.386 -30.167  -3.667
   42    HE1  HIS   1           HE1      HIS   1  19.195 -29.969  -6.841
   43    HE2  HIS   1           HE2      HIS   1  16.891 -30.716  -6.144
   44    H    HIS   2           H        HIS   2  20.411 -26.799  -0.703
   45    HA   HIS   2           HA       HIS   2  18.759 -26.597   1.706
   46    HB2  HIS   2           HB2      HIS   2  21.671 -27.091   1.213
   47    HB3  HIS   2           HB3      HIS   2  21.143 -26.484   2.778
   48    HD1  HIS   2           HD1      HIS   2  19.068 -28.050   3.822
   49    HD2  HIS   2           HD2      HIS   2  21.704 -29.790   1.120
   50    HE1  HIS   2           HE1      HIS   2  18.854 -30.530   4.175
   51    HE2  HIS   2           HE2      HIS   2  20.459 -31.565   2.532
   52    H    HIS   3           H        HIS   3  18.677 -24.821   3.002
   53    HA   HIS   3           HA       HIS   3  20.069 -22.386   2.104
   54    HB2  HIS   3           HB2      HIS   3  17.153 -22.678   2.841
   55    HB3  HIS   3           HB3      HIS   3  17.972 -21.121   2.783
   56    HD1  HIS   3           HD1      HIS   3  18.920 -20.423   0.368
   57    HD2  HIS   3           HD2      HIS   3  16.224 -23.585   0.438
   58    HE1  HIS   3           HE1      HIS   3  18.121 -20.677  -2.003
   59    HE2  HIS   3           HE2      HIS   3  16.488 -22.596  -1.938
   60    H    SER   4           H        SER   4  20.892 -21.105   3.686
   61    HA   SER   4           HA       SER   4  20.849 -22.181   6.403
   62    HB2  SER   4           HB2      SER   4  22.589 -20.046   5.151
   63    HB3  SER   4           HB3      SER   4  22.762 -20.665   6.793
   64    HG   SER   4           HG       SER   4  22.727 -22.535   4.734
   65    H    THR   5           H        THR   5  19.805 -21.278   8.042
   66    HA   THR   5           HA       THR   5  18.563 -18.646   7.653
   67    HB   THR   5           HB       THR   5  16.909 -20.341   8.089
   68    HG1  THR   5           HG1      THR   5  17.265 -18.873  10.501
   69   HG21  THR   5          HG21      THR   5  18.422 -21.002  10.623
   70   HG22  THR   5          HG22      THR   5  18.246 -22.041   9.208
   71   HG23  THR   5          HG23      THR   5  16.836 -21.637  10.187
   72    H    SER   6           H        SER   6  18.884 -16.973   9.038
   73    HA   SER   6           HA       SER   6  21.155 -17.212  10.861
   74    HB2  SER   6           HB2      SER   6  19.677 -14.756   9.883
   75    HB3  SER   6           HB3      SER   6  21.141 -14.748  10.866
   76    HG   SER   6           HG       SER   6  21.172 -14.631   8.362
   77    H    VAL   7           H        VAL   7  21.124 -16.607  13.013
   78    HA   VAL   7           HA       VAL   7  18.488 -16.701  14.313
   79    HB   VAL   7           HB       VAL   7  21.177 -16.906  15.702
   80   HG11  VAL   7          HG11      VAL   7  19.878 -18.071  17.449
   81   HG12  VAL   7          HG12      VAL   7  18.402 -17.761  16.536
   82   HG13  VAL   7          HG13      VAL   7  19.330 -16.414  17.193
   83   HG21  VAL   7          HG21      VAL   7  21.127 -18.698  14.090
   84   HG22  VAL   7          HG22      VAL   7  19.494 -19.148  14.580
   85   HG23  VAL   7          HG23      VAL   7  20.842 -19.366  15.698
   86    H    ASP   8           H        ASP   8  17.613 -14.942  15.190
   87    HA   ASP   8           HA       ASP   8  19.077 -12.428  15.202
   88    HB2  ASP   8           HB2      ASP   8  16.180 -13.138  15.660
   89    HB3  ASP   8           HB3      ASP   8  16.801 -11.505  15.887
   90    H    LEU   9           H        LEU   9  19.284 -11.057  16.990
   91    HA   LEU   9           HA       LEU   9  19.094 -12.352  19.623
   92    HB2  LEU   9           HB2      LEU   9  21.403 -11.693  18.519
   93    HB3  LEU   9           HB3      LEU   9  20.978 -10.094  19.077
   94    HG   LEU   9           HG       LEU   9  22.533 -11.154  20.607
   95   HD11  LEU   9          HD11      LEU   9  20.969  -9.625  21.618
   96   HD12  LEU   9          HD12      LEU   9  21.330 -10.948  22.727
   97   HD13  LEU   9          HD13      LEU   9  19.801 -10.927  21.850
   98   HD21  LEU   9          HD21      LEU   9  22.050 -13.148  21.865
   99   HD22  LEU   9          HD22      LEU   9  21.957 -13.499  20.138
  100   HD23  LEU   9          HD23      LEU   9  20.478 -13.308  21.081
  101    H    GLY  10           H        GLY  10  18.749  -9.413  17.822
  102    HA2  GLY  10           HA2      GLY  10  16.924  -7.899  18.157
  103    HA3  GLY  10           HA3      GLY  10  16.908  -8.354  19.855
  104    H    THR  11           H        THR  11  19.016  -6.839  17.429
  105    HA   THR  11           HA       THR  11  19.909  -4.917  19.483
  106    HB   THR  11           HB       THR  11  22.044  -4.721  18.254
  107    HG1  THR  11           HG1      THR  11  22.495  -6.167  16.571
  108   HG21  THR  11          HG21      THR  11  22.023  -6.255  20.103
  109   HG22  THR  11          HG22      THR  11  22.945  -6.993  18.792
  110   HG23  THR  11          HG23      THR  11  21.286  -7.511  19.106
  111    H    GLU  12           H        GLU  12  18.601  -5.456  16.360
  112    HA   GLU  12           HA       GLU  12  18.609  -2.589  15.746
  113    HB2  GLU  12           HB2      GLU  12  19.930  -3.909  14.152
  114    HB3  GLU  12           HB3      GLU  12  18.546  -4.947  13.856
  115    HG2  GLU  12           HG2      GLU  12  17.351  -3.149  12.828
  116    HG3  GLU  12           HG3      GLU  12  18.627  -2.006  13.241
  117    H    ASN  13           H        ASN  13  16.790  -5.535  15.259
  118    HA   ASN  13           HA       ASN  13  14.303  -4.218  14.762
  119    HB2  ASN  13           HB2      ASN  13  15.205  -6.472  13.804
  120    HB3  ASN  13           HB3      ASN  13  14.592  -7.159  15.294
  121   HD21  ASN  13          HD21      ASN  13  13.995  -7.346  12.434
  122   HD22  ASN  13          HD22      ASN  13  12.313  -7.105  12.339
  123    H    LEU  14           H        LEU  14  15.056  -3.277  17.130
  124    HA   LEU  14           HA       LEU  14  13.984  -4.782  19.340
  125    HB2  LEU  14           HB2      LEU  14  14.636  -1.853  19.403
  126    HB3  LEU  14           HB3      LEU  14  14.611  -2.978  20.743
  127    HG   LEU  14           HG       LEU  14  16.562  -4.079  19.199
  128   HD11  LEU  14          HD11      LEU  14  16.324  -2.112  17.642
  129   HD12  LEU  14          HD12      LEU  14  17.949  -2.402  18.268
  130   HD13  LEU  14          HD13      LEU  14  16.961  -1.108  18.946
  131   HD21  LEU  14          HD21      LEU  14  16.809  -1.951  21.319
  132   HD22  LEU  14          HD22      LEU  14  18.140  -2.962  20.754
  133   HD23  LEU  14          HD23      LEU  14  16.754  -3.698  21.561
  134    H    TYR  15           H        TYR  15  12.858  -2.306  17.232
  135    HA   TYR  15           HA       TYR  15  10.505  -1.673  18.776
  136    HB2  TYR  15           HB2      TYR  15   9.910  -0.217  16.832
  137    HB3  TYR  15           HB3      TYR  15  11.473   0.143  17.542
  138    HD1  TYR  15           HD1      TYR  15  13.556  -0.758  16.332
  139    HD2  TYR  15           HD2      TYR  15   9.704  -0.603  14.534
  140    HE1  TYR  15           HE1      TYR  15  14.596  -0.888  14.110
  141    HE2  TYR  15           HE2      TYR  15  10.734  -0.735  12.305
  142    HH   TYR  15           HH       TYR  15  14.040  -1.514  11.851
  143    H    PHE  16           H        PHE  16   8.712  -2.811  18.733
  144    HA   PHE  16           HA       PHE  16   8.371  -4.992  16.919
  145    HB2  PHE  16           HB2      PHE  16   7.923  -4.739  19.504
  146    HB3  PHE  16           HB3      PHE  16   6.324  -4.265  18.942
  147    HD1  PHE  16           HD1      PHE  16   8.740  -6.993  19.205
  148    HD2  PHE  16           HD2      PHE  16   4.850  -5.874  17.892
  149    HE1  PHE  16           HE1      PHE  16   8.133  -9.368  18.996
  150    HE2  PHE  16           HE2      PHE  16   4.237  -8.248  17.679
  151    HZ   PHE  16           HZ       PHE  16   5.879  -9.997  18.231
  152    H    GLN  17           H        GLN  17   7.255  -1.759  17.064
  153    HA   GLN  17           HA       GLN  17   4.861  -2.276  15.463
  154    HB2  GLN  17           HB2      GLN  17   5.974   0.249  16.703
  155    HB3  GLN  17           HB3      GLN  17   4.564   0.234  15.653
  156    HG2  GLN  17           HG2      GLN  17   4.662  -1.502  18.085
  157    HG3  GLN  17           HG3      GLN  17   4.242   0.205  18.217
  158   HE21  GLN  17          HE21      GLN  17   3.263  -2.909  17.029
  159   HE22  GLN  17          HE22      GLN  17   1.623  -2.490  16.681
  160    H    SER  18           H        SER  18   5.222  -2.610  13.366
  161    HA   SER  18           HA       SER  18   7.114  -0.843  11.952
  162    HB2  SER  18           HB2      SER  18   7.827  -3.250  12.104
  163    HB3  SER  18           HB3      SER  18   6.401  -3.674  11.158
  164    HG   SER  18           HG       SER  18   8.267  -3.414   9.851
  165    H    ASN  19           H        ASN  19   6.436   0.182  10.151
  166    HA   ASN  19           HA       ASN  19   3.682  -0.330   9.228
  167    HB2  ASN  19           HB2      ASN  19   5.200   2.268   9.482
  168    HB3  ASN  19           HB3      ASN  19   3.758   2.123   8.494
  169   HD21  ASN  19          HD21      ASN  19   4.440   3.681  10.814
  170   HD22  ASN  19          HD22      ASN  19   3.232   3.328  11.965
  171    H    ALA  20           H        ALA  20   6.920   0.725   8.235
  172    HA   ALA  20           HA       ALA  20   6.319   0.362   5.411
  173    HB1  ALA  20           HB1      ALA  20   8.590   1.214   5.041
  174    HB2  ALA  20           HB2      ALA  20   8.865   1.234   6.782
  175    HB3  ALA  20           HB3      ALA  20   7.648   2.292   6.069
  176    H    GLY  21           H        GLY  21   7.325  -1.144   4.072
  177    HA2  GLY  21           HA2      GLY  21   9.176  -2.852   3.947
  178    HA3  GLY  21           HA3      GLY  21   8.545  -3.444   5.475
  179    H    LYS  22           H        LYS  22   5.883  -2.506   3.844
  180    HA   LYS  22           HA       LYS  22   5.272  -5.211   3.019
  181    HB2  LYS  22           HB2      LYS  22   2.957  -4.423   2.792
  182    HB3  LYS  22           HB3      LYS  22   3.630  -4.053   4.367
  183    HG2  LYS  22           HG2      LYS  22   4.152  -1.741   3.167
  184    HG3  LYS  22           HG3      LYS  22   2.762  -2.242   2.200
  185    HD2  LYS  22           HD2      LYS  22   1.450  -2.544   4.253
  186    HD3  LYS  22           HD3      LYS  22   2.838  -2.029   5.214
  187    HE2  LYS  22           HE2      LYS  22   2.781   0.150   4.037
  188    HE3  LYS  22           HE3      LYS  22   1.322  -0.377   3.198
  189    HZ1  LYS  22           HZ1      LYS  22   0.215  -0.595   5.336
  190    HZ2  LYS  22           HZ2      LYS  22   0.790   0.982   5.122
  191    HZ3  LYS  22           HZ3      LYS  22   1.615  -0.088   6.139
  192    H    MET  23           H        MET  23   3.788  -5.307   0.917
  193    HA   MET  23           HA       MET  23   5.167  -3.901  -1.196
  194    HB2  MET  23           HB2      MET  23   4.617  -6.774  -0.786
  195    HB3  MET  23           HB3      MET  23   4.424  -6.161  -2.412
  196    HG2  MET  23           HG2      MET  23   6.746  -5.196  -2.201
  197    HG3  MET  23           HG3      MET  23   6.889  -6.124  -0.711
  198    HE1  MET  23           HE1      MET  23   7.239  -7.561  -4.987
  199    HE2  MET  23           HE2      MET  23   8.234  -6.330  -4.212
  200    HE3  MET  23           HE3      MET  23   6.505  -6.051  -4.447
  201    H    PHE  24           H        PHE  24   4.059  -3.566  -3.020
  202    HA   PHE  24           HA       PHE  24   1.190  -3.060  -2.813
  203    HB2  PHE  24           HB2      PHE  24   2.906  -1.174  -3.169
  204    HB3  PHE  24           HB3      PHE  24   3.189  -1.846  -4.761
  205    HD1  PHE  24           HD1      PHE  24   2.398   0.959  -4.190
  206    HD2  PHE  24           HD2      PHE  24   0.008  -2.475  -4.988
  207    HE1  PHE  24           HE1      PHE  24   0.615   2.407  -5.071
  208    HE2  PHE  24           HE2      PHE  24  -1.759  -1.025  -5.873
  209    HZ   PHE  24           HZ       PHE  24  -1.470   1.413  -5.912
  210    H    ILE  25           H        ILE  25   0.166  -4.775  -3.749
  211    HA   ILE  25           HA       ILE  25   1.274  -6.113  -6.071
  212    HB   ILE  25           HB       ILE  25  -1.223  -6.972  -4.820
  213   HG12  ILE  25          HG12      ILE  25   0.221  -6.385  -2.893
  214   HG13  ILE  25          HG13      ILE  25  -0.179  -8.082  -2.958
  215   HG21  ILE  25          HG21      ILE  25   1.119  -8.398  -6.023
  216   HG22  ILE  25          HG22      ILE  25  -0.527  -8.290  -6.642
  217   HG23  ILE  25          HG23      ILE  25  -0.189  -9.242  -5.199
  218   HD11  ILE  25          HD11      ILE  25   2.140  -7.681  -2.271
  219   HD12  ILE  25          HD12      ILE  25   2.450  -6.880  -3.811
  220   HD13  ILE  25          HD13      ILE  25   2.058  -8.599  -3.775
  221    H    GLY  26           H        GLY  26   0.750  -5.256  -7.923
  222    HA2  GLY  26           HA2      GLY  26  -1.805  -3.996  -8.312
  223    HA3  GLY  26           HA3      GLY  26  -0.419  -3.728  -9.306
  224    H    GLY  27           H        GLY  27  -2.963  -4.137 -10.250
  225    HA2  GLY  27           HA2      GLY  27  -3.890  -5.167 -12.089
  226    HA3  GLY  27           HA3      GLY  27  -2.475  -6.194 -12.167
  227    H    LEU  28           H        LEU  28  -4.291  -6.200  -9.185
  228    HA   LEU  28           HA       LEU  28  -4.711  -8.944  -9.186
  229    HB2  LEU  28           HB2      LEU  28  -6.339  -6.873  -7.689
  230    HB3  LEU  28           HB3      LEU  28  -6.191  -8.567  -7.278
  231    HG   LEU  28           HG       LEU  28  -3.809  -6.718  -7.260
  232   HD11  LEU  28          HD11      LEU  28  -5.650  -7.351  -4.955
  233   HD12  LEU  28          HD12      LEU  28  -5.561  -5.802  -5.794
  234   HD13  LEU  28          HD13      LEU  28  -4.170  -6.394  -4.888
  235   HD21  LEU  28          HD21      LEU  28  -3.496  -9.216  -7.233
  236   HD22  LEU  28          HD22      LEU  28  -4.338  -9.233  -5.686
  237   HD23  LEU  28          HD23      LEU  28  -2.817  -8.361  -5.851
  238    H    SER  29           H        SER  29  -7.034  -9.936  -8.971
  239    HA   SER  29           HA       SER  29  -8.588  -9.084 -11.273
  240    HB2  SER  29           HB2      SER  29  -7.562 -11.442 -11.093
  241    HB3  SER  29           HB3      SER  29  -8.789 -11.752  -9.866
  242    HG   SER  29           HG       SER  29  -9.679 -10.635 -12.242
  243    H    TRP  30           H        TRP  30 -10.920  -9.824 -10.970
  244    HA   TRP  30           HA       TRP  30 -12.147  -8.216  -9.011
  245    HB2  TRP  30           HB2      TRP  30 -14.210  -8.928 -10.118
  246    HB3  TRP  30           HB3      TRP  30 -13.012  -8.460 -11.298
  247    HD1  TRP  30           HD1      TRP  30 -11.425 -11.069 -11.765
  248    HE1  TRP  30           HE1      TRP  30 -12.499 -13.171 -12.738
  249    HE3  TRP  30           HE3      TRP  30 -16.344 -10.062 -10.729
  250    HZ2  TRP  30           HZ2      TRP  30 -15.038 -14.266 -13.069
  251    HZ3  TRP  30           HZ3      TRP  30 -18.035 -11.711 -11.427
  252    HH2  TRP  30           HH2      TRP  30 -17.396 -13.769 -12.575
  253    H    GLN  31           H        GLN  31 -11.134 -11.434  -9.119
  254    HA   GLN  31           HA       GLN  31 -13.001 -12.438  -7.126
  255    HB2  GLN  31           HB2      GLN  31 -10.914 -13.705  -8.869
  256    HB3  GLN  31           HB3      GLN  31 -11.773 -14.602  -7.621
  257    HG2  GLN  31           HG2      GLN  31 -13.905 -14.028  -8.766
  258    HG3  GLN  31           HG3      GLN  31 -12.957 -13.285 -10.056
  259   HE21  GLN  31          HE21      GLN  31 -13.750 -16.264  -8.443
  260   HE22  GLN  31          HE22      GLN  31 -13.252 -17.321  -9.712
  261    H    THR  32           H        THR  32  -9.739 -11.413  -7.497
  262    HA   THR  32           HA       THR  32  -8.536 -12.709  -5.319
  263    HB   THR  32           HB       THR  32  -7.648 -10.050  -6.201
  264    HG1  THR  32           HG1      THR  32  -8.173 -12.117  -7.856
  265   HG21  THR  32          HG21      THR  32  -6.265 -11.181  -4.570
  266   HG22  THR  32          HG22      THR  32  -5.419 -11.153  -6.116
  267   HG23  THR  32          HG23      THR  32  -6.218 -12.627  -5.576
  268    H    SER  33           H        SER  33  -9.088 -12.551  -3.283
  269    HA   SER  33           HA       SER  33 -10.078 -10.032  -2.138
  270    HB2  SER  33           HB2      SER  33 -10.240 -12.899  -1.182
  271    HB3  SER  33           HB3      SER  33 -10.800 -11.523  -0.236
  272    HG   SER  33           HG       SER  33 -11.779 -11.510  -2.777
  273    HA   PRO  34           HA       PRO  34  -6.354  -9.327   0.232
  274    HB2  PRO  34           HB2      PRO  34  -7.296  -8.990   2.820
  275    HB3  PRO  34           HB3      PRO  34  -7.230  -7.713   1.595
  276    HG2  PRO  34           HG2      PRO  34  -9.543  -9.416   2.414
  277    HG3  PRO  34           HG3      PRO  34  -9.502  -7.689   2.001
  278    HD2  PRO  34           HD2      PRO  34 -10.416  -9.477   0.254
  279    HD3  PRO  34           HD3      PRO  34  -9.442  -8.096  -0.280
  280    H    ASP  35           H        ASP  35  -8.593 -11.703   1.298
  281    HA   ASP  35           HA       ASP  35  -6.775 -13.153   2.986
  282    HB2  ASP  35           HB2      ASP  35  -9.545 -13.336   2.218
  283    HB3  ASP  35           HB3      ASP  35  -8.788 -14.886   2.451
  284    H    SER  36           H        SER  36  -7.914 -13.197  -0.256
  285    HA   SER  36           HA       SER  36  -6.843 -15.717  -1.073
  286    HB2  SER  36           HB2      SER  36  -8.710 -14.522  -2.258
  287    HB3  SER  36           HB3      SER  36  -7.534 -13.333  -2.813
  288    HG   SER  36           HG       SER  36  -7.901 -14.986  -4.360
  289    H    LEU  37           H        LEU  37  -5.734 -12.359  -1.037
  290    HA   LEU  37           HA       LEU  37  -3.327 -12.741  -2.450
  291    HB2  LEU  37           HB2      LEU  37  -4.903 -10.719  -1.141
  292    HB3  LEU  37           HB3      LEU  37  -3.238 -10.547  -0.728
  293    HG   LEU  37           HG       LEU  37  -4.248 -10.672  -3.546
  294   HD11  LEU  37          HD11      LEU  37  -3.619  -8.267  -1.848
  295   HD12  LEU  37          HD12      LEU  37  -5.207  -8.767  -2.432
  296   HD13  LEU  37          HD13      LEU  37  -3.977  -8.233  -3.576
  297   HD21  LEU  37          HD21      LEU  37  -2.081  -9.603  -4.080
  298   HD22  LEU  37          HD22      LEU  37  -1.900 -11.215  -3.394
  299   HD23  LEU  37          HD23      LEU  37  -1.602  -9.793  -2.397
  300    H    ARG  38           H        ARG  38  -4.329 -12.741   0.923
  301    HA   ARG  38           HA       ARG  38  -1.794 -12.949   2.105
  302    HB2  ARG  38           HB2      ARG  38  -4.251 -12.403   3.071
  303    HB3  ARG  38           HB3      ARG  38  -4.140 -14.102   3.508
  304    HG2  ARG  38           HG2      ARG  38  -2.061 -13.648   4.725
  305    HG3  ARG  38           HG3      ARG  38  -2.192 -11.943   4.296
  306    HD2  ARG  38           HD2      ARG  38  -4.326 -13.421   5.823
  307    HD3  ARG  38           HD3      ARG  38  -2.993 -12.577   6.610
  308    HE   ARG  38           HE       ARG  38  -4.447 -10.932   4.758
  309   HH11  ARG  38          HH11      ARG  38  -4.397 -12.083   8.076
  310   HH12  ARG  38          HH12      ARG  38  -5.325 -10.747   8.672
  311   HH21  ARG  38          HH21      ARG  38  -6.036  -9.115   7.249
  312   HH22  ARG  38          HH22      ARG  38  -5.655  -9.197   5.562
  313    H    ASP  39           H        ASP  39  -4.323 -15.255   1.179
  314    HA   ASP  39           HA       ASP  39  -3.033 -17.608   1.988
  315    HB2  ASP  39           HB2      ASP  39  -5.380 -16.886   0.433
  316    HB3  ASP  39           HB3      ASP  39  -4.587 -18.322  -0.207
  317    H    TYR  40           H        TYR  40  -2.908 -15.784  -1.054
  318    HA   TYR  40           HA       TYR  40  -1.431 -17.691  -2.539
  319    HB2  TYR  40           HB2      TYR  40  -2.603 -15.099  -2.972
  320    HB3  TYR  40           HB3      TYR  40  -0.965 -15.122  -3.609
  321    HD1  TYR  40           HD1      TYR  40  -0.380 -17.196  -5.117
  322    HD2  TYR  40           HD2      TYR  40  -4.337 -15.871  -4.297
  323    HE1  TYR  40           HE1      TYR  40  -1.176 -18.341  -7.144
  324    HE2  TYR  40           HE2      TYR  40  -5.146 -17.018  -6.316
  325    HH   TYR  40           HH       TYR  40  -3.264 -19.267  -8.036
  326    H    PHE  41           H        PHE  41  -0.541 -14.615  -0.993
  327    HA   PHE  41           HA       PHE  41   2.198 -14.794  -1.583
  328    HB2  PHE  41           HB2      PHE  41   0.433 -12.971  -0.137
  329    HB3  PHE  41           HB3      PHE  41   2.147 -12.829   0.148
  330    HD1  PHE  41           HD1      PHE  41  -0.381 -12.979  -2.573
  331    HD2  PHE  41           HD2      PHE  41   3.478 -11.634  -1.386
  332    HE1  PHE  41           HE1      PHE  41  -0.137 -11.769  -4.707
  333    HE2  PHE  41           HE2      PHE  41   3.716 -10.418  -3.501
  334    HZ   PHE  41           HZ       PHE  41   1.911 -10.490  -5.170
  335    H    SER  42           H        SER  42   0.307 -15.985   1.096
  336    HA   SER  42           HA       SER  42   2.319 -16.131   3.084
  337    HB2  SER  42           HB2      SER  42   0.871 -17.946   4.092
  338    HB3  SER  42           HB3      SER  42   0.034 -16.425   3.791
  339    HG   SER  42           HG       SER  42  -0.119 -17.986   1.614
  340    H    LYS  43           H        LYS  43   1.851 -17.601   0.246
  341    HA   LYS  43           HA       LYS  43   3.057 -20.153   0.715
  342    HB2  LYS  43           HB2      LYS  43   1.926 -18.696  -1.617
  343    HB3  LYS  43           HB3      LYS  43   2.948 -20.079  -1.902
  344    HG2  LYS  43           HG2      LYS  43   1.025 -20.768   0.087
  345    HG3  LYS  43           HG3      LYS  43   0.202 -20.047  -1.295
  346    HD2  LYS  43           HD2      LYS  43   1.264 -21.641  -2.790
  347    HD3  LYS  43           HD3      LYS  43   2.180 -22.322  -1.446
  348    HE2  LYS  43           HE2      LYS  43   0.365 -23.791  -1.816
  349    HE3  LYS  43           HE3      LYS  43  -0.036 -22.868  -0.369
  350    HZ1  LYS  43           HZ1      LYS  43  -1.440 -21.434  -1.726
  351    HZ2  LYS  43           HZ2      LYS  43  -1.935 -23.047  -1.841
  352    HZ3  LYS  43           HZ3      LYS  43  -1.065 -22.339  -3.107
  353    H    PHE  44           H        PHE  44   4.228 -17.043   0.183
  354    HA   PHE  44           HA       PHE  44   6.803 -17.967  -0.900
  355    HB2  PHE  44           HB2      PHE  44   5.216 -15.766  -1.537
  356    HB3  PHE  44           HB3      PHE  44   6.597 -15.130  -0.660
  357    HD1  PHE  44           HD1      PHE  44   8.854 -15.344  -1.548
  358    HD2  PHE  44           HD2      PHE  44   5.477 -16.817  -3.682
  359    HE1  PHE  44           HE1      PHE  44  10.234 -15.571  -3.578
  360    HE2  PHE  44           HE2      PHE  44   6.852 -17.045  -5.707
  361    HZ   PHE  44           HZ       PHE  44   9.227 -16.434  -5.650
  362    H    GLY  45           H        GLY  45   5.250 -16.344   1.751
  363    HA2  GLY  45           HA2      GLY  45   7.303 -16.926   3.585
  364    HA3  GLY  45           HA3      GLY  45   7.250 -15.217   3.183
  365    H    GLU  46           H        GLU  46   6.666 -14.944   5.418
  366    HA   GLU  46           HA       GLU  46   3.970 -15.657   6.071
  367    HB2  GLU  46           HB2      GLU  46   5.862 -16.246   7.665
  368    HB3  GLU  46           HB3      GLU  46   5.957 -14.520   8.010
  369    HG2  GLU  46           HG2      GLU  46   3.732 -14.477   8.842
  370    HG3  GLU  46           HG3      GLU  46   3.418 -16.108   8.267
  371    H    ILE  47           H        ILE  47   2.515 -14.273   6.326
  372    HA   ILE  47           HA       ILE  47   3.054 -11.455   5.827
  373    HB   ILE  47           HB       ILE  47   0.551 -12.958   5.329
  374   HG12  ILE  47          HG12      ILE  47   1.834 -11.602   3.142
  375   HG13  ILE  47          HG13      ILE  47   2.848 -12.822   3.885
  376   HG21  ILE  47          HG21      ILE  47   1.147 -10.049   4.994
  377   HG22  ILE  47          HG22      ILE  47  -0.197 -10.788   5.865
  378   HG23  ILE  47          HG23      ILE  47  -0.145 -10.851   4.103
  379   HD11  ILE  47          HD11      ILE  47   0.598 -14.246   3.584
  380   HD12  ILE  47          HD12      ILE  47   1.817 -14.142   2.312
  381   HD13  ILE  47          HD13      ILE  47   0.390 -13.104   2.262
  382    H    ARG  48           H        ARG  48   2.481  -9.912   7.127
  383    HA   ARG  48           HA       ARG  48   1.582 -10.517   9.807
  384    HB2  ARG  48           HB2      ARG  48   3.389  -8.816   8.810
  385    HB3  ARG  48           HB3      ARG  48   2.004  -7.754   8.795
  386    HG2  ARG  48           HG2      ARG  48   1.733  -7.898  11.130
  387    HG3  ARG  48           HG3      ARG  48   2.883  -9.232  11.251
  388    HD2  ARG  48           HD2      ARG  48   4.631  -7.636  10.353
  389    HD3  ARG  48           HD3      ARG  48   3.450  -6.348  10.589
  390    HE   ARG  48           HE       ARG  48   3.585  -7.635  13.002
  391   HH11  ARG  48          HH11      ARG  48   6.936  -5.539  12.286
  392   HH12  ARG  48          HH12      ARG  48   5.934  -6.014  10.955
  393   HH21  ARG  48          HH21      ARG  48   6.362  -6.101  14.416
  394   HH22  ARG  48          HH22      ARG  48   4.919  -7.009  14.728
  395    H    GLU  49           H        GLU  49   0.524  -8.747   6.964
  396    HA   GLU  49           HA       GLU  49  -2.246  -8.920   7.581
  397    HB2  GLU  49           HB2      GLU  49  -1.245  -6.877   8.936
  398    HB3  GLU  49           HB3      GLU  49  -1.294  -6.080   7.373
  399    HG2  GLU  49           HG2      GLU  49  -3.718  -6.597   7.244
  400    HG3  GLU  49           HG3      GLU  49  -3.623  -7.249   8.880
  401    H    CYS  50           H        CYS  50  -3.502  -8.061   5.820
  402    HA   CYS  50           HA       CYS  50  -2.115  -7.395   3.415
  403    HB2  CYS  50           HB2      CYS  50  -2.479  -9.773   3.205
  404    HB3  CYS  50           HB3      CYS  50  -4.179  -9.585   3.619
  405    HG   CYS  50           HG       CYS  50  -2.955  -9.796   0.705
  406    H    MET  51           H        MET  51  -3.362  -6.296   1.921
  407    HA   MET  51           HA       MET  51  -5.912  -5.233   2.747
  408    HB2  MET  51           HB2      MET  51  -4.295  -3.772   3.795
  409    HB3  MET  51           HB3      MET  51  -3.545  -3.516   2.248
  410    HG2  MET  51           HG2      MET  51  -5.531  -2.367   1.443
  411    HG3  MET  51           HG3      MET  51  -6.314  -2.645   3.000
  412    HE1  MET  51           HE1      MET  51  -5.392   1.261   2.719
  413    HE2  MET  51           HE2      MET  51  -6.731   0.115   2.777
  414    HE3  MET  51           HE3      MET  51  -5.701   0.196   1.349
  415    H    VAL  52           H        VAL  52  -7.207  -4.926   1.195
  416    HA   VAL  52           HA       VAL  52  -6.311  -4.467  -1.546
  417    HB   VAL  52           HB       VAL  52  -8.645  -6.113  -0.730
  418   HG11  VAL  52          HG11      VAL  52  -8.854  -6.642  -3.157
  419   HG12  VAL  52          HG12      VAL  52  -7.644  -5.394  -3.467
  420   HG13  VAL  52          HG13      VAL  52  -9.200  -4.957  -2.761
  421   HG21  VAL  52          HG21      VAL  52  -6.193  -6.987  -2.186
  422   HG22  VAL  52          HG22      VAL  52  -7.473  -8.017  -1.541
  423   HG23  VAL  52          HG23      VAL  52  -6.397  -7.144  -0.443
  424    H    MET  53           H        MET  53  -7.000  -2.699  -2.332
  425    HA   MET  53           HA       MET  53  -8.693  -0.903  -0.885
  426    HB2  MET  53           HB2      MET  53  -6.843  -0.753  -3.129
  427    HB3  MET  53           HB3      MET  53  -8.250   0.278  -3.340
  428    HG2  MET  53           HG2      MET  53  -6.674   0.311  -0.796
  429    HG3  MET  53           HG3      MET  53  -6.172   1.249  -2.197
  430    HE1  MET  53           HE1      MET  53  -9.575   0.873   0.233
  431    HE2  MET  53           HE2      MET  53  -9.072   2.402   0.952
  432    HE3  MET  53           HE3      MET  53  -7.947   1.047   0.887
  433    H    ARG  54           H        ARG  54 -10.720  -0.340  -1.185
  434    HA   ARG  54           HA       ARG  54 -12.184  -1.245  -3.571
  435    HB2  ARG  54           HB2      ARG  54 -12.488  -2.475  -1.183
  436    HB3  ARG  54           HB3      ARG  54 -13.664  -1.180  -1.007
  437    HG2  ARG  54           HG2      ARG  54 -14.704  -1.907  -3.140
  438    HG3  ARG  54           HG3      ARG  54 -13.588  -3.273  -3.169
  439    HD2  ARG  54           HD2      ARG  54 -15.393  -2.730  -0.832
  440    HD3  ARG  54           HD3      ARG  54 -15.919  -3.681  -2.217
  441    HE   ARG  54           HE       ARG  54 -13.451  -4.630  -1.134
  442   HH11  ARG  54          HH11      ARG  54 -16.876  -6.276   0.171
  443   HH12  ARG  54          HH12      ARG  54 -16.929  -4.756  -0.657
  444   HH21  ARG  54          HH21      ARG  54 -13.408  -6.626  -0.056
  445   HH22  ARG  54          HH22      ARG  54 -14.884  -7.334   0.511
  446    H    ASP  55           H        ASP  55 -14.208   0.032  -3.931
  447    HA   ASP  55           HA       ASP  55 -13.885   2.758  -3.069
  448    HB2  ASP  55           HB2      ASP  55 -14.641   1.512  -5.576
  449    HB3  ASP  55           HB3      ASP  55 -15.560   2.929  -5.155
  450    HA   PRO  56           HA       PRO  56 -17.709   1.963  -0.724
  451    HB2  PRO  56           HB2      PRO  56 -17.700   4.902  -0.381
  452    HB3  PRO  56           HB3      PRO  56 -17.736   3.629   0.845
  453    HG2  PRO  56           HG2      PRO  56 -15.539   5.087   0.436
  454    HG3  PRO  56           HG3      PRO  56 -15.451   3.365   0.857
  455    HD2  PRO  56           HD2      PRO  56 -15.056   4.680  -1.795
  456    HD3  PRO  56           HD3      PRO  56 -14.213   3.289  -1.081
  457    H    THR  57           H        THR  57 -17.312   3.847  -3.546
  458    HA   THR  57           HA       THR  57 -20.005   4.810  -3.737
  459    HB   THR  57           HB       THR  57 -19.280   5.474  -6.089
  460    HG1  THR  57           HG1      THR  57 -16.834   4.490  -5.031
  461   HG21  THR  57          HG21      THR  57 -19.348   7.079  -4.264
  462   HG22  THR  57          HG22      THR  57 -17.927   7.365  -5.268
  463   HG23  THR  57          HG23      THR  57 -17.759   6.551  -3.713
  464    H    THR  58           H        THR  58 -18.051   2.340  -5.352
  465    HA   THR  58           HA       THR  58 -20.505   1.199  -6.525
  466    HB   THR  58           HB       THR  58 -19.070   0.208  -8.282
  467    HG1  THR  58           HG1      THR  58 -16.890   1.067  -8.429
  468   HG21  THR  58          HG21      THR  58 -18.496   2.347  -9.445
  469   HG22  THR  58          HG22      THR  58 -18.893   3.199  -7.950
  470   HG23  THR  58          HG23      THR  58 -20.141   2.292  -8.807
  471    H    LYS  59           H        LYS  59 -18.204   0.675  -4.172
  472    HA   LYS  59           HA       LYS  59 -17.578  -1.035  -2.823
  473    HB2  LYS  59           HB2      LYS  59 -19.776  -2.752  -3.938
  474    HB3  LYS  59           HB3      LYS  59 -19.133  -2.719  -2.307
  475    HG2  LYS  59           HG2      LYS  59 -20.516  -0.318  -3.387
  476    HG3  LYS  59           HG3      LYS  59 -21.476  -1.696  -2.839
  477    HD2  LYS  59           HD2      LYS  59 -20.433  -1.559  -0.632
  478    HD3  LYS  59           HD3      LYS  59 -19.425  -0.218  -1.182
  479    HE2  LYS  59           HE2      LYS  59 -21.207   0.756   0.026
  480    HE3  LYS  59           HE3      LYS  59 -21.564   1.026  -1.679
  481    HZ1  LYS  59           HZ1      LYS  59 -23.530   0.315  -0.480
  482    HZ2  LYS  59           HZ2      LYS  59 -22.753  -1.098   0.031
  483    HZ3  LYS  59           HZ3      LYS  59 -23.085  -0.864  -1.610
  484    H    ARG  60           H        ARG  60 -17.009  -0.999  -5.863
  485    HA   ARG  60           HA       ARG  60 -16.004  -3.736  -6.220
  486    HB2  ARG  60           HB2      ARG  60 -16.300  -1.425  -8.144
  487    HB3  ARG  60           HB3      ARG  60 -15.534  -2.949  -8.568
  488    HG2  ARG  60           HG2      ARG  60 -17.652  -4.113  -8.040
  489    HG3  ARG  60           HG3      ARG  60 -18.397  -2.541  -7.741
  490    HD2  ARG  60           HD2      ARG  60 -18.085  -1.876 -10.008
  491    HD3  ARG  60           HD3      ARG  60 -17.068  -3.277 -10.340
  492    HE   ARG  60           HE       ARG  60 -19.519  -4.263  -9.522
  493   HH11  ARG  60          HH11      ARG  60 -19.570  -2.853 -13.283
  494   HH12  ARG  60          HH12      ARG  60 -18.338  -2.313 -12.191
  495   HH21  ARG  60          HH21      ARG  60 -21.123  -4.959 -10.968
  496   HH22  ARG  60          HH22      ARG  60 -21.145  -4.351 -12.590
  497    H    SER  61           H        SER  61 -13.844  -4.125  -6.907
  498    HA   SER  61           HA       SER  61 -11.899  -2.285  -5.735
  499    HB2  SER  61           HB2      SER  61 -11.558  -5.093  -6.829
  500    HB3  SER  61           HB3      SER  61 -10.309  -4.158  -6.007
  501    HG   SER  61           HG       SER  61 -12.734  -4.458  -4.680
  502    H    ARG  62           H        ARG  62  -9.982  -1.640  -6.886
  503    HA   ARG  62           HA       ARG  62 -10.498  -1.159  -9.715
  504    HB2  ARG  62           HB2      ARG  62  -8.710   0.077  -7.664
  505    HB3  ARG  62           HB3      ARG  62  -8.297   0.253  -9.366
  506    HG2  ARG  62           HG2      ARG  62 -10.472   1.265  -9.799
  507    HG3  ARG  62           HG3      ARG  62 -10.907   1.069  -8.101
  508    HD2  ARG  62           HD2      ARG  62  -9.158   2.583  -7.427
  509    HD3  ARG  62           HD3      ARG  62  -8.557   2.685  -9.082
  510    HE   ARG  62           HE       ARG  62 -10.961   3.606  -9.490
  511   HH11  ARG  62          HH11      ARG  62  -9.645   5.871  -6.443
  512   HH12  ARG  62          HH12      ARG  62  -8.934   4.313  -6.705
  513   HH21  ARG  62          HH21      ARG  62 -11.878   5.643  -9.119
  514   HH22  ARG  62          HH22      ARG  62 -11.308   6.621  -7.808
  515    H    GLY  63           H        GLY  63  -8.910  -3.463  -7.928
  516    HA2  GLY  63           HA2      GLY  63  -7.781  -5.313  -8.832
  517    HA3  GLY  63           HA3      GLY  63  -7.421  -4.369 -10.266
  518    H    PHE  64           H        PHE  64  -6.780  -3.444  -6.901
  519    HA   PHE  64           HA       PHE  64  -3.982  -4.089  -7.080
  520    HB2  PHE  64           HB2      PHE  64  -3.057  -1.935  -7.025
  521    HB3  PHE  64           HB3      PHE  64  -4.238  -1.904  -8.314
  522    HD1  PHE  64           HD1      PHE  64  -5.966  -0.347  -8.319
  523    HD2  PHE  64           HD2      PHE  64  -3.655  -0.935  -4.823
  524    HE1  PHE  64           HE1      PHE  64  -6.973   1.680  -7.333
  525    HE2  PHE  64           HE2      PHE  64  -4.634   1.094  -3.815
  526    HZ   PHE  64           HZ       PHE  64  -6.305   2.402  -5.072
  527    H    GLY  65           H        GLY  65  -2.917  -4.159  -5.092
  528    HA2  GLY  65           HA2      GLY  65  -4.217  -3.215  -2.743
  529    HA3  GLY  65           HA3      GLY  65  -4.142  -4.962  -2.895
  530    H    PHE  66           H        PHE  66  -2.893  -4.558  -0.896
  531    HA   PHE  66           HA       PHE  66  -0.086  -4.438  -1.386
  532    HB2  PHE  66           HB2      PHE  66  -1.650  -3.141   0.785
  533    HB3  PHE  66           HB3      PHE  66   0.066  -3.304   0.813
  534    HD1  PHE  66           HD1      PHE  66   1.462  -1.762  -0.351
  535    HD2  PHE  66           HD2      PHE  66  -2.752  -1.748  -0.936
  536    HE1  PHE  66           HE1      PHE  66   1.638   0.391  -1.533
  537    HE2  PHE  66           HE2      PHE  66  -2.586   0.402  -2.127
  538    HZ   PHE  66           HZ       PHE  66  -0.389   1.473  -2.425
  539    H    VAL  67           H        VAL  67   1.104  -5.527   0.316
  540    HA   VAL  67           HA       VAL  67  -0.328  -7.279   2.132
  541    HB   VAL  67           HB       VAL  67   1.609  -8.397   0.067
  542   HG11  VAL  67          HG11      VAL  67   2.210  -9.943   1.566
  543   HG12  VAL  67          HG12      VAL  67   0.539 -10.509   1.581
  544   HG13  VAL  67          HG13      VAL  67   1.070  -9.300   2.752
  545   HG21  VAL  67          HG21      VAL  67  -0.203  -9.832  -0.629
  546   HG22  VAL  67          HG22      VAL  67  -0.738  -8.153  -0.699
  547   HG23  VAL  67          HG23      VAL  67  -1.249  -9.188   0.635
  548    H    THR  68           H        THR  68   0.639  -7.488   3.915
  549    HA   THR  68           HA       THR  68   3.201  -6.176   4.237
  550    HB   THR  68           HB       THR  68   1.389  -6.753   6.471
  551    HG1  THR  68           HG1      THR  68   0.383  -5.635   4.475
  552   HG21  THR  68          HG21      THR  68   3.840  -5.492   6.189
  553   HG22  THR  68          HG22      THR  68   2.778  -5.390   7.603
  554   HG23  THR  68          HG23      THR  68   2.685  -4.155   6.346
  555    H    PHE  69           H        PHE  69   4.741  -7.546   4.169
  556    HA   PHE  69           HA       PHE  69   4.554 -10.168   5.260
  557    HB2  PHE  69           HB2      PHE  69   6.530  -8.655   3.650
  558    HB3  PHE  69           HB3      PHE  69   7.057 -10.090   4.509
  559    HD1  PHE  69           HD1      PHE  69   5.155  -8.792   1.744
  560    HD2  PHE  69           HD2      PHE  69   6.023 -12.283   4.011
  561    HE1  PHE  69           HE1      PHE  69   4.221 -10.187  -0.050
  562    HE2  PHE  69           HE2      PHE  69   5.099 -13.690   2.222
  563    HZ   PHE  69           HZ       PHE  69   4.207 -12.649   0.189
  564    H    ALA  70           H        ALA  70   5.122 -10.753   7.266
  565    HA   ALA  70           HA       ALA  70   6.181  -8.897   9.086
  566    HB1  ALA  70           HB1      ALA  70   5.774 -11.822   9.561
  567    HB2  ALA  70           HB2      ALA  70   4.501 -10.609   9.696
  568    HB3  ALA  70           HB3      ALA  70   5.886 -10.557  10.784
  569    H    ASP  71           H        ASP  71   7.778 -10.434   6.888
  570    HA   ASP  71           HA       ASP  71  10.247 -10.546   8.388
  571    HB2  ASP  71           HB2      ASP  71   9.186 -12.756   7.530
  572    HB3  ASP  71           HB3      ASP  71   9.816 -12.250   5.997
  573    HA   PRO  72           HA       PRO  72  11.571  -7.738   5.117
  574    HB2  PRO  72           HB2      PRO  72  14.279  -8.176   5.969
  575    HB3  PRO  72           HB3      PRO  72  13.324  -6.722   6.056
  576    HG2  PRO  72           HG2      PRO  72  14.057  -8.072   8.266
  577    HG3  PRO  72           HG3      PRO  72  12.539  -7.158   8.159
  578    HD2  PRO  72           HD2      PRO  72  12.990 -10.099   7.902
  579    HD3  PRO  72           HD3      PRO  72  11.675  -9.217   8.709
  580    H    ALA  73           H        ALA  73  12.603 -10.911   5.653
  581    HA   ALA  73           HA       ALA  73  14.357 -11.119   3.405
  582    HB1  ALA  73           HB1      ALA  73  13.186 -13.302   5.105
  583    HB2  ALA  73           HB2      ALA  73  14.743 -12.513   5.358
  584    HB3  ALA  73           HB3      ALA  73  14.480 -13.503   3.922
  585    H    SER  74           H        SER  74  11.033 -11.667   4.034
  586    HA   SER  74           HA       SER  74  10.466 -13.228   1.715
  587    HB2  SER  74           HB2      SER  74   9.080 -12.997   3.902
  588    HB3  SER  74           HB3      SER  74   8.374 -11.594   3.096
  589    HG   SER  74           HG       SER  74   8.456 -14.236   2.052
  590    H    VAL  75           H        VAL  75  10.559  -9.867   2.430
  591    HA   VAL  75           HA       VAL  75   9.305  -8.904   0.089
  592    HB   VAL  75           HB       VAL  75  11.356  -7.384   1.700
  593   HG11  VAL  75          HG11      VAL  75  10.622  -6.290  -0.361
  594   HG12  VAL  75          HG12      VAL  75  10.074  -5.399   1.058
  595   HG13  VAL  75          HG13      VAL  75   8.944  -6.413   0.164
  596   HG21  VAL  75          HG21      VAL  75   9.785  -8.276   3.310
  597   HG22  VAL  75          HG22      VAL  75   8.423  -7.697   2.350
  598   HG23  VAL  75          HG23      VAL  75   9.514  -6.542   3.119
  599    H    ASP  76           H        ASP  76  12.514  -9.786   0.955
  600    HA   ASP  76           HA       ASP  76  13.861  -8.773  -1.312
  601    HB2  ASP  76           HB2      ASP  76  14.702  -9.567   1.053
  602    HB3  ASP  76           HB3      ASP  76  14.862 -11.107   0.240
  603    H    LYS  77           H        LYS  77  12.527 -11.805  -0.362
  604    HA   LYS  77           HA       LYS  77  13.270 -13.380  -2.542
  605    HB2  LYS  77           HB2      LYS  77  11.067 -13.693  -0.527
  606    HB3  LYS  77           HB3      LYS  77  11.406 -14.901  -1.754
  607    HG2  LYS  77           HG2      LYS  77  13.813 -14.843  -0.768
  608    HG3  LYS  77           HG3      LYS  77  13.016 -14.129   0.636
  609    HD2  LYS  77           HD2      LYS  77  11.481 -16.055   0.718
  610    HD3  LYS  77           HD3      LYS  77  12.334 -16.776  -0.647
  611    HE2  LYS  77           HE2      LYS  77  13.225 -17.832   1.247
  612    HE3  LYS  77           HE3      LYS  77  14.429 -16.627   0.795
  613    HZ1  LYS  77           HZ1      LYS  77  13.469 -15.152   2.497
  614    HZ2  LYS  77           HZ2      LYS  77  14.093 -16.579   3.154
  615    HZ3  LYS  77           HZ3      LYS  77  12.423 -16.394   2.973
  616    H    VAL  78           H        VAL  78  10.374 -11.516  -1.917
  617    HA   VAL  78           HA       VAL  78   9.066 -12.394  -4.320
  618    HB   VAL  78           HB       VAL  78   8.210 -10.311  -2.287
  619   HG11  VAL  78          HG11      VAL  78   6.037 -10.282  -3.314
  620   HG12  VAL  78          HG12      VAL  78   6.523 -11.499  -4.493
  621   HG13  VAL  78          HG13      VAL  78   7.233  -9.886  -4.551
  622   HG21  VAL  78          HG21      VAL  78   6.577 -12.019  -1.606
  623   HG22  VAL  78          HG22      VAL  78   8.237 -12.582  -1.408
  624   HG23  VAL  78          HG23      VAL  78   7.275 -13.139  -2.776
  625    H    LEU  79           H        LEU  79  10.963  -9.602  -3.324
  626    HA   LEU  79           HA       LEU  79  10.268  -7.829  -5.402
  627    HB2  LEU  79           HB2      LEU  79  11.699  -7.688  -3.124
  628    HB3  LEU  79           HB3      LEU  79  12.995  -7.783  -4.280
  629    HG   LEU  79           HG       LEU  79  10.844  -5.670  -4.164
  630   HD11  LEU  79          HD11      LEU  79  13.799  -5.445  -3.643
  631   HD12  LEU  79          HD12      LEU  79  12.556  -5.553  -2.397
  632   HD13  LEU  79          HD13      LEU  79  12.592  -4.167  -3.488
  633   HD21  LEU  79          HD21      LEU  79  13.081  -6.063  -6.135
  634   HD22  LEU  79          HD22      LEU  79  12.318  -4.497  -5.859
  635   HD23  LEU  79          HD23      LEU  79  11.357  -5.852  -6.450
  636    H    GLY  80           H        GLY  80  12.682 -10.395  -5.126
  637    HA2  GLY  80           HA2      GLY  80  14.016  -9.771  -7.553
  638    HA3  GLY  80           HA3      GLY  80  14.259 -11.205  -6.590
  639    H    GLN  81           H        GLN  81  11.162 -11.490  -6.852
  640    HA   GLN  81           HA       GLN  81  11.252 -13.006  -9.320
  641    HB2  GLN  81           HB2      GLN  81   9.501 -12.996  -6.882
  642    HB3  GLN  81           HB3      GLN  81   9.060 -13.879  -8.325
  643    HG2  GLN  81           HG2      GLN  81  11.773 -14.301  -7.243
  644    HG3  GLN  81           HG3      GLN  81  10.426 -14.989  -6.347
  645   HE21  GLN  81          HE21      GLN  81   9.184 -16.632  -7.306
  646   HE22  GLN  81          HE22      GLN  81   9.753 -17.523  -8.671
  647    HA   PRO  82           HA       PRO  82   8.764  -9.486 -10.927
  648    HB2  PRO  82           HB2      PRO  82   9.573 -10.273 -13.586
  649    HB3  PRO  82           HB3      PRO  82  10.022  -8.821 -12.687
  650    HG2  PRO  82           HG2      PRO  82  11.788 -10.801 -13.313
  651    HG3  PRO  82           HG3      PRO  82  11.965  -9.724 -11.915
  652    HD2  PRO  82           HD2      PRO  82  10.953 -12.536 -12.015
  653    HD3  PRO  82           HD3      PRO  82  12.002 -11.748 -10.816
  654    H    HIS  83           H        HIS  83   8.707 -12.861 -11.839
  655    HA   HIS  83           HA       HIS  83   6.275 -12.575 -13.409
  656    HB2  HIS  83           HB2      HIS  83   8.256 -14.179 -13.890
  657    HB3  HIS  83           HB3      HIS  83   7.531 -15.199 -12.654
  658    HD1  HIS  83           HD1      HIS  83   6.967 -13.906 -16.124
  659    HD2  HIS  83           HD2      HIS  83   5.168 -16.500 -13.422
  660    HE1  HIS  83           HE1      HIS  83   5.205 -15.130 -17.437
  661    HE2  HIS  83           HE2      HIS  83   4.127 -16.695 -15.782
  662    H    HIS  84           H        HIS  84   4.384 -12.461 -12.449
  663    HA   HIS  84           HA       HIS  84   3.716 -14.247 -10.238
  664    HB2  HIS  84           HB2      HIS  84   4.259 -11.591  -9.812
  665    HB3  HIS  84           HB3      HIS  84   2.515 -11.570 -10.038
  666    HD1  HIS  84           HD1      HIS  84   5.175 -12.826  -7.724
  667    HD2  HIS  84           HD2      HIS  84   1.028 -12.782  -7.998
  668    HE1  HIS  84           HE1      HIS  84   4.345 -13.581  -5.474
  669    HE2  HIS  84           HE2      HIS  84   1.833 -13.548  -5.662
  670    H    GLU  85           H        GLU  85   1.946 -15.332 -10.839
  671    HA   GLU  85           HA       GLU  85   0.145 -14.136 -12.727
  672    HB2  GLU  85           HB2      GLU  85   1.646 -16.271 -13.274
  673    HB3  GLU  85           HB3      GLU  85   0.300 -17.090 -12.495
  674    HG2  GLU  85           HG2      GLU  85  -1.245 -16.202 -14.104
  675    HG3  GLU  85           HG3      GLU  85   0.020 -15.207 -14.823
  676    H    LEU  86           H        LEU  86  -1.856 -14.071 -12.296
  677    HA   LEU  86           HA       LEU  86  -3.160 -15.621 -10.256
  678    HB2  LEU  86           HB2      LEU  86  -2.544 -13.670  -9.023
  679    HB3  LEU  86           HB3      LEU  86  -2.933 -12.628 -10.366
  680    HG   LEU  86           HG       LEU  86  -5.341 -13.526 -10.007
  681   HD11  LEU  86          HD11      LEU  86  -4.079 -13.965  -7.307
  682   HD12  LEU  86          HD12      LEU  86  -4.924 -15.150  -8.304
  683   HD13  LEU  86          HD13      LEU  86  -5.816 -13.817  -7.570
  684   HD21  LEU  86          HD21      LEU  86  -4.816 -11.214  -9.854
  685   HD22  LEU  86          HD22      LEU  86  -3.989 -11.445  -8.313
  686   HD23  LEU  86          HD23      LEU  86  -5.737 -11.640  -8.412
  687    H    ASP  87           H        ASP  87  -5.117 -16.114 -10.904
  688    HA   ASP  87           HA       ASP  87  -6.868 -16.597 -12.258
  689    HB2  ASP  87           HB2      ASP  87  -7.316 -14.374 -11.254
  690    HB3  ASP  87           HB3      ASP  87  -6.816 -13.658 -12.759
  691    H    SER  88           H        SER  88  -4.402 -16.830 -13.368
  692    HA   SER  88           HA       SER  88  -3.373 -17.459 -15.303
  693    HB2  SER  88           HB2      SER  88  -6.037 -16.842 -16.609
  694    HB3  SER  88           HB3      SER  88  -4.680 -17.621 -17.420
  695    HG   SER  88           HG       SER  88  -5.284 -19.422 -16.547
  696    H    LYS  89           H        LYS  89  -3.882 -14.446 -14.438
  697    HA   LYS  89           HA       LYS  89  -2.561 -13.358 -16.795
  698    HB2  LYS  89           HB2      LYS  89  -3.565 -11.091 -15.995
  699    HB3  LYS  89           HB3      LYS  89  -4.515 -12.170 -16.988
  700    HG2  LYS  89           HG2      LYS  89  -5.668 -12.966 -14.935
  701    HG3  LYS  89           HG3      LYS  89  -4.749 -11.777 -14.007
  702    HD2  LYS  89           HD2      LYS  89  -5.712  -9.989 -15.430
  703    HD3  LYS  89           HD3      LYS  89  -6.698 -11.207 -16.239
  704    HE2  LYS  89           HE2      LYS  89  -7.724 -11.772 -14.068
  705    HE3  LYS  89           HE3      LYS  89  -6.783 -10.486 -13.313
  706    HZ1  LYS  89           HZ1      LYS  89  -8.992  -9.709 -13.807
  707    HZ2  LYS  89           HZ2      LYS  89  -8.835 -10.147 -15.433
  708    HZ3  LYS  89           HZ3      LYS  89  -7.886  -8.898 -14.800
  709    H    THR  90           H        THR  90  -1.168 -11.749 -16.471
  710    HA   THR  90           HA       THR  90   0.577 -12.104 -14.208
  711    HB   THR  90           HB       THR  90   1.021 -10.104 -16.412
  712    HG1  THR  90           HG1      THR  90   2.007 -12.686 -16.751
  713   HG21  THR  90          HG21      THR  90   3.379 -10.697 -16.086
  714   HG22  THR  90          HG22      THR  90   2.922 -11.864 -14.847
  715   HG23  THR  90          HG23      THR  90   2.656 -10.143 -14.575
  716    H    ILE  91           H        ILE  91   0.641 -10.902 -12.432
  717    HA   ILE  91           HA       ILE  91  -0.535  -8.202 -12.462
  718    HB   ILE  91           HB       ILE  91  -1.032  -8.465 -10.081
  719   HG12  ILE  91          HG12      ILE  91  -0.231 -11.326 -10.356
  720   HG13  ILE  91          HG13      ILE  91   0.710 -10.137  -9.484
  721   HG21  ILE  91          HG21      ILE  91  -2.128 -10.611 -11.872
  722   HG22  ILE  91          HG22      ILE  91  -2.735  -8.962 -11.697
  723   HG23  ILE  91          HG23      ILE  91  -2.866 -10.097 -10.354
  724   HD11  ILE  91          HD11      ILE  91  -2.084 -10.259  -8.636
  725   HD12  ILE  91          HD12      ILE  91  -0.596 -10.301  -7.673
  726   HD13  ILE  91          HD13      ILE  91  -1.208 -11.783  -8.408
  727    H    ASP  92           H        ASP  92   0.516  -6.683 -10.658
  728    HA   ASP  92           HA       ASP  92   3.418  -7.106 -10.992
  729    HB2  ASP  92           HB2      ASP  92   2.183  -5.290 -12.320
  730    HB3  ASP  92           HB3      ASP  92   2.134  -4.412 -10.801
  731    HA   PRO  93           HA       PRO  93   3.278  -6.496  -6.444
  732    HB2  PRO  93           HB2      PRO  93   5.420  -8.388  -6.158
  733    HB3  PRO  93           HB3      PRO  93   3.734  -8.587  -5.670
  734    HG2  PRO  93           HG2      PRO  93   4.937 -10.034  -7.675
  735    HG3  PRO  93           HG3      PRO  93   3.190  -9.758  -7.540
  736    HD2  PRO  93           HD2      PRO  93   5.190  -8.371  -9.276
  737    HD3  PRO  93           HD3      PRO  93   3.521  -8.863  -9.643
  738    H    LYS  94           H        LYS  94   4.343  -4.748  -5.707
  739    HA   LYS  94           HA       LYS  94   7.233  -4.514  -6.104
  740    HB2  LYS  94           HB2      LYS  94   7.006  -2.129  -6.887
  741    HB3  LYS  94           HB3      LYS  94   6.499  -3.344  -8.048
  742    HG2  LYS  94           HG2      LYS  94   4.121  -2.856  -6.968
  743    HG3  LYS  94           HG3      LYS  94   4.886  -1.309  -6.599
  744    HD2  LYS  94           HD2      LYS  94   5.485  -1.082  -8.987
  745    HD3  LYS  94           HD3      LYS  94   4.627  -2.588  -9.318
  746    HE2  LYS  94           HE2      LYS  94   2.564  -1.540  -8.400
  747    HE3  LYS  94           HE3      LYS  94   3.451  -0.023  -8.254
  748    HZ1  LYS  94           HZ1      LYS  94   3.221   0.384 -10.414
  749    HZ2  LYS  94           HZ2      LYS  94   2.060  -0.847 -10.437
  750    HZ3  LYS  94           HZ3      LYS  94   3.662  -1.187 -10.863
  751    H    VAL  95           H        VAL  95   8.324  -3.403  -4.508
  752    HA   VAL  95           HA       VAL  95   6.944  -2.933  -2.047
  753    HB   VAL  95           HB       VAL  95   9.754  -2.138  -2.523
  754   HG11  VAL  95          HG11      VAL  95   8.406  -3.263  -0.082
  755   HG12  VAL  95          HG12      VAL  95   8.733  -1.554  -0.363
  756   HG13  VAL  95          HG13      VAL  95  10.071  -2.689  -0.181
  757   HG21  VAL  95          HG21      VAL  95  10.584  -4.306  -2.273
  758   HG22  VAL  95          HG22      VAL  95   9.216  -4.498  -3.369
  759   HG23  VAL  95          HG23      VAL  95   9.042  -4.915  -1.665
  760    H    ALA  96           H        ALA  96   6.063  -1.119  -1.322
  761    HA   ALA  96           HA       ALA  96   6.222   1.302  -2.843
  762    HB1  ALA  96           HB1      ALA  96   4.619   0.610  -0.396
  763    HB2  ALA  96           HB2      ALA  96   4.063   0.588  -2.071
  764    HB3  ALA  96           HB3      ALA  96   4.483   2.118  -1.300
  765    H    PHE  97           H        PHE  97   6.806   3.337  -2.082
  766    HA   PHE  97           HA       PHE  97   8.673   3.385   0.175
  767    HB2  PHE  97           HB2      PHE  97   8.648   4.566  -2.516
  768    HB3  PHE  97           HB3      PHE  97   9.112   5.684  -1.246
  769    HD1  PHE  97           HD1      PHE  97  11.207   5.477  -0.120
  770    HD2  PHE  97           HD2      PHE  97   9.958   2.530  -2.926
  771    HE1  PHE  97           HE1      PHE  97  13.473   4.514  -0.112
  772    HE2  PHE  97           HE2      PHE  97  12.223   1.564  -2.926
  773    HZ   PHE  97           HZ       PHE  97  13.981   2.555  -1.515
  774    HA   PRO  98           HA       PRO  98   5.541   6.042   2.098
  775    HB2  PRO  98           HB2      PRO  98   7.544   6.744   4.120
  776    HB3  PRO  98           HB3      PRO  98   6.041   5.830   4.308
  777    HG2  PRO  98           HG2      PRO  98   8.415   4.624   4.526
  778    HG3  PRO  98           HG3      PRO  98   7.024   3.810   3.776
  779    HD2  PRO  98           HD2      PRO  98   9.321   5.202   2.437
  780    HD3  PRO  98           HD3      PRO  98   8.622   3.601   2.104
  781    H    ARG  99           H        ARG  99   4.968   8.126   1.981
  782    HA   ARG  99           HA       ARG  99   6.940  10.267   1.842
  783    HB2  ARG  99           HB2      ARG  99   5.237   9.405  -0.462
  784    HB3  ARG  99           HB3      ARG  99   5.552  11.119  -0.244
  785    HG2  ARG  99           HG2      ARG  99   7.942  10.720  -0.382
  786    HG3  ARG  99           HG3      ARG  99   7.658   8.984  -0.526
  787    HD2  ARG  99           HD2      ARG  99   6.717   9.194  -2.655
  788    HD3  ARG  99           HD3      ARG  99   6.423  10.920  -2.454
  789    HE   ARG  99           HE       ARG  99   9.076  10.853  -2.368
  790   HH11  ARG  99          HH11      ARG  99   6.893   9.259  -4.609
  791   HH12  ARG  99          HH12      ARG  99   8.028   9.290  -5.916
  792   HH21  ARG  99          HH21      ARG  99  10.093  10.212  -5.623
  793   HH22  ARG  99          HH22      ARG  99  10.543  10.889  -4.093
  794    H    ARG 100           H        ARG 100   6.235  11.794   3.169
  795    HA   ARG 100           HA       ARG 100   3.356  12.088   3.680
  796    HB2  ARG 100           HB2      ARG 100   5.360  11.879   5.461
  797    HB3  ARG 100           HB3      ARG 100   5.365  13.624   5.251
  798    HG2  ARG 100           HG2      ARG 100   3.929  13.394   7.025
  799    HG3  ARG 100           HG3      ARG 100   2.795  13.395   5.675
  800    HD2  ARG 100           HD2      ARG 100   2.091  11.617   7.025
  801    HD3  ARG 100           HD3      ARG 100   3.005  10.845   5.730
  802    HE   ARG 100           HE       ARG 100   4.843  11.230   7.702
  803   HH11  ARG 100          HH11      ARG 100   2.150   8.467   8.818
  804   HH12  ARG 100          HH12      ARG 100   1.727   9.615   7.592
  805   HH21  ARG 100          HH21      ARG 100   5.372   9.728   9.309
  806   HH22  ARG 100          HH22      ARG 100   4.215   8.533   9.791
  807    H    ALA 101           H        ALA 101   2.258  13.797   2.924
  808    HA   ALA 101           HA       ALA 101   3.638  15.818   1.422
  809    HB1  ALA 101           HB1      ALA 101   1.817  15.878   0.134
  810    HB2  ALA 101           HB2      ALA 101   0.757  16.098   1.524
  811    HB3  ALA 101           HB3      ALA 101   1.262  14.474   1.050
  812    H    GLN 102           H        GLN 102   2.643  18.084   1.495
  813    HA   GLN 102           HA       GLN 102   2.368  18.958   4.302
  814    HB2  GLN 102           HB2      GLN 102   3.772  20.261   1.969
  815    HB3  GLN 102           HB3      GLN 102   3.340  21.155   3.419
  816    HG2  GLN 102           HG2      GLN 102   4.714  19.639   4.759
  817    HG3  GLN 102           HG3      GLN 102   5.156  18.755   3.301
  818   HE21  GLN 102          HE21      GLN 102   5.557  21.691   5.111
  819   HE22  GLN 102          HE22      GLN 102   6.921  22.287   4.233
  820    HA   PRO 103           HA       PRO 103  -1.556  20.692   3.021
  821    HB2  PRO 103           HB2      PRO 103  -2.032  22.457   5.011
  822    HB3  PRO 103           HB3      PRO 103  -2.104  20.707   5.263
  823    HG2  PRO 103           HG2      PRO 103   0.086  22.614   5.942
  824    HG3  PRO 103           HG3      PRO 103  -0.555  21.257   6.889
  825    HD2  PRO 103           HD2      PRO 103   1.744  21.101   5.428
  826    HD3  PRO 103           HD3      PRO 103   0.702  19.705   5.768
  827    H    LYS 104           H        LYS 104  -2.681  22.870   2.708
  828    HA   LYS 104           HA       LYS 104  -0.934  24.606   1.153
  829    HB2  LYS 104           HB2      LYS 104  -3.932  24.421   1.449
  830    HB3  LYS 104           HB3      LYS 104  -3.152  25.696   0.528
  831    HG2  LYS 104           HG2      LYS 104  -2.309  24.167  -1.063
  832    HG3  LYS 104           HG3      LYS 104  -2.707  22.780  -0.045
  833    HD2  LYS 104           HD2      LYS 104  -5.090  23.267  -0.309
  834    HD3  LYS 104           HD3      LYS 104  -4.698  24.664  -1.313
  835    HE2  LYS 104           HE2      LYS 104  -3.781  21.890  -2.014
  836    HE3  LYS 104           HE3      LYS 104  -5.364  22.496  -2.498
  837    HZ1  LYS 104           HZ1      LYS 104  -3.700  22.804  -4.232
  838    HZ2  LYS 104           HZ2      LYS 104  -2.760  23.750  -3.192
  839    HZ3  LYS 104           HZ3      LYS 104  -4.284  24.295  -3.684
  840    H    MET 105           H        MET 105  -1.048  26.947   1.313
  841    HA   MET 105           HA       MET 105  -1.196  27.845   4.089
  842    HB2  MET 105           HB2      MET 105   0.036  29.061   1.615
  843    HB3  MET 105           HB3      MET 105  -0.050  29.908   3.152
  844    HG2  MET 105           HG2      MET 105   1.283  28.147   4.198
  845    HG3  MET 105           HG3      MET 105   1.365  27.298   2.655
  846    HE1  MET 105           HE1      MET 105   4.042  27.277   3.156
  847    HE2  MET 105           HE2      MET 105   3.859  28.305   4.579
  848    HE3  MET 105           HE3      MET 105   5.004  28.747   3.314
  849    H    VAL 106           H        VAL 106  -3.219  27.830   1.444
  850    HA   VAL 106           HA       VAL 106  -4.431  30.430   1.935
  851    HB   VAL 106           HB       VAL 106  -5.534  28.386   0.027
  852   HG11  VAL 106          HG11      VAL 106  -5.493  31.403  -0.052
  853   HG12  VAL 106          HG12      VAL 106  -6.869  30.392   0.394
  854   HG13  VAL 106          HG13      VAL 106  -6.241  30.353  -1.254
  855   HG21  VAL 106          HG21      VAL 106  -3.261  30.272  -0.601
  856   HG22  VAL 106          HG22      VAL 106  -4.119  29.266  -1.768
  857   HG23  VAL 106          HG23      VAL 106  -3.152  28.514  -0.499
  858    H    THR 107           H        THR 107  -6.809  30.551   2.249
  859    HA   THR 107           HA       THR 107  -7.633  28.663   4.235
  860    HB   THR 107           HB       THR 107  -7.737  30.995   4.850
  861    HG1  THR 107           HG1      THR 107  -9.302  30.111   5.993
  862   HG21  THR 107          HG21      THR 107  -8.147  32.082   2.726
  863   HG22  THR 107          HG22      THR 107  -9.417  32.532   3.863
  864   HG23  THR 107          HG23      THR 107  -9.740  31.333   2.611
  865    H    ARG 108           H        ARG 108  -8.953  30.038   1.232
  866    HA   ARG 108           HA       ARG 108 -11.066  28.002   1.236
  867    HB2  ARG 108           HB2      ARG 108 -11.164  30.686   0.670
  868    HB3  ARG 108           HB3      ARG 108 -11.076  29.977  -0.937
  869    HG2  ARG 108           HG2      ARG 108 -13.031  28.618  -0.472
  870    HG3  ARG 108           HG3      ARG 108 -13.100  29.252   1.171
  871    HD2  ARG 108           HD2      ARG 108 -13.407  31.528   0.222
  872    HD3  ARG 108           HD3      ARG 108 -13.470  30.808  -1.387
  873    HE   ARG 108           HE       ARG 108 -15.365  29.520   0.208
  874   HH11  ARG 108          HH11      ARG 108 -14.857  32.716  -1.157
  875   HH12  ARG 108          HH12      ARG 108 -16.550  33.077  -1.233
  876   HH21  ARG 108          HH21      ARG 108 -18.083  31.547  -0.520
  877   HH22  ARG 108          HH22      ARG 108 -17.571  30.014   0.102
  878    H    THR 109           H        THR 109 -11.117  26.360  -0.166
  879    HA   THR 109           HA       THR 109  -8.872  26.038  -2.010
  880    HB   THR 109           HB       THR 109  -9.829  23.685  -2.265
  881    HG1  THR 109           HG1      THR 109 -11.076  23.740   0.141
  882   HG21  THR 109          HG21      THR 109  -8.896  24.592   0.461
  883   HG22  THR 109          HG22      THR 109  -7.867  24.134  -0.898
  884   HG23  THR 109          HG23      THR 109  -8.890  22.926  -0.119
  885    H    LYS 110           H        LYS 110  -9.053  25.929  -4.180
  886    HA   LYS 110           HA       LYS 110 -11.518  26.765  -5.384
  887    HB2  LYS 110           HB2      LYS 110  -8.775  27.120  -5.949
  888    HB3  LYS 110           HB3      LYS 110  -9.470  26.260  -7.315
  889    HG2  LYS 110           HG2      LYS 110 -11.108  27.993  -7.637
  890    HG3  LYS 110           HG3      LYS 110 -10.562  28.823  -6.177
  891    HD2  LYS 110           HD2      LYS 110  -8.372  29.191  -7.200
  892    HD3  LYS 110           HD3      LYS 110  -8.903  28.341  -8.653
  893    HE2  LYS 110           HE2      LYS 110 -10.618  30.029  -9.032
  894    HE3  LYS 110           HE3      LYS 110 -10.139  30.866  -7.556
  895    HZ1  LYS 110           HZ1      LYS 110  -8.428  30.474  -9.954
  896    HZ2  LYS 110           HZ2      LYS 110  -7.967  31.274  -8.537
  897    HZ3  LYS 110           HZ3      LYS 110  -9.192  31.917  -9.511
  898    H    LYS 111           H        LYS 111 -12.903  25.487  -6.443
  899    HA   LYS 111           HA       LYS 111 -12.300  22.693  -6.752
  900    HB2  LYS 111           HB2      LYS 111 -14.823  24.304  -6.849
  901    HB3  LYS 111           HB3      LYS 111 -14.796  22.660  -7.469
  902    HG2  LYS 111           HG2      LYS 111 -13.742  23.139  -4.730
  903    HG3  LYS 111           HG3      LYS 111 -15.489  23.196  -4.978
  904    HD2  LYS 111           HD2      LYS 111 -15.417  20.954  -5.965
  905    HD3  LYS 111           HD3      LYS 111 -13.672  20.897  -5.712
  906    HE2  LYS 111           HE2      LYS 111 -14.014  21.087  -3.300
  907    HE3  LYS 111           HE3      LYS 111 -15.759  21.159  -3.549
  908    HZ1  LYS 111           HZ1      LYS 111 -13.997  18.869  -4.237
  909    HZ2  LYS 111           HZ2      LYS 111 -15.665  18.935  -4.506
  910    HZ3  LYS 111           HZ3      LYS 111 -15.063  18.941  -2.926
  Start of MODEL    8
    1    H1   MET  -3           H1       MET  -3  23.378 -32.183  20.044
    2    H2   MET  -3           H2       MET  -3  22.564 -33.128  18.901
    3    H3   MET  -3           H3       MET  -3  23.619 -33.857  20.003
    4    HA   MET  -3           HA       MET  -3  22.196 -33.271  21.834
    5    HB2  MET  -3           HB2      MET  -3  20.743 -31.846  19.651
    6    HB3  MET  -3           HB3      MET  -3  19.808 -32.501  20.989
    7    HG2  MET  -3           HG2      MET  -3  21.018 -31.180  22.569
    8    HG3  MET  -3           HG3      MET  -3  22.152 -30.648  21.331
    9    HE1  MET  -3           HE1      MET  -3  21.896 -28.550  19.983
   10    HE2  MET  -3           HE2      MET  -3  20.346 -27.944  19.396
   11    HE3  MET  -3           HE3      MET  -3  20.894 -29.557  18.938
   12    H    HIS  -2           H        HIS  -2  20.716 -34.770  22.571
   13    HA   HIS  -2           HA       HIS  -2  19.865 -36.812  20.621
   14    HB2  HIS  -2           HB2      HIS  -2  21.745 -37.235  22.517
   15    HB3  HIS  -2           HB3      HIS  -2  20.298 -37.652  23.428
   16    HD1  HIS  -2           HD1      HIS  -2  18.698 -39.476  22.082
   17    HD2  HIS  -2           HD2      HIS  -2  22.726 -39.296  21.074
   18    HE1  HIS  -2           HE1      HIS  -2  19.198 -41.648  20.917
   19    HE2  HIS  -2           HE2      HIS  -2  21.642 -41.518  20.316
   20    H    HIS  -1           H        HIS  -1  19.142 -35.207  23.696
   21    HA   HIS  -1           HA       HIS  -1  16.419 -36.277  23.683
   22    HB2  HIS  -1           HB2      HIS  -1  18.033 -34.781  25.746
   23    HB3  HIS  -1           HB3      HIS  -1  16.305 -35.063  25.931
   24    HD1  HIS  -1           HD1      HIS  -1  19.600 -36.711  26.242
   25    HD2  HIS  -1           HD2      HIS  -1  15.590 -37.797  26.322
   26    HE1  HIS  -1           HE1      HIS  -1  19.550 -39.030  27.214
   27    HE2  HIS  -1           HE2      HIS  -1  17.112 -39.668  27.254
   28    H    HIS   0           H        HIS   0  14.583 -34.884  23.932
   29    HA   HIS   0           HA       HIS   0  14.887 -32.372  22.466
   30    HB2  HIS   0           HB2      HIS   0  12.511 -34.117  23.091
   31    HB3  HIS   0           HB3      HIS   0  12.329 -32.498  22.424
   32    HD1  HIS   0           HD1      HIS   0  13.308 -32.124  19.992
   33    HD2  HIS   0           HD2      HIS   0  13.177 -36.075  21.276
   34    HE1  HIS   0           HE1      HIS   0  13.598 -33.514  17.917
   35    HE2  HIS   0           HE2      HIS   0  13.514 -35.903  18.717
   36    H    HIS   1           H        HIS   1  14.269 -30.401  23.235
   37    HA   HIS   1           HA       HIS   1  13.563 -30.250  26.095
   38    HB2  HIS   1           HB2      HIS   1  15.882 -29.385  25.166
   39    HB3  HIS   1           HB3      HIS   1  14.927 -27.988  24.684
   40    HD1  HIS   1           HD1      HIS   1  16.121 -29.828  27.736
   41    HD2  HIS   1           HD2      HIS   1  14.185 -26.286  26.748
   42    HE1  HIS   1           HE1      HIS   1  16.077 -28.473  29.853
   43    HE2  HIS   1           HE2      HIS   1  14.902 -26.333  29.233
   44    H    HIS   2           H        HIS   2  11.910 -28.922  26.708
   45    HA   HIS   2           HA       HIS   2  10.516 -27.414  24.595
   46    HB2  HIS   2           HB2      HIS   2   9.335 -29.263  26.664
   47    HB3  HIS   2           HB3      HIS   2   8.372 -28.056  25.821
   48    HD1  HIS   2           HD1      HIS   2   8.192 -28.372  23.172
   49    HD2  HIS   2           HD2      HIS   2   9.750 -31.595  25.286
   50    HE1  HIS   2           HE1      HIS   2   8.058 -30.334  21.603
   51    HE2  HIS   2           HE2      HIS   2   9.007 -32.273  22.902
   52    H    HIS   3           H        HIS   3   9.641 -25.470  25.143
   53    HA   HIS   3           HA       HIS   3  10.381 -24.403  27.776
   54    HB2  HIS   3           HB2      HIS   3   9.921 -23.128  25.092
   55    HB3  HIS   3           HB3      HIS   3   9.880 -22.167  26.566
   56    HD1  HIS   3           HD1      HIS   3  12.200 -23.893  24.240
   57    HD2  HIS   3           HD2      HIS   3  12.376 -21.903  27.885
   58    HE1  HIS   3           HE1      HIS   3  14.641 -23.440  24.642
   59    HE2  HIS   3           HE2      HIS   3  14.725 -22.234  26.854
   60    H    SER   4           H        SER   4   8.916 -23.027  28.915
   61    HA   SER   4           HA       SER   4   6.084 -23.653  28.382
   62    HB2  SER   4           HB2      SER   4   7.453 -23.064  31.015
   63    HB3  SER   4           HB3      SER   4   5.724 -23.351  30.813
   64    HG   SER   4           HG       SER   4   6.099 -25.415  30.706
   65    H    THR   5           H        THR   5   8.363 -21.082  29.174
   66    HA   THR   5           HA       THR   5   6.347 -19.061  29.462
   67    HB   THR   5           HB       THR   5   8.463 -17.587  29.409
   68    HG1  THR   5           HG1      THR   5   9.699 -19.500  28.543
   69   HG21  THR   5          HG21      THR   5   8.065 -19.630  31.582
   70   HG22  THR   5          HG22      THR   5   7.237 -18.078  31.451
   71   HG23  THR   5          HG23      THR   5   8.974 -18.128  31.754
   72    H    SER   6           H        SER   6   5.359 -18.145  27.805
   73    HA   SER   6           HA       SER   6   6.863 -17.546  25.352
   74    HB2  SER   6           HB2      SER   6   4.080 -18.743  25.427
   75    HB3  SER   6           HB3      SER   6   4.929 -18.212  23.975
   76    HG   SER   6           HG       SER   6   5.075 -20.564  25.202
   77    H    VAL   7           H        VAL   7   6.448 -15.601  24.445
   78    HA   VAL   7           HA       VAL   7   4.743 -13.751  25.925
   79    HB   VAL   7           HB       VAL   7   6.467 -13.053  23.535
   80   HG11  VAL   7          HG11      VAL   7   6.529 -10.822  24.580
   81   HG12  VAL   7          HG12      VAL   7   5.459 -11.404  25.855
   82   HG13  VAL   7          HG13      VAL   7   4.886 -11.331  24.189
   83   HG21  VAL   7          HG21      VAL   7   7.922 -14.157  25.138
   84   HG22  VAL   7          HG22      VAL   7   7.317 -13.120  26.431
   85   HG23  VAL   7          HG23      VAL   7   8.252 -12.424  25.107
   86    H    ASP   8           H        ASP   8   2.992 -12.650  25.046
   87    HA   ASP   8           HA       ASP   8   1.893 -13.805  22.572
   88    HB2  ASP   8           HB2      ASP   8   0.538 -12.569  24.970
   89    HB3  ASP   8           HB3      ASP   8  -0.313 -12.914  23.468
   90    H    LEU   9           H        LEU   9   2.293 -10.714  24.296
   91    HA   LEU   9           HA       LEU   9   1.355  -9.177  22.025
   92    HB2  LEU   9           HB2      LEU   9   1.301  -8.709  24.682
   93    HB3  LEU   9           HB3      LEU   9   2.749  -7.821  24.252
   94    HG   LEU   9           HG       LEU   9   1.098  -6.858  22.370
   95   HD11  LEU   9          HD11      LEU   9  -0.697  -7.445  24.720
   96   HD12  LEU   9          HD12      LEU   9  -0.808  -8.194  23.127
   97   HD13  LEU   9          HD13      LEU   9  -1.110  -6.466  23.312
   98   HD21  LEU   9          HD21      LEU   9   0.741  -4.931  23.851
   99   HD22  LEU   9          HD22      LEU   9   2.403  -5.517  23.909
  100   HD23  LEU   9          HD23      LEU   9   1.288  -5.898  25.221
  101    H    GLY  10           H        GLY  10   2.580  -7.719  20.802
  102    HA2  GLY  10           HA2      GLY  10   5.488  -7.738  21.088
  103    HA3  GLY  10           HA3      GLY  10   4.836  -8.398  19.595
  104    H    THR  11           H        THR  11   4.716  -5.506  21.650
  105    HA   THR  11           HA       THR  11   5.017  -3.813  19.308
  106    HB   THR  11           HB       THR  11   2.589  -3.981  19.430
  107    HG1  THR  11           HG1      THR  11   2.321  -1.558  20.170
  108   HG21  THR  11          HG21      THR  11   2.836  -2.979  22.274
  109   HG22  THR  11          HG22      THR  11   2.237  -4.557  21.761
  110   HG23  THR  11          HG23      THR  11   1.324  -3.098  21.374
  111    H    GLU  12           H        GLU  12   6.276  -4.591  22.048
  112    HA   GLU  12           HA       GLU  12   6.657  -1.912  23.145
  113    HB2  GLU  12           HB2      GLU  12   5.887  -3.669  24.701
  114    HB3  GLU  12           HB3      GLU  12   7.337  -4.595  24.351
  115    HG2  GLU  12           HG2      GLU  12   8.716  -2.907  25.360
  116    HG3  GLU  12           HG3      GLU  12   7.319  -1.858  25.605
  117    H    ASN  13           H        ASN  13   8.560  -4.778  22.445
  118    HA   ASN  13           HA       ASN  13  11.063  -3.422  22.451
  119    HB2  ASN  13           HB2      ASN  13  10.478  -5.890  23.025
  120    HB3  ASN  13           HB3      ASN  13  10.587  -6.153  21.299
  121   HD21  ASN  13          HD21      ASN  13  12.169  -7.505  21.485
  122   HD22  ASN  13          HD22      ASN  13  13.747  -7.020  21.873
  123    H    LEU  14           H        LEU  14   8.961  -4.773  19.912
  124    HA   LEU  14           HA       LEU  14  10.724  -3.904  17.792
  125    HB2  LEU  14           HB2      LEU  14   8.987  -4.822  16.278
  126    HB3  LEU  14           HB3      LEU  14   9.583  -5.980  17.446
  127    HG   LEU  14           HG       LEU  14   7.395  -5.111  18.766
  128   HD11  LEU  14          HD11      LEU  14   5.550  -4.820  17.233
  129   HD12  LEU  14          HD12      LEU  14   6.635  -4.974  15.851
  130   HD13  LEU  14          HD13      LEU  14   6.773  -3.586  16.930
  131   HD21  LEU  14          HD21      LEU  14   7.462  -7.237  16.627
  132   HD22  LEU  14          HD22      LEU  14   6.265  -7.115  17.917
  133   HD23  LEU  14          HD23      LEU  14   7.955  -7.431  18.310
  134    H    TYR  15           H        TYR  15  10.022  -2.500  16.033
  135    HA   TYR  15           HA       TYR  15   8.870  -0.060  17.024
  136    HB2  TYR  15           HB2      TYR  15   9.938  -0.882  14.319
  137    HB3  TYR  15           HB3      TYR  15   9.264   0.714  14.632
  138    HD1  TYR  15           HD1      TYR  15  12.056  -1.565  15.350
  139    HD2  TYR  15           HD2      TYR  15  10.470   2.337  15.952
  140    HE1  TYR  15           HE1      TYR  15  14.237  -0.817  16.203
  141    HE2  TYR  15           HE2      TYR  15  12.647   3.097  16.804
  142    HH   TYR  15           HH       TYR  15  15.492   1.287  16.458
  143    H    PHE  16           H        PHE  16   7.040   1.044  16.119
  144    HA   PHE  16           HA       PHE  16   5.146  -0.524  14.587
  145    HB2  PHE  16           HB2      PHE  16   4.811  -0.586  17.217
  146    HB3  PHE  16           HB3      PHE  16   4.066   0.984  16.931
  147    HD1  PHE  16           HD1      PHE  16   1.999   1.169  15.671
  148    HD2  PHE  16           HD2      PHE  16   3.786  -2.618  16.431
  149    HE1  PHE  16           HE1      PHE  16  -0.093   0.055  15.011
  150    HE2  PHE  16           HE2      PHE  16   1.696  -3.739  15.774
  151    HZ   PHE  16           HZ       PHE  16  -0.246  -2.402  15.061
  152    H    GLN  17           H        GLN  17   6.727   2.352  15.083
  153    HA   GLN  17           HA       GLN  17   4.651   4.120  14.077
  154    HB2  GLN  17           HB2      GLN  17   7.518   4.546  14.905
  155    HB3  GLN  17           HB3      GLN  17   6.558   5.818  14.166
  156    HG2  GLN  17           HG2      GLN  17   5.533   4.392  16.581
  157    HG3  GLN  17           HG3      GLN  17   6.744   5.661  16.752
  158   HE21  GLN  17          HE21      GLN  17   3.471   4.923  15.827
  159   HE22  GLN  17          HE22      GLN  17   2.888   6.549  15.836
  160    H    SER  18           H        SER  18   6.766   1.971  12.670
  161    HA   SER  18           HA       SER  18   7.478   3.526  10.336
  162    HB2  SER  18           HB2      SER  18   8.453   1.360   9.535
  163    HB3  SER  18           HB3      SER  18   9.076   1.890  11.096
  164    HG   SER  18           HG       SER  18   7.357   0.464  11.983
  165    H    ASN  19           H        ASN  19   6.829   3.058   8.191
  166    HA   ASN  19           HA       ASN  19   4.208   1.724   7.972
  167    HB2  ASN  19           HB2      ASN  19   5.223   4.221   6.611
  168    HB3  ASN  19           HB3      ASN  19   3.813   3.346   6.044
  169   HD21  ASN  19          HD21      ASN  19   4.267   6.005   7.073
  170   HD22  ASN  19          HD22      ASN  19   3.163   6.176   8.362
  171    H    ALA  20           H        ALA  20   7.366   2.197   6.556
  172    HA   ALA  20           HA       ALA  20   6.842   0.756   4.129
  173    HB1  ALA  20           HB1      ALA  20   9.474   1.584   5.345
  174    HB2  ALA  20           HB2      ALA  20   8.513   2.545   4.222
  175    HB3  ALA  20           HB3      ALA  20   9.218   1.017   3.695
  176    H    GLY  21           H        GLY  21   7.654  -1.256   3.532
  177    HA2  GLY  21           HA2      GLY  21   9.173  -3.133   4.391
  178    HA3  GLY  21           HA3      GLY  21   8.109  -3.102   5.785
  179    H    LYS  22           H        LYS  22   5.944  -2.379   3.708
  180    HA   LYS  22           HA       LYS  22   5.276  -5.152   3.071
  181    HB2  LYS  22           HB2      LYS  22   2.957  -4.398   2.839
  182    HB3  LYS  22           HB3      LYS  22   3.623  -3.991   4.408
  183    HG2  LYS  22           HG2      LYS  22   4.131  -1.707   3.109
  184    HG3  LYS  22           HG3      LYS  22   2.693  -2.239   2.234
  185    HD2  LYS  22           HD2      LYS  22   1.542  -2.528   4.418
  186    HD3  LYS  22           HD3      LYS  22   2.962  -1.847   5.214
  187    HE2  LYS  22           HE2      LYS  22   1.544  -0.019   5.007
  188    HE3  LYS  22           HE3      LYS  22   2.625   0.146   3.625
  189    HZ1  LYS  22           HZ1      LYS  22   0.925  -0.892   2.236
  190    HZ2  LYS  22           HZ2      LYS  22   0.343   0.517   2.970
  191    HZ3  LYS  22           HZ3      LYS  22  -0.115  -0.998   3.567
  192    H    MET  23           H        MET  23   3.813  -5.307   0.980
  193    HA   MET  23           HA       MET  23   5.205  -3.950  -1.164
  194    HB2  MET  23           HB2      MET  23   4.435  -6.791  -0.738
  195    HB3  MET  23           HB3      MET  23   4.373  -6.159  -2.366
  196    HG2  MET  23           HG2      MET  23   6.766  -5.376  -1.991
  197    HG3  MET  23           HG3      MET  23   6.746  -6.394  -0.554
  198    HE1  MET  23           HE1      MET  23   7.172  -7.614  -4.900
  199    HE2  MET  23           HE2      MET  23   8.221  -6.503  -4.020
  200    HE3  MET  23           HE3      MET  23   6.529  -6.083  -4.304
  201    H    PHE  24           H        PHE  24   4.082  -3.571  -2.960
  202    HA   PHE  24           HA       PHE  24   1.224  -2.984  -2.743
  203    HB2  PHE  24           HB2      PHE  24   2.939  -1.113  -3.051
  204    HB3  PHE  24           HB3      PHE  24   3.300  -1.795  -4.621
  205    HD1  PHE  24           HD1      PHE  24  -0.034  -2.317  -4.683
  206    HD2  PHE  24           HD2      PHE  24   2.681   0.956  -4.460
  207    HE1  PHE  24           HE1      PHE  24  -1.719  -0.842  -5.680
  208    HE2  PHE  24           HE2      PHE  24   0.987   2.430  -5.457
  209    HZ   PHE  24           HZ       PHE  24  -1.219   1.530  -6.070
  210    H    ILE  25           H        ILE  25   0.188  -4.706  -3.685
  211    HA   ILE  25           HA       ILE  25   1.282  -6.054  -6.000
  212    HB   ILE  25           HB       ILE  25  -1.253  -6.846  -4.767
  213   HG12  ILE  25          HG12      ILE  25   0.186  -6.329  -2.820
  214   HG13  ILE  25          HG13      ILE  25  -0.234  -8.019  -2.913
  215   HG21  ILE  25          HG21      ILE  25  -0.611  -8.181  -6.589
  216   HG22  ILE  25          HG22      ILE  25  -0.263  -9.147  -5.156
  217   HG23  ILE  25          HG23      ILE  25   1.044  -8.322  -5.998
  218   HD11  ILE  25          HD11      ILE  25   2.095  -7.633  -2.213
  219   HD12  ILE  25          HD12      ILE  25   2.412  -6.852  -3.761
  220   HD13  ILE  25          HD13      ILE  25   1.992  -8.564  -3.706
  221    H    GLY  26           H        GLY  26   0.709  -5.379  -7.907
  222    HA2  GLY  26           HA2      GLY  26  -1.795  -3.989  -8.280
  223    HA3  GLY  26           HA3      GLY  26  -0.400  -3.733  -9.269
  224    H    GLY  27           H        GLY  27  -2.952  -4.123 -10.210
  225    HA2  GLY  27           HA2      GLY  27  -3.907  -5.140 -12.030
  226    HA3  GLY  27           HA3      GLY  27  -2.480  -6.144 -12.160
  227    H    LEU  28           H        LEU  28  -4.263  -6.232  -9.151
  228    HA   LEU  28           HA       LEU  28  -4.626  -8.982  -9.171
  229    HB2  LEU  28           HB2      LEU  28  -6.302  -6.956  -7.665
  230    HB3  LEU  28           HB3      LEU  28  -6.114  -8.648  -7.264
  231    HG   LEU  28           HG       LEU  28  -3.755  -6.774  -7.258
  232   HD11  LEU  28          HD11      LEU  28  -4.127  -6.427  -4.880
  233   HD12  LEU  28          HD12      LEU  28  -5.621  -7.362  -4.958
  234   HD13  LEU  28          HD13      LEU  28  -5.497  -5.823  -5.812
  235   HD21  LEU  28          HD21      LEU  28  -3.446  -9.275  -7.188
  236   HD22  LEU  28          HD22      LEU  28  -4.288  -9.266  -5.640
  237   HD23  LEU  28          HD23      LEU  28  -2.765  -8.398  -5.821
  238    H    SER  29           H        SER  29  -6.951 -10.010  -8.938
  239    HA   SER  29           HA       SER  29  -8.484  -9.230 -11.273
  240    HB2  SER  29           HB2      SER  29  -7.447 -11.576 -11.006
  241    HB3  SER  29           HB3      SER  29  -8.698 -11.854  -9.795
  242    HG   SER  29           HG       SER  29  -9.700 -12.483 -11.577
  243    H    TRP  30           H        TRP  30 -10.810  -9.973 -10.989
  244    HA   TRP  30           HA       TRP  30 -12.080  -8.341  -9.076
  245    HB2  TRP  30           HB2      TRP  30 -14.118  -9.075 -10.206
  246    HB3  TRP  30           HB3      TRP  30 -12.906  -8.625 -11.379
  247    HD1  TRP  30           HD1      TRP  30 -11.306 -11.260 -11.732
  248    HE1  TRP  30           HE1      TRP  30 -12.365 -13.369 -12.703
  249    HE3  TRP  30           HE3      TRP  30 -16.245 -10.186 -10.878
  250    HZ2  TRP  30           HZ2      TRP  30 -14.905 -14.443 -13.097
  251    HZ3  TRP  30           HZ3      TRP  30 -17.931 -11.829 -11.601
  252    HH2  TRP  30           HH2      TRP  30 -17.275 -13.917 -12.689
  253    H    GLN  31           H        GLN  31 -11.057 -11.563  -9.133
  254    HA   GLN  31           HA       GLN  31 -12.944 -12.525  -7.138
  255    HB2  GLN  31           HB2      GLN  31 -10.835 -13.845  -8.812
  256    HB3  GLN  31           HB3      GLN  31 -11.732 -14.703  -7.565
  257    HG2  GLN  31           HG2      GLN  31 -13.829 -14.145  -8.770
  258    HG3  GLN  31           HG3      GLN  31 -12.852 -13.428 -10.053
  259   HE21  GLN  31          HE21      GLN  31 -13.697 -16.375  -8.408
  260   HE22  GLN  31          HE22      GLN  31 -13.171 -17.455  -9.648
  261    H    THR  32           H        THR  32  -9.675 -11.503  -7.489
  262    HA   THR  32           HA       THR  32  -8.514 -12.761  -5.265
  263    HB   THR  32           HB       THR  32  -7.571 -10.137  -6.187
  264    HG1  THR  32           HG1      THR  32  -8.083 -11.113  -8.128
  265   HG21  THR  32          HG21      THR  32  -6.197 -12.725  -5.499
  266   HG22  THR  32          HG22      THR  32  -6.246 -11.268  -4.508
  267   HG23  THR  32          HG23      THR  32  -5.364 -11.267  -6.035
  268    H    SER  33           H        SER  33  -9.055 -12.553  -3.250
  269    HA   SER  33           HA       SER  33 -10.065 -10.026  -2.147
  270    HB2  SER  33           HB2      SER  33 -10.241 -12.884  -1.167
  271    HB3  SER  33           HB3      SER  33 -10.811 -11.498  -0.243
  272    HG   SER  33           HG       SER  33 -12.150 -12.841  -2.024
  273    HA   PRO  34           HA       PRO  34  -6.375  -9.305   0.259
  274    HB2  PRO  34           HB2      PRO  34  -7.372  -8.943   2.828
  275    HB3  PRO  34           HB3      PRO  34  -7.262  -7.678   1.596
  276    HG2  PRO  34           HG2      PRO  34  -9.611  -9.349   2.369
  277    HG3  PRO  34           HG3      PRO  34  -9.544  -7.626   1.944
  278    HD2  PRO  34           HD2      PRO  34 -10.436  -9.414   0.189
  279    HD3  PRO  34           HD3      PRO  34  -9.424  -8.055  -0.333
  280    H    ASP  35           H        ASP  35  -8.642 -11.663   1.331
  281    HA   ASP  35           HA       ASP  35  -6.846 -13.085   3.068
  282    HB2  ASP  35           HB2      ASP  35  -9.607 -13.291   2.259
  283    HB3  ASP  35           HB3      ASP  35  -8.847 -14.824   2.569
  284    H    SER  36           H        SER  36  -7.971 -13.214  -0.182
  285    HA   SER  36           HA       SER  36  -6.894 -15.754  -0.911
  286    HB2  SER  36           HB2      SER  36  -8.748 -14.597  -2.152
  287    HB3  SER  36           HB3      SER  36  -7.567 -13.422  -2.728
  288    HG   SER  36           HG       SER  36  -7.459 -14.848  -4.304
  289    H    LEU  37           H        LEU  37  -5.776 -12.399  -0.941
  290    HA   LEU  37           HA       LEU  37  -3.373 -12.822  -2.346
  291    HB2  LEU  37           HB2      LEU  37  -4.943 -10.772  -1.080
  292    HB3  LEU  37           HB3      LEU  37  -3.281 -10.599  -0.652
  293    HG   LEU  37           HG       LEU  37  -4.259 -10.762  -3.479
  294   HD11  LEU  37          HD11      LEU  37  -3.649  -8.334  -1.805
  295   HD12  LEU  37          HD12      LEU  37  -5.232  -8.833  -2.409
  296   HD13  LEU  37          HD13      LEU  37  -3.979  -8.321  -3.539
  297   HD21  LEU  37          HD21      LEU  37  -1.639  -9.774  -2.358
  298   HD22  LEU  37          HD22      LEU  37  -2.102  -9.784  -4.058
  299   HD23  LEU  37          HD23      LEU  37  -1.885 -11.304  -3.195
  300    H    ARG  38           H        ARG  38  -4.360 -12.721   1.033
  301    HA   ARG  38           HA       ARG  38  -1.829 -12.915   2.218
  302    HB2  ARG  38           HB2      ARG  38  -4.216 -12.295   3.203
  303    HB3  ARG  38           HB3      ARG  38  -4.254 -14.012   3.571
  304    HG2  ARG  38           HG2      ARG  38  -2.047 -13.686   4.754
  305    HG3  ARG  38           HG3      ARG  38  -2.306 -11.951   4.570
  306    HD2  ARG  38           HD2      ARG  38  -4.302 -13.785   5.884
  307    HD3  ARG  38           HD3      ARG  38  -3.027 -12.953   6.774
  308    HE   ARG  38           HE       ARG  38  -4.526 -11.115   5.220
  309   HH11  ARG  38          HH11      ARG  38  -4.744 -12.999   8.174
  310   HH12  ARG  38          HH12      ARG  38  -5.854 -11.903   8.927
  311   HH21  ARG  38          HH21      ARG  38  -6.552 -10.033   7.823
  312   HH22  ARG  38          HH22      ARG  38  -5.980  -9.694   6.224
  313    H    ASP  39           H        ASP  39  -4.354 -15.245   1.340
  314    HA   ASP  39           HA       ASP  39  -3.038 -17.565   2.220
  315    HB2  ASP  39           HB2      ASP  39  -5.457 -16.908   0.810
  316    HB3  ASP  39           HB3      ASP  39  -4.671 -18.286   0.044
  317    H    TYR  40           H        TYR  40  -3.007 -15.875  -0.920
  318    HA   TYR  40           HA       TYR  40  -1.551 -17.878  -2.309
  319    HB2  TYR  40           HB2      TYR  40  -3.075 -15.927  -3.192
  320    HB3  TYR  40           HB3      TYR  40  -1.566 -15.021  -3.193
  321    HD1  TYR  40           HD1      TYR  40   0.075 -15.379  -4.868
  322    HD2  TYR  40           HD2      TYR  40  -3.261 -17.993  -4.577
  323    HE1  TYR  40           HE1      TYR  40   0.682 -16.379  -7.033
  324    HE2  TYR  40           HE2      TYR  40  -2.673 -19.000  -6.747
  325    HH   TYR  40           HH       TYR  40   0.330 -18.413  -8.283
  326    H    PHE  41           H        PHE  41  -0.661 -14.716  -0.917
  327    HA   PHE  41           HA       PHE  41   2.066 -14.872  -1.601
  328    HB2  PHE  41           HB2      PHE  41   0.329 -13.036  -0.137
  329    HB3  PHE  41           HB3      PHE  41   2.050 -12.895   0.128
  330    HD1  PHE  41           HD1      PHE  41  -0.499 -13.080  -2.572
  331    HD2  PHE  41           HD2      PHE  41   3.357 -11.704  -1.410
  332    HE1  PHE  41           HE1      PHE  41  -0.263 -11.899  -4.724
  333    HE2  PHE  41           HE2      PHE  41   3.591 -10.518  -3.547
  334    HZ   PHE  41           HZ       PHE  41   1.780 -10.618  -5.211
  335    H    SER  42           H        SER  42   0.256 -16.026   1.134
  336    HA   SER  42           HA       SER  42   2.282 -16.110   3.103
  337    HB2  SER  42           HB2      SER  42  -0.170 -16.495   3.538
  338    HB3  SER  42           HB3      SER  42   0.016 -18.091   2.812
  339    HG   SER  42           HG       SER  42   1.245 -17.092   5.161
  340    H    LYS  43           H        LYS  43   1.850 -17.618   0.273
  341    HA   LYS  43           HA       LYS  43   3.218 -20.092   0.754
  342    HB2  LYS  43           HB2      LYS  43   1.902 -18.758  -1.554
  343    HB3  LYS  43           HB3      LYS  43   3.000 -20.076  -1.858
  344    HG2  LYS  43           HG2      LYS  43   1.203 -20.843   0.220
  345    HG3  LYS  43           HG3      LYS  43   0.286 -20.212  -1.146
  346    HD2  LYS  43           HD2      LYS  43   1.331 -21.779  -2.642
  347    HD3  LYS  43           HD3      LYS  43   2.430 -22.322  -1.371
  348    HE2  LYS  43           HE2      LYS  43   0.537 -23.188  -0.097
  349    HE3  LYS  43           HE3      LYS  43  -0.572 -22.623  -1.345
  350    HZ1  LYS  43           HZ1      LYS  43   0.453 -24.134  -2.910
  351    HZ2  LYS  43           HZ2      LYS  43  -0.086 -24.990  -1.555
  352    HZ3  LYS  43           HZ3      LYS  43   1.560 -24.652  -1.740
  353    H    PHE  44           H        PHE  44   4.077 -16.907   0.033
  354    HA   PHE  44           HA       PHE  44   6.653 -17.560  -1.193
  355    HB2  PHE  44           HB2      PHE  44   4.859 -15.344  -1.274
  356    HB3  PHE  44           HB3      PHE  44   6.447 -14.807  -0.763
  357    HD1  PHE  44           HD1      PHE  44   8.407 -15.204  -2.243
  358    HD2  PHE  44           HD2      PHE  44   4.411 -15.958  -3.499
  359    HE1  PHE  44           HE1      PHE  44   9.147 -15.208  -4.588
  360    HE2  PHE  44           HE2      PHE  44   5.146 -15.967  -5.846
  361    HZ   PHE  44           HZ       PHE  44   7.518 -15.593  -6.393
  362    H    GLY  45           H        GLY  45   5.189 -16.275   1.686
  363    HA2  GLY  45           HA2      GLY  45   7.308 -16.889   3.395
  364    HA3  GLY  45           HA3      GLY  45   7.275 -15.165   3.057
  365    H    GLU  46           H        GLU  46   6.762 -14.947   5.315
  366    HA   GLU  46           HA       GLU  46   4.098 -15.676   6.061
  367    HB2  GLU  46           HB2      GLU  46   6.030 -16.229   7.601
  368    HB3  GLU  46           HB3      GLU  46   6.155 -14.499   7.908
  369    HG2  GLU  46           HG2      GLU  46   3.947 -14.422   8.807
  370    HG3  GLU  46           HG3      GLU  46   3.631 -16.079   8.318
  371    H    ILE  47           H        ILE  47   2.626 -14.327   6.340
  372    HA   ILE  47           HA       ILE  47   3.079 -11.485   5.860
  373    HB   ILE  47           HB       ILE  47   0.608 -13.044   5.362
  374   HG12  ILE  47          HG12      ILE  47   1.863 -11.643   3.182
  375   HG13  ILE  47          HG13      ILE  47   2.882 -12.875   3.896
  376   HG21  ILE  47          HG21      ILE  47  -0.205 -10.977   4.208
  377   HG22  ILE  47          HG22      ILE  47   1.144 -10.124   4.959
  378   HG23  ILE  47          HG23      ILE  47  -0.108 -10.851   5.966
  379   HD11  ILE  47          HD11      ILE  47   1.817 -14.094   2.233
  380   HD12  ILE  47          HD12      ILE  47   0.336 -13.143   2.373
  381   HD13  ILE  47          HD13      ILE  47   0.718 -14.354   3.592
  382    H    ARG  48           H        ARG  48   2.450  -9.972   7.178
  383    HA   ARG  48           HA       ARG  48   1.533 -10.651   9.841
  384    HB2  ARG  48           HB2      ARG  48   3.339  -8.907   8.990
  385    HB3  ARG  48           HB3      ARG  48   1.948  -7.863   8.852
  386    HG2  ARG  48           HG2      ARG  48   1.517  -7.920  11.149
  387    HG3  ARG  48           HG3      ARG  48   2.581  -9.304  11.403
  388    HD2  ARG  48           HD2      ARG  48   3.695  -6.749  10.323
  389    HD3  ARG  48           HD3      ARG  48   3.381  -6.902  12.052
  390    HE   ARG  48           HE       ARG  48   4.940  -9.041  10.878
  391   HH11  ARG  48          HH11      ARG  48   6.674  -6.202  13.130
  392   HH12  ARG  48          HH12      ARG  48   5.058  -5.958  12.556
  393   HH21  ARG  48          HH21      ARG  48   7.800  -8.116  12.617
  394   HH22  ARG  48          HH22      ARG  48   7.052  -9.343  11.652
  395    H    GLU  49           H        GLU  49   0.495  -8.846   7.000
  396    HA   GLU  49           HA       GLU  49  -2.277  -9.118   7.547
  397    HB2  GLU  49           HB2      GLU  49  -1.399  -7.140   9.058
  398    HB3  GLU  49           HB3      GLU  49  -1.417  -6.239   7.551
  399    HG2  GLU  49           HG2      GLU  49  -3.803  -6.739   7.290
  400    HG3  GLU  49           HG3      GLU  49  -3.777  -7.618   8.818
  401    H    CYS  50           H        CYS  50  -3.531  -8.210   5.820
  402    HA   CYS  50           HA       CYS  50  -2.126  -7.393   3.466
  403    HB2  CYS  50           HB2      CYS  50  -2.484  -9.765   3.157
  404    HB3  CYS  50           HB3      CYS  50  -4.185  -9.596   3.574
  405    HG   CYS  50           HG       CYS  50  -2.904  -9.626   0.648
  406    H    MET  51           H        MET  51  -3.382  -6.244   2.004
  407    HA   MET  51           HA       MET  51  -5.966  -5.280   2.825
  408    HB2  MET  51           HB2      MET  51  -4.448  -3.813   3.989
  409    HB3  MET  51           HB3      MET  51  -3.631  -3.483   2.490
  410    HG2  MET  51           HG2      MET  51  -5.423  -2.218   1.646
  411    HG3  MET  51           HG3      MET  51  -6.509  -2.792   2.912
  412    HE1  MET  51           HE1      MET  51  -2.861  -1.222   2.814
  413    HE2  MET  51           HE2      MET  51  -3.213   0.405   3.399
  414    HE3  MET  51           HE3      MET  51  -3.873  -0.141   1.857
  415    H    VAL  52           H        VAL  52  -7.229  -4.897   1.245
  416    HA   VAL  52           HA       VAL  52  -6.252  -4.379  -1.457
  417    HB   VAL  52           HB       VAL  52  -8.603  -6.044  -0.732
  418   HG11  VAL  52          HG11      VAL  52  -7.537  -5.249  -3.417
  419   HG12  VAL  52          HG12      VAL  52  -9.153  -4.958  -2.772
  420   HG13  VAL  52          HG13      VAL  52  -8.651  -6.600  -3.187
  421   HG21  VAL  52          HG21      VAL  52  -6.370  -7.078  -0.371
  422   HG22  VAL  52          HG22      VAL  52  -6.099  -6.909  -2.103
  423   HG23  VAL  52          HG23      VAL  52  -7.403  -7.941  -1.513
  424    H    MET  53           H        MET  53  -6.938  -2.598  -2.242
  425    HA   MET  53           HA       MET  53  -8.573  -0.770  -0.804
  426    HB2  MET  53           HB2      MET  53  -6.804  -0.684  -3.092
  427    HB3  MET  53           HB3      MET  53  -8.246   0.282  -3.369
  428    HG2  MET  53           HG2      MET  53  -6.383   0.531  -1.017
  429    HG3  MET  53           HG3      MET  53  -6.438   1.603  -2.413
  430    HE1  MET  53           HE1      MET  53  -6.713   2.666   0.699
  431    HE2  MET  53           HE2      MET  53  -7.875   3.937   0.320
  432    HE3  MET  53           HE3      MET  53  -6.550   3.593  -0.792
  433    H    ARG  54           H        ARG  54 -10.671  -0.685  -0.734
  434    HA   ARG  54           HA       ARG  54 -12.262  -1.133  -3.157
  435    HB2  ARG  54           HB2      ARG  54 -12.129  -3.008  -1.142
  436    HB3  ARG  54           HB3      ARG  54 -13.558  -2.082  -0.704
  437    HG2  ARG  54           HG2      ARG  54 -14.554  -2.524  -2.855
  438    HG3  ARG  54           HG3      ARG  54 -13.090  -3.347  -3.396
  439    HD2  ARG  54           HD2      ARG  54 -13.411  -4.977  -1.535
  440    HD3  ARG  54           HD3      ARG  54 -14.961  -4.209  -1.197
  441    HE   ARG  54           HE       ARG  54 -15.683  -4.913  -3.416
  442   HH11  ARG  54          HH11      ARG  54 -13.033  -7.919  -3.134
  443   HH12  ARG  54          HH12      ARG  54 -12.839  -6.523  -2.127
  444   HH21  ARG  54          HH21      ARG  54 -15.915  -6.750  -4.723
  445   HH22  ARG  54          HH22      ARG  54 -14.772  -8.046  -4.601
  446    H    ASP  55           H        ASP  55 -14.373  -0.092  -3.090
  447    HA   ASP  55           HA       ASP  55 -14.387   2.279  -1.482
  448    HB2  ASP  55           HB2      ASP  55 -15.409   1.536  -4.090
  449    HB3  ASP  55           HB3      ASP  55 -16.419   2.631  -3.189
  450    HA   PRO  56           HA       PRO  56 -17.457   0.230   1.183
  451    HB2  PRO  56           HB2      PRO  56 -17.786   3.013   2.168
  452    HB3  PRO  56           HB3      PRO  56 -17.493   1.523   3.075
  453    HG2  PRO  56           HG2      PRO  56 -15.542   3.283   2.741
  454    HG3  PRO  56           HG3      PRO  56 -15.220   1.538   2.660
  455    HD2  PRO  56           HD2      PRO  56 -15.437   3.518   0.436
  456    HD3  PRO  56           HD3      PRO  56 -14.343   2.131   0.616
  457    H    THR  57           H        THR  57 -18.075   2.632  -1.195
  458    HA   THR  57           HA       THR  57 -20.834   3.030  -0.545
  459    HB   THR  57           HB       THR  57 -20.913   4.175  -2.816
  460    HG1  THR  57           HG1      THR  57 -18.929   3.023  -3.517
  461   HG21  THR  57          HG21      THR  57 -20.679   5.425  -0.729
  462   HG22  THR  57          HG22      THR  57 -19.707   6.156  -2.007
  463   HG23  THR  57          HG23      THR  57 -18.933   5.174  -0.763
  464    H    THR  58           H        THR  58 -19.086   1.294  -3.106
  465    HA   THR  58           HA       THR  58 -21.513  -0.303  -3.596
  466    HB   THR  58           HB       THR  58 -20.974  -0.408  -5.985
  467    HG1  THR  58           HG1      THR  58 -18.676  -0.023  -5.735
  468   HG21  THR  58          HG21      THR  58 -22.499   1.332  -5.336
  469   HG22  THR  58          HG22      THR  58 -21.408   1.991  -6.556
  470   HG23  THR  58          HG23      THR  58 -21.163   2.377  -4.849
  471    H    LYS  59           H        LYS  59 -18.352  -0.358  -2.611
  472    HA   LYS  59           HA       LYS  59 -16.720  -1.877  -2.325
  473    HB2  LYS  59           HB2      LYS  59 -19.125  -3.679  -2.404
  474    HB3  LYS  59           HB3      LYS  59 -17.501  -4.316  -2.130
  475    HG2  LYS  59           HG2      LYS  59 -17.645  -3.740   0.008
  476    HG3  LYS  59           HG3      LYS  59 -17.809  -2.052  -0.492
  477    HD2  LYS  59           HD2      LYS  59 -20.258  -2.451  -0.767
  478    HD3  LYS  59           HD3      LYS  59 -20.027  -4.049  -0.053
  479    HE2  LYS  59           HE2      LYS  59 -19.182  -3.039   1.987
  480    HE3  LYS  59           HE3      LYS  59 -19.323  -1.434   1.272
  481    HZ1  LYS  59           HZ1      LYS  59 -21.712  -1.733   1.144
  482    HZ2  LYS  59           HZ2      LYS  59 -21.181  -1.929   2.738
  483    HZ3  LYS  59           HZ3      LYS  59 -21.584  -3.284   1.811
  484    H    ARG  60           H        ARG  60 -16.530  -0.882  -4.562
  485    HA   ARG  60           HA       ARG  60 -16.212  -2.921  -6.641
  486    HB2  ARG  60           HB2      ARG  60 -15.855  -1.004  -8.169
  487    HB3  ARG  60           HB3      ARG  60 -17.396  -0.935  -7.332
  488    HG2  ARG  60           HG2      ARG  60 -16.619   0.801  -5.883
  489    HG3  ARG  60           HG3      ARG  60 -14.970   0.642  -6.489
  490    HD2  ARG  60           HD2      ARG  60 -15.834   2.532  -7.578
  491    HD3  ARG  60           HD3      ARG  60 -15.932   1.241  -8.774
  492    HE   ARG  60           HE       ARG  60 -18.313   1.745  -7.173
  493   HH11  ARG  60          HH11      ARG  60 -18.142   2.615 -11.089
  494   HH12  ARG  60          HH12      ARG  60 -16.684   2.207 -10.248
  495   HH21  ARG  60          HH21      ARG  60 -20.210   2.285  -8.292
  496   HH22  ARG  60          HH22      ARG  60 -20.135   2.659  -9.982
  497    H    SER  61           H        SER  61 -14.277  -3.681  -7.249
  498    HA   SER  61           HA       SER  61 -11.900  -2.724  -5.847
  499    HB2  SER  61           HB2      SER  61 -12.304  -5.162  -7.598
  500    HB3  SER  61           HB3      SER  61 -10.842  -4.787  -6.688
  501    HG   SER  61           HG       SER  61 -11.858  -5.987  -5.255
  502    H    ARG  62           H        ARG  62 -10.084  -1.922  -6.834
  503    HA   ARG  62           HA       ARG  62 -10.422  -1.004  -9.588
  504    HB2  ARG  62           HB2      ARG  62  -8.678  -0.127  -7.310
  505    HB3  ARG  62           HB3      ARG  62  -8.289   0.345  -8.959
  506    HG2  ARG  62           HG2      ARG  62 -10.500   1.388  -9.171
  507    HG3  ARG  62           HG3      ARG  62 -10.862   0.938  -7.505
  508    HD2  ARG  62           HD2      ARG  62  -9.040   2.324  -6.705
  509    HD3  ARG  62           HD3      ARG  62  -8.580   2.714  -8.363
  510    HE   ARG  62           HE       ARG  62 -11.179   3.510  -8.188
  511   HH11  ARG  62          HH11      ARG  62  -8.839   5.876  -5.938
  512   HH12  ARG  62          HH12      ARG  62  -8.293   4.283  -6.341
  513   HH21  ARG  62          HH21      ARG  62 -11.870   5.601  -7.655
  514   HH22  ARG  62          HH22      ARG  62 -10.863   6.621  -6.681
  515    H    GLY  63           H        GLY  63  -8.911  -3.487  -7.932
  516    HA2  GLY  63           HA2      GLY  63  -7.757  -5.261  -8.939
  517    HA3  GLY  63           HA3      GLY  63  -7.365  -4.213 -10.290
  518    H    PHE  64           H        PHE  64  -6.781  -3.362  -6.906
  519    HA   PHE  64           HA       PHE  64  -4.003  -4.115  -7.026
  520    HB2  PHE  64           HB2      PHE  64  -3.003  -1.990  -6.907
  521    HB3  PHE  64           HB3      PHE  64  -4.131  -1.917  -8.244
  522    HD1  PHE  64           HD1      PHE  64  -3.691  -1.016  -4.715
  523    HD2  PHE  64           HD2      PHE  64  -5.772  -0.270  -8.319
  524    HE1  PHE  64           HE1      PHE  64  -4.656   1.029  -3.711
  525    HE2  PHE  64           HE2      PHE  64  -6.767   1.768  -7.344
  526    HZ   PHE  64           HZ       PHE  64  -6.208   2.419  -5.032
  527    H    GLY  65           H        GLY  65  -2.885  -4.011  -5.012
  528    HA2  GLY  65           HA2      GLY  65  -4.188  -3.096  -2.677
  529    HA3  GLY  65           HA3      GLY  65  -4.174  -4.847  -2.812
  530    H    PHE  66           H        PHE  66  -2.886  -4.483  -0.815
  531    HA   PHE  66           HA       PHE  66  -0.083  -4.442  -1.344
  532    HB2  PHE  66           HB2      PHE  66  -1.594  -3.105   0.835
  533    HB3  PHE  66           HB3      PHE  66   0.115  -3.350   0.886
  534    HD1  PHE  66           HD1      PHE  66  -2.602  -1.671  -0.906
  535    HD2  PHE  66           HD2      PHE  66   1.593  -1.846  -0.228
  536    HE1  PHE  66           HE1      PHE  66  -2.325   0.477  -2.091
  537    HE2  PHE  66           HE2      PHE  66   1.882   0.294  -1.410
  538    HZ   PHE  66           HZ       PHE  66  -0.080   1.457  -2.345
  539    H    VAL  67           H        VAL  67   1.107  -5.533   0.352
  540    HA   VAL  67           HA       VAL  67  -0.329  -7.297   2.150
  541    HB   VAL  67           HB       VAL  67   1.618  -8.362   0.072
  542   HG11  VAL  67          HG11      VAL  67   2.335  -9.708   1.751
  543   HG12  VAL  67          HG12      VAL  67   0.847 -10.590   1.402
  544   HG13  VAL  67          HG13      VAL  67   0.895  -9.428   2.733
  545   HG21  VAL  67          HG21      VAL  67  -0.160  -9.842  -0.614
  546   HG22  VAL  67          HG22      VAL  67  -0.753  -8.179  -0.649
  547   HG23  VAL  67          HG23      VAL  67  -1.199  -9.246   0.679
  548    H    THR  68           H        THR  68   0.639  -7.547   3.941
  549    HA   THR  68           HA       THR  68   3.187  -6.201   4.290
  550    HB   THR  68           HB       THR  68   1.354  -6.803   6.503
  551    HG1  THR  68           HG1      THR  68   0.379  -5.661   4.500
  552   HG21  THR  68          HG21      THR  68   2.652  -4.207   6.412
  553   HG22  THR  68          HG22      THR  68   3.807  -5.544   6.250
  554   HG23  THR  68          HG23      THR  68   2.736  -5.459   7.659
  555    H    PHE  69           H        PHE  69   4.721  -7.595   4.197
  556    HA   PHE  69           HA       PHE  69   4.516 -10.227   5.248
  557    HB2  PHE  69           HB2      PHE  69   6.516  -8.691   3.699
  558    HB3  PHE  69           HB3      PHE  69   7.052 -10.118   4.566
  559    HD1  PHE  69           HD1      PHE  69   5.211  -8.848   1.760
  560    HD2  PHE  69           HD2      PHE  69   6.033 -12.328   4.062
  561    HE1  PHE  69           HE1      PHE  69   4.316 -10.255  -0.051
  562    HE2  PHE  69           HE2      PHE  69   5.144 -13.745   2.260
  563    HZ   PHE  69           HZ       PHE  69   4.288 -12.713   0.203
  564    H    ALA  70           H        ALA  70   5.066 -10.889   7.234
  565    HA   ALA  70           HA       ALA  70   6.051  -9.093   9.152
  566    HB1  ALA  70           HB1      ALA  70   5.804 -10.872  10.762
  567    HB2  ALA  70           HB2      ALA  70   5.684 -12.049   9.455
  568    HB3  ALA  70           HB3      ALA  70   4.412 -10.850   9.680
  569    H    ASP  71           H        ASP  71   7.716 -10.477   6.912
  570    HA   ASP  71           HA       ASP  71  10.179 -10.531   8.418
  571    HB2  ASP  71           HB2      ASP  71   9.236 -12.768   7.574
  572    HB3  ASP  71           HB3      ASP  71   9.766 -12.235   6.013
  573    HA   PRO  72           HA       PRO  72  11.351  -7.592   5.199
  574    HB2  PRO  72           HB2      PRO  72  14.072  -7.870   6.080
  575    HB3  PRO  72           HB3      PRO  72  13.020  -6.485   6.174
  576    HG2  PRO  72           HG2      PRO  72  13.816  -7.818   8.376
  577    HG3  PRO  72           HG3      PRO  72  12.244  -6.999   8.263
  578    HD2  PRO  72           HD2      PRO  72  12.882  -9.904   7.968
  579    HD3  PRO  72           HD3      PRO  72  11.509  -9.117   8.775
  580    H    ALA  73           H        ALA  73  12.563 -10.705   5.720
  581    HA   ALA  73           HA       ALA  73  14.353 -10.786   3.493
  582    HB1  ALA  73           HB1      ALA  73  13.302 -13.073   5.125
  583    HB2  ALA  73           HB2      ALA  73  14.770 -12.159   5.474
  584    HB3  ALA  73           HB3      ALA  73  14.663 -13.132   4.006
  585    H    SER  74           H        SER  74  11.049 -11.482   4.040
  586    HA   SER  74           HA       SER  74  10.603 -13.108   1.745
  587    HB2  SER  74           HB2      SER  74   9.128 -12.890   3.850
  588    HB3  SER  74           HB3      SER  74   8.452 -11.474   3.041
  589    HG   SER  74           HG       SER  74   8.483 -14.148   2.095
  590    H    VAL  75           H        VAL  75  10.604  -9.717   2.353
  591    HA   VAL  75           HA       VAL  75   9.364  -8.839  -0.029
  592    HB   VAL  75           HB       VAL  75  11.415  -7.285   1.557
  593   HG11  VAL  75          HG11      VAL  75   9.099  -6.377  -0.159
  594   HG12  VAL  75          HG12      VAL  75  10.815  -6.211  -0.527
  595   HG13  VAL  75          HG13      VAL  75  10.112  -5.310   0.815
  596   HG21  VAL  75          HG21      VAL  75   8.455  -7.522   2.110
  597   HG22  VAL  75          HG22      VAL  75   9.538  -6.361   2.878
  598   HG23  VAL  75          HG23      VAL  75   9.769  -8.090   3.140
  599    H    ASP  76           H        ASP  76  12.574  -9.707   0.852
  600    HA   ASP  76           HA       ASP  76  13.919  -8.790  -1.451
  601    HB2  ASP  76           HB2      ASP  76  14.729  -9.545   0.954
  602    HB3  ASP  76           HB3      ASP  76  14.918 -11.083   0.144
  603    H    LYS  77           H        LYS  77  12.480 -11.745  -0.425
  604    HA   LYS  77           HA       LYS  77  13.233 -13.396  -2.564
  605    HB2  LYS  77           HB2      LYS  77  11.002 -13.663  -0.571
  606    HB3  LYS  77           HB3      LYS  77  11.402 -14.909  -1.744
  607    HG2  LYS  77           HG2      LYS  77  13.766 -14.795  -0.716
  608    HG3  LYS  77           HG3      LYS  77  12.967 -13.980   0.628
  609    HD2  LYS  77           HD2      LYS  77  11.397 -15.910   0.779
  610    HD3  LYS  77           HD3      LYS  77  12.361 -16.731  -0.448
  611    HE2  LYS  77           HE2      LYS  77  13.165 -17.577   1.578
  612    HE3  LYS  77           HE3      LYS  77  14.347 -16.352   1.116
  613    HZ1  LYS  77           HZ1      LYS  77  13.797 -16.163   3.445
  614    HZ2  LYS  77           HZ2      LYS  77  12.151 -16.006   3.087
  615    HZ3  LYS  77           HZ3      LYS  77  13.238 -14.797   2.620
  616    H    VAL  78           H        VAL  78  10.338 -11.531  -1.942
  617    HA   VAL  78           HA       VAL  78   8.981 -12.421  -4.300
  618    HB   VAL  78           HB       VAL  78   8.244 -10.131  -2.457
  619   HG11  VAL  78          HG11      VAL  78   7.207 -10.035  -4.737
  620   HG12  VAL  78          HG12      VAL  78   6.048 -10.199  -3.417
  621   HG13  VAL  78          HG13      VAL  78   6.465 -11.602  -4.403
  622   HG21  VAL  78          HG21      VAL  78   7.290 -12.996  -2.510
  623   HG22  VAL  78          HG22      VAL  78   6.617 -11.718  -1.500
  624   HG23  VAL  78          HG23      VAL  78   8.283 -12.244  -1.260
  625    H    LEU  79           H        LEU  79  11.014  -9.693  -3.456
  626    HA   LEU  79           HA       LEU  79  10.376  -8.047  -5.676
  627    HB2  LEU  79           HB2      LEU  79  11.700  -7.750  -3.324
  628    HB3  LEU  79           HB3      LEU  79  13.032  -7.855  -4.436
  629    HG   LEU  79           HG       LEU  79  10.842  -5.792  -4.366
  630   HD11  LEU  79          HD11      LEU  79  13.829  -5.546  -4.096
  631   HD12  LEU  79          HD12      LEU  79  12.663  -5.489  -2.775
  632   HD13  LEU  79          HD13      LEU  79  12.662  -4.226  -4.005
  633   HD21  LEU  79          HD21      LEU  79  11.135  -6.110  -6.674
  634   HD22  LEU  79          HD22      LEU  79  12.886  -6.277  -6.514
  635   HD23  LEU  79          HD23      LEU  79  12.121  -4.706  -6.264
  636    H    GLY  80           H        GLY  80  12.604 -10.675  -5.077
  637    HA2  GLY  80           HA2      GLY  80  14.235 -10.288  -7.352
  638    HA3  GLY  80           HA3      GLY  80  14.192 -11.721  -6.359
  639    H    GLN  81           H        GLN  81  11.295 -12.018  -6.757
  640    HA   GLN  81           HA       GLN  81  11.357 -13.242  -9.389
  641    HB2  GLN  81           HB2      GLN  81   9.725 -13.621  -6.901
  642    HB3  GLN  81           HB3      GLN  81   9.203 -14.284  -8.433
  643    HG2  GLN  81           HG2      GLN  81  11.252 -15.559  -8.625
  644    HG3  GLN  81           HG3      GLN  81  11.848 -14.821  -7.138
  645   HE21  GLN  81          HE21      GLN  81  11.331 -15.708  -5.233
  646   HE22  GLN  81          HE22      GLN  81  10.292 -17.073  -5.030
  647    HA   PRO  82           HA       PRO  82   8.826  -9.560 -10.471
  648    HB2  PRO  82           HB2      PRO  82   9.591 -10.050 -13.221
  649    HB3  PRO  82           HB3      PRO  82  10.018  -8.687 -12.182
  650    HG2  PRO  82           HG2      PRO  82  11.827 -10.531 -13.024
  651    HG3  PRO  82           HG3      PRO  82  11.979  -9.632 -11.502
  652    HD2  PRO  82           HD2      PRO  82  11.029 -12.430 -11.951
  653    HD3  PRO  82           HD3      PRO  82  12.068 -11.773 -10.667
  654    H    HIS  83           H        HIS  83   8.788 -12.747 -11.999
  655    HA   HIS  83           HA       HIS  83   6.320 -12.246 -13.412
  656    HB2  HIS  83           HB2      HIS  83   8.290 -13.819 -14.075
  657    HB3  HIS  83           HB3      HIS  83   7.506 -14.971 -13.004
  658    HD1  HIS  83           HD1      HIS  83   7.245 -13.410 -16.351
  659    HD2  HIS  83           HD2      HIS  83   4.943 -15.867 -13.915
  660    HE1  HIS  83           HE1      HIS  83   5.450 -14.344 -17.843
  661    HE2  HIS  83           HE2      HIS  83   4.068 -15.831 -16.348
  662    H    HIS  84           H        HIS  84   4.426 -12.250 -12.460
  663    HA   HIS  84           HA       HIS  84   3.780 -14.208 -10.383
  664    HB2  HIS  84           HB2      HIS  84   4.265 -11.601  -9.771
  665    HB3  HIS  84           HB3      HIS  84   2.540 -11.537 -10.107
  666    HD1  HIS  84           HD1      HIS  84   0.968 -12.834  -8.503
  667    HD2  HIS  84           HD2      HIS  84   4.981 -12.954  -7.433
  668    HE1  HIS  84           HE1      HIS  84   1.010 -13.709  -6.147
  669    HE2  HIS  84           HE2      HIS  84   3.449 -13.781  -5.520
  670    H    GLU  85           H        GLU  85   2.037 -15.294 -11.021
  671    HA   GLU  85           HA       GLU  85   0.210 -14.088 -12.876
  672    HB2  GLU  85           HB2      GLU  85   1.712 -16.202 -13.467
  673    HB3  GLU  85           HB3      GLU  85   0.400 -17.046 -12.656
  674    HG2  GLU  85           HG2      GLU  85  -1.200 -16.080 -14.216
  675    HG3  GLU  85           HG3      GLU  85   0.103 -15.206 -15.019
  676    H    LEU  86           H        LEU  86  -1.800 -14.048 -12.419
  677    HA   LEU  86           HA       LEU  86  -3.046 -15.618 -10.359
  678    HB2  LEU  86           HB2      LEU  86  -2.425 -13.670  -9.128
  679    HB3  LEU  86           HB3      LEU  86  -2.845 -12.624 -10.459
  680    HG   LEU  86           HG       LEU  86  -5.241 -13.532 -10.059
  681   HD11  LEU  86          HD11      LEU  86  -5.688 -13.874  -7.636
  682   HD12  LEU  86          HD12      LEU  86  -3.947 -13.958  -7.370
  683   HD13  LEU  86          HD13      LEU  86  -4.745 -15.171  -8.371
  684   HD21  LEU  86          HD21      LEU  86  -4.787 -11.227  -9.904
  685   HD22  LEU  86          HD22      LEU  86  -3.829 -11.437  -8.439
  686   HD23  LEU  86          HD23      LEU  86  -5.578 -11.661  -8.390
  687    H    ASP  87           H        ASP  87  -5.026 -16.118 -10.955
  688    HA   ASP  87           HA       ASP  87  -6.803 -16.613 -12.269
  689    HB2  ASP  87           HB2      ASP  87  -7.252 -14.403 -11.252
  690    HB3  ASP  87           HB3      ASP  87  -6.782 -13.672 -12.758
  691    H    SER  88           H        SER  88  -4.375 -16.831 -13.454
  692    HA   SER  88           HA       SER  88  -3.400 -17.443 -15.424
  693    HB2  SER  88           HB2      SER  88  -6.092 -16.816 -16.672
  694    HB3  SER  88           HB3      SER  88  -4.756 -17.625 -17.492
  695    HG   SER  88           HG       SER  88  -6.005 -19.244 -16.724
  696    H    LYS  89           H        LYS  89  -3.897 -14.456 -14.509
  697    HA   LYS  89           HA       LYS  89  -2.664 -13.305 -16.883
  698    HB2  LYS  89           HB2      LYS  89  -3.693 -11.076 -15.912
  699    HB3  LYS  89           HB3      LYS  89  -4.590 -12.093 -17.015
  700    HG2  LYS  89           HG2      LYS  89  -5.757 -13.093 -15.056
  701    HG3  LYS  89           HG3      LYS  89  -4.910 -11.943 -14.019
  702    HD2  LYS  89           HD2      LYS  89  -5.936 -10.087 -15.201
  703    HD3  LYS  89           HD3      LYS  89  -6.730 -11.204 -16.311
  704    HE2  LYS  89           HE2      LYS  89  -7.967 -12.173 -14.423
  705    HE3  LYS  89           HE3      LYS  89  -7.190 -11.022 -13.335
  706    HZ1  LYS  89           HZ1      LYS  89  -8.233  -9.216 -14.530
  707    HZ2  LYS  89           HZ2      LYS  89  -9.413 -10.306 -14.002
  708    HZ3  LYS  89           HZ3      LYS  89  -8.938 -10.296 -15.625
  709    H    THR  90           H        THR  90  -1.242 -11.710 -16.548
  710    HA   THR  90           HA       THR  90   0.510 -12.088 -14.285
  711    HB   THR  90           HB       THR  90   0.975 -10.115 -16.516
  712    HG1  THR  90           HG1      THR  90   1.712 -11.785 -17.789
  713   HG21  THR  90          HG21      THR  90   3.328 -10.693 -16.159
  714   HG22  THR  90          HG22      THR  90   2.865 -11.852 -14.915
  715   HG23  THR  90          HG23      THR  90   2.592 -10.128 -14.659
  716    H    ILE  91           H        ILE  91   0.644 -10.832 -12.532
  717    HA   ILE  91           HA       ILE  91  -0.612  -8.168 -12.579
  718    HB   ILE  91           HB       ILE  91  -1.017  -8.384 -10.186
  719   HG12  ILE  91          HG12      ILE  91  -0.081 -11.208 -10.395
  720   HG13  ILE  91          HG13      ILE  91   0.822  -9.942  -9.593
  721   HG21  ILE  91          HG21      ILE  91  -2.732  -9.032 -11.761
  722   HG22  ILE  91          HG22      ILE  91  -2.802 -10.062 -10.331
  723   HG23  ILE  91          HG23      ILE  91  -2.078 -10.670 -11.820
  724   HD11  ILE  91          HD11      ILE  91  -0.384 -10.160  -7.726
  725   HD12  ILE  91          HD12      ILE  91  -1.019 -11.649  -8.427
  726   HD13  ILE  91          HD13      ILE  91  -1.915 -10.130  -8.621
  727    H    ASP  92           H        ASP  92   0.419  -6.617 -10.778
  728    HA   ASP  92           HA       ASP  92   3.316  -6.798 -11.302
  729    HB2  ASP  92           HB2      ASP  92   1.900  -4.986 -12.411
  730    HB3  ASP  92           HB3      ASP  92   1.811  -4.247 -10.818
  731    HA   PRO  93           HA       PRO  93   3.395  -6.632  -6.708
  732    HB2  PRO  93           HB2      PRO  93   5.633  -8.422  -6.708
  733    HB3  PRO  93           HB3      PRO  93   3.980  -8.767  -6.190
  734    HG2  PRO  93           HG2      PRO  93   5.190  -9.911  -8.384
  735    HG3  PRO  93           HG3      PRO  93   3.438  -9.788  -8.141
  736    HD2  PRO  93           HD2      PRO  93   5.233  -8.095  -9.824
  737    HD3  PRO  93           HD3      PRO  93   3.576  -8.653 -10.138
  738    H    LYS  94           H        LYS  94   4.420  -4.932  -5.842
  739    HA   LYS  94           HA       LYS  94   7.261  -4.501  -6.389
  740    HB2  LYS  94           HB2      LYS  94   6.899  -2.062  -6.803
  741    HB3  LYS  94           HB3      LYS  94   6.260  -3.097  -8.067
  742    HG2  LYS  94           HG2      LYS  94   4.040  -2.819  -6.595
  743    HG3  LYS  94           HG3      LYS  94   4.847  -1.307  -6.178
  744    HD2  LYS  94           HD2      LYS  94   5.020  -0.719  -8.525
  745    HD3  LYS  94           HD3      LYS  94   4.305  -2.265  -8.988
  746    HE2  LYS  94           HE2      LYS  94   2.239  -1.657  -7.832
  747    HE3  LYS  94           HE3      LYS  94   2.952  -0.116  -7.358
  748    HZ1  LYS  94           HZ1      LYS  94   2.433  -1.009 -10.143
  749    HZ2  LYS  94           HZ2      LYS  94   3.144   0.462  -9.704
  750    HZ3  LYS  94           HZ3      LYS  94   1.537   0.143  -9.286
  751    H    VAL  95           H        VAL  95   8.236  -2.832  -4.898
  752    HA   VAL  95           HA       VAL  95   7.072  -3.137  -2.235
  753    HB   VAL  95           HB       VAL  95   9.792  -2.116  -2.882
  754   HG11  VAL  95          HG11      VAL  95   9.114  -1.485  -0.657
  755   HG12  VAL  95          HG12      VAL  95  10.316  -2.770  -0.548
  756   HG13  VAL  95          HG13      VAL  95   8.607  -3.139  -0.315
  757   HG21  VAL  95          HG21      VAL  95   9.281  -4.483  -3.662
  758   HG22  VAL  95          HG22      VAL  95   9.197  -4.902  -1.949
  759   HG23  VAL  95          HG23      VAL  95  10.696  -4.266  -2.633
  760    H    ALA  96           H        ALA  96   6.703  -1.423  -0.827
  761    HA   ALA  96           HA       ALA  96   5.654   0.930  -1.909
  762    HB1  ALA  96           HB1      ALA  96   5.256   1.588   0.400
  763    HB2  ALA  96           HB2      ALA  96   6.339   0.313   0.958
  764    HB3  ALA  96           HB3      ALA  96   4.832  -0.104   0.144
  765    H    PHE  97           H        PHE  97   6.231   3.163  -1.111
  766    HA   PHE  97           HA       PHE  97   9.082   3.625  -1.412
  767    HB2  PHE  97           HB2      PHE  97   6.593   5.124  -2.100
  768    HB3  PHE  97           HB3      PHE  97   8.073   6.016  -1.827
  769    HD1  PHE  97           HD1      PHE  97   6.584   3.304  -3.861
  770    HD2  PHE  97           HD2      PHE  97   9.712   6.173  -3.501
  771    HE1  PHE  97           HE1      PHE  97   7.292   2.820  -6.168
  772    HE2  PHE  97           HE2      PHE  97  10.424   5.690  -5.806
  773    HZ   PHE  97           HZ       PHE  97   9.215   4.012  -7.141
  774    HA   PRO  98           HA       PRO  98   9.213   5.067   2.842
  775    HB2  PRO  98           HB2      PRO  98  11.581   6.663   2.125
  776    HB3  PRO  98           HB3      PRO  98  11.463   5.250   3.186
  777    HG2  PRO  98           HG2      PRO  98  12.681   5.035   0.841
  778    HG3  PRO  98           HG3      PRO  98  11.615   3.737   1.429
  779    HD2  PRO  98           HD2      PRO  98  10.950   5.946  -0.492
  780    HD3  PRO  98           HD3      PRO  98  10.746   4.190  -0.689
  781    H    ARG  99           H        ARG  99   9.859   7.260   4.045
  782    HA   ARG  99           HA       ARG  99   7.845   9.163   3.347
  783    HB2  ARG  99           HB2      ARG  99   9.762   8.756   5.570
  784    HB3  ARG  99           HB3      ARG  99   9.183  10.398   5.324
  785    HG2  ARG  99           HG2      ARG  99   6.925   9.740   5.658
  786    HG3  ARG  99           HG3      ARG  99   7.355   8.029   5.619
  787    HD2  ARG  99           HD2      ARG  99   8.594   9.830   7.657
  788    HD3  ARG  99           HD3      ARG  99   6.958   9.220   7.907
  789    HE   ARG  99           HE       ARG  99   8.293   6.969   7.364
  790   HH11  ARG  99          HH11      ARG  99   9.078   9.577   9.583
  791   HH12  ARG  99          HH12      ARG  99   9.932   8.542  10.677
  792   HH21  ARG  99          HH21      ARG  99  10.114   6.311  10.244
  793   HH22  ARG  99          HH22      ARG  99   9.403   5.632   8.818
  794    H    ARG 100           H        ARG 100   8.127  11.432   3.070
  795    HA   ARG 100           HA       ARG 100   8.822  13.231   1.897
  796    HB2  ARG 100           HB2      ARG 100  11.181  12.460   3.532
  797    HB3  ARG 100           HB3      ARG 100  11.426  13.684   2.294
  798    HG2  ARG 100           HG2      ARG 100   9.126  13.979   4.164
  799    HG3  ARG 100           HG3      ARG 100  10.753  14.350   4.739
  800    HD2  ARG 100           HD2      ARG 100  11.032  16.083   3.198
  801    HD3  ARG 100           HD3      ARG 100   9.723  15.504   2.169
  802    HE   ARG 100           HE       ARG 100   8.703  16.221   4.699
  803   HH11  ARG 100          HH11      ARG 100   9.069  19.185   2.012
  804   HH12  ARG 100          HH12      ARG 100   9.970  17.723   1.790
  805   HH21  ARG 100          HH21      ARG 100   7.522  18.140   4.966
  806   HH22  ARG 100          HH22      ARG 100   7.684  19.420   3.810
  807    H    ALA 101           H        ALA 101   8.465  12.650  -0.192
  808    HA   ALA 101           HA       ALA 101  10.745  11.714  -1.730
  809    HB1  ALA 101           HB1      ALA 101   9.366  10.529  -3.121
  810    HB2  ALA 101           HB2      ALA 101   8.009  11.625  -2.876
  811    HB3  ALA 101           HB3      ALA 101   8.428  10.450  -1.629
  812    H    GLN 102           H        GLN 102  10.212  12.466  -4.243
  813    HA   GLN 102           HA       GLN 102  10.026  15.400  -4.091
  814    HB2  GLN 102           HB2      GLN 102  11.600  13.593  -5.910
  815    HB3  GLN 102           HB3      GLN 102  11.274  15.267  -6.340
  816    HG2  GLN 102           HG2      GLN 102  12.343  15.945  -4.190
  817    HG3  GLN 102           HG3      GLN 102  12.810  14.261  -3.959
  818   HE21  GLN 102          HE21      GLN 102  14.367  13.351  -5.308
  819   HE22  GLN 102          HE22      GLN 102  15.426  14.320  -6.269
  820    HA   PRO 103           HA       PRO 103   6.310  14.842  -6.566
  821    HB2  PRO 103           HB2      PRO 103   5.581  17.421  -6.804
  822    HB3  PRO 103           HB3      PRO 103   5.433  16.548  -5.271
  823    HG2  PRO 103           HG2      PRO 103   7.545  18.471  -6.142
  824    HG3  PRO 103           HG3      PRO 103   6.726  18.339  -4.572
  825    HD2  PRO 103           HD2      PRO 103   9.211  17.319  -5.057
  826    HD3  PRO 103           HD3      PRO 103   8.094  16.652  -3.851
  827    H    LYS 104           H        LYS 104   5.369  15.790  -8.627
  828    HA   LYS 104           HA       LYS 104   7.422  15.824 -10.677
  829    HB2  LYS 104           HB2      LYS 104   4.407  15.744 -10.765
  830    HB3  LYS 104           HB3      LYS 104   5.386  15.898 -12.217
  831    HG2  LYS 104           HG2      LYS 104   6.401  13.763 -11.834
  832    HG3  LYS 104           HG3      LYS 104   5.622  13.625 -10.257
  833    HD2  LYS 104           HD2      LYS 104   3.782  12.759 -11.186
  834    HD3  LYS 104           HD3      LYS 104   3.651  14.129 -12.289
  835    HE2  LYS 104           HE2      LYS 104   3.809  12.170 -13.624
  836    HE3  LYS 104           HE3      LYS 104   5.358  13.003 -13.744
  837    HZ1  LYS 104           HZ1      LYS 104   5.647  10.622 -13.450
  838    HZ2  LYS 104           HZ2      LYS 104   4.784  10.669 -11.996
  839    HZ3  LYS 104           HZ3      LYS 104   6.272  11.462 -12.121
  840    H    MET 105           H        MET 105   7.666  17.450 -12.261
  841    HA   MET 105           HA       MET 105   6.468  20.051 -11.621
  842    HB2  MET 105           HB2      MET 105   8.662  21.136 -12.214
  843    HB3  MET 105           HB3      MET 105   8.655  20.233 -10.709
  844    HG2  MET 105           HG2      MET 105   9.835  18.398 -11.764
  845    HG3  MET 105           HG3      MET 105   9.755  19.209 -13.326
  846    HE1  MET 105           HE1      MET 105  12.370  21.969 -13.153
  847    HE2  MET 105           HE2      MET 105  10.610  22.079 -13.134
  848    HE3  MET 105           HE3      MET 105  11.408  20.900 -14.174
  849    H    VAL 106           H        VAL 106   7.215  17.746 -13.964
  850    HA   VAL 106           HA       VAL 106   6.897  19.613 -16.194
  851    HB   VAL 106           HB       VAL 106   7.376  16.668 -16.524
  852   HG11  VAL 106          HG11      VAL 106   6.874  17.904 -18.541
  853   HG12  VAL 106          HG12      VAL 106   8.562  17.396 -18.568
  854   HG13  VAL 106          HG13      VAL 106   8.150  19.068 -18.182
  855   HG21  VAL 106          HG21      VAL 106   9.087  17.407 -14.942
  856   HG22  VAL 106          HG22      VAL 106   9.549  18.706 -16.042
  857   HG23  VAL 106          HG23      VAL 106   9.797  17.024 -16.512
  858    H    THR 107           H        THR 107   5.400  18.987 -17.941
  859    HA   THR 107           HA       THR 107   2.989  17.774 -16.893
  860    HB   THR 107           HB       THR 107   3.060  19.638 -19.250
  861    HG1  THR 107           HG1      THR 107   3.782  21.022 -17.769
  862   HG21  THR 107          HG21      THR 107   0.981  18.361 -18.886
  863   HG22  THR 107          HG22      THR 107   0.733  20.088 -18.630
  864   HG23  THR 107          HG23      THR 107   0.880  19.004 -17.247
  865    H    ARG 108           H        ARG 108   4.735  18.226 -19.971
  866    HA   ARG 108           HA       ARG 108   3.553  15.756 -21.012
  867    HB2  ARG 108           HB2      ARG 108   4.802  18.164 -22.245
  868    HB3  ARG 108           HB3      ARG 108   4.904  16.641 -23.119
  869    HG2  ARG 108           HG2      ARG 108   2.473  16.444 -23.073
  870    HG3  ARG 108           HG3      ARG 108   2.365  17.966 -22.184
  871    HD2  ARG 108           HD2      ARG 108   3.185  19.207 -24.021
  872    HD3  ARG 108           HD3      ARG 108   3.705  17.750 -24.867
  873    HE   ARG 108           HE       ARG 108   0.893  17.758 -24.400
  874   HH11  ARG 108          HH11      ARG 108   3.351  19.063 -26.539
  875   HH12  ARG 108          HH12      ARG 108   2.256  19.263 -27.865
  876   HH21  ARG 108          HH21      ARG 108   0.064  18.676 -27.645
  877   HH22  ARG 108          HH22      ARG 108  -0.524  18.023 -26.152
  878    H    THR 109           H        THR 109   4.736  14.008 -21.655
  879    HA   THR 109           HA       THR 109   7.496  13.879 -20.657
  880    HB   THR 109           HB       THR 109   7.173  11.370 -20.985
  881    HG1  THR 109           HG1      THR 109   4.455  11.589 -20.751
  882   HG21  THR 109          HG21      THR 109   5.861  11.126 -18.901
  883   HG22  THR 109          HG22      THR 109   5.426  12.833 -19.002
  884   HG23  THR 109          HG23      THR 109   7.111  12.363 -18.775
  885    H    LYS 110           H        LYS 110   9.114  13.975 -22.056
  886    HA   LYS 110           HA       LYS 110   8.656  13.607 -24.872
  887    HB2  LYS 110           HB2      LYS 110  10.890  14.771 -23.257
  888    HB3  LYS 110           HB3      LYS 110  11.148  14.340 -24.941
  889    HG2  LYS 110           HG2      LYS 110   9.257  15.823 -25.556
  890    HG3  LYS 110           HG3      LYS 110   9.155  16.324 -23.866
  891    HD2  LYS 110           HD2      LYS 110  11.394  17.219 -23.950
  892    HD3  LYS 110           HD3      LYS 110  11.621  16.597 -25.585
  893    HE2  LYS 110           HE2      LYS 110  11.149  18.893 -25.836
  894    HE3  LYS 110           HE3      LYS 110   9.662  18.050 -26.264
  895    HZ1  LYS 110           HZ1      LYS 110   9.185  19.936 -24.863
  896    HZ2  LYS 110           HZ2      LYS 110  10.240  19.372 -23.667
  897    HZ3  LYS 110           HZ3      LYS 110   8.829  18.510 -24.023
  898    H    LYS 111           H        LYS 111   9.796  12.157 -26.185
  899    HA   LYS 111           HA       LYS 111  10.659   9.758 -24.870
  900    HB2  LYS 111           HB2      LYS 111   9.627  10.460 -27.508
  901    HB3  LYS 111           HB3      LYS 111  10.937   9.289 -27.565
  902    HG2  LYS 111           HG2      LYS 111   9.708   7.853 -26.002
  903    HG3  LYS 111           HG3      LYS 111   8.385   9.021 -25.989
  904    HD2  LYS 111           HD2      LYS 111   7.935   8.648 -28.305
  905    HD3  LYS 111           HD3      LYS 111   9.403   7.688 -28.494
  906    HE2  LYS 111           HE2      LYS 111   7.175   6.895 -26.634
  907    HE3  LYS 111           HE3      LYS 111   7.212   6.411 -28.328
  908    HZ1  LYS 111           HZ1      LYS 111   9.317   5.307 -27.942
  909    HZ2  LYS 111           HZ2      LYS 111   8.150   4.713 -26.873
  910    HZ3  LYS 111           HZ3      LYS 111   9.321   5.803 -26.325
  Start of MODEL    9
    1    H1   MET  -3           H1       MET  -3 -33.334  20.007  17.039
    2    H2   MET  -3           H2       MET  -3 -33.528  18.359  17.366
    3    H3   MET  -3           H3       MET  -3 -34.060  18.995  15.893
    4    HA   MET  -3           HA       MET  -3 -31.245  18.865  16.802
    5    HB2  MET  -3           HB2      MET  -3 -32.876  17.167  14.931
    6    HB3  MET  -3           HB3      MET  -3 -31.132  17.292  14.745
    7    HG2  MET  -3           HG2      MET  -3 -32.537  16.377  17.245
    8    HG3  MET  -3           HG3      MET  -3 -31.839  15.312  16.026
    9    HE1  MET  -3           HE1      MET  -3 -30.317  14.048  17.750
   10    HE2  MET  -3           HE2      MET  -3 -31.057  14.997  19.039
   11    HE3  MET  -3           HE3      MET  -3 -29.302  14.860  18.941
   12    H    HIS  -2           H        HIS  -2 -29.751  19.836  15.521
   13    HA   HIS  -2           HA       HIS  -2 -30.705  21.295  13.150
   14    HB2  HIS  -2           HB2      HIS  -2 -29.128  22.321  15.488
   15    HB3  HIS  -2           HB3      HIS  -2 -28.919  23.050  13.900
   16    HD1  HIS  -2           HD1      HIS  -2 -30.615  24.751  13.203
   17    HD2  HIS  -2           HD2      HIS  -2 -31.846  22.549  16.506
   18    HE1  HIS  -2           HE1      HIS  -2 -32.723  25.862  14.004
   19    HE2  HIS  -2           HE2      HIS  -2 -33.452  24.513  16.003
   20    H    HIS  -1           H        HIS  -1 -29.463  21.153  11.386
   21    HA   HIS  -1           HA       HIS  -1 -26.958  19.631  11.589
   22    HB2  HIS  -1           HB2      HIS  -1 -29.149  19.712   9.651
   23    HB3  HIS  -1           HB3      HIS  -1 -27.557  19.780   8.903
   24    HD1  HIS  -1           HD1      HIS  -1 -25.959  17.726   9.370
   25    HD2  HIS  -1           HD2      HIS  -1 -29.890  17.244  10.629
   26    HE1  HIS  -1           HE1      HIS  -1 -26.238  15.260   9.775
   27    HE2  HIS  -1           HE2      HIS  -1 -28.624  14.990  10.536
   28    H    HIS   0           H        HIS   0 -28.338  22.617  10.327
   29    HA   HIS   0           HA       HIS   0 -25.816  23.455   9.145
   30    HB2  HIS   0           HB2      HIS   0 -28.563  24.684   9.250
   31    HB3  HIS   0           HB3      HIS   0 -27.172  25.562   8.626
   32    HD1  HIS   0           HD1      HIS   0 -26.495  25.099   6.253
   33    HD2  HIS   0           HD2      HIS   0 -29.254  22.345   7.694
   34    HE1  HIS   0           HE1      HIS   0 -27.179  23.728   4.259
   35    HE2  HIS   0           HE2      HIS   0 -28.850  22.067   5.154
   36    H    HIS   1           H        HIS   1 -27.822  24.247  11.940
   37    HA   HIS   1           HA       HIS   1 -25.999  26.384  12.746
   38    HB2  HIS   1           HB2      HIS   1 -28.677  26.267  12.903
   39    HB3  HIS   1           HB3      HIS   1 -28.278  25.600  14.482
   40    HD1  HIS   1           HD1      HIS   1 -28.135  28.754  12.487
   41    HD2  HIS   1           HD2      HIS   1 -27.158  27.421  16.300
   42    HE1  HIS   1           HE1      HIS   1 -27.683  30.831  13.830
   43    HE2  HIS   1           HE2      HIS   1 -27.094  30.002  16.135
   44    H    HIS   2           H        HIS   2 -24.512  26.198  14.289
   45    HA   HIS   2           HA       HIS   2 -24.355  23.673  15.794
   46    HB2  HIS   2           HB2      HIS   2 -22.230  25.609  14.882
   47    HB3  HIS   2           HB3      HIS   2 -21.915  24.383  16.104
   48    HD1  HIS   2           HD1      HIS   2 -21.308  22.105  15.279
   49    HD2  HIS   2           HD2      HIS   2 -22.962  24.475  12.294
   50    HE1  HIS   2           HE1      HIS   2 -21.043  20.789  13.153
   51    HE2  HIS   2           HE2      HIS   2 -22.051  22.242  11.358
   52    H    HIS   3           H        HIS   3 -23.846  23.697  18.003
   53    HA   HIS   3           HA       HIS   3 -24.206  26.291  19.355
   54    HB2  HIS   3           HB2      HIS   3 -25.389  23.607  20.052
   55    HB3  HIS   3           HB3      HIS   3 -25.299  24.926  21.215
   56    HD1  HIS   3           HD1      HIS   3 -27.121  23.798  18.163
   57    HD2  HIS   3           HD2      HIS   3 -27.072  27.059  20.739
   58    HE1  HIS   3           HE1      HIS   3 -29.205  25.103  17.636
   59    HE2  HIS   3           HE2      HIS   3 -29.157  27.072  19.208
   60    H    SER   4           H        SER   4 -22.829  23.022  19.632
   61    HA   SER   4           HA       SER   4 -21.146  23.837  21.870
   62    HB2  SER   4           HB2      SER   4 -21.443  21.161  20.488
   63    HB3  SER   4           HB3      SER   4 -20.459  21.459  21.921
   64    HG   SER   4           HG       SER   4 -22.538  22.284  22.837
   65    H    THR   5           H        THR   5 -19.159  24.596  21.629
   66    HA   THR   5           HA       THR   5 -17.801  24.460  19.086
   67    HB   THR   5           HB       THR   5 -16.164  25.951  20.375
   68    HG1  THR   5           HG1      THR   5 -17.625  27.017  22.131
   69   HG21  THR   5          HG21      THR   5 -17.721  26.834  18.721
   70   HG22  THR   5          HG22      THR   5 -17.584  27.936  20.091
   71   HG23  THR   5          HG23      THR   5 -18.993  26.884  19.941
   72    H    SER   6           H        SER   6 -15.505  23.935  18.973
   73    HA   SER   6           HA       SER   6 -14.871  21.554  20.516
   74    HB2  SER   6           HB2      SER   6 -12.940  21.377  18.917
   75    HB3  SER   6           HB3      SER   6 -14.523  21.396  18.140
   76    HG   SER   6           HG       SER   6 -13.681  23.906  18.369
   77    H    VAL   7           H        VAL   7 -13.421  21.415  22.108
   78    HA   VAL   7           HA       VAL   7 -11.822  23.805  22.756
   79    HB   VAL   7           HB       VAL   7 -12.552  21.581  24.680
   80   HG11  VAL   7          HG11      VAL   7 -12.029  23.272  26.408
   81   HG12  VAL   7          HG12      VAL   7 -11.518  24.381  25.136
   82   HG13  VAL   7          HG13      VAL   7 -10.638  22.875  25.397
   83   HG21  VAL   7          HG21      VAL   7 -14.286  23.051  25.587
   84   HG22  VAL   7          HG22      VAL   7 -14.616  22.630  23.907
   85   HG23  VAL   7          HG23      VAL   7 -13.967  24.220  24.306
   86    H    ASP   8           H        ASP   8 -11.707  20.235  22.794
   87    HA   ASP   8           HA       ASP   8  -8.830  20.205  23.146
   88    HB2  ASP   8           HB2      ASP   8 -10.816  18.472  23.861
   89    HB3  ASP   8           HB3      ASP   8 -10.171  17.685  22.423
   90    H    LEU   9           H        LEU   9  -7.343  20.065  21.605
   91    HA   LEU   9           HA       LEU   9  -8.163  19.923  18.814
   92    HB2  LEU   9           HB2      LEU   9  -6.219  21.355  20.196
   93    HB3  LEU   9           HB3      LEU   9  -5.303  20.155  19.308
   94    HG   LEU   9           HG       LEU   9  -6.791  21.005  17.286
   95   HD11  LEU   9          HD11      LEU   9  -6.664  23.435  19.065
   96   HD12  LEU   9          HD12      LEU   9  -8.128  22.532  18.681
   97   HD13  LEU   9          HD13      LEU   9  -7.253  23.375  17.403
   98   HD21  LEU   9          HD21      LEU   9  -4.417  21.074  17.226
   99   HD22  LEU   9          HD22      LEU   9  -4.360  22.365  18.424
  100   HD23  LEU   9          HD23      LEU   9  -4.997  22.685  16.812
  101    H    GLY  10           H        GLY  10  -6.808  18.620  17.275
  102    HA2  GLY  10           HA2      GLY  10  -5.978  16.057  18.479
  103    HA3  GLY  10           HA3      GLY  10  -6.985  16.117  17.040
  104    H    THR  11           H        THR  11  -3.883  17.297  18.281
  105    HA   THR  11           HA       THR  11  -2.616  16.520  15.757
  106    HB   THR  11           HB       THR  11  -3.055  18.912  15.518
  107    HG1  THR  11           HG1      THR  11  -1.015  19.428  14.866
  108   HG21  THR  11          HG21      THR  11  -1.270  19.401  17.905
  109   HG22  THR  11          HG22      THR  11  -3.028  19.475  17.968
  110   HG23  THR  11          HG23      THR  11  -2.135  20.602  16.946
  111    H    GLU  12           H        GLU  12  -2.699  15.744  18.769
  112    HA   GLU  12           HA       GLU  12   0.207  15.549  19.151
  113    HB2  GLU  12           HB2      GLU  12  -0.736  17.060  20.794
  114    HB3  GLU  12           HB3      GLU  12  -1.967  15.883  21.219
  115    HG2  GLU  12           HG2      GLU  12  -0.338  14.448  22.216
  116    HG3  GLU  12           HG3      GLU  12   0.983  15.476  21.656
  117    H    ASN  13           H        ASN  13  -2.856  14.018  19.818
  118    HA   ASN  13           HA       ASN  13  -1.796  11.503  20.626
  119    HB2  ASN  13           HB2      ASN  13  -4.049  12.663  21.212
  120    HB3  ASN  13           HB3      ASN  13  -4.628  11.921  19.737
  121   HD21  ASN  13          HD21      ASN  13  -5.285  11.668  22.526
  122   HD22  ASN  13          HD22      ASN  13  -5.153  10.005  22.870
  123    H    LEU  14           H        LEU  14  -1.562  12.699  17.641
  124    HA   LEU  14           HA       LEU  14  -2.620  10.514  16.080
  125    HB2  LEU  14           HB2      LEU  14  -1.420  11.646  14.169
  126    HB3  LEU  14           HB3      LEU  14  -2.667  12.578  14.963
  127    HG   LEU  14           HG       LEU  14  -0.649  13.624  16.290
  128   HD11  LEU  14          HD11      LEU  14   1.390  13.773  14.948
  129   HD12  LEU  14          HD12      LEU  14   0.708  12.638  13.783
  130   HD13  LEU  14          HD13      LEU  14   1.058  12.108  15.428
  131   HD21  LEU  14          HD21      LEU  14  -2.205  14.699  14.597
  132   HD22  LEU  14          HD22      LEU  14  -0.959  14.372  13.396
  133   HD23  LEU  14          HD23      LEU  14  -0.608  15.422  14.767
  134    H    TYR  15           H        TYR  15  -1.189   9.325  14.498
  135    HA   TYR  15           HA       TYR  15   0.866   7.941  15.967
  136    HB2  TYR  15           HB2      TYR  15  -0.347   7.575  13.228
  137    HB3  TYR  15           HB3      TYR  15   1.025   6.613  13.771
  138    HD1  TYR  15           HD1      TYR  15  -2.546   7.318  14.291
  139    HD2  TYR  15           HD2      TYR  15   0.759   4.900  15.444
  140    HE1  TYR  15           HE1      TYR  15  -4.082   5.775  15.434
  141    HE2  TYR  15           HE2      TYR  15  -0.768   3.348  16.587
  142    HH   TYR  15           HH       TYR  15  -3.017   3.376  17.582
  143    H    PHE  16           H        PHE  16   2.962   8.400  15.942
  144    HA   PHE  16           HA       PHE  16   4.046  10.166  13.906
  145    HB2  PHE  16           HB2      PHE  16   4.103  10.509  16.546
  146    HB3  PHE  16           HB3      PHE  16   5.570   9.553  16.377
  147    HD1  PHE  16           HD1      PHE  16   7.497  10.431  15.178
  148    HD2  PHE  16           HD2      PHE  16   3.956  12.741  15.664
  149    HE1  PHE  16           HE1      PHE  16   8.730  12.455  14.517
  150    HE2  PHE  16           HE2      PHE  16   5.183  14.769  15.003
  151    HZ   PHE  16           HZ       PHE  16   7.573  14.627  14.427
  152    H    GLN  17           H        GLN  17   4.146   6.914  14.937
  153    HA   GLN  17           HA       GLN  17   6.845   6.339  14.061
  154    HB2  GLN  17           HB2      GLN  17   4.573   4.626  15.047
  155    HB3  GLN  17           HB3      GLN  17   6.062   3.926  14.429
  156    HG2  GLN  17           HG2      GLN  17   7.339   5.076  16.147
  157    HG3  GLN  17           HG3      GLN  17   5.865   5.832  16.751
  158   HE21  GLN  17          HE21      GLN  17   7.687   2.883  16.505
  159   HE22  GLN  17          HE22      GLN  17   6.795   1.994  17.688
  160    H    SER  18           H        SER  18   7.458   5.065  12.303
  161    HA   SER  18           HA       SER  18   5.679   5.228   9.993
  162    HB2  SER  18           HB2      SER  18   8.624   4.544  10.188
  163    HB3  SER  18           HB3      SER  18   7.719   4.713   8.683
  164    HG   SER  18           HG       SER  18   8.975   6.604   9.738
  165    H    ASN  19           H        ASN  19   5.591   3.409   8.449
  166    HA   ASN  19           HA       ASN  19   5.933   0.756   9.646
  167    HB2  ASN  19           HB2      ASN  19   3.344   1.914   8.639
  168    HB3  ASN  19           HB3      ASN  19   3.627   0.188   8.555
  169   HD21  ASN  19          HD21      ASN  19   2.137  -0.399   9.870
  170   HD22  ASN  19          HD22      ASN  19   2.156  -0.067  11.542
  171    H    ALA  20           H        ALA  20   7.736   0.711   8.221
  172    HA   ALA  20           HA       ALA  20   7.172   0.572   5.349
  173    HB1  ALA  20           HB1      ALA  20   9.860   0.553   6.704
  174    HB2  ALA  20           HB2      ALA  20   9.011   2.023   6.225
  175    HB3  ALA  20           HB3      ALA  20   9.507   0.852   5.001
  176    H    GLY  21           H        GLY  21   7.367  -1.252   4.188
  177    HA2  GLY  21           HA2      GLY  21   8.741  -3.456   4.200
  178    HA3  GLY  21           HA3      GLY  21   7.826  -3.751   5.670
  179    H    LYS  22           H        LYS  22   5.793  -2.026   3.783
  180    HA   LYS  22           HA       LYS  22   4.229  -4.324   3.046
  181    HB2  LYS  22           HB2      LYS  22   3.860  -1.389   3.111
  182    HB3  LYS  22           HB3      LYS  22   2.873  -2.280   1.961
  183    HG2  LYS  22           HG2      LYS  22   1.642  -3.270   3.578
  184    HG3  LYS  22           HG3      LYS  22   2.989  -3.325   4.714
  185    HD2  LYS  22           HD2      LYS  22   2.777  -0.959   5.149
  186    HD3  LYS  22           HD3      LYS  22   1.499  -0.825   3.940
  187    HE2  LYS  22           HE2      LYS  22   0.069  -2.284   5.269
  188    HE3  LYS  22           HE3      LYS  22   1.349  -2.470   6.463
  189    HZ1  LYS  22           HZ1      LYS  22   1.234  -0.072   6.871
  190    HZ2  LYS  22           HZ2      LYS  22  -0.232  -0.843   7.207
  191    HZ3  LYS  22           HZ3      LYS  22  -0.056   0.053   5.783
  192    H    MET  23           H        MET  23   3.577  -4.952   1.048
  193    HA   MET  23           HA       MET  23   5.061  -3.924  -1.236
  194    HB2  MET  23           HB2      MET  23   4.472  -6.671  -0.310
  195    HB3  MET  23           HB3      MET  23   4.313  -6.387  -2.029
  196    HG2  MET  23           HG2      MET  23   6.664  -5.327  -1.841
  197    HG3  MET  23           HG3      MET  23   6.745  -6.189  -0.308
  198    HE1  MET  23           HE1      MET  23   6.339  -6.367  -4.106
  199    HE2  MET  23           HE2      MET  23   7.260  -7.819  -4.498
  200    HE3  MET  23           HE3      MET  23   8.069  -6.438  -3.756
  201    H    PHE  24           H        PHE  24   3.976  -3.251  -2.827
  202    HA   PHE  24           HA       PHE  24   1.103  -2.976  -2.804
  203    HB2  PHE  24           HB2      PHE  24   2.698  -1.037  -3.064
  204    HB3  PHE  24           HB3      PHE  24   3.225  -1.716  -4.586
  205    HD1  PHE  24           HD1      PHE  24   2.680   0.794  -5.047
  206    HD2  PHE  24           HD2      PHE  24  -0.286  -2.191  -4.392
  207    HE1  PHE  24           HE1      PHE  24   1.026   2.185  -6.211
  208    HE2  PHE  24           HE2      PHE  24  -1.929  -0.795  -5.557
  209    HZ   PHE  24           HZ       PHE  24  -1.286   1.390  -6.468
  210    H    ILE  25           H        ILE  25   0.186  -4.745  -3.702
  211    HA   ILE  25           HA       ILE  25   1.302  -6.091  -6.005
  212    HB   ILE  25           HB       ILE  25  -1.243  -6.896  -4.807
  213   HG12  ILE  25          HG12      ILE  25   0.133  -6.349  -2.830
  214   HG13  ILE  25          HG13      ILE  25  -0.248  -8.048  -2.926
  215   HG21  ILE  25          HG21      ILE  25   1.101  -8.386  -5.934
  216   HG22  ILE  25          HG22      ILE  25  -0.516  -8.217  -6.618
  217   HG23  ILE  25          HG23      ILE  25  -0.268  -9.186  -5.168
  218   HD11  ILE  25          HD11      ILE  25   2.003  -8.561  -3.635
  219   HD12  ILE  25          HD12      ILE  25   2.053  -7.590  -2.163
  220   HD13  ILE  25          HD13      ILE  25   2.393  -6.843  -3.724
  221    H    GLY  26           H        GLY  26   0.828  -5.228  -7.882
  222    HA2  GLY  26           HA2      GLY  26  -1.687  -3.910  -8.312
  223    HA3  GLY  26           HA3      GLY  26  -0.294  -3.702  -9.304
  224    H    GLY  27           H        GLY  27  -2.945  -4.075 -10.079
  225    HA2  GLY  27           HA2      GLY  27  -4.001  -5.024 -11.880
  226    HA3  GLY  27           HA3      GLY  27  -2.576  -6.004 -12.141
  227    H    LEU  28           H        LEU  28  -4.351  -6.166  -9.088
  228    HA   LEU  28           HA       LEU  28  -4.601  -8.933  -9.125
  229    HB2  LEU  28           HB2      LEU  28  -6.327  -6.962  -7.607
  230    HB3  LEU  28           HB3      LEU  28  -6.130  -8.660  -7.231
  231    HG   LEU  28           HG       LEU  28  -3.795  -6.756  -7.171
  232   HD11  LEU  28          HD11      LEU  28  -5.395  -5.785  -5.694
  233   HD12  LEU  28          HD12      LEU  28  -4.216  -6.648  -4.706
  234   HD13  LEU  28          HD13      LEU  28  -5.803  -7.356  -5.008
  235   HD21  LEU  28          HD21      LEU  28  -3.461  -9.265  -7.159
  236   HD22  LEU  28          HD22      LEU  28  -4.276  -9.284  -5.599
  237   HD23  LEU  28          HD23      LEU  28  -2.767  -8.395  -5.794
  238    H    SER  29           H        SER  29  -6.906 -10.030  -8.866
  239    HA   SER  29           HA       SER  29  -8.424  -9.349 -11.243
  240    HB2  SER  29           HB2      SER  29  -7.339 -11.659 -10.893
  241    HB3  SER  29           HB3      SER  29  -8.592 -11.929  -9.684
  242    HG   SER  29           HG       SER  29  -9.437 -10.982 -12.151
  243    H    TRP  30           H        TRP  30 -10.731 -10.131 -10.983
  244    HA   TRP  30           HA       TRP  30 -12.076  -8.496  -9.121
  245    HB2  TRP  30           HB2      TRP  30 -14.078  -9.292 -10.281
  246    HB3  TRP  30           HB3      TRP  30 -12.855  -8.815 -11.432
  247    HD1  TRP  30           HD1      TRP  30 -11.184 -11.400 -11.765
  248    HE1  TRP  30           HE1      TRP  30 -12.171 -13.543 -12.740
  249    HE3  TRP  30           HE3      TRP  30 -16.162 -10.472 -10.966
  250    HZ2  TRP  30           HZ2      TRP  30 -14.673 -14.693 -13.158
  251    HZ3  TRP  30           HZ3      TRP  30 -17.791 -12.166 -11.702
  252    HH2  TRP  30           HH2      TRP  30 -17.062 -14.235 -12.778
  253    H    GLN  31           H        GLN  31 -10.988 -11.696  -9.132
  254    HA   GLN  31           HA       GLN  31 -12.876 -12.668  -7.143
  255    HB2  GLN  31           HB2      GLN  31 -10.749 -13.976  -8.807
  256    HB3  GLN  31           HB3      GLN  31 -11.636 -14.837  -7.554
  257    HG2  GLN  31           HG2      GLN  31 -13.742 -14.298  -8.765
  258    HG3  GLN  31           HG3      GLN  31 -12.763 -13.600 -10.056
  259   HE21  GLN  31          HE21      GLN  31 -13.608 -16.522  -8.367
  260   HE22  GLN  31          HE22      GLN  31 -13.077 -17.623  -9.585
  261    H    THR  32           H        THR  32  -9.616 -11.616  -7.490
  262    HA   THR  32           HA       THR  32  -8.452 -12.838  -5.240
  263    HB   THR  32           HB       THR  32  -7.521 -10.234  -6.237
  264    HG1  THR  32           HG1      THR  32  -7.135 -12.674  -7.627
  265   HG21  THR  32          HG21      THR  32  -5.300 -11.335  -6.026
  266   HG22  THR  32          HG22      THR  32  -6.122 -12.776  -5.430
  267   HG23  THR  32          HG23      THR  32  -6.190 -11.276  -4.505
  268    H    SER  33           H        SER  33  -9.002 -12.590  -3.228
  269    HA   SER  33           HA       SER  33 -10.010 -10.035  -2.176
  270    HB2  SER  33           HB2      SER  33 -10.224 -12.883  -1.179
  271    HB3  SER  33           HB3      SER  33 -10.753 -11.493  -0.239
  272    HG   SER  33           HG       SER  33 -11.718 -11.538  -2.808
  273    HA   PRO  34           HA       PRO  34  -6.356  -9.283   0.288
  274    HB2  PRO  34           HB2      PRO  34  -7.368  -8.924   2.849
  275    HB3  PRO  34           HB3      PRO  34  -7.272  -7.661   1.613
  276    HG2  PRO  34           HG2      PRO  34  -9.599  -9.363   2.383
  277    HG3  PRO  34           HG3      PRO  34  -9.555  -7.639   1.960
  278    HD2  PRO  34           HD2      PRO  34 -10.418  -9.438   0.202
  279    HD3  PRO  34           HD3      PRO  34  -9.426  -8.064  -0.316
  280    H    ASP  35           H        ASP  35  -8.608 -11.661   1.327
  281    HA   ASP  35           HA       ASP  35  -6.825 -13.067   3.088
  282    HB2  ASP  35           HB2      ASP  35  -9.571 -13.290   2.243
  283    HB3  ASP  35           HB3      ASP  35  -8.806 -14.825   2.536
  284    H    SER  36           H        SER  36  -7.898 -13.193  -0.177
  285    HA   SER  36           HA       SER  36  -6.771 -15.710  -0.914
  286    HB2  SER  36           HB2      SER  36  -8.633 -14.557  -2.161
  287    HB3  SER  36           HB3      SER  36  -7.451 -13.378  -2.729
  288    HG   SER  36           HG       SER  36  -6.281 -15.286  -3.560
  289    H    LEU  37           H        LEU  37  -5.707 -12.341  -0.919
  290    HA   LEU  37           HA       LEU  37  -3.287 -12.703  -2.306
  291    HB2  LEU  37           HB2      LEU  37  -4.916 -10.696  -1.056
  292    HB3  LEU  37           HB3      LEU  37  -3.269 -10.484  -0.582
  293    HG   LEU  37           HG       LEU  37  -4.253 -10.577  -3.418
  294   HD11  LEU  37          HD11      LEU  37  -4.727  -8.418  -3.293
  295   HD12  LEU  37          HD12      LEU  37  -3.152  -8.056  -2.589
  296   HD13  LEU  37          HD13      LEU  37  -4.497  -8.520  -1.548
  297   HD21  LEU  37          HD21      LEU  37  -1.931 -11.250  -3.286
  298   HD22  LEU  37          HD22      LEU  37  -1.549  -9.838  -2.308
  299   HD23  LEU  37          HD23      LEU  37  -2.048  -9.639  -3.984
  300    H    ARG  38           H        ARG  38  -4.306 -12.692   1.049
  301    HA   ARG  38           HA       ARG  38  -1.764 -12.855   2.247
  302    HB2  ARG  38           HB2      ARG  38  -4.193 -12.256   3.205
  303    HB3  ARG  38           HB3      ARG  38  -4.161 -13.962   3.626
  304    HG2  ARG  38           HG2      ARG  38  -1.938 -13.494   4.759
  305    HG3  ARG  38           HG3      ARG  38  -2.317 -11.783   4.559
  306    HD2  ARG  38           HD2      ARG  38  -4.134 -13.749   5.946
  307    HD3  ARG  38           HD3      ARG  38  -2.937 -12.769   6.787
  308    HE   ARG  38           HE       ARG  38  -4.820 -11.296   5.150
  309   HH11  ARG  38          HH11      ARG  38  -4.101 -12.492   8.374
  310   HH12  ARG  38          HH12      ARG  38  -5.151 -11.357   9.154
  311   HH21  ARG  38          HH21      ARG  38  -6.333  -9.849   7.920
  312   HH22  ARG  38          HH22      ARG  38  -6.193  -9.823   6.194
  313    H    ASP  39           H        ASP  39  -4.293 -15.166   1.341
  314    HA   ASP  39           HA       ASP  39  -3.010 -17.497   2.239
  315    HB2  ASP  39           HB2      ASP  39  -5.310 -16.856   0.501
  316    HB3  ASP  39           HB3      ASP  39  -4.583 -18.441   0.263
  317    H    TYR  40           H        TYR  40  -2.910 -15.800  -0.898
  318    HA   TYR  40           HA       TYR  40  -1.504 -17.853  -2.266
  319    HB2  TYR  40           HB2      TYR  40  -2.944 -15.791  -3.137
  320    HB3  TYR  40           HB3      TYR  40  -1.356 -15.033  -3.212
  321    HD1  TYR  40           HD1      TYR  40  -3.319 -17.942  -4.408
  322    HD2  TYR  40           HD2      TYR  40   0.132 -15.523  -4.979
  323    HE1  TYR  40           HE1      TYR  40  -2.899 -19.063  -6.558
  324    HE2  TYR  40           HE2      TYR  40   0.563 -16.635  -7.129
  325    HH   TYR  40           HH       TYR  40  -1.717 -18.600  -8.676
  326    H    PHE  41           H        PHE  41  -0.522 -14.695  -0.943
  327    HA   PHE  41           HA       PHE  41   2.203 -14.991  -1.570
  328    HB2  PHE  41           HB2      PHE  41   0.537 -13.037  -0.172
  329    HB3  PHE  41           HB3      PHE  41   2.267 -12.946   0.042
  330    HD1  PHE  41           HD1      PHE  41   3.694 -12.232  -1.768
  331    HD2  PHE  41           HD2      PHE  41  -0.476 -12.813  -2.402
  332    HE1  PHE  41           HE1      PHE  41   3.896 -11.152  -3.957
  333    HE2  PHE  41           HE2      PHE  41  -0.270 -11.726  -4.614
  334    HZ   PHE  41           HZ       PHE  41   1.911 -10.898  -5.387
  335    H    SER  42           H        SER  42   0.326 -15.959   1.207
  336    HA   SER  42           HA       SER  42   2.368 -16.056   3.167
  337    HB2  SER  42           HB2      SER  42  -0.130 -16.300   3.601
  338    HB3  SER  42           HB3      SER  42   0.026 -17.957   3.024
  339    HG   SER  42           HG       SER  42   0.781 -18.476   4.904
  340    H    LYS  43           H        LYS  43   1.809 -17.658   0.419
  341    HA   LYS  43           HA       LYS  43   3.006 -20.198   1.004
  342    HB2  LYS  43           HB2      LYS  43   1.780 -18.884  -1.368
  343    HB3  LYS  43           HB3      LYS  43   2.773 -20.296  -1.603
  344    HG2  LYS  43           HG2      LYS  43   0.951 -20.855   0.501
  345    HG3  LYS  43           HG3      LYS  43   0.053 -20.170  -0.851
  346    HD2  LYS  43           HD2      LYS  43   1.037 -21.829  -2.352
  347    HD3  LYS  43           HD3      LYS  43   1.954 -22.508  -1.005
  348    HE2  LYS  43           HE2      LYS  43  -0.106 -23.121   0.122
  349    HE3  LYS  43           HE3      LYS  43  -1.055 -22.376  -1.164
  350    HZ1  LYS  43           HZ1      LYS  43  -0.144 -23.992  -2.716
  351    HZ2  LYS  43           HZ2      LYS  43  -0.931 -24.769  -1.438
  352    HZ3  LYS  43           HZ3      LYS  43   0.758 -24.709  -1.477
  353    H    PHE  44           H        PHE  44   4.123 -17.121   0.178
  354    HA   PHE  44           HA       PHE  44   6.658 -18.095  -0.959
  355    HB2  PHE  44           HB2      PHE  44   5.040 -15.994  -1.711
  356    HB3  PHE  44           HB3      PHE  44   6.339 -15.235  -0.809
  357    HD1  PHE  44           HD1      PHE  44   8.650 -15.356  -1.587
  358    HD2  PHE  44           HD2      PHE  44   5.446 -17.067  -3.806
  359    HE1  PHE  44           HE1      PHE  44  10.119 -15.555  -3.552
  360    HE2  PHE  44           HE2      PHE  44   6.909 -17.269  -5.771
  361    HZ   PHE  44           HZ       PHE  44   9.245 -16.525  -5.642
  362    H    GLY  45           H        GLY  45   5.215 -16.397   1.697
  363    HA2  GLY  45           HA2      GLY  45   7.373 -16.846   3.440
  364    HA3  GLY  45           HA3      GLY  45   7.256 -15.154   2.973
  365    H    GLU  46           H        GLU  46   6.781 -14.859   5.260
  366    HA   GLU  46           HA       GLU  46   4.122 -15.584   6.031
  367    HB2  GLU  46           HB2      GLU  46   6.066 -16.142   7.559
  368    HB3  GLU  46           HB3      GLU  46   6.183 -14.413   7.870
  369    HG2  GLU  46           HG2      GLU  46   3.985 -14.347   8.779
  370    HG3  GLU  46           HG3      GLU  46   3.660 -15.996   8.271
  371    H    ILE  47           H        ILE  47   2.665 -14.225   6.305
  372    HA   ILE  47           HA       ILE  47   3.135 -11.386   5.821
  373    HB   ILE  47           HB       ILE  47   0.655 -12.936   5.337
  374   HG12  ILE  47          HG12      ILE  47   1.890 -11.524   3.153
  375   HG13  ILE  47          HG13      ILE  47   2.919 -12.754   3.856
  376   HG21  ILE  47          HG21      ILE  47  -0.156 -10.859   4.193
  377   HG22  ILE  47          HG22      ILE  47   1.189 -10.014   4.960
  378   HG23  ILE  47          HG23      ILE  47  -0.068 -10.754   5.952
  379   HD11  ILE  47          HD11      ILE  47   0.475 -13.008   2.221
  380   HD12  ILE  47          HD12      ILE  47   0.618 -14.146   3.553
  381   HD13  ILE  47          HD13      ILE  47   1.871 -14.086   2.313
  382    H    ARG  48           H        ARG  48   2.521  -9.876   7.143
  383    HA   ARG  48           HA       ARG  48   1.638 -10.540   9.816
  384    HB2  ARG  48           HB2      ARG  48   3.422  -8.786   8.866
  385    HB3  ARG  48           HB3      ARG  48   2.016  -7.751   8.851
  386    HG2  ARG  48           HG2      ARG  48   1.742  -7.889  11.171
  387    HG3  ARG  48           HG3      ARG  48   2.849  -9.256  11.304
  388    HD2  ARG  48           HD2      ARG  48   4.689  -7.765  10.541
  389    HD3  ARG  48           HD3      ARG  48   3.559  -6.413  10.585
  390    HE   ARG  48           HE       ARG  48   3.375  -7.403  13.081
  391   HH11  ARG  48          HH11      ARG  48   7.126  -6.071  12.528
  392   HH12  ARG  48          HH12      ARG  48   6.168  -6.502  11.150
  393   HH21  ARG  48          HH21      ARG  48   6.267  -6.259  14.629
  394   HH22  ARG  48          HH22      ARG  48   4.652  -6.835  14.871
  395    H    GLU  49           H        GLU  49   0.569  -8.736   6.994
  396    HA   GLU  49           HA       GLU  49  -2.201  -8.998   7.567
  397    HB2  GLU  49           HB2      GLU  49  -1.274  -6.973   8.998
  398    HB3  GLU  49           HB3      GLU  49  -1.335  -6.126   7.462
  399    HG2  GLU  49           HG2      GLU  49  -3.718  -6.593   7.285
  400    HG3  GLU  49           HG3      GLU  49  -3.664  -7.485   8.805
  401    H    CYS  50           H        CYS  50  -3.463  -8.126   5.819
  402    HA   CYS  50           HA       CYS  50  -2.076  -7.354   3.444
  403    HB2  CYS  50           HB2      CYS  50  -2.373  -9.734   3.166
  404    HB3  CYS  50           HB3      CYS  50  -4.077  -9.606   3.584
  405    HG   CYS  50           HG       CYS  50  -4.150  -7.696   1.182
  406    H    MET  51           H        MET  51  -3.339  -6.255   1.963
  407    HA   MET  51           HA       MET  51  -5.930  -5.294   2.768
  408    HB2  MET  51           HB2      MET  51  -4.392  -3.791   3.880
  409    HB3  MET  51           HB3      MET  51  -3.613  -3.483   2.354
  410    HG2  MET  51           HG2      MET  51  -5.620  -2.400   1.513
  411    HG3  MET  51           HG3      MET  51  -6.434  -2.730   3.044
  412    HE1  MET  51           HE1      MET  51  -6.953   0.017   2.813
  413    HE2  MET  51           HE2      MET  51  -5.875   0.136   1.423
  414    HE3  MET  51           HE3      MET  51  -5.656   1.212   2.803
  415    H    VAL  52           H        VAL  52  -7.203  -4.902   1.187
  416    HA   VAL  52           HA       VAL  52  -6.242  -4.433  -1.528
  417    HB   VAL  52           HB       VAL  52  -8.610  -6.078  -0.800
  418   HG11  VAL  52          HG11      VAL  52  -7.440  -5.526  -3.511
  419   HG12  VAL  52          HG12      VAL  52  -8.965  -4.885  -2.900
  420   HG13  VAL  52          HG13      VAL  52  -8.786  -6.619  -3.181
  421   HG21  VAL  52          HG21      VAL  52  -6.119  -7.024  -2.137
  422   HG22  VAL  52          HG22      VAL  52  -7.431  -8.007  -1.484
  423   HG23  VAL  52          HG23      VAL  52  -6.365  -7.111  -0.396
  424    H    MET  53           H        MET  53  -6.960  -2.658  -2.330
  425    HA   MET  53           HA       MET  53  -8.555  -0.829  -0.863
  426    HB2  MET  53           HB2      MET  53  -6.942  -0.768  -3.294
  427    HB3  MET  53           HB3      MET  53  -8.353   0.275  -3.380
  428    HG2  MET  53           HG2      MET  53  -6.179   0.341  -1.299
  429    HG3  MET  53           HG3      MET  53  -6.472   1.524  -2.569
  430    HE1  MET  53           HE1      MET  53  -7.396   3.606   0.569
  431    HE2  MET  53           HE2      MET  53  -6.438   3.521  -0.910
  432    HE3  MET  53           HE3      MET  53  -6.093   2.426   0.429
  433    H    ARG  54           H        ARG  54 -10.625  -0.750  -0.705
  434    HA   ARG  54           HA       ARG  54 -12.331  -1.234  -3.036
  435    HB2  ARG  54           HB2      ARG  54 -12.415  -2.629  -0.402
  436    HB3  ARG  54           HB3      ARG  54 -13.944  -2.261  -1.191
  437    HG2  ARG  54           HG2      ARG  54 -13.131  -3.464  -3.202
  438    HG3  ARG  54           HG3      ARG  54 -11.687  -3.917  -2.296
  439    HD2  ARG  54           HD2      ARG  54 -13.041  -5.100  -0.672
  440    HD3  ARG  54           HD3      ARG  54 -14.515  -4.583  -1.490
  441    HE   ARG  54           HE       ARG  54 -12.523  -6.409  -2.676
  442   HH11  ARG  54          HH11      ARG  54 -16.488  -6.652  -3.273
  443   HH12  ARG  54          HH12      ARG  54 -15.861  -5.386  -2.272
  444   HH21  ARG  54          HH21      ARG  54 -13.371  -8.058  -3.980
  445   HH22  ARG  54          HH22      ARG  54 -15.080  -8.162  -4.238
  446    H    ASP  55           H        ASP  55 -14.341  -0.106  -2.978
  447    HA   ASP  55           HA       ASP  55 -14.387   2.149  -1.196
  448    HB2  ASP  55           HB2      ASP  55 -15.136   1.717  -3.976
  449    HB3  ASP  55           HB3      ASP  55 -16.127   2.829  -3.076
  450    HA   PRO  56           HA       PRO  56 -17.985  -0.010   0.615
  451    HB2  PRO  56           HB2      PRO  56 -18.253   2.487   2.178
  452    HB3  PRO  56           HB3      PRO  56 -18.106   0.818   2.744
  453    HG2  PRO  56           HG2      PRO  56 -16.082   2.525   3.011
  454    HG3  PRO  56           HG3      PRO  56 -15.803   0.817   2.616
  455    HD2  PRO  56           HD2      PRO  56 -15.725   3.203   0.812
  456    HD3  PRO  56           HD3      PRO  56 -14.660   1.781   0.857
  457    H    THR  57           H        THR  57 -17.886   2.876  -1.189
  458    HA   THR  57           HA       THR  57 -20.660   3.556  -0.961
  459    HB   THR  57           HB       THR  57 -20.123   5.173  -2.848
  460    HG1  THR  57           HG1      THR  57 -17.806   5.536  -3.056
  461   HG21  THR  57          HG21      THR  57 -20.232   5.925  -0.551
  462   HG22  THR  57          HG22      THR  57 -18.867   6.699  -1.356
  463   HG23  THR  57          HG23      THR  57 -18.592   5.351  -0.253
  464    H    THR  58           H        THR  58 -18.572   2.139  -3.448
  465    HA   THR  58           HA       THR  58 -20.977   1.294  -4.930
  466    HB   THR  58           HB       THR  58 -19.585   1.265  -6.976
  467    HG1  THR  58           HG1      THR  58 -17.609   1.897  -5.121
  468   HG21  THR  58          HG21      THR  58 -20.906   3.238  -6.556
  469   HG22  THR  58          HG22      THR  58 -19.340   3.737  -7.198
  470   HG23  THR  58          HG23      THR  58 -19.671   3.877  -5.469
  471    H    LYS  59           H        LYS  59 -18.361   0.190  -3.137
  472    HA   LYS  59           HA       LYS  59 -17.452  -1.823  -2.630
  473    HB2  LYS  59           HB2      LYS  59 -19.663  -3.224  -4.095
  474    HB3  LYS  59           HB3      LYS  59 -18.828  -3.716  -2.633
  475    HG2  LYS  59           HG2      LYS  59 -20.446  -1.231  -2.593
  476    HG3  LYS  59           HG3      LYS  59 -21.285  -2.785  -2.561
  477    HD2  LYS  59           HD2      LYS  59 -20.039  -3.428  -0.560
  478    HD3  LYS  59           HD3      LYS  59 -19.146  -1.905  -0.614
  479    HE2  LYS  59           HE2      LYS  59 -21.260  -0.680  -0.325
  480    HE3  LYS  59           HE3      LYS  59 -22.124  -2.214  -0.227
  481    HZ1  LYS  59           HZ1      LYS  59 -20.873  -2.763   1.757
  482    HZ2  LYS  59           HZ2      LYS  59 -21.670  -1.285   1.963
  483    HZ3  LYS  59           HZ3      LYS  59 -20.008  -1.312   1.654
  484    H    ARG  60           H        ARG  60 -17.246  -0.587  -5.467
  485    HA   ARG  60           HA       ARG  60 -16.316  -2.871  -7.028
  486    HB2  ARG  60           HB2      ARG  60 -16.597   0.065  -7.649
  487    HB3  ARG  60           HB3      ARG  60 -15.830  -1.064  -8.757
  488    HG2  ARG  60           HG2      ARG  60 -17.970  -2.405  -8.670
  489    HG3  ARG  60           HG3      ARG  60 -18.686  -1.025  -7.834
  490    HD2  ARG  60           HD2      ARG  60 -18.228   0.410  -9.717
  491    HD3  ARG  60           HD3      ARG  60 -17.350  -0.882 -10.533
  492    HE   ARG  60           HE       ARG  60 -20.194  -1.238  -9.907
  493   HH11  ARG  60          HH11      ARG  60 -18.693  -1.395 -13.630
  494   HH12  ARG  60          HH12      ARG  60 -17.670  -0.900 -12.324
  495   HH21  ARG  60          HH21      ARG  60 -21.517  -1.885 -11.631
  496   HH22  ARG  60          HH22      ARG  60 -20.869  -1.953 -13.236
  497    H    SER  61           H        SER  61 -14.267  -3.445  -7.354
  498    HA   SER  61           HA       SER  61 -12.141  -1.945  -6.002
  499    HB2  SER  61           HB2      SER  61 -12.098  -4.730  -7.198
  500    HB3  SER  61           HB3      SER  61 -10.812  -3.994  -6.243
  501    HG   SER  61           HG       SER  61 -12.459  -5.449  -5.179
  502    H    ARG  62           H        ARG  62 -10.082  -1.586  -7.082
  503    HA   ARG  62           HA       ARG  62 -10.448  -1.019  -9.931
  504    HB2  ARG  62           HB2      ARG  62  -9.540   0.602  -7.959
  505    HB3  ARG  62           HB3      ARG  62  -8.022  -0.020  -8.587
  506    HG2  ARG  62           HG2      ARG  62  -8.649   0.730 -10.835
  507    HG3  ARG  62           HG3      ARG  62 -10.158   1.374 -10.187
  508    HD2  ARG  62           HD2      ARG  62  -8.762   2.803  -8.655
  509    HD3  ARG  62           HD3      ARG  62  -7.351   2.280  -9.576
  510    HE   ARG  62           HE       ARG  62  -9.516   3.453 -11.113
  511   HH11  ARG  62          HH11      ARG  62  -6.084   5.435 -10.457
  512   HH12  ARG  62          HH12      ARG  62  -6.422   4.002  -9.543
  513   HH21  ARG  62          HH21      ARG  62  -9.050   5.328 -12.299
  514   HH22  ARG  62          HH22      ARG  62  -7.571   6.183 -12.015
  515    H    GLY  63           H        GLY  63  -8.951  -3.292  -7.959
  516    HA2  GLY  63           HA2      GLY  63  -7.881  -5.228  -8.758
  517    HA3  GLY  63           HA3      GLY  63  -7.486  -4.374 -10.237
  518    H    PHE  64           H        PHE  64  -6.814  -3.440  -6.862
  519    HA   PHE  64           HA       PHE  64  -4.032  -4.135  -7.071
  520    HB2  PHE  64           HB2      PHE  64  -3.056  -1.988  -6.923
  521    HB3  PHE  64           HB3      PHE  64  -4.174  -1.940  -8.268
  522    HD1  PHE  64           HD1      PHE  64  -5.820  -0.306  -8.370
  523    HD2  PHE  64           HD2      PHE  64  -3.810  -1.043  -4.727
  524    HE1  PHE  64           HE1      PHE  64  -6.859   1.718  -7.406
  525    HE2  PHE  64           HE2      PHE  64  -4.810   0.983  -3.738
  526    HZ   PHE  64           HZ       PHE  64  -6.352   2.365  -5.081
  527    H    GLY  65           H        GLY  65  -2.874  -4.043  -5.058
  528    HA2  GLY  65           HA2      GLY  65  -4.214  -3.175  -2.717
  529    HA3  GLY  65           HA3      GLY  65  -4.115  -4.919  -2.863
  530    H    PHE  66           H        PHE  66  -2.900  -4.468  -0.854
  531    HA   PHE  66           HA       PHE  66  -0.088  -4.332  -1.303
  532    HB2  PHE  66           HB2      PHE  66  -1.695  -3.013   0.816
  533    HB3  PHE  66           HB3      PHE  66   0.024  -3.170   0.882
  534    HD1  PHE  66           HD1      PHE  66  -2.774  -1.638  -0.891
  535    HD2  PHE  66           HD2      PHE  66   1.445  -1.680  -0.349
  536    HE1  PHE  66           HE1      PHE  66  -2.594   0.482  -2.144
  537    HE2  PHE  66           HE2      PHE  66   1.636   0.434  -1.597
  538    HZ   PHE  66           HZ       PHE  66  -0.386   1.516  -2.500
  539    H    VAL  67           H        VAL  67   1.092  -5.427   0.345
  540    HA   VAL  67           HA       VAL  67  -0.312  -7.157   2.205
  541    HB   VAL  67           HB       VAL  67   1.605  -8.269   0.116
  542   HG11  VAL  67          HG11      VAL  67   0.826  -9.316   2.768
  543   HG12  VAL  67          HG12      VAL  67   2.284  -9.609   1.816
  544   HG13  VAL  67          HG13      VAL  67   0.793 -10.472   1.436
  545   HG21  VAL  67          HG21      VAL  67  -1.271  -8.965   0.703
  546   HG22  VAL  67          HG22      VAL  67  -0.236  -9.792  -0.464
  547   HG23  VAL  67          HG23      VAL  67  -0.674  -8.099  -0.711
  548    H    THR  68           H        THR  68   0.679  -7.386   3.971
  549    HA   THR  68           HA       THR  68   3.238  -6.056   4.276
  550    HB   THR  68           HB       THR  68   1.425  -6.680   6.506
  551    HG1  THR  68           HG1      THR  68   0.465  -5.476   4.544
  552   HG21  THR  68          HG21      THR  68   2.941  -5.505   7.672
  553   HG22  THR  68          HG22      THR  68   2.738  -4.131   6.593
  554   HG23  THR  68          HG23      THR  68   3.912  -5.397   6.198
  555    H    PHE  69           H        PHE  69   4.757  -7.438   4.130
  556    HA   PHE  69           HA       PHE  69   4.607 -10.097   5.108
  557    HB2  PHE  69           HB2      PHE  69   6.622  -8.464   3.651
  558    HB3  PHE  69           HB3      PHE  69   7.105  -9.978   4.391
  559    HD1  PHE  69           HD1      PHE  69   6.038 -12.101   3.686
  560    HD2  PHE  69           HD2      PHE  69   5.304  -8.415   1.689
  561    HE1  PHE  69           HE1      PHE  69   5.110 -13.327   1.770
  562    HE2  PHE  69           HE2      PHE  69   4.381  -9.640  -0.233
  563    HZ   PHE  69           HZ       PHE  69   4.291 -12.097  -0.181
  564    H    ALA  70           H        ALA  70   5.134 -10.785   7.096
  565    HA   ALA  70           HA       ALA  70   6.157  -9.020   9.035
  566    HB1  ALA  70           HB1      ALA  70   5.680 -11.955   9.364
  567    HB2  ALA  70           HB2      ALA  70   4.429 -10.724   9.522
  568    HB3  ALA  70           HB3      ALA  70   5.784 -10.753  10.649
  569    H    ASP  71           H        ASP  71   7.782 -10.471   6.815
  570    HA   ASP  71           HA       ASP  71  10.220 -10.656   8.355
  571    HB2  ASP  71           HB2      ASP  71   9.170 -12.840   7.482
  572    HB3  ASP  71           HB3      ASP  71   9.755 -12.325   5.934
  573    HA   PRO  72           HA       PRO  72  11.575  -7.792   5.141
  574    HB2  PRO  72           HB2      PRO  72  14.279  -8.223   6.010
  575    HB3  PRO  72           HB3      PRO  72  13.308  -6.779   6.110
  576    HG2  PRO  72           HG2      PRO  72  14.038  -8.156   8.306
  577    HG3  PRO  72           HG3      PRO  72  12.513  -7.252   8.203
  578    HD2  PRO  72           HD2      PRO  72  12.988 -10.188   7.898
  579    HD3  PRO  72           HD3      PRO  72  11.664  -9.330   8.716
  580    H    ALA  73           H        ALA  73  12.618 -10.964   5.667
  581    HA   ALA  73           HA       ALA  73  14.376 -11.148   3.419
  582    HB1  ALA  73           HB1      ALA  73  14.724 -12.536   5.413
  583    HB2  ALA  73           HB2      ALA  73  14.582 -13.497   3.941
  584    HB3  ALA  73           HB3      ALA  73  13.219 -13.382   5.055
  585    H    SER  74           H        SER  74  11.052 -11.698   4.028
  586    HA   SER  74           HA       SER  74  10.495 -13.281   1.721
  587    HB2  SER  74           HB2      SER  74   9.071 -13.096   3.851
  588    HB3  SER  74           HB3      SER  74   8.443 -11.608   3.140
  589    HG   SER  74           HG       SER  74   7.708 -12.808   1.381
  590    H    VAL  75           H        VAL  75  10.620  -9.915   2.389
  591    HA   VAL  75           HA       VAL  75   9.362  -8.962   0.043
  592    HB   VAL  75           HB       VAL  75  11.426  -7.452   1.640
  593   HG11  VAL  75          HG11      VAL  75   9.012  -6.510   0.088
  594   HG12  VAL  75          HG12      VAL  75  10.700  -6.342  -0.399
  595   HG13  VAL  75          HG13      VAL  75  10.098  -5.474   1.015
  596   HG21  VAL  75          HG21      VAL  75   9.623  -6.625   3.092
  597   HG22  VAL  75          HG22      VAL  75   9.832  -8.370   3.238
  598   HG23  VAL  75          HG23      VAL  75   8.489  -7.720   2.299
  599    H    ASP  76           H        ASP  76  12.563  -9.877   0.901
  600    HA   ASP  76           HA       ASP  76  13.913  -8.875  -1.366
  601    HB2  ASP  76           HB2      ASP  76  14.738  -9.695   1.004
  602    HB3  ASP  76           HB3      ASP  76  14.906 -11.219   0.164
  603    H    LYS  77           H        LYS  77  12.539 -11.890  -0.427
  604    HA   LYS  77           HA       LYS  77  13.283 -13.455  -2.628
  605    HB2  LYS  77           HB2      LYS  77  11.092 -13.829  -0.606
  606    HB3  LYS  77           HB3      LYS  77  11.520 -15.037  -1.807
  607    HG2  LYS  77           HG2      LYS  77  13.876 -14.914  -0.813
  608    HG3  LYS  77           HG3      LYS  77  13.114 -14.079   0.540
  609    HD2  LYS  77           HD2      LYS  77  11.582 -15.989   0.827
  610    HD3  LYS  77           HD3      LYS  77  12.410 -16.828  -0.488
  611    HE2  LYS  77           HE2      LYS  77  14.508 -16.718   0.811
  612    HE3  LYS  77           HE3      LYS  77  13.620 -15.966   2.137
  613    HZ1  LYS  77           HZ1      LYS  77  12.240 -17.960   2.271
  614    HZ2  LYS  77           HZ2      LYS  77  13.873 -18.324   2.513
  615    HZ3  LYS  77           HZ3      LYS  77  13.140 -18.681   1.032
  616    H    VAL  78           H        VAL  78  10.396 -11.609  -1.937
  617    HA   VAL  78           HA       VAL  78   9.034 -12.514  -4.301
  618    HB   VAL  78           HB       VAL  78   8.217 -10.429  -2.257
  619   HG11  VAL  78          HG11      VAL  78   6.061 -10.335  -3.233
  620   HG12  VAL  78          HG12      VAL  78   6.407 -11.684  -4.314
  621   HG13  VAL  78          HG13      VAL  78   7.196 -10.128  -4.569
  622   HG21  VAL  78          HG21      VAL  78   8.322 -12.714  -1.383
  623   HG22  VAL  78          HG22      VAL  78   7.279 -13.268  -2.692
  624   HG23  VAL  78          HG23      VAL  78   6.653 -12.148  -1.483
  625    H    LEU  79           H        LEU  79  10.928  -9.690  -3.366
  626    HA   LEU  79           HA       LEU  79  10.149  -7.967  -5.468
  627    HB2  LEU  79           HB2      LEU  79  11.616  -7.754  -3.203
  628    HB3  LEU  79           HB3      LEU  79  12.883  -7.801  -4.392
  629    HG   LEU  79           HG       LEU  79  10.686  -5.760  -4.125
  630   HD11  LEU  79          HD11      LEU  79  12.511  -4.196  -3.767
  631   HD12  LEU  79          HD12      LEU  79  13.677  -5.507  -3.950
  632   HD13  LEU  79          HD13      LEU  79  12.556  -5.508  -2.590
  633   HD21  LEU  79          HD21      LEU  79  12.645  -6.120  -6.371
  634   HD22  LEU  79          HD22      LEU  79  11.890  -4.568  -6.009
  635   HD23  LEU  79          HD23      LEU  79  10.890  -5.953  -6.454
  636    H    GLY  80           H        GLY  80  12.647 -10.445  -5.132
  637    HA2  GLY  80           HA2      GLY  80  13.981  -9.895  -7.558
  638    HA3  GLY  80           HA3      GLY  80  14.160 -11.344  -6.600
  639    H    GLN  81           H        GLN  81  11.075 -11.541  -6.877
  640    HA   GLN  81           HA       GLN  81  11.105 -13.015  -9.376
  641    HB2  GLN  81           HB2      GLN  81   9.337 -12.990  -6.944
  642    HB3  GLN  81           HB3      GLN  81   8.920 -13.866  -8.396
  643    HG2  GLN  81           HG2      GLN  81  11.611 -14.349  -7.326
  644    HG3  GLN  81           HG3      GLN  81  10.272 -14.946  -6.356
  645   HE21  GLN  81          HE21      GLN  81  11.946 -15.187  -9.395
  646   HE22  GLN  81          HE22      GLN  81  11.252 -16.688  -9.894
  647    HA   PRO  82           HA       PRO  82   8.710  -9.356 -10.832
  648    HB2  PRO  82           HB2      PRO  82   9.553 -10.015 -13.516
  649    HB3  PRO  82           HB3      PRO  82  10.005  -8.619 -12.535
  650    HG2  PRO  82           HG2      PRO  82  11.757 -10.585 -13.234
  651    HG3  PRO  82           HG3      PRO  82  11.920  -9.588 -11.775
  652    HD2  PRO  82           HD2      PRO  82  10.872 -12.376 -12.046
  653    HD3  PRO  82           HD3      PRO  82  11.914 -11.669 -10.790
  654    H    HIS  83           H        HIS  83   8.740 -12.617 -12.212
  655    HA   HIS  83           HA       HIS  83   6.223 -12.207 -13.602
  656    HB2  HIS  83           HB2      HIS  83   8.262 -13.630 -14.376
  657    HB3  HIS  83           HB3      HIS  83   7.599 -14.859 -13.308
  658    HD1  HIS  83           HD1      HIS  83   5.271 -15.876 -13.988
  659    HD2  HIS  83           HD2      HIS  83   6.922 -13.276 -16.776
  660    HE1  HIS  83           HE1      HIS  83   3.962 -16.240 -16.104
  661    HE2  HIS  83           HE2      HIS  83   4.978 -14.656 -17.778
  662    H    HIS  84           H        HIS  84   4.369 -12.334 -12.564
  663    HA   HIS  84           HA       HIS  84   3.855 -14.473 -10.649
  664    HB2  HIS  84           HB2      HIS  84   4.318 -11.902  -9.810
  665    HB3  HIS  84           HB3      HIS  84   2.566 -11.920  -9.972
  666    HD1  HIS  84           HD1      HIS  84   5.327 -13.809  -8.189
  667    HD2  HIS  84           HD2      HIS  84   1.237 -13.129  -7.910
  668    HE1  HIS  84           HE1      HIS  84   4.616 -14.869  -6.022
  669    HE2  HIS  84           HE2      HIS  84   2.136 -14.445  -5.873
  670    H    GLU  85           H        GLU  85   2.058 -15.488 -11.264
  671    HA   GLU  85           HA       GLU  85   0.185 -14.134 -12.961
  672    HB2  GLU  85           HB2      GLU  85   1.632 -16.242 -13.723
  673    HB3  GLU  85           HB3      GLU  85   0.304 -17.098 -12.954
  674    HG2  GLU  85           HG2      GLU  85  -1.275 -15.881 -14.413
  675    HG3  GLU  85           HG3      GLU  85   0.099 -15.137 -15.227
  676    H    LEU  86           H        LEU  86  -1.805 -14.106 -12.467
  677    HA   LEU  86           HA       LEU  86  -3.005 -15.748 -10.420
  678    HB2  LEU  86           HB2      LEU  86  -2.404 -13.828  -9.165
  679    HB3  LEU  86           HB3      LEU  86  -2.798 -12.763 -10.484
  680    HG   LEU  86           HG       LEU  86  -5.217 -13.582 -10.109
  681   HD11  LEU  86          HD11      LEU  86  -4.822 -15.302  -8.488
  682   HD12  LEU  86          HD12      LEU  86  -5.684 -13.984  -7.693
  683   HD13  LEU  86          HD13      LEU  86  -3.950 -14.182  -7.441
  684   HD21  LEU  86          HD21      LEU  86  -3.771 -11.633  -8.331
  685   HD22  LEU  86          HD22      LEU  86  -5.528 -11.756  -8.429
  686   HD23  LEU  86          HD23      LEU  86  -4.595 -11.301  -9.853
  687    H    ASP  87           H        ASP  87  -4.904 -16.353 -11.053
  688    HA   ASP  87           HA       ASP  87  -6.644 -16.927 -12.399
  689    HB2  ASP  87           HB2      ASP  87  -7.194 -14.778 -11.214
  690    HB3  ASP  87           HB3      ASP  87  -6.930 -13.988 -12.741
  691    H    SER  88           H        SER  88  -4.220 -16.823 -13.636
  692    HA   SER  88           HA       SER  88  -3.237 -17.187 -15.662
  693    HB2  SER  88           HB2      SER  88  -5.442 -18.181 -16.335
  694    HB3  SER  88           HB3      SER  88  -5.911 -16.602 -16.965
  695    HG   SER  88           HG       SER  88  -3.478 -17.680 -17.816
  696    H    LYS  89           H        LYS  89  -3.909 -14.388 -14.452
  697    HA   LYS  89           HA       LYS  89  -2.911 -12.844 -16.726
  698    HB2  LYS  89           HB2      LYS  89  -4.050 -11.100 -14.762
  699    HB3  LYS  89           HB3      LYS  89  -4.474 -11.262 -16.453
  700    HG2  LYS  89           HG2      LYS  89  -5.604 -13.323 -14.676
  701    HG3  LYS  89           HG3      LYS  89  -6.189 -11.680 -14.408
  702    HD2  LYS  89           HD2      LYS  89  -6.682 -11.541 -16.856
  703    HD3  LYS  89           HD3      LYS  89  -6.267 -13.252 -16.982
  704    HE2  LYS  89           HE2      LYS  89  -8.053 -13.839 -15.472
  705    HE3  LYS  89           HE3      LYS  89  -8.411 -12.138 -15.180
  706    HZ1  LYS  89           HZ1      LYS  89  -9.027 -11.910 -17.510
  707    HZ2  LYS  89           HZ2      LYS  89  -9.964 -13.096 -16.751
  708    HZ3  LYS  89           HZ3      LYS  89  -8.698 -13.548 -17.778
  709    H    THR  90           H        THR  90  -1.199 -11.712 -16.408
  710    HA   THR  90           HA       THR  90   0.480 -12.158 -14.127
  711    HB   THR  90           HB       THR  90   1.096 -10.220 -16.351
  712    HG1  THR  90           HG1      THR  90   2.029 -12.208 -17.363
  713   HG21  THR  90          HG21      THR  90   2.836 -12.100 -14.740
  714   HG22  THR  90          HG22      THR  90   2.717 -10.355 -14.514
  715   HG23  THR  90          HG23      THR  90   3.399 -11.005 -16.004
  716    H    ILE  91           H        ILE  91   0.597 -10.934 -12.341
  717    HA   ILE  91           HA       ILE  91  -0.473  -8.197 -12.409
  718    HB   ILE  91           HB       ILE  91  -0.914  -8.412 -10.006
  719   HG12  ILE  91          HG12      ILE  91  -0.235 -11.304 -10.271
  720   HG13  ILE  91          HG13      ILE  91   0.792 -10.149  -9.454
  721   HG21  ILE  91          HG21      ILE  91  -2.129 -10.561 -11.714
  722   HG22  ILE  91          HG22      ILE  91  -2.649  -8.877 -11.620
  723   HG23  ILE  91          HG23      ILE  91  -2.822  -9.934 -10.220
  724   HD11  ILE  91          HD11      ILE  91  -1.971 -10.143  -8.497
  725   HD12  ILE  91          HD12      ILE  91  -0.448 -10.228  -7.590
  726   HD13  ILE  91          HD13      ILE  91  -1.147 -11.693  -8.277
  727    H    ASP  92           H        ASP  92   0.603  -6.691 -10.613
  728    HA   ASP  92           HA       ASP  92   3.500  -7.099 -11.003
  729    HB2  ASP  92           HB2      ASP  92   2.221  -5.242 -12.252
  730    HB3  ASP  92           HB3      ASP  92   2.219  -4.411 -10.705
  731    HA   PRO  93           HA       PRO  93   3.363  -6.681  -6.427
  732    HB2  PRO  93           HB2      PRO  93   5.446  -8.646  -6.225
  733    HB3  PRO  93           HB3      PRO  93   3.755  -8.817  -5.748
  734    HG2  PRO  93           HG2      PRO  93   4.915 -10.205  -7.816
  735    HG3  PRO  93           HG3      PRO  93   3.177  -9.886  -7.668
  736    HD2  PRO  93           HD2      PRO  93   5.216  -8.481  -9.344
  737    HD3  PRO  93           HD3      PRO  93   3.533  -8.908  -9.724
  738    H    LYS  94           H        LYS  94   4.473  -5.013  -5.599
  739    HA   LYS  94           HA       LYS  94   7.367  -4.838  -5.962
  740    HB2  LYS  94           HB2      LYS  94   7.257  -2.447  -6.687
  741    HB3  LYS  94           HB3      LYS  94   6.638  -3.575  -7.880
  742    HG2  LYS  94           HG2      LYS  94   4.440  -2.746  -6.296
  743    HG3  LYS  94           HG3      LYS  94   5.351  -1.300  -6.733
  744    HD2  LYS  94           HD2      LYS  94   5.236  -1.923  -9.084
  745    HD3  LYS  94           HD3      LYS  94   4.380  -3.408  -8.665
  746    HE2  LYS  94           HE2      LYS  94   2.542  -2.075  -7.737
  747    HE3  LYS  94           HE3      LYS  94   3.396  -0.597  -8.179
  748    HZ1  LYS  94           HZ1      LYS  94   2.395  -2.667 -10.059
  749    HZ2  LYS  94           HZ2      LYS  94   3.268  -1.290 -10.508
  750    HZ3  LYS  94           HZ3      LYS  94   1.731  -1.130  -9.820
  751    H    VAL  95           H        VAL  95   8.407  -3.246  -4.524
  752    HA   VAL  95           HA       VAL  95   7.057  -3.099  -1.971
  753    HB   VAL  95           HB       VAL  95   9.777  -2.062  -2.589
  754   HG11  VAL  95          HG11      VAL  95   8.542  -2.918   0.018
  755   HG12  VAL  95          HG12      VAL  95   8.859  -1.255  -0.476
  756   HG13  VAL  95          HG13      VAL  95  10.203  -2.362  -0.198
  757   HG21  VAL  95          HG21      VAL  95   9.322  -4.544  -3.109
  758   HG22  VAL  95          HG22      VAL  95   9.279  -4.742  -1.358
  759   HG23  VAL  95          HG23      VAL  95  10.739  -4.135  -2.143
  760    H    ALA  96           H        ALA  96   6.409  -1.263  -0.881
  761    HA   ALA  96           HA       ALA  96   5.553   0.921  -2.444
  762    HB1  ALA  96           HB1      ALA  96   4.577   1.779  -0.411
  763    HB2  ALA  96           HB2      ALA  96   5.514   0.630   0.544
  764    HB3  ALA  96           HB3      ALA  96   4.270   0.049  -0.564
  765    H    PHE  97           H        PHE  97   6.108   3.048  -2.449
  766    HA   PHE  97           HA       PHE  97   8.638   3.839  -1.203
  767    HB2  PHE  97           HB2      PHE  97   7.580   4.079  -3.952
  768    HB3  PHE  97           HB3      PHE  97   8.384   5.501  -3.318
  769    HD1  PHE  97           HD1      PHE  97   8.780   1.986  -4.236
  770    HD2  PHE  97           HD2      PHE  97  10.760   5.524  -2.949
  771    HE1  PHE  97           HE1      PHE  97  10.955   0.957  -4.769
  772    HE2  PHE  97           HE2      PHE  97  12.937   4.506  -3.479
  773    HZ   PHE  97           HZ       PHE  97  13.036   2.220  -4.390
  774    HA   PRO  98           HA       PRO  98   6.031   7.023   0.704
  775    HB2  PRO  98           HB2      PRO  98   8.494   8.548   1.223
  776    HB3  PRO  98           HB3      PRO  98   7.363   7.821   2.375
  777    HG2  PRO  98           HG2      PRO  98   9.789   6.788   2.057
  778    HG3  PRO  98           HG3      PRO  98   8.373   5.738   2.280
  779    HD2  PRO  98           HD2      PRO  98   9.755   6.485  -0.278
  780    HD3  PRO  98           HD3      PRO  98   9.287   4.877   0.319
  781    H    ARG  99           H        ARG  99   5.109   8.958   0.181
  782    HA   ARG  99           HA       ARG  99   6.252  10.419  -2.115
  783    HB2  ARG  99           HB2      ARG  99   3.396   9.816  -1.382
  784    HB3  ARG  99           HB3      ARG  99   3.804  11.121  -2.486
  785    HG2  ARG  99           HG2      ARG  99   4.801   9.584  -4.033
  786    HG3  ARG  99           HG3      ARG  99   4.616   8.249  -2.895
  787    HD2  ARG  99           HD2      ARG  99   2.264   9.820  -3.917
  788    HD3  ARG  99           HD3      ARG  99   2.908   8.429  -4.787
  789    HE   ARG  99           HE       ARG  99   2.483   7.607  -2.175
  790   HH11  ARG  99          HH11      ARG  99   0.491   8.756  -4.832
  791   HH12  ARG  99          HH12      ARG  99  -0.905   7.872  -4.316
  792   HH21  ARG  99          HH21      ARG  99  -0.819   6.573  -2.445
  793   HH22  ARG  99          HH22      ARG  99   0.642   6.457  -1.523
  794    H    ARG 100           H        ARG 100   4.520  10.779   0.961
  795    HA   ARG 100           HA       ARG 100   4.679  13.683   0.854
  796    HB2  ARG 100           HB2      ARG 100   3.457  11.719   2.773
  797    HB3  ARG 100           HB3      ARG 100   3.639  13.412   3.209
  798    HG2  ARG 100           HG2      ARG 100   2.407  13.052   0.596
  799    HG3  ARG 100           HG3      ARG 100   1.488  12.299   1.899
  800    HD2  ARG 100           HD2      ARG 100   1.613  14.459   3.141
  801    HD3  ARG 100           HD3      ARG 100   2.371  15.178   1.720
  802    HE   ARG 100           HE       ARG 100   0.158  14.263   0.625
  803   HH11  ARG 100          HH11      ARG 100  -1.096  16.593   3.649
  804   HH12  ARG 100          HH12      ARG 100   0.497  15.914   3.709
  805   HH21  ARG 100          HH21      ARG 100  -1.926  15.156   0.576
  806   HH22  ARG 100          HH22      ARG 100  -2.465  16.164   1.878
  807    H    ALA 101           H        ALA 101   6.301  14.832   1.650
  808    HA   ALA 101           HA       ALA 101   7.965  13.736   3.762
  809    HB1  ALA 101           HB1      ALA 101   9.869  13.936   2.594
  810    HB2  ALA 101           HB2      ALA 101   9.406  15.517   1.970
  811    HB3  ALA 101           HB3      ALA 101   8.828  14.054   1.173
  812    H    GLN 102           H        GLN 102   9.427  15.582   4.703
  813    HA   GLN 102           HA       GLN 102   7.665  17.879   5.235
  814    HB2  GLN 102           HB2      GLN 102   9.742  16.509   6.932
  815    HB3  GLN 102           HB3      GLN 102   9.157  18.121   7.317
  816    HG2  GLN 102           HG2      GLN 102   6.850  17.198   7.398
  817    HG3  GLN 102           HG3      GLN 102   7.537  15.589   7.177
  818   HE21  GLN 102          HE21      GLN 102   7.167  18.281   9.338
  819   HE22  GLN 102          HE22      GLN 102   7.706  17.473  10.767
  820    HA   PRO 103           HA       PRO 103  11.024  20.090   3.099
  821    HB2  PRO 103           HB2      PRO 103   9.609  22.219   2.288
  822    HB3  PRO 103           HB3      PRO 103   9.439  20.642   1.506
  823    HG2  PRO 103           HG2      PRO 103   7.636  21.973   3.465
  824    HG3  PRO 103           HG3      PRO 103   7.228  20.972   2.058
  825    HD2  PRO 103           HD2      PRO 103   7.268  20.083   4.688
  826    HD3  PRO 103           HD3      PRO 103   7.350  19.044   3.253
  827    H    LYS 104           H        LYS 104  11.859  22.409   3.221
  828    HA   LYS 104           HA       LYS 104  12.070  23.191   6.016
  829    HB2  LYS 104           HB2      LYS 104  13.536  24.027   3.513
  830    HB3  LYS 104           HB3      LYS 104  13.787  24.824   5.058
  831    HG2  LYS 104           HG2      LYS 104  14.566  22.753   6.040
  832    HG3  LYS 104           HG3      LYS 104  14.230  21.891   4.536
  833    HD2  LYS 104           HD2      LYS 104  15.898  23.197   3.371
  834    HD3  LYS 104           HD3      LYS 104  16.175  24.183   4.807
  835    HE2  LYS 104           HE2      LYS 104  17.010  22.239   6.004
  836    HE3  LYS 104           HE3      LYS 104  16.672  21.213   4.610
  837    HZ1  LYS 104           HZ1      LYS 104  19.017  21.856   4.763
  838    HZ2  LYS 104           HZ2      LYS 104  18.585  23.485   4.620
  839    HZ3  LYS 104           HZ3      LYS 104  18.302  22.421   3.337
  840    H    MET 105           H        MET 105  11.251  25.006   6.913
  841    HA   MET 105           HA       MET 105   9.386  26.593   5.342
  842    HB2  MET 105           HB2      MET 105   9.962  26.405   8.294
  843    HB3  MET 105           HB3      MET 105   8.888  27.627   7.626
  844    HG2  MET 105           HG2      MET 105   7.480  25.848   6.684
  845    HG3  MET 105           HG3      MET 105   8.542  24.645   7.415
  846    HE1  MET 105           HE1      MET 105   6.304  23.596   8.488
  847    HE2  MET 105           HE2      MET 105   5.314  24.901   7.835
  848    HE3  MET 105           HE3      MET 105   5.219  24.496   9.547
  849    H    VAL 106           H        VAL 106   9.463  28.798   5.054
  850    HA   VAL 106           HA       VAL 106  12.045  30.079   5.643
  851    HB   VAL 106           HB       VAL 106  10.220  30.692   3.295
  852   HG11  VAL 106          HG11      VAL 106  12.971  31.732   3.975
  853   HG12  VAL 106          HG12      VAL 106  11.468  32.653   3.943
  854   HG13  VAL 106          HG13      VAL 106  12.137  32.006   2.444
  855   HG21  VAL 106          HG21      VAL 106  12.860  29.227   3.319
  856   HG22  VAL 106          HG22      VAL 106  11.933  29.666   1.885
  857   HG23  VAL 106          HG23      VAL 106  11.276  28.503   3.037
  858    H    THR 107           H        THR 107   8.612  30.850   5.034
  859    HA   THR 107           HA       THR 107   8.764  33.336   6.371
  860    HB   THR 107           HB       THR 107   7.282  33.198   4.499
  861    HG1  THR 107           HG1      THR 107   5.756  34.368   5.419
  862   HG21  THR 107          HG21      THR 107   5.727  31.078   5.992
  863   HG22  THR 107          HG22      THR 107   6.694  30.828   4.538
  864   HG23  THR 107          HG23      THR 107   5.242  31.827   4.471
  865    H    ARG 108           H        ARG 108   9.369  33.000   8.432
  866    HA   ARG 108           HA       ARG 108   7.429  31.658  10.194
  867    HB2  ARG 108           HB2      ARG 108   9.372  31.367  11.803
  868    HB3  ARG 108           HB3      ARG 108   9.407  30.375  10.357
  869    HG2  ARG 108           HG2      ARG 108  11.015  31.994   9.356
  870    HG3  ARG 108           HG3      ARG 108  11.045  32.847  10.900
  871    HD2  ARG 108           HD2      ARG 108  11.925  30.902  12.013
  872    HD3  ARG 108           HD3      ARG 108  11.751  29.936  10.548
  873    HE   ARG 108           HE       ARG 108  13.416  32.223  10.150
  874   HH11  ARG 108          HH11      ARG 108  13.452  28.935  11.388
  875   HH12  ARG 108          HH12      ARG 108  15.151  28.732  11.120
  876   HH21  ARG 108          HH21      ARG 108  16.385  30.430  10.226
  877   HH22  ARG 108          HH22      ARG 108  15.634  31.933   9.805
  878    H    THR 109           H        THR 109   9.634  34.408   9.882
  879    HA   THR 109           HA       THR 109   8.190  35.750  12.065
  880    HB   THR 109           HB       THR 109  10.520  35.557  12.639
  881    HG1  THR 109           HG1      THR 109  10.116  38.239  11.787
  882   HG21  THR 109          HG21      THR 109  12.329  36.559  11.326
  883   HG22  THR 109          HG22      THR 109  11.182  36.993  10.059
  884   HG23  THR 109          HG23      THR 109  11.508  35.296  10.407
  885    H    LYS 110           H        LYS 110   9.466  36.217   8.792
  886    HA   LYS 110           HA       LYS 110   8.367  38.826   8.494
  887    HB2  LYS 110           HB2      LYS 110   9.783  36.924   6.670
  888    HB3  LYS 110           HB3      LYS 110   8.988  38.347   6.013
  889    HG2  LYS 110           HG2      LYS 110  10.357  39.771   7.470
  890    HG3  LYS 110           HG3      LYS 110  11.176  38.332   8.081
  891    HD2  LYS 110           HD2      LYS 110  12.085  37.849   5.920
  892    HD3  LYS 110           HD3      LYS 110  11.107  39.113   5.170
  893    HE2  LYS 110           HE2      LYS 110  12.319  40.806   6.458
  894    HE3  LYS 110           HE3      LYS 110  13.299  39.541   7.199
  895    HZ1  LYS 110           HZ1      LYS 110  14.173  38.979   5.029
  896    HZ2  LYS 110           HZ2      LYS 110  14.443  40.618   5.352
  897    HZ3  LYS 110           HZ3      LYS 110  13.206  40.157   4.295
  898    H    LYS 111           H        LYS 111   6.600  39.474   7.284
  899    HA   LYS 111           HA       LYS 111   4.499  37.557   6.995
  900    HB2  LYS 111           HB2      LYS 111   4.469  40.116   7.789
  901    HB3  LYS 111           HB3      LYS 111   4.104  40.350   6.085
  902    HG2  LYS 111           HG2      LYS 111   2.270  38.597   6.429
  903    HG3  LYS 111           HG3      LYS 111   2.522  38.868   8.155
  904    HD2  LYS 111           HD2      LYS 111   2.089  41.274   7.810
  905    HD3  LYS 111           HD3      LYS 111   1.769  40.953   6.105
  906    HE2  LYS 111           HE2      LYS 111  -0.353  41.021   7.078
  907    HE3  LYS 111           HE3      LYS 111   0.001  39.300   6.943
  908    HZ1  LYS 111           HZ1      LYS 111   0.227  40.966   9.391
  909    HZ2  LYS 111           HZ2      LYS 111   0.717  39.350   9.288
  910    HZ3  LYS 111           HZ3      LYS 111  -0.915  39.752   9.093
  Start of MODEL   10
    1    H1   MET  -3           H1       MET  -3  20.461 -15.429  23.740
    2    H2   MET  -3           H2       MET  -3  21.850 -14.653  24.314
    3    H3   MET  -3           H3       MET  -3  21.885 -15.456  22.825
    4    HA   MET  -3           HA       MET  -3  21.773 -13.068  22.534
    5    HB2  MET  -3           HB2      MET  -3  19.487 -14.800  21.652
    6    HB3  MET  -3           HB3      MET  -3  19.539 -13.103  21.192
    7    HG2  MET  -3           HG2      MET  -3  21.771 -13.493  20.192
    8    HG3  MET  -3           HG3      MET  -3  21.596 -15.207  20.560
    9    HE1  MET  -3           HE1      MET  -3  20.566 -16.884  18.901
   10    HE2  MET  -3           HE2      MET  -3  19.054 -16.517  18.071
   11    HE3  MET  -3           HE3      MET  -3  19.147 -16.399  19.828
   12    H    HIS  -2           H        HIS  -2  19.090 -14.385  24.419
   13    HA   HIS  -2           HA       HIS  -2  18.545 -11.672  25.423
   14    HB2  HIS  -2           HB2      HIS  -2  16.590 -13.736  24.458
   15    HB3  HIS  -2           HB3      HIS  -2  16.111 -12.559  25.676
   16    HD1  HIS  -2           HD1      HIS  -2  17.536 -12.613  22.153
   17    HD2  HIS  -2           HD2      HIS  -2  15.266 -10.192  24.654
   18    HE1  HIS  -2           HE1      HIS  -2  16.787 -10.684  20.724
   19    HE2  HIS  -2           HE2      HIS  -2  15.413  -9.232  22.258
   20    H    HIS  -1           H        HIS  -1  18.188 -11.467  27.575
   21    HA   HIS  -1           HA       HIS  -1  18.204 -13.912  29.209
   22    HB2  HIS  -1           HB2      HIS  -1  19.570 -12.592  30.905
   23    HB3  HIS  -1           HB3      HIS  -1  20.414 -13.104  29.452
   24    HD1  HIS  -1           HD1      HIS  -1  19.685 -10.167  31.479
   25    HD2  HIS  -1           HD2      HIS  -1  20.792 -10.911  27.543
   26    HE1  HIS  -1           HE1      HIS  -1  20.544  -7.974  30.596
   27    HE2  HIS  -1           HE2      HIS  -1  21.209  -8.447  28.213
   28    H    HIS   0           H        HIS   0  17.416 -10.451  29.134
   29    HA   HIS   0           HA       HIS   0  15.422 -10.877  31.252
   30    HB2  HIS   0           HB2      HIS   0  16.957  -8.483  30.318
   31    HB3  HIS   0           HB3      HIS   0  15.392  -8.244  31.087
   32    HD1  HIS   0           HD1      HIS   0  18.916  -8.794  31.833
   33    HD2  HIS   0           HD2      HIS   0  15.297  -9.317  33.807
   34    HE1  HIS   0           HE1      HIS   0  19.505  -9.024  34.267
   35    HE2  HIS   0           HE2      HIS   0  17.299  -9.339  35.444
   36    H    HIS   1           H        HIS   1  13.312  -9.905  31.019
   37    HA   HIS   1           HA       HIS   1  12.287 -10.190  28.316
   38    HB2  HIS   1           HB2      HIS   1  11.074 -10.111  31.045
   39    HB3  HIS   1           HB3      HIS   1  10.059  -9.753  29.652
   40    HD1  HIS   1           HD1      HIS   1  12.141 -12.539  31.120
   41    HD2  HIS   1           HD2      HIS   1   9.258 -11.940  28.188
   42    HE1  HIS   1           HE1      HIS   1  11.474 -14.840  30.352
   43    HE2  HIS   1           HE2      HIS   1   9.728 -14.453  28.578
   44    H    HIS   2           H        HIS   2  12.566  -7.662  30.776
   45    HA   HIS   2           HA       HIS   2  11.249  -5.723  29.032
   46    HB2  HIS   2           HB2      HIS   2  12.207  -5.584  31.890
   47    HB3  HIS   2           HB3      HIS   2  11.616  -4.174  31.018
   48    HD1  HIS   2           HD1      HIS   2  10.492  -7.070  32.951
   49    HD2  HIS   2           HD2      HIS   2   8.822  -4.391  30.249
   50    HE1  HIS   2           HE1      HIS   2   8.003  -7.309  33.218
   51    HE2  HIS   2           HE2      HIS   2   7.011  -5.679  31.574
   52    H    HIS   3           H        HIS   3  12.236  -4.047  28.038
   53    HA   HIS   3           HA       HIS   3  15.179  -3.931  28.194
   54    HB2  HIS   3           HB2      HIS   3  13.323  -3.422  25.865
   55    HB3  HIS   3           HB3      HIS   3  15.030  -2.995  25.847
   56    HD1  HIS   3           HD1      HIS   3  12.722  -5.939  25.743
   57    HD2  HIS   3           HD2      HIS   3  16.794  -5.141  25.531
   58    HE1  HIS   3           HE1      HIS   3  13.787  -8.079  24.959
   59    HE2  HIS   3           HE2      HIS   3  16.253  -7.572  24.836
   60    H    SER   4           H        SER   4  16.168  -2.020  28.537
   61    HA   SER   4           HA       SER   4  14.461   0.298  29.127
   62    HB2  SER   4           HB2      SER   4  17.315  -0.305  29.943
   63    HB3  SER   4           HB3      SER   4  16.415   1.141  30.401
   64    HG   SER   4           HG       SER   4  16.321  -1.364  31.453
   65    H    THR   5           H        THR   5  14.456   2.019  27.842
   66    HA   THR   5           HA       THR   5  16.555   2.265  25.799
   67    HB   THR   5           HB       THR   5  14.381   2.012  24.783
   68    HG1  THR   5           HG1      THR   5  14.631   4.739  24.387
   69   HG21  THR   5          HG21      THR   5  12.964   2.800  26.645
   70   HG22  THR   5          HG22      THR   5  12.533   3.567  25.117
   71   HG23  THR   5          HG23      THR   5  13.470   4.459  26.315
   72    H    SER   6           H        SER   6  17.749   4.084  25.568
   73    HA   SER   6           HA       SER   6  17.720   5.983  27.769
   74    HB2  SER   6           HB2      SER   6  19.849   6.802  26.720
   75    HB3  SER   6           HB3      SER   6  19.876   5.093  27.154
   76    HG   SER   6           HG       SER   6  20.558   4.965  25.142
   77    H    VAL   7           H        VAL   7  17.895   8.306  27.400
   78    HA   VAL   7           HA       VAL   7  16.115   9.178  25.239
   79    HB   VAL   7           HB       VAL   7  17.030  10.880  27.567
   80   HG11  VAL   7          HG11      VAL   7  14.573  11.039  25.816
   81   HG12  VAL   7          HG12      VAL   7  15.992  12.079  25.701
   82   HG13  VAL   7          HG13      VAL   7  14.974  12.133  27.140
   83   HG21  VAL   7          HG21      VAL   7  14.573   9.126  27.483
   84   HG22  VAL   7          HG22      VAL   7  14.988  10.273  28.758
   85   HG23  VAL   7          HG23      VAL   7  16.000   8.855  28.484
   86    H    ASP   8           H        ASP   8  19.426   9.149  26.039
   87    HA   ASP   8           HA       ASP   8  20.036  11.502  24.402
   88    HB2  ASP   8           HB2      ASP   8  21.718   9.837  26.275
   89    HB3  ASP   8           HB3      ASP   8  22.417  11.043  25.199
   90    H    LEU   9           H        LEU   9  20.977   8.067  24.660
   91    HA   LEU   9           HA       LEU   9  22.149   8.120  21.989
   92    HB2  LEU   9           HB2      LEU   9  22.038   6.051  24.178
   93    HB3  LEU   9           HB3      LEU   9  22.570   5.635  22.568
   94    HG   LEU   9           HG       LEU   9  24.466   5.954  24.050
   95   HD11  LEU   9          HD11      LEU   9  24.649   6.599  21.650
   96   HD12  LEU   9          HD12      LEU   9  25.810   7.381  22.721
   97   HD13  LEU   9          HD13      LEU   9  24.408   8.276  22.142
   98   HD21  LEU   9          HD21      LEU   9  25.024   8.120  25.024
   99   HD22  LEU   9          HD22      LEU   9  23.494   7.506  25.651
  100   HD23  LEU   9          HD23      LEU   9  23.500   8.784  24.435
  101    H    GLY  10           H        GLY  10  21.140   7.448  20.197
  102    HA2  GLY  10           HA2      GLY  10  19.083   5.428  20.288
  103    HA3  GLY  10           HA3      GLY  10  18.478   7.028  19.899
  104    H    THR  11           H        THR  11  20.973   4.685  18.909
  105    HA   THR  11           HA       THR  11  20.252   5.061  16.128
  106    HB   THR  11           HB       THR  11  21.884   6.827  16.293
  107    HG1  THR  11           HG1      THR  11  21.992   5.494  14.412
  108   HG21  THR  11          HG21      THR  11  24.211   6.467  16.969
  109   HG22  THR  11          HG22      THR  11  23.845   4.791  17.376
  110   HG23  THR  11          HG23      THR  11  23.109   6.103  18.297
  111    H    GLU  12           H        GLU  12  21.960   3.329  18.613
  112    HA   GLU  12           HA       GLU  12  22.650   1.145  16.819
  113    HB2  GLU  12           HB2      GLU  12  24.254   2.115  18.551
  114    HB3  GLU  12           HB3      GLU  12  23.258   1.319  19.760
  115    HG2  GLU  12           HG2      GLU  12  23.762  -0.838  18.814
  116    HG3  GLU  12           HG3      GLU  12  24.664  -0.085  17.500
  117    H    ASN  13           H        ASN  13  21.333   1.240  20.070
  118    HA   ASN  13           HA       ASN  13  19.882  -1.209  19.748
  119    HB2  ASN  13           HB2      ASN  13  21.056  -0.210  21.855
  120    HB3  ASN  13           HB3      ASN  13  19.549   0.655  22.072
  121   HD21  ASN  13          HD21      ASN  13  21.013  -1.390  23.521
  122   HD22  ASN  13          HD22      ASN  13  19.880  -2.632  23.782
  123    H    LEU  14           H        LEU  14  19.162   1.905  18.817
  124    HA   LEU  14           HA       LEU  14  16.350   1.933  19.511
  125    HB2  LEU  14           HB2      LEU  14  18.017   3.927  19.224
  126    HB3  LEU  14           HB3      LEU  14  17.592   3.796  17.534
  127    HG   LEU  14           HG       LEU  14  15.128   3.936  18.465
  128   HD11  LEU  14          HD11      LEU  14  14.978   5.434  20.402
  129   HD12  LEU  14          HD12      LEU  14  16.724   5.321  20.616
  130   HD13  LEU  14          HD13      LEU  14  15.716   3.888  20.819
  131   HD21  LEU  14          HD21      LEU  14  16.978   6.306  18.231
  132   HD22  LEU  14          HD22      LEU  14  15.217   6.372  18.163
  133   HD23  LEU  14          HD23      LEU  14  16.116   5.514  16.912
  134    H    TYR  15           H        TYR  15  14.632   1.972  18.035
  135    HA   TYR  15           HA       TYR  15  14.988   0.229  15.725
  136    HB2  TYR  15           HB2      TYR  15  12.573   1.260  17.216
  137    HB3  TYR  15           HB3      TYR  15  12.424   0.409  15.682
  138    HD1  TYR  15           HD1      TYR  15  12.754  -1.960  15.542
  139    HD2  TYR  15           HD2      TYR  15  13.423   0.083  19.214
  140    HE1  TYR  15           HE1      TYR  15  12.852  -4.117  16.719
  141    HE2  TYR  15           HE2      TYR  15  13.520  -2.067  20.401
  142    HH   TYR  15           HH       TYR  15  13.805  -5.036  18.802
  143    H    PHE  16           H        PHE  16  14.585   0.840  13.617
  144    HA   PHE  16           HA       PHE  16  14.204   3.687  13.134
  145    HB2  PHE  16           HB2      PHE  16  16.414   2.424  12.511
  146    HB3  PHE  16           HB3      PHE  16  15.481   1.885  11.119
  147    HD1  PHE  16           HD1      PHE  16  17.091   4.720  12.750
  148    HD2  PHE  16           HD2      PHE  16  14.755   3.470   9.419
  149    HE1  PHE  16           HE1      PHE  16  17.578   6.848  11.615
  150    HE2  PHE  16           HE2      PHE  16  15.242   5.593   8.276
  151    HZ   PHE  16           HZ       PHE  16  16.654   7.286   9.374
  152    H    GLN  17           H        GLN  17  13.446   0.454  11.863
  153    HA   GLN  17           HA       GLN  17  11.529   1.507   9.954
  154    HB2  GLN  17           HB2      GLN  17  12.428  -1.281  10.660
  155    HB3  GLN  17           HB3      GLN  17  11.105  -0.979   9.543
  156    HG2  GLN  17           HG2      GLN  17  12.634   0.323   8.121
  157    HG3  GLN  17           HG3      GLN  17  13.955  -0.064   9.223
  158   HE21  GLN  17          HE21      GLN  17  14.755  -2.164   9.296
  159   HE22  GLN  17          HE22      GLN  17  14.430  -3.314   8.049
  160    H    SER  18           H        SER  18   9.399   1.688  10.222
  161    HA   SER  18           HA       SER  18   8.036   0.209  12.350
  162    HB2  SER  18           HB2      SER  18   7.827   3.213  11.997
  163    HB3  SER  18           HB3      SER  18   6.848   2.246  13.099
  164    HG   SER  18           HG       SER  18   9.213   1.568  13.745
  165    H    ASN  19           H        ASN  19   7.744   2.324   9.520
  166    HA   ASN  19           HA       ASN  19   5.102   1.162   8.942
  167    HB2  ASN  19           HB2      ASN  19   6.345   3.786   8.125
  168    HB3  ASN  19           HB3      ASN  19   4.904   3.155   7.355
  169   HD21  ASN  19          HD21      ASN  19   3.651   4.731   7.926
  170   HD22  ASN  19          HD22      ASN  19   3.145   4.995   9.533
  171    H    ALA  20           H        ALA  20   8.350   1.489   7.761
  172    HA   ALA  20           HA       ALA  20   7.863   0.773   5.038
  173    HB1  ALA  20           HB1      ALA  20   9.829   2.046   5.647
  174    HB2  ALA  20           HB2      ALA  20  10.310   0.516   4.913
  175    HB3  ALA  20           HB3      ALA  20  10.404   0.723   6.661
  176    H    GLY  21           H        GLY  21   8.279  -1.186   3.979
  177    HA2  GLY  21           HA2      GLY  21   9.189  -3.496   4.216
  178    HA3  GLY  21           HA3      GLY  21   8.318  -3.564   5.737
  179    H    LYS  22           H        LYS  22   6.271  -1.884   3.900
  180    HA   LYS  22           HA       LYS  22   4.599  -4.155   3.327
  181    HB2  LYS  22           HB2      LYS  22   4.298  -1.197   3.295
  182    HB3  LYS  22           HB3      LYS  22   3.181  -2.147   2.325
  183    HG2  LYS  22           HG2      LYS  22   2.161  -3.065   4.137
  184    HG3  LYS  22           HG3      LYS  22   3.612  -2.943   5.142
  185    HD2  LYS  22           HD2      LYS  22   3.344  -0.531   5.283
  186    HD3  LYS  22           HD3      LYS  22   1.910  -0.620   4.255
  187    HE2  LYS  22           HE2      LYS  22   0.773  -1.966   5.954
  188    HE3  LYS  22           HE3      LYS  22   2.207  -1.892   6.976
  189    HZ1  LYS  22           HZ1      LYS  22   0.627   0.465   6.103
  190    HZ2  LYS  22           HZ2      LYS  22   1.950   0.480   7.158
  191    HZ3  LYS  22           HZ3      LYS  22   0.508  -0.273   7.622
  192    H    MET  23           H        MET  23   3.627  -4.599   1.341
  193    HA   MET  23           HA       MET  23   5.106  -3.792  -1.014
  194    HB2  MET  23           HB2      MET  23   4.135  -6.417  -0.037
  195    HB3  MET  23           HB3      MET  23   3.957  -6.105  -1.750
  196    HG2  MET  23           HG2      MET  23   6.472  -5.407  -1.594
  197    HG3  MET  23           HG3      MET  23   6.437  -6.378  -0.124
  198    HE1  MET  23           HE1      MET  23   5.835  -6.231  -3.904
  199    HE2  MET  23           HE2      MET  23   6.494  -7.780  -4.432
  200    HE3  MET  23           HE3      MET  23   7.545  -6.590  -3.661
  201    H    PHE  24           H        PHE  24   3.922  -3.580  -2.854
  202    HA   PHE  24           HA       PHE  24   1.072  -2.925  -2.576
  203    HB2  PHE  24           HB2      PHE  24   2.519  -0.942  -2.854
  204    HB3  PHE  24           HB3      PHE  24   3.183  -1.617  -4.323
  205    HD1  PHE  24           HD1      PHE  24   2.641   0.604  -5.279
  206    HD2  PHE  24           HD2      PHE  24  -0.419  -2.050  -3.962
  207    HE1  PHE  24           HE1      PHE  24   0.988   1.851  -6.599
  208    HE2  PHE  24           HE2      PHE  24  -2.064  -0.805  -5.284
  209    HZ   PHE  24           HZ       PHE  24  -1.369   1.147  -6.604
  210    H    ILE  25           H        ILE  25  -0.021  -4.526  -3.564
  211    HA   ILE  25           HA       ILE  25   1.017  -5.935  -5.857
  212    HB   ILE  25           HB       ILE  25  -1.586  -6.550  -4.663
  213   HG12  ILE  25          HG12      ILE  25  -0.153  -6.138  -2.689
  214   HG13  ILE  25          HG13      ILE  25  -0.686  -7.797  -2.795
  215   HG21  ILE  25          HG21      ILE  25  -0.963  -7.898  -6.500
  216   HG22  ILE  25          HG22      ILE  25  -0.823  -8.904  -5.058
  217   HG23  ILE  25          HG23      ILE  25   0.623  -8.222  -5.802
  218   HD11  ILE  25          HD11      ILE  25   1.483  -8.540  -3.430
  219   HD12  ILE  25          HD12      ILE  25   1.692  -7.443  -2.064
  220   HD13  ILE  25          HD13      ILE  25   2.034  -6.888  -3.703
  221    H    GLY  26           H        GLY  26   0.400  -5.415  -7.809
  222    HA2  GLY  26           HA2      GLY  26  -2.038  -3.901  -8.192
  223    HA3  GLY  26           HA3      GLY  26  -0.624  -3.635  -9.152
  224    H    GLY  27           H        GLY  27  -3.182  -4.045 -10.114
  225    HA2  GLY  27           HA2      GLY  27  -4.107  -5.048 -11.959
  226    HA3  GLY  27           HA3      GLY  27  -2.650  -6.006 -12.106
  227    H    LEU  28           H        LEU  28  -4.451  -6.216  -9.111
  228    HA   LEU  28           HA       LEU  28  -4.727  -8.969  -9.188
  229    HB2  LEU  28           HB2      LEU  28  -6.494  -7.029  -7.673
  230    HB3  LEU  28           HB3      LEU  28  -6.268  -8.721  -7.306
  231    HG   LEU  28           HG       LEU  28  -3.960  -6.789  -7.212
  232   HD11  LEU  28          HD11      LEU  28  -5.880  -7.450  -4.978
  233   HD12  LEU  28          HD12      LEU  28  -5.731  -5.890  -5.785
  234   HD13  LEU  28          HD13      LEU  28  -4.392  -6.518  -4.824
  235   HD21  LEU  28          HD21      LEU  28  -3.448  -9.191  -7.181
  236   HD22  LEU  28          HD22      LEU  28  -4.524  -9.405  -5.805
  237   HD23  LEU  28          HD23      LEU  28  -3.063  -8.435  -5.636
  238    H    SER  29           H        SER  29  -6.987 -10.106  -9.067
  239    HA   SER  29           HA       SER  29  -8.464  -9.354 -11.442
  240    HB2  SER  29           HB2      SER  29  -7.353 -11.647 -11.157
  241    HB3  SER  29           HB3      SER  29  -8.607 -11.986  -9.965
  242    HG   SER  29           HG       SER  29  -9.696 -12.584 -11.661
  243    H    TRP  30           H        TRP  30 -10.765 -10.177 -11.278
  244    HA   TRP  30           HA       TRP  30 -12.200  -8.605  -9.434
  245    HB2  TRP  30           HB2      TRP  30 -14.152  -9.443 -10.660
  246    HB3  TRP  30           HB3      TRP  30 -12.911  -8.909 -11.767
  247    HD1  TRP  30           HD1      TRP  30 -11.159 -11.411 -12.139
  248    HE1  TRP  30           HE1      TRP  30 -12.046 -13.576 -13.161
  249    HE3  TRP  30           HE3      TRP  30 -16.177 -10.710 -11.362
  250    HZ2  TRP  30           HZ2      TRP  30 -14.493 -14.821 -13.624
  251    HZ3  TRP  30           HZ3      TRP  30 -17.726 -12.457 -12.145
  252    HH2  TRP  30           HH2      TRP  30 -16.901 -14.472 -13.254
  253    H    GLN  31           H        GLN  31 -11.049 -11.780  -9.446
  254    HA   GLN  31           HA       GLN  31 -12.981 -12.817  -7.532
  255    HB2  GLN  31           HB2      GLN  31 -10.785 -14.049  -9.163
  256    HB3  GLN  31           HB3      GLN  31 -11.682 -14.955  -7.950
  257    HG2  GLN  31           HG2      GLN  31 -13.770 -14.422  -9.207
  258    HG3  GLN  31           HG3      GLN  31 -12.763 -13.698 -10.461
  259   HE21  GLN  31          HE21      GLN  31 -13.613 -16.651  -8.826
  260   HE22  GLN  31          HE22      GLN  31 -13.037 -17.731 -10.045
  261    H    THR  32           H        THR  32  -9.744 -11.686  -7.773
  262    HA   THR  32           HA       THR  32  -8.648 -12.920  -5.483
  263    HB   THR  32           HB       THR  32  -7.636 -10.348  -6.465
  264    HG1  THR  32           HG1      THR  32  -7.589 -11.085  -8.439
  265   HG21  THR  32          HG21      THR  32  -6.398 -11.496  -4.707
  266   HG22  THR  32          HG22      THR  32  -5.457 -11.474  -6.196
  267   HG23  THR  32          HG23      THR  32  -6.304 -12.941  -5.709
  268    H    SER  33           H        SER  33  -9.227 -12.626  -3.504
  269    HA   SER  33           HA       SER  33 -10.200 -10.053  -2.479
  270    HB2  SER  33           HB2      SER  33 -11.626 -12.162  -2.257
  271    HB3  SER  33           HB3      SER  33 -10.390 -12.772  -1.160
  272    HG   SER  33           HG       SER  33 -12.389 -11.422  -0.422
  273    HA   PRO  34           HA       PRO  34  -6.462  -9.392  -0.134
  274    HB2  PRO  34           HB2      PRO  34  -7.386  -9.009   2.450
  275    HB3  PRO  34           HB3      PRO  34  -7.273  -7.753   1.211
  276    HG2  PRO  34           HG2      PRO  34  -9.644  -9.374   2.026
  277    HG3  PRO  34           HG3      PRO  34  -9.549  -7.646   1.624
  278    HD2  PRO  34           HD2      PRO  34 -10.517  -9.376  -0.140
  279    HD3  PRO  34           HD3      PRO  34  -9.453  -8.055  -0.665
  280    H    ASP  35           H        ASP  35  -8.699 -11.741   0.977
  281    HA   ASP  35           HA       ASP  35  -6.862 -13.095   2.740
  282    HB2  ASP  35           HB2      ASP  35  -9.624 -13.323   2.013
  283    HB3  ASP  35           HB3      ASP  35  -8.858 -14.878   2.185
  284    H    SER  36           H        SER  36  -7.913 -13.223  -0.515
  285    HA   SER  36           HA       SER  36  -6.880 -15.772  -1.228
  286    HB2  SER  36           HB2      SER  36  -8.644 -14.525  -2.523
  287    HB3  SER  36           HB3      SER  36  -7.386 -13.420  -3.071
  288    HG   SER  36           HG       SER  36  -6.307 -15.447  -3.815
  289    H    LEU  37           H        LEU  37  -5.606 -12.385  -1.549
  290    HA   LEU  37           HA       LEU  37  -3.166 -13.337  -2.633
  291    HB2  LEU  37           HB2      LEU  37  -2.442 -10.953  -2.190
  292    HB3  LEU  37           HB3      LEU  37  -3.651 -11.275  -3.398
  293    HG   LEU  37           HG       LEU  37  -4.766 -10.726  -0.811
  294   HD11  LEU  37          HD11      LEU  37  -2.839  -9.264  -0.596
  295   HD12  LEU  37          HD12      LEU  37  -4.284  -8.297  -0.883
  296   HD13  LEU  37          HD13      LEU  37  -3.142  -8.592  -2.195
  297   HD21  LEU  37          HD21      LEU  37  -5.974  -9.024  -2.310
  298   HD22  LEU  37          HD22      LEU  37  -6.239 -10.730  -2.609
  299   HD23  LEU  37          HD23      LEU  37  -5.140  -9.810  -3.637
  300    H    ARG  38           H        ARG  38  -4.351 -12.638   0.563
  301    HA   ARG  38           HA       ARG  38  -1.895 -12.604   1.924
  302    HB2  ARG  38           HB2      ARG  38  -4.291 -11.936   2.756
  303    HB3  ARG  38           HB3      ARG  38  -4.419 -13.636   3.187
  304    HG2  ARG  38           HG2      ARG  38  -2.293 -13.335   4.519
  305    HG3  ARG  38           HG3      ARG  38  -2.476 -11.601   4.251
  306    HD2  ARG  38           HD2      ARG  38  -4.584 -13.349   5.513
  307    HD3  ARG  38           HD3      ARG  38  -3.391 -12.430   6.429
  308    HE   ARG  38           HE       ARG  38  -4.666 -10.649   4.720
  309   HH11  ARG  38          HH11      ARG  38  -5.566 -12.664   7.448
  310   HH12  ARG  38          HH12      ARG  38  -6.843 -11.607   7.952
  311   HH21  ARG  38          HH21      ARG  38  -7.273  -9.689   6.793
  312   HH22  ARG  38          HH22      ARG  38  -6.328  -9.276   5.401
  313    H    ASP  39           H        ASP  39  -4.289 -15.121   1.165
  314    HA   ASP  39           HA       ASP  39  -2.869 -17.283   2.306
  315    HB2  ASP  39           HB2      ASP  39  -5.228 -16.943   0.586
  316    HB3  ASP  39           HB3      ASP  39  -4.369 -18.462   0.348
  317    H    TYR  40           H        TYR  40  -2.848 -15.812  -0.889
  318    HA   TYR  40           HA       TYR  40  -1.287 -17.774  -2.207
  319    HB2  TYR  40           HB2      TYR  40  -2.877 -15.871  -3.119
  320    HB3  TYR  40           HB3      TYR  40  -1.384 -14.939  -3.147
  321    HD1  TYR  40           HD1      TYR  40  -2.992 -18.018  -4.430
  322    HD2  TYR  40           HD2      TYR  40   0.195 -15.242  -4.873
  323    HE1  TYR  40           HE1      TYR  40  -2.410 -19.044  -6.591
  324    HE2  TYR  40           HE2      TYR  40   0.791 -16.257  -7.031
  325    HH   TYR  40           HH       TYR  40  -1.236 -18.402  -8.676
  326    H    PHE  41           H        PHE  41  -0.540 -14.554  -0.865
  327    HA   PHE  41           HA       PHE  41   2.204 -14.592  -1.500
  328    HB2  PHE  41           HB2      PHE  41   0.377 -12.852  -0.005
  329    HB3  PHE  41           HB3      PHE  41   2.090 -12.605   0.186
  330    HD1  PHE  41           HD1      PHE  41  -0.722 -12.558  -2.168
  331    HD2  PHE  41           HD2      PHE  41   3.409 -11.677  -1.629
  332    HE1  PHE  41           HE1      PHE  41  -0.704 -11.311  -4.292
  333    HE2  PHE  41           HE2      PHE  41   3.429 -10.432  -3.741
  334    HZ   PHE  41           HZ       PHE  41   1.373 -10.250  -5.080
  335    H    SER  42           H        SER  42   0.364 -15.741   1.235
  336    HA   SER  42           HA       SER  42   2.402 -15.776   3.207
  337    HB2  SER  42           HB2      SER  42   0.985 -17.522   4.335
  338    HB3  SER  42           HB3      SER  42   0.111 -16.048   3.934
  339    HG   SER  42           HG       SER  42  -0.522 -17.216   1.960
  340    H    LYS  43           H        LYS  43   1.908 -17.372   0.449
  341    HA   LYS  43           HA       LYS  43   3.153 -19.890   0.990
  342    HB2  LYS  43           HB2      LYS  43   1.999 -18.511  -1.377
  343    HB3  LYS  43           HB3      LYS  43   3.057 -19.871  -1.637
  344    HG2  LYS  43           HG2      LYS  43   1.167 -20.606   0.350
  345    HG3  LYS  43           HG3      LYS  43   0.304 -19.882  -1.007
  346    HD2  LYS  43           HD2      LYS  43   1.371 -21.423  -2.546
  347    HD3  LYS  43           HD3      LYS  43   2.327 -22.110  -1.232
  348    HE2  LYS  43           HE2      LYS  43   0.338 -22.950  -0.163
  349    HE3  LYS  43           HE3      LYS  43  -0.685 -22.149  -1.355
  350    HZ1  LYS  43           HZ1      LYS  43  -0.384 -24.537  -1.787
  351    HZ2  LYS  43           HZ2      LYS  43   1.277 -24.287  -1.987
  352    HZ3  LYS  43           HZ3      LYS  43   0.181 -23.576  -3.061
  353    H    PHE  44           H        PHE  44   4.253 -16.769   0.329
  354    HA   PHE  44           HA       PHE  44   6.830 -17.647  -0.768
  355    HB2  PHE  44           HB2      PHE  44   5.201 -15.321  -1.093
  356    HB3  PHE  44           HB3      PHE  44   6.809 -14.869  -0.558
  357    HD1  PHE  44           HD1      PHE  44   4.785 -16.037  -3.285
  358    HD2  PHE  44           HD2      PHE  44   8.787 -15.593  -1.905
  359    HE1  PHE  44           HE1      PHE  44   5.605 -16.330  -5.584
  360    HE2  PHE  44           HE2      PHE  44   9.616 -15.887  -4.200
  361    HZ   PHE  44           HZ       PHE  44   8.017 -16.259  -6.046
  362    H    GLY  45           H        GLY  45   5.313 -16.053   1.925
  363    HA2  GLY  45           HA2      GLY  45   7.362 -16.674   3.748
  364    HA3  GLY  45           HA3      GLY  45   7.335 -14.960   3.358
  365    H    GLU  46           H        GLU  46   6.738 -14.691   5.595
  366    HA   GLU  46           HA       GLU  46   4.036 -15.394   6.224
  367    HB2  GLU  46           HB2      GLU  46   5.898 -15.973   7.847
  368    HB3  GLU  46           HB3      GLU  46   6.007 -14.245   8.171
  369    HG2  GLU  46           HG2      GLU  46   3.765 -14.169   8.966
  370    HG3  GLU  46           HG3      GLU  46   3.458 -15.815   8.433
  371    H    ILE  47           H        ILE  47   2.576 -14.021   6.426
  372    HA   ILE  47           HA       ILE  47   3.091 -11.198   5.926
  373    HB   ILE  47           HB       ILE  47   0.592 -12.728   5.474
  374   HG12  ILE  47          HG12      ILE  47   1.830 -11.310   3.291
  375   HG13  ILE  47          HG13      ILE  47   2.842 -12.563   3.977
  376   HG21  ILE  47          HG21      ILE  47  -0.228 -10.652   4.343
  377   HG22  ILE  47          HG22      ILE  47   1.137  -9.811   5.082
  378   HG23  ILE  47          HG23      ILE  47  -0.107 -10.537   6.099
  379   HD11  ILE  47          HD11      ILE  47   1.766 -13.851   2.406
  380   HD12  ILE  47          HD12      ILE  47   0.376 -12.762   2.355
  381   HD13  ILE  47          HD13      ILE  47   0.528 -13.924   3.664
  382    H    ARG  48           H        ARG  48   2.498  -9.647   7.222
  383    HA   ARG  48           HA       ARG  48   1.596 -10.287   9.909
  384    HB2  ARG  48           HB2      ARG  48   3.524  -8.671   8.962
  385    HB3  ARG  48           HB3      ARG  48   2.207  -7.528   9.013
  386    HG2  ARG  48           HG2      ARG  48   1.985  -7.675  11.316
  387    HG3  ARG  48           HG3      ARG  48   2.890  -9.185  11.404
  388    HD2  ARG  48           HD2      ARG  48   4.903  -7.894  10.609
  389    HD3  ARG  48           HD3      ARG  48   3.957  -6.424  10.841
  390    HE   ARG  48           HE       ARG  48   3.748  -7.588  13.239
  391   HH11  ARG  48          HH11      ARG  48   7.648  -6.867  12.601
  392   HH12  ARG  48          HH12      ARG  48   6.579  -7.002  11.244
  393   HH21  ARG  48          HH21      ARG  48   6.848  -7.099  14.723
  394   HH22  ARG  48          HH22      ARG  48   5.167  -7.413  14.998
  395    H    GLU  49           H        GLU  49   0.684  -8.387   7.099
  396    HA   GLU  49           HA       GLU  49  -2.082  -8.290   7.848
  397    HB2  GLU  49           HB2      GLU  49  -0.728  -6.254   8.915
  398    HB3  GLU  49           HB3      GLU  49  -0.912  -5.593   7.298
  399    HG2  GLU  49           HG2      GLU  49  -3.328  -5.783   7.474
  400    HG3  GLU  49           HG3      GLU  49  -3.168  -6.510   9.073
  401    H    CYS  50           H        CYS  50  -3.366  -7.440   6.122
  402    HA   CYS  50           HA       CYS  50  -2.184  -7.023   3.568
  403    HB2  CYS  50           HB2      CYS  50  -2.430  -9.366   3.408
  404    HB3  CYS  50           HB3      CYS  50  -4.010  -9.328   4.176
  405    HG   CYS  50           HG       CYS  50  -5.351  -9.290   1.994
  406    H    MET  51           H        MET  51  -3.547  -6.060   2.101
  407    HA   MET  51           HA       MET  51  -6.168  -5.173   2.851
  408    HB2  MET  51           HB2      MET  51  -4.775  -3.597   4.018
  409    HB3  MET  51           HB3      MET  51  -3.932  -3.255   2.539
  410    HG2  MET  51           HG2      MET  51  -5.946  -2.278   1.583
  411    HG3  MET  51           HG3      MET  51  -6.809  -2.614   3.085
  412    HE1  MET  51           HE1      MET  51  -6.153   0.195   1.339
  413    HE2  MET  51           HE2      MET  51  -6.050   1.362   2.659
  414    HE3  MET  51           HE3      MET  51  -7.353   0.173   2.631
  415    H    VAL  52           H        VAL  52  -7.409  -4.914   1.216
  416    HA   VAL  52           HA       VAL  52  -6.396  -4.250  -1.445
  417    HB   VAL  52           HB       VAL  52  -8.653  -6.091  -0.850
  418   HG11  VAL  52          HG11      VAL  52  -9.106  -4.913  -2.910
  419   HG12  VAL  52          HG12      VAL  52  -8.672  -6.590  -3.269
  420   HG13  VAL  52          HG13      VAL  52  -7.488  -5.296  -3.500
  421   HG21  VAL  52          HG21      VAL  52  -7.338  -7.893  -1.436
  422   HG22  VAL  52          HG22      VAL  52  -6.245  -6.879  -0.490
  423   HG23  VAL  52          HG23      VAL  52  -6.155  -6.868  -2.251
  424    H    MET  53           H        MET  53  -7.215  -2.501  -2.196
  425    HA   MET  53           HA       MET  53  -9.003  -0.881  -0.689
  426    HB2  MET  53           HB2      MET  53  -7.396  -0.539  -3.158
  427    HB3  MET  53           HB3      MET  53  -8.742   0.564  -2.924
  428    HG2  MET  53           HG2      MET  53  -7.695   0.874  -0.545
  429    HG3  MET  53           HG3      MET  53  -6.244   0.251  -1.324
  430    HE1  MET  53           HE1      MET  53  -9.184   2.775  -2.271
  431    HE2  MET  53           HE2      MET  53  -8.294   4.290  -2.112
  432    HE3  MET  53           HE3      MET  53  -8.532   3.254  -0.704
  433    H    ARG  54           H        ARG  54 -11.068  -1.018  -0.631
  434    HA   ARG  54           HA       ARG  54 -12.630  -1.317  -3.096
  435    HB2  ARG  54           HB2      ARG  54 -12.727  -3.045  -0.666
  436    HB3  ARG  54           HB3      ARG  54 -14.253  -2.650  -1.448
  437    HG2  ARG  54           HG2      ARG  54 -13.275  -3.509  -3.586
  438    HG3  ARG  54           HG3      ARG  54 -11.893  -4.077  -2.649
  439    HD2  ARG  54           HD2      ARG  54 -14.728  -4.858  -2.011
  440    HD3  ARG  54           HD3      ARG  54 -13.720  -5.773  -3.130
  441    HE   ARG  54           HE       ARG  54 -12.157  -5.703  -0.973
  442   HH11  ARG  54          HH11      ARG  54 -15.561  -7.534   0.124
  443   HH12  ARG  54          HH12      ARG  54 -15.576  -6.463  -1.237
  444   HH21  ARG  54          HH21      ARG  54 -12.160  -7.113   0.803
  445   HH22  ARG  54          HH22      ARG  54 -13.628  -7.902   1.277
  446    H    ASP  55           H        ASP  55 -14.814  -0.438  -2.909
  447    HA   ASP  55           HA       ASP  55 -14.937   1.781  -1.106
  448    HB2  ASP  55           HB2      ASP  55 -16.031   1.155  -3.718
  449    HB3  ASP  55           HB3      ASP  55 -17.073   2.102  -2.690
  450    HA   PRO  56           HA       PRO  56 -17.724  -0.681   1.538
  451    HB2  PRO  56           HB2      PRO  56 -18.177   2.001   2.743
  452    HB3  PRO  56           HB3      PRO  56 -17.757   0.469   3.524
  453    HG2  PRO  56           HG2      PRO  56 -15.930   2.367   3.242
  454    HG3  PRO  56           HG3      PRO  56 -15.509   0.657   3.021
  455    HD2  PRO  56           HD2      PRO  56 -15.931   2.773   0.959
  456    HD3  PRO  56           HD3      PRO  56 -14.762   1.437   0.988
  457    H    THR  57           H        THR  57 -18.576   1.846  -0.610
  458    HA   THR  57           HA       THR  57 -21.333   2.031   0.128
  459    HB   THR  57           HB       THR  57 -21.534   3.324  -2.055
  460    HG1  THR  57           HG1      THR  57 -18.820   3.763  -2.100
  461   HG21  THR  57          HG21      THR  57 -19.533   4.326  -0.028
  462   HG22  THR  57          HG22      THR  57 -21.286   4.398   0.152
  463   HG23  THR  57          HG23      THR  57 -20.492   5.315  -1.130
  464    H    THR  58           H        THR  58 -19.537   0.561  -2.557
  465    HA   THR  58           HA       THR  58 -21.891  -1.113  -3.147
  466    HB   THR  58           HB       THR  58 -21.331  -1.054  -5.536
  467    HG1  THR  58           HG1      THR  58 -19.268   0.708  -4.670
  468   HG21  THR  58          HG21      THR  58 -21.662   1.641  -4.230
  469   HG22  THR  58          HG22      THR  58 -22.941   0.568  -4.807
  470   HG23  THR  58          HG23      THR  58 -21.866   1.358  -5.961
  471    H    LYS  59           H        LYS  59 -18.719  -1.071  -2.178
  472    HA   LYS  59           HA       LYS  59 -17.024  -2.519  -1.966
  473    HB2  LYS  59           HB2      LYS  59 -19.387  -4.361  -1.960
  474    HB3  LYS  59           HB3      LYS  59 -17.748  -4.998  -1.796
  475    HG2  LYS  59           HG2      LYS  59 -17.729  -4.430   0.352
  476    HG3  LYS  59           HG3      LYS  59 -18.001  -2.745  -0.105
  477    HD2  LYS  59           HD2      LYS  59 -20.445  -3.253  -0.216
  478    HD3  LYS  59           HD3      LYS  59 -20.090  -4.844   0.466
  479    HE2  LYS  59           HE2      LYS  59 -19.008  -3.675   2.398
  480    HE3  LYS  59           HE3      LYS  59 -19.605  -2.155   1.736
  481    HZ1  LYS  59           HZ1      LYS  59 -21.872  -3.066   1.908
  482    HZ2  LYS  59           HZ2      LYS  59 -21.107  -2.938   3.411
  483    HZ3  LYS  59           HZ3      LYS  59 -21.249  -4.447   2.661
  484    H    ARG  60           H        ARG  60 -16.898  -1.511  -4.189
  485    HA   ARG  60           HA       ARG  60 -16.547  -3.520  -6.293
  486    HB2  ARG  60           HB2      ARG  60 -16.260  -1.594  -7.808
  487    HB3  ARG  60           HB3      ARG  60 -17.777  -1.529  -6.930
  488    HG2  ARG  60           HG2      ARG  60 -17.232   0.385  -5.855
  489    HG3  ARG  60           HG3      ARG  60 -15.531  -0.056  -5.708
  490    HD2  ARG  60           HD2      ARG  60 -15.190   0.473  -8.072
  491    HD3  ARG  60           HD3      ARG  60 -16.891   0.915  -8.219
  492    HE   ARG  60           HE       ARG  60 -16.063   2.528  -6.242
  493   HH11  ARG  60          HH11      ARG  60 -13.983   3.477  -9.545
  494   HH12  ARG  60          HH12      ARG  60 -14.680   1.897  -9.408
  495   HH21  ARG  60          HH21      ARG  60 -15.142   4.589  -6.442
  496   HH22  ARG  60          HH22      ARG  60 -14.245   4.999  -7.866
  497    H    SER  61           H        SER  61 -14.608  -4.262  -6.882
  498    HA   SER  61           HA       SER  61 -12.215  -3.164  -5.593
  499    HB2  SER  61           HB2      SER  61 -12.755  -5.626  -5.455
  500    HB3  SER  61           HB3      SER  61 -12.462  -5.723  -7.190
  501    HG   SER  61           HG       SER  61 -10.332  -4.821  -6.688
  502    H    ARG  62           H        ARG  62 -10.536  -2.271  -6.706
  503    HA   ARG  62           HA       ARG  62 -10.977  -1.725  -9.541
  504    HB2  ARG  62           HB2      ARG  62  -9.388  -0.412  -7.385
  505    HB3  ARG  62           HB3      ARG  62  -8.871  -0.200  -9.054
  506    HG2  ARG  62           HG2      ARG  62 -11.170   0.599  -9.593
  507    HG3  ARG  62           HG3      ARG  62 -11.535   0.540  -7.868
  508    HD2  ARG  62           HD2      ARG  62 -10.017   2.254  -7.373
  509    HD3  ARG  62           HD3      ARG  62  -9.193   2.091  -8.923
  510    HE   ARG  62           HE       ARG  62 -11.401   2.924  -9.880
  511   HH11  ARG  62          HH11      ARG  62 -11.052   5.449  -6.778
  512   HH12  ARG  62          HH12      ARG  62 -10.218   3.931  -6.728
  513   HH21  ARG  62          HH21      ARG  62 -12.479   4.910  -9.920
  514   HH22  ARG  62          HH22      ARG  62 -12.330   6.002  -8.583
  515    H    GLY  63           H        GLY  63  -9.225  -3.857  -7.647
  516    HA2  GLY  63           HA2      GLY  63  -7.956  -5.635  -8.498
  517    HA3  GLY  63           HA3      GLY  63  -7.669  -4.710  -9.958
  518    H    PHE  64           H        PHE  64  -7.082  -3.731  -6.580
  519    HA   PHE  64           HA       PHE  64  -4.245  -4.125  -6.791
  520    HB2  PHE  64           HB2      PHE  64  -3.481  -1.896  -6.749
  521    HB3  PHE  64           HB3      PHE  64  -4.658  -1.976  -8.047
  522    HD1  PHE  64           HD1      PHE  64  -6.526  -0.562  -8.058
  523    HD2  PHE  64           HD2      PHE  64  -4.145  -0.921  -4.581
  524    HE1  PHE  64           HE1      PHE  64  -7.693   1.382  -7.079
  525    HE2  PHE  64           HE2      PHE  64  -5.286   1.025  -3.574
  526    HZ   PHE  64           HZ       PHE  64  -7.070   2.177  -4.828
  527    H    GLY  65           H        GLY  65  -3.115  -3.941  -4.819
  528    HA2  GLY  65           HA2      GLY  65  -4.382  -3.019  -2.473
  529    HA3  GLY  65           HA3      GLY  65  -4.299  -4.770  -2.554
  530    H    PHE  66           H        PHE  66  -2.989  -4.245  -0.610
  531    HA   PHE  66           HA       PHE  66  -0.199  -4.125  -1.193
  532    HB2  PHE  66           HB2      PHE  66  -1.725  -2.784   0.973
  533    HB3  PHE  66           HB3      PHE  66  -0.004  -2.950   0.994
  534    HD1  PHE  66           HD1      PHE  66   1.384  -1.441  -0.226
  535    HD2  PHE  66           HD2      PHE  66  -2.837  -1.449  -0.789
  536    HE1  PHE  66           HE1      PHE  66   1.556   0.658  -1.504
  537    HE2  PHE  66           HE2      PHE  66  -2.670   0.647  -2.078
  538    HZ   PHE  66           HZ       PHE  66  -0.472   1.700  -2.437
  539    H    VAL  67           H        VAL  67   1.052  -5.069   0.614
  540    HA   VAL  67           HA       VAL  67  -0.276  -6.903   2.389
  541    HB   VAL  67           HB       VAL  67   1.594  -7.996   0.243
  542   HG11  VAL  67          HG11      VAL  67   2.298  -9.371   1.903
  543   HG12  VAL  67          HG12      VAL  67   0.782 -10.210   1.566
  544   HG13  VAL  67          HG13      VAL  67   0.878  -9.061   2.902
  545   HG21  VAL  67          HG21      VAL  67  -0.777  -7.762  -0.441
  546   HG22  VAL  67          HG22      VAL  67  -1.229  -8.819   0.897
  547   HG23  VAL  67          HG23      VAL  67  -0.223  -9.438  -0.413
  548    H    THR  68           H        THR  68   0.739  -7.163   4.115
  549    HA   THR  68           HA       THR  68   3.318  -5.867   4.411
  550    HB   THR  68           HB       THR  68   1.518  -6.532   6.645
  551    HG1  THR  68           HG1      THR  68   0.556  -5.260   4.731
  552   HG21  THR  68          HG21      THR  68   3.049  -5.407   7.832
  553   HG22  THR  68          HG22      THR  68   2.867  -4.006   6.782
  554   HG23  THR  68          HG23      THR  68   4.018  -5.286   6.355
  555    H    PHE  69           H        PHE  69   4.813  -7.307   4.190
  556    HA   PHE  69           HA       PHE  69   4.588  -9.958   5.186
  557    HB2  PHE  69           HB2      PHE  69   6.579  -8.431   3.612
  558    HB3  PHE  69           HB3      PHE  69   7.093  -9.901   4.420
  559    HD1  PHE  69           HD1      PHE  69   5.986 -12.060   3.885
  560    HD2  PHE  69           HD2      PHE  69   5.218  -8.493   1.697
  561    HE1  PHE  69           HE1      PHE  69   5.008 -13.396   2.070
  562    HE2  PHE  69           HE2      PHE  69   4.247  -9.831  -0.137
  563    HZ   PHE  69           HZ       PHE  69   4.152 -12.288   0.063
  564    H    ALA  70           H        ALA  70   5.106 -10.623   7.168
  565    HA   ALA  70           HA       ALA  70   6.304  -8.908   9.052
  566    HB1  ALA  70           HB1      ALA  70   5.628 -11.802   9.415
  567    HB2  ALA  70           HB2      ALA  70   4.492 -10.476   9.642
  568    HB3  ALA  70           HB3      ALA  70   5.896 -10.621  10.695
  569    H    ASP  71           H        ASP  71   7.755 -10.519   6.807
  570    HA   ASP  71           HA       ASP  71  10.202 -10.902   8.302
  571    HB2  ASP  71           HB2      ASP  71   8.970 -12.984   7.445
  572    HB3  ASP  71           HB3      ASP  71   9.537 -12.504   5.878
  573    HA   PRO  72           HA       PRO  72  11.791  -8.134   5.107
  574    HB2  PRO  72           HB2      PRO  72  14.437  -8.770   6.028
  575    HB3  PRO  72           HB3      PRO  72  13.577  -7.256   6.113
  576    HG2  PRO  72           HG2      PRO  72  14.165  -8.693   8.317
  577    HG3  PRO  72           HG3      PRO  72  12.725  -7.662   8.194
  578    HD2  PRO  72           HD2      PRO  72  12.949 -10.627   7.906
  579    HD3  PRO  72           HD3      PRO  72  11.687  -9.651   8.690
  580    H    ALA  73           H        ALA  73  12.563 -11.371   5.676
  581    HA   ALA  73           HA       ALA  73  14.350 -11.734   3.477
  582    HB1  ALA  73           HB1      ALA  73  12.959 -13.804   5.147
  583    HB2  ALA  73           HB2      ALA  73  14.554 -13.124   5.467
  584    HB3  ALA  73           HB3      ALA  73  14.287 -14.104   4.025
  585    H    SER  74           H        SER  74  10.972 -11.983   4.003
  586    HA   SER  74           HA       SER  74  10.340 -13.532   1.691
  587    HB2  SER  74           HB2      SER  74   8.882 -13.208   3.774
  588    HB3  SER  74           HB3      SER  74   8.412 -11.670   3.046
  589    HG   SER  74           HG       SER  74   8.139 -14.236   1.860
  590    H    VAL  75           H        VAL  75  10.736 -10.172   2.335
  591    HA   VAL  75           HA       VAL  75   9.631  -9.176  -0.065
  592    HB   VAL  75           HB       VAL  75  11.770  -7.792   1.549
  593   HG11  VAL  75          HG11      VAL  75   9.507  -6.700  -0.129
  594   HG12  VAL  75          HG12      VAL  75  11.224  -6.671  -0.529
  595   HG13  VAL  75          HG13      VAL  75  10.618  -5.722   0.830
  596   HG21  VAL  75          HG21      VAL  75   8.806  -7.774   2.128
  597   HG22  VAL  75          HG22      VAL  75  10.012  -6.761   2.921
  598   HG23  VAL  75          HG23      VAL  75  10.057  -8.513   3.126
  599    H    ASP  76           H        ASP  76  12.704 -10.339   0.922
  600    HA   ASP  76           HA       ASP  76  14.238  -9.538  -1.304
  601    HB2  ASP  76           HB2      ASP  76  14.889 -10.391   1.104
  602    HB3  ASP  76           HB3      ASP  76  14.902 -11.948   0.309
  603    H    LYS  77           H        LYS  77  12.556 -12.408  -0.368
  604    HA   LYS  77           HA       LYS  77  13.191 -14.063  -2.527
  605    HB2  LYS  77           HB2      LYS  77  10.879 -14.145  -0.608
  606    HB3  LYS  77           HB3      LYS  77  11.178 -15.398  -1.804
  607    HG2  LYS  77           HG2      LYS  77  13.512 -15.565  -0.715
  608    HG3  LYS  77           HG3      LYS  77  12.771 -14.695   0.629
  609    HD2  LYS  77           HD2      LYS  77  11.048 -16.432   0.799
  610    HD3  LYS  77           HD3      LYS  77  11.797 -17.303  -0.541
  611    HE2  LYS  77           HE2      LYS  77  13.223 -16.651   2.033
  612    HE3  LYS  77           HE3      LYS  77  12.358 -18.161   1.755
  613    HZ1  LYS  77           HZ1      LYS  77  14.736 -18.370   1.318
  614    HZ2  LYS  77           HZ2      LYS  77  14.639 -17.173   0.127
  615    HZ3  LYS  77           HZ3      LYS  77  13.831 -18.643  -0.085
  616    H    VAL  78           H        VAL  78  10.518 -11.877  -1.993
  617    HA   VAL  78           HA       VAL  78   9.158 -12.562  -4.416
  618    HB   VAL  78           HB       VAL  78   8.673 -10.260  -2.504
  619   HG11  VAL  78          HG11      VAL  78   6.500  -9.978  -3.584
  620   HG12  VAL  78          HG12      VAL  78   6.908 -11.227  -4.760
  621   HG13  VAL  78          HG13      VAL  78   7.807  -9.709  -4.738
  622   HG21  VAL  78          HG21      VAL  78   8.276 -12.465  -1.524
  623   HG22  VAL  78          HG22      VAL  78   7.212 -12.877  -2.868
  624   HG23  VAL  78          HG23      VAL  78   6.761 -11.590  -1.750
  625    H    LEU  79           H        LEU  79  11.477 -10.099  -3.430
  626    HA   LEU  79           HA       LEU  79  11.271  -8.305  -5.547
  627    HB2  LEU  79           HB2      LEU  79  12.573  -8.484  -3.223
  628    HB3  LEU  79           HB3      LEU  79  13.874  -8.934  -4.288
  629    HG   LEU  79           HG       LEU  79  13.850  -6.579  -3.590
  630   HD11  LEU  79          HD11      LEU  79  15.060  -7.221  -5.584
  631   HD12  LEU  79          HD12      LEU  79  14.345  -5.622  -5.796
  632   HD13  LEU  79          HD13      LEU  79  13.600  -7.029  -6.554
  633   HD21  LEU  79          HD21      LEU  79  11.634  -6.006  -5.499
  634   HD22  LEU  79          HD22      LEU  79  12.254  -5.026  -4.170
  635   HD23  LEU  79          HD23      LEU  79  11.267  -6.448  -3.832
  636    H    GLY  80           H        GLY  80  13.067 -11.332  -5.201
  637    HA2  GLY  80           HA2      GLY  80  14.542 -11.053  -7.611
  638    HA3  GLY  80           HA3      GLY  80  14.449 -12.493  -6.627
  639    H    GLN  81           H        GLN  81  11.382 -12.084  -6.920
  640    HA   GLN  81           HA       GLN  81  11.117 -13.613  -9.371
  641    HB2  GLN  81           HB2      GLN  81   9.397 -13.157  -6.947
  642    HB3  GLN  81           HB3      GLN  81   8.799 -13.966  -8.374
  643    HG2  GLN  81           HG2      GLN  81  11.338 -14.961  -7.271
  644    HG3  GLN  81           HG3      GLN  81   9.894 -15.257  -6.312
  645   HE21  GLN  81          HE21      GLN  81  11.508 -15.884  -9.330
  646   HE22  GLN  81          HE22      GLN  81  10.535 -17.230  -9.805
  647    HA   PRO  82           HA       PRO  82   9.522  -9.598 -10.954
  648    HB2  PRO  82           HB2      PRO  82  10.130 -10.502 -13.623
  649    HB3  PRO  82           HB3      PRO  82  10.919  -9.226 -12.692
  650    HG2  PRO  82           HG2      PRO  82  12.135 -11.578 -13.370
  651    HG3  PRO  82           HG3      PRO  82  12.588 -10.590 -11.970
  652    HD2  PRO  82           HD2      PRO  82  10.927 -13.070 -12.069
  653    HD3  PRO  82           HD3      PRO  82  12.136 -12.560 -10.872
  654    H    HIS  83           H        HIS  83   8.847 -12.806 -12.333
  655    HA   HIS  83           HA       HIS  83   6.380 -11.867 -13.556
  656    HB2  HIS  83           HB2      HIS  83   8.109 -13.599 -14.495
  657    HB3  HIS  83           HB3      HIS  83   7.229 -14.735 -13.483
  658    HD1  HIS  83           HD1      HIS  83   4.804 -15.325 -14.202
  659    HD2  HIS  83           HD2      HIS  83   6.740 -12.677 -16.753
  660    HE1  HIS  83           HE1      HIS  83   3.371 -15.209 -16.265
  661    HE2  HIS  83           HE2      HIS  83   4.561 -13.601 -17.797
  662    H    HIS  84           H        HIS  84   4.444 -12.011 -12.653
  663    HA   HIS  84           HA       HIS  84   3.890 -13.983 -10.565
  664    HB2  HIS  84           HB2      HIS  84   4.347 -11.345  -9.968
  665    HB3  HIS  84           HB3      HIS  84   2.598 -11.374 -10.160
  666    HD1  HIS  84           HD1      HIS  84   1.288 -13.050  -8.556
  667    HD2  HIS  84           HD2      HIS  84   5.285 -12.413  -7.617
  668    HE1  HIS  84           HE1      HIS  84   1.572 -13.905  -6.209
  669    HE2  HIS  84           HE2      HIS  84   3.999 -13.510  -5.661
  670    H    GLU  85           H        GLU  85   2.162 -15.094 -11.202
  671    HA   GLU  85           HA       GLU  85   0.266 -13.865 -12.969
  672    HB2  GLU  85           HB2      GLU  85   1.788 -15.929 -13.660
  673    HB3  GLU  85           HB3      GLU  85   0.521 -16.825 -12.832
  674    HG2  GLU  85           HG2      GLU  85  -1.147 -15.843 -14.319
  675    HG3  GLU  85           HG3      GLU  85   0.123 -14.942 -15.147
  676    H    LEU  86           H        LEU  86  -1.724 -13.872 -12.479
  677    HA   LEU  86           HA       LEU  86  -2.910 -15.507 -10.435
  678    HB2  LEU  86           HB2      LEU  86  -2.329 -13.545  -9.191
  679    HB3  LEU  86           HB3      LEU  86  -2.813 -12.501 -10.503
  680    HG   LEU  86           HG       LEU  86  -5.158 -13.553 -10.076
  681   HD11  LEU  86          HD11      LEU  86  -5.555 -13.907  -7.657
  682   HD12  LEU  86          HD12      LEU  86  -3.811 -13.858  -7.396
  683   HD13  LEU  86          HD13      LEU  86  -4.521 -15.138  -8.380
  684   HD21  LEU  86          HD21      LEU  86  -4.752 -11.211  -9.960
  685   HD22  LEU  86          HD22      LEU  86  -3.887 -11.378  -8.433
  686   HD23  LEU  86          HD23      LEU  86  -5.624 -11.675  -8.500
  687    H    ASP  87           H        ASP  87  -4.894 -16.029 -11.006
  688    HA   ASP  87           HA       ASP  87  -6.664 -16.554 -12.320
  689    HB2  ASP  87           HB2      ASP  87  -7.095 -14.302 -11.323
  690    HB3  ASP  87           HB3      ASP  87  -6.697 -13.631 -12.878
  691    H    SER  88           H        SER  88  -4.219 -16.744 -13.483
  692    HA   SER  88           HA       SER  88  -3.215 -17.348 -15.434
  693    HB2  SER  88           HB2      SER  88  -5.914 -16.797 -16.696
  694    HB3  SER  88           HB3      SER  88  -4.557 -17.572 -17.513
  695    HG   SER  88           HG       SER  88  -5.334 -18.650 -15.071
  696    H    LYS  89           H        LYS  89  -3.743 -14.363 -14.554
  697    HA   LYS  89           HA       LYS  89  -2.512 -13.228 -16.936
  698    HB2  LYS  89           HB2      LYS  89  -3.603 -11.001 -16.043
  699    HB3  LYS  89           HB3      LYS  89  -4.462 -12.063 -17.132
  700    HG2  LYS  89           HG2      LYS  89  -5.713 -12.993 -15.247
  701    HG3  LYS  89           HG3      LYS  89  -4.822 -11.944 -14.140
  702    HD2  LYS  89           HD2      LYS  89  -5.808 -10.000 -15.015
  703    HD3  LYS  89           HD3      LYS  89  -6.375 -10.837 -16.460
  704    HE2  LYS  89           HE2      LYS  89  -7.362 -11.534 -13.708
  705    HE3  LYS  89           HE3      LYS  89  -8.111 -10.272 -14.683
  706    HZ1  LYS  89           HZ1      LYS  89  -8.527 -11.916 -16.414
  707    HZ2  LYS  89           HZ2      LYS  89  -9.255 -12.372 -14.957
  708    HZ3  LYS  89           HZ3      LYS  89  -7.827 -13.125 -15.459
  709    H    THR  90           H        THR  90  -1.146 -11.578 -16.613
  710    HA   THR  90           HA       THR  90   0.592 -11.858 -14.333
  711    HB   THR  90           HB       THR  90   0.988  -9.861 -16.553
  712    HG1  THR  90           HG1      THR  90   0.915 -12.617 -16.723
  713   HG21  THR  90          HG21      THR  90   2.584  -9.879 -14.645
  714   HG22  THR  90          HG22      THR  90   3.346 -10.291 -16.180
  715   HG23  THR  90          HG23      THR  90   2.964 -11.561 -15.018
  716    H    ILE  91           H        ILE  91   0.644 -10.603 -12.579
  717    HA   ILE  91           HA       ILE  91  -0.733  -8.000 -12.646
  718    HB   ILE  91           HB       ILE  91  -1.180  -8.242 -10.260
  719   HG12  ILE  91          HG12      ILE  91  -0.259 -11.066 -10.416
  720   HG13  ILE  91          HG13      ILE  91   0.759  -9.803  -9.756
  721   HG21  ILE  91          HG21      ILE  91  -2.108 -10.554 -11.936
  722   HG22  ILE  91          HG22      ILE  91  -2.832  -8.946 -11.874
  723   HG23  ILE  91          HG23      ILE  91  -2.885  -9.992 -10.455
  724   HD11  ILE  91          HD11      ILE  91  -0.476  -9.635  -7.854
  725   HD12  ILE  91          HD12      ILE  91  -0.830 -11.319  -8.243
  726   HD13  ILE  91          HD13      ILE  91  -1.994 -10.049  -8.668
  727    H    ASP  92           H        ASP  92   0.182  -6.467 -10.712
  728    HA   ASP  92           HA       ASP  92   3.086  -6.462 -11.206
  729    HB2  ASP  92           HB2      ASP  92   1.549  -4.698 -12.273
  730    HB3  ASP  92           HB3      ASP  92   1.452  -4.011 -10.656
  731    HA   PRO  93           HA       PRO  93   2.942  -6.337  -6.587
  732    HB2  PRO  93           HB2      PRO  93   4.891  -8.437  -6.455
  733    HB3  PRO  93           HB3      PRO  93   3.191  -8.516  -5.978
  734    HG2  PRO  93           HG2      PRO  93   4.264  -9.912  -8.092
  735    HG3  PRO  93           HG3      PRO  93   2.549  -9.492  -7.929
  736    HD2  PRO  93           HD2      PRO  93   4.670  -8.153  -9.560
  737    HD3  PRO  93           HD3      PRO  93   2.968  -8.473  -9.962
  738    H    LYS  94           H        LYS  94   4.179  -4.734  -5.759
  739    HA   LYS  94           HA       LYS  94   7.061  -4.848  -6.065
  740    HB2  LYS  94           HB2      LYS  94   7.286  -2.505  -6.875
  741    HB3  LYS  94           HB3      LYS  94   6.609  -3.611  -8.049
  742    HG2  LYS  94           HG2      LYS  94   5.203  -1.865  -8.387
  743    HG3  LYS  94           HG3      LYS  94   4.323  -2.643  -7.072
  744    HD2  LYS  94           HD2      LYS  94   4.863  -1.004  -5.570
  745    HD3  LYS  94           HD3      LYS  94   6.410  -0.655  -6.334
  746    HE2  LYS  94           HE2      LYS  94   3.808   0.026  -7.663
  747    HE3  LYS  94           HE3      LYS  94   4.565   1.114  -6.500
  748    HZ1  LYS  94           HZ1      LYS  94   6.552   1.137  -7.896
  749    HZ2  LYS  94           HZ2      LYS  94   5.199   1.692  -8.745
  750    HZ3  LYS  94           HZ3      LYS  94   5.789   0.131  -9.023
  751    H    VAL  95           H        VAL  95   8.262  -3.631  -4.618
  752    HA   VAL  95           HA       VAL  95   6.963  -3.153  -2.100
  753    HB   VAL  95           HB       VAL  95   9.817  -2.580  -2.613
  754   HG11  VAL  95          HG11      VAL  95   8.354  -3.625  -0.204
  755   HG12  VAL  95          HG12      VAL  95   8.993  -1.995  -0.418
  756   HG13  VAL  95          HG13      VAL  95  10.096  -3.365  -0.293
  757   HG21  VAL  95          HG21      VAL  95   8.763  -5.333  -2.026
  758   HG22  VAL  95          HG22      VAL  95  10.449  -4.870  -2.264
  759   HG23  VAL  95          HG23      VAL  95   9.314  -4.796  -3.612
  760    H    ALA  96           H        ALA  96   6.686  -1.253  -1.025
  761    HA   ALA  96           HA       ALA  96   6.607   1.178  -2.486
  762    HB1  ALA  96           HB1      ALA  96   6.140   0.649   0.442
  763    HB2  ALA  96           HB2      ALA  96   4.916   0.683  -0.828
  764    HB3  ALA  96           HB3      ALA  96   5.774   2.160  -0.391
  765    H    PHE  97           H        PHE  97   7.621   3.219  -1.793
  766    HA   PHE  97           HA       PHE  97  10.372   2.821  -0.863
  767    HB2  PHE  97           HB2      PHE  97   9.080   4.492  -2.921
  768    HB3  PHE  97           HB3      PHE  97  10.355   5.273  -2.008
  769    HD1  PHE  97           HD1      PHE  97   9.574   2.377  -4.165
  770    HD2  PHE  97           HD2      PHE  97  12.627   4.772  -2.409
  771    HE1  PHE  97           HE1      PHE  97  11.254   1.270  -5.583
  772    HE2  PHE  97           HE2      PHE  97  14.311   3.667  -3.824
  773    HZ   PHE  97           HZ       PHE  97  13.625   1.915  -5.412
  774    HA   PRO  98           HA       PRO  98   9.059   5.340   2.699
  775    HB2  PRO  98           HB2      PRO  98  11.767   5.205   3.719
  776    HB3  PRO  98           HB3      PRO  98  10.323   4.388   4.325
  777    HG2  PRO  98           HG2      PRO  98  12.385   3.052   3.182
  778    HG3  PRO  98           HG3      PRO  98  10.704   2.491   3.107
  779    HD2  PRO  98           HD2      PRO  98  12.290   3.955   1.030
  780    HD3  PRO  98           HD3      PRO  98  11.207   2.558   0.853
  781    H    ARG  99           H        ARG  99   9.549   7.370   3.697
  782    HA   ARG  99           HA       ARG  99  11.045   9.204   1.946
  783    HB2  ARG  99           HB2      ARG  99   8.750   9.579   3.853
  784    HB3  ARG  99           HB3      ARG  99   9.720  10.949   3.329
  785    HG2  ARG  99           HG2      ARG  99   8.942  10.851   1.174
  786    HG3  ARG  99           HG3      ARG  99   8.584   9.125   1.268
  787    HD2  ARG  99           HD2      ARG  99   6.661   9.547   2.645
  788    HD3  ARG  99           HD3      ARG  99   7.061  11.260   2.752
  789    HE   ARG  99           HE       ARG  99   6.782  11.006   0.136
  790   HH11  ARG  99          HH11      ARG  99   4.731   9.720   2.679
  791   HH12  ARG  99          HH12      ARG  99   3.298   9.771   1.707
  792   HH21  ARG  99          HH21      ARG  99   3.392  10.535  -0.441
  793   HH22  ARG  99          HH22      ARG  99   4.895  11.070  -1.116
  794    H    ARG 100           H        ARG 100  12.725  10.412   2.692
  795    HA   ARG 100           HA       ARG 100  13.637   9.868   5.433
  796    HB2  ARG 100           HB2      ARG 100  14.993   9.576   3.097
  797    HB3  ARG 100           HB3      ARG 100  15.489  11.199   3.558
  798    HG2  ARG 100           HG2      ARG 100  16.232  10.355   5.729
  799    HG3  ARG 100           HG3      ARG 100  15.741   8.727   5.259
  800    HD2  ARG 100           HD2      ARG 100  17.344   8.817   3.386
  801    HD3  ARG 100           HD3      ARG 100  17.865  10.411   3.936
  802    HE   ARG 100           HE       ARG 100  18.254   8.958   6.133
  803   HH11  ARG 100          HH11      ARG 100  20.552   7.329   3.272
  804   HH12  ARG 100          HH12      ARG 100  19.171   8.266   2.814
  805   HH21  ARG 100          HH21      ARG 100  20.058   7.722   6.708
  806   HH22  ARG 100          HH22      ARG 100  21.054   7.021   5.477
  807    H    ALA 101           H        ALA 101  14.963  11.705   6.425
  808    HA   ALA 101           HA       ALA 101  13.314  14.028   6.569
  809    HB1  ALA 101           HB1      ALA 101  14.145  14.277   8.643
  810    HB2  ALA 101           HB2      ALA 101  15.806  14.049   8.101
  811    HB3  ALA 101           HB3      ALA 101  14.777  12.647   8.396
  812    H    GLN 102           H        GLN 102  14.589  16.200   6.962
  813    HA   GLN 102           HA       GLN 102  15.685  17.984   6.123
  814    HB2  GLN 102           HB2      GLN 102  17.609  15.838   5.273
  815    HB3  GLN 102           HB3      GLN 102  17.884  17.526   4.862
  816    HG2  GLN 102           HG2      GLN 102  17.757  18.069   7.287
  817    HG3  GLN 102           HG3      GLN 102  17.671  16.340   7.618
  818   HE21  GLN 102          HE21      GLN 102  19.676  18.963   6.556
  819   HE22  GLN 102          HE22      GLN 102  21.183  18.125   6.655
  820    HA   PRO 103           HA       PRO 103  13.960  18.410   2.020
  821    HB2  PRO 103           HB2      PRO 103  14.378  21.048   1.646
  822    HB3  PRO 103           HB3      PRO 103  13.175  20.444   2.794
  823    HG2  PRO 103           HG2      PRO 103  15.921  21.486   3.324
  824    HG3  PRO 103           HG3      PRO 103  14.417  21.765   4.226
  825    HD2  PRO 103           HD2      PRO 103  16.330  19.959   4.986
  826    HD3  PRO 103           HD3      PRO 103  14.613  19.826   5.411
  827    H    LYS 104           H        LYS 104  14.694  19.774  -0.096
  828    HA   LYS 104           HA       LYS 104  17.179  18.571  -0.938
  829    HB2  LYS 104           HB2      LYS 104  15.082  20.207  -2.351
  830    HB3  LYS 104           HB3      LYS 104  16.584  19.743  -3.139
  831    HG2  LYS 104           HG2      LYS 104  16.043  17.392  -2.827
  832    HG3  LYS 104           HG3      LYS 104  14.555  17.836  -1.987
  833    HD2  LYS 104           HD2      LYS 104  13.739  18.940  -4.011
  834    HD3  LYS 104           HD3      LYS 104  15.233  18.518  -4.849
  835    HE2  LYS 104           HE2      LYS 104  14.726  16.146  -4.568
  836    HE3  LYS 104           HE3      LYS 104  13.245  16.559  -3.704
  837    HZ1  LYS 104           HZ1      LYS 104  12.798  16.017  -6.013
  838    HZ2  LYS 104           HZ2      LYS 104  13.845  17.239  -6.533
  839    HZ3  LYS 104           HZ3      LYS 104  12.424  17.639  -5.706
  840    H    MET 105           H        MET 105  19.038  19.566  -1.591
  841    HA   MET 105           HA       MET 105  19.503  22.258  -0.554
  842    HB2  MET 105           HB2      MET 105  21.363  20.061  -1.464
  843    HB3  MET 105           HB3      MET 105  21.926  21.667  -1.028
  844    HG2  MET 105           HG2      MET 105  20.405  19.827   0.802
  845    HG3  MET 105           HG3      MET 105  22.159  20.005   0.781
  846    HE1  MET 105           HE1      MET 105  20.585  20.341   3.456
  847    HE2  MET 105           HE2      MET 105  21.304  21.815   4.104
  848    HE3  MET 105           HE3      MET 105  22.321  20.613   3.309
  849    H    VAL 106           H        VAL 106  20.751  23.811  -1.784
  850    HA   VAL 106           HA       VAL 106  20.182  23.669  -4.663
  851    HB   VAL 106           HB       VAL 106  20.734  26.170  -3.032
  852   HG11  VAL 106          HG11      VAL 106  21.281  26.489  -5.364
  853   HG12  VAL 106          HG12      VAL 106  19.794  27.359  -4.988
  854   HG13  VAL 106          HG13      VAL 106  19.722  25.826  -5.856
  855   HG21  VAL 106          HG21      VAL 106  18.087  25.062  -3.967
  856   HG22  VAL 106          HG22      VAL 106  18.327  26.646  -3.231
  857   HG23  VAL 106          HG23      VAL 106  18.641  25.184  -2.298
  858    H    THR 107           H        THR 107  22.622  25.022  -2.432
  859    HA   THR 107           HA       THR 107  24.662  24.693  -4.447
  860    HB   THR 107           HB       THR 107  25.079  26.046  -1.792
  861    HG1  THR 107           HG1      THR 107  23.670  26.972  -4.035
  862   HG21  THR 107          HG21      THR 107  26.326  26.516  -4.509
  863   HG22  THR 107          HG22      THR 107  27.068  25.608  -3.191
  864   HG23  THR 107          HG23      THR 107  26.760  27.335  -3.008
  865    H    ARG 108           H        ARG 108  25.124  22.531  -4.379
  866    HA   ARG 108           HA       ARG 108  25.737  21.240  -1.839
  867    HB2  ARG 108           HB2      ARG 108  25.194  20.301  -4.613
  868    HB3  ARG 108           HB3      ARG 108  26.157  19.268  -3.565
  869    HG2  ARG 108           HG2      ARG 108  24.369  19.204  -1.934
  870    HG3  ARG 108           HG3      ARG 108  23.409  20.314  -2.913
  871    HD2  ARG 108           HD2      ARG 108  23.121  18.711  -4.623
  872    HD3  ARG 108           HD3      ARG 108  24.377  17.667  -3.958
  873    HE   ARG 108           HE       ARG 108  22.754  17.460  -1.990
  874   HH11  ARG 108          HH11      ARG 108  21.697  17.836  -5.319
  875   HH12  ARG 108          HH12      ARG 108  20.201  17.005  -5.057
  876   HH21  ARG 108          HH21      ARG 108  19.691  16.175  -2.994
  877   HH22  ARG 108          HH22      ARG 108  20.795  16.369  -1.673
  878    H    THR 109           H        THR 109  27.692  20.341  -1.294
  879    HA   THR 109           HA       THR 109  30.026  21.488  -2.637
  880    HB   THR 109           HB       THR 109  31.261  20.572  -0.605
  881    HG1  THR 109           HG1      THR 109  28.627  19.853  -0.003
  882   HG21  THR 109          HG21      THR 109  29.088  22.630  -0.191
  883   HG22  THR 109          HG22      THR 109  30.722  22.929  -0.784
  884   HG23  THR 109          HG23      THR 109  30.472  22.390   0.876
  885    H    LYS 110           H        LYS 110  31.715  20.282  -3.432
  886    HA   LYS 110           HA       LYS 110  31.551  17.401  -3.377
  887    HB2  LYS 110           HB2      LYS 110  31.499  19.091  -5.850
  888    HB3  LYS 110           HB3      LYS 110  32.198  17.479  -5.897
  889    HG2  LYS 110           HG2      LYS 110  30.134  16.466  -5.339
  890    HG3  LYS 110           HG3      LYS 110  29.410  18.019  -4.915
  891    HD2  LYS 110           HD2      LYS 110  29.461  18.731  -7.212
  892    HD3  LYS 110           HD3      LYS 110  30.365  17.289  -7.682
  893    HE2  LYS 110           HE2      LYS 110  27.650  17.117  -6.409
  894    HE3  LYS 110           HE3      LYS 110  27.846  17.324  -8.149
  895    HZ1  LYS 110           HZ1      LYS 110  28.991  15.090  -6.558
  896    HZ2  LYS 110           HZ2      LYS 110  29.099  15.277  -8.235
  897    HZ3  LYS 110           HZ3      LYS 110  27.597  14.991  -7.514
  898    H    LYS 111           H        LYS 111  33.443  20.219  -4.394
  899    HA   LYS 111           HA       LYS 111  35.907  18.752  -4.281
  900    HB2  LYS 111           HB2      LYS 111  35.161  21.528  -5.111
  901    HB3  LYS 111           HB3      LYS 111  36.845  21.121  -4.810
  902    HG2  LYS 111           HG2      LYS 111  36.796  19.434  -6.525
  903    HG3  LYS 111           HG3      LYS 111  35.065  19.681  -6.765
  904    HD2  LYS 111           HD2      LYS 111  35.440  21.906  -7.591
  905    HD3  LYS 111           HD3      LYS 111  37.155  21.815  -7.184
  906    HE2  LYS 111           HE2      LYS 111  37.510  20.109  -8.841
  907    HE3  LYS 111           HE3      LYS 111  35.781  20.008  -9.169
  908    HZ1  LYS 111           HZ1      LYS 111  35.811  22.204 -10.076
  909    HZ2  LYS 111           HZ2      LYS 111  37.037  21.314 -10.827
  910    HZ3  LYS 111           HZ3      LYS 111  37.425  22.439  -9.625