*HEADER    SIGNALING PROTEIN                       01-JUN-17   5O57              
*TITLE     SOLUTION STRUCTURE OF THE N-TERMINAL REGION OF DKK4                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DICKKOPF-RELATED PROTEIN 4;                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: HDKK-4;                                                     
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: DKK4;                                                          
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: ROSETTA 2 (DE3);                           
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PLEICS-05                                 
*KEYWDS    DKK4, WNT SIGNALLING, CYSTEINE-RICH DOMAIN 1, SIGNALING PROTEIN       
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    70                                                                    
*AUTHOR    L.C.WATERS,S.PATEL,A.M.BARKELL,F.W.MUSKETT,M.K.ROBINSON,G.HOLDSWORTH, 
*AUTHOR   2 M.D.CARR                                                             
*REVDAT   1   13-JUN-18 5O57    0                                                
# Restraints file 1: disulphide.txt
ssbond 41-53
ssbond 47-63
ssbond 66-80
ssbond 73-85
ssbond 79-90
# Restraints file 2: hbond.txt
hbond atom1=H residue1=89 atom2=O residue2=86
hbond atom1=H residue1=86 atom2=O residue2=89
hbond atom1=H residue1=91 atom2=O residue2=84
hbond atom1=H residue1=84 atom2=O residue2=91
hbond atom1=H residue1=73 atom2=O residue2=88
hbond atom1=H residue1=90 atom2=O residue2=71
# Restraints file 3: talos.txt

# Phi/Psi Angles From 'Strong' TALOS-N Predictions: 
#    error margins are set to conservative default values of double the 
#    standard deviation observed in TALOS-N capped at a minimum of +/-20 degree.
  20   VAL  PHI    -115.7   -61.2
  20   VAL  PSI     106.5   147.2
  21   LEU  PHI     -93.2   -53.2
  21   LEU  PSI     114.5   154.5
  41   CYSS PHI    -166.0  -126.0
  41   CYSS PSI     140.3   180.3
  44   ASP  PHI     -78.1   -38.1
  44   ASP  PSI     -54.3   -14.3
  45   THR  PHI     -89.3   -49.3
  45   THR  PSI     -36.4     3.6
  46   ASP  PHI    -108.1   -68.1
  46   ASP  PSI     -29.5    10.5
  51   LYS  PHI    -153.6  -113.6
  51   LYS  PSI     133.1   173.1
  52   PHE  PHI    -177.0   -93.1
  52   PHE  PSI     110.8   179.7
  53   CYSS PHI    -110.3   -70.3
  53   CYSS PSI      92.4   132.4
  54   LEU  PHI    -121.7   -68.0
  54   LEU  PSI     100.7   140.7
  55   GLN  PHI    -154.7   -37.6
  55   GLN  PSI      90.0   180.0
  56   PRO  PSI     128.2   168.2
  57   ARG  PHI     -83.3   -43.3
  57   ARG  PSI     -46.2    -6.2
  58   ASP  PHI    -109.7   -67.4
  58   ASP  PSI     -23.3    29.4
  59   GLU  PHI    -166.8   -74.7
  59   GLU  PSI     123.1   182.1
  60   LYS  PHI    -113.8   -40.7
  60   LYS  PSI     118.0   161.9
  62   PHE  PHI    -170.0   -97.7
  62   PHE  PSI     125.4   179.8
  63   CYSS PHI    -112.8   -70.3
  63   CYSS PSI     105.5   145.5
  64   ALA  PHI    -160.7  -103.6
  64   ALA  PSI     109.1   175.1
  66   CYSS PHI    -161.3   -44.0
  66   CYSS PSI     109.3   174.6
  68   GLY  PHI    -145.5   -44.9
  68   GLY  PSI     139.0   201.0
  73   CYSS PHI    -154.4  -114.4
  73   CYSS PSI     135.0   175.0
  75   ARG  PHI    -177.5   -81.7
  75   ARG  PSI     121.2   182.9
  76   ASP  PHI     -80.0   -40.0
  76   ASP  PSI     -56.5   -16.5
  77   ALA  PHI     -82.3   -42.3
  77   ALA  PSI     -44.9    -4.9
  78   MET  PHI     -93.0   -53.0
  78   MET  PSI     -42.7    -2.7
  81   PRO  PSI     118.8   158.8
  83   THR  PHI    -156.2  -116.2
  83   THR  PSI     133.5   173.5
  84   LEU  PHI    -151.5  -107.3
  84   LEU  PSI     106.3   162.7
  85   CYSS PHI    -115.4   -63.2
  85   CYSS PSI      97.8   141.6
  86   VAL  PHI    -147.0  -107.0
  86   VAL  PSI     103.3   143.3
  87   ASN  PHI      34.0    74.0
  87   ASN  PSI      23.6    63.6
  88   ASP  PHI      45.6    85.6
  88   ASP  PSI       3.5    43.5
  89   VAL  PHI    -148.2  -108.2
  89   VAL  PSI     113.5   155.4
  90   CYSS PHI    -101.2   -56.7
  90   CYSS PSI     106.3   146.3
  91   THR  PHI    -153.4   -98.4
  91   THR  PSI     108.0   170.5
  92   THR  PHI     -97.5   -43.9
  92   THR  PSI     116.5   161.3
  94   GLU  PHI     -89.0   -49.0
  94   GLU  PSI     -49.4    -9.4
  95   ASP  PHI     -95.5   -52.3
  95   ASP  PSI     -54.3    -2.2

# Phi/Psi Angles From 'Generous' TALOS-N Predictions: 
#    error margins are set to default values of triple the standard
#    deviation observed in TALOS-N capped at a minimum of +/-30 degree.
  40   GLN  PHI    -144.7   -45.8
  40   GLN  PSI     -83.3    55.8
  61   PRO  PSI     114.8   174.8
  65   THR  PHI    -100.9   -38.1
  65   THR  PSI     101.5   171.3
  69   LEU  PHI     -92.1   -32.1
  69   LEU  PSI     -61.4    -1.4
  70   ARG  PHI     -98.4   -38.4
  70   ARG  PSI     -50.9    12.3
  72   ARG  PHI    -104.2   -36.6
  72   ARG  PSI     104.4   164.4
  79   CYSS PHI    -123.0   -63.0
  80   CYSS PHI    -111.4   -45.0
  80   CYSS PSI     101.2   189.1
# Restraints file 4: upperlimits.txt
 53  CYSS HA	 54   LEU  H	   3.47 	   #peak     1 #SUP  0.95  #QF  0.95
 54  LEU  HA	 55   GLN  H	   3.28 	   #peak     2 #SUP  0.92  #QF  0.92
 79  CYSS HA	 80   CYSS H	   3.52 	   #peak     3 #SUP  1.00
 68  GLY  HA2	 69   LEU  H	   3.32 	   #peak     4 #SUP  0.94  #QF  0.94
 68  GLY  HA3	 69   LEU  H	   3.28 	   #peak     5 #SUP  0.97  #QF  0.92
 43  SER  H	 46   ASP  H	   4.40 	   #peak    12 #SUP  0.79  #QF  0.79
 46  ASP  H	 46   ASP  HB2     3.78 	   #peak    13 #SUP  0.97  #QF  0.97
 46  ASP  H	 46   ASP  HB3     3.78 	   #peak    14 #SUP  0.94  #QF  0.94
 49  THR  HB	 50   ARG  H	   4.16 	   #peak    16 #SUP  0.99  #QF  0.99
 54  LEU  H	 63   CYSS HA	   4.18 	   #peak    23 #SUP  0.64  #QF  0.64
 54  LEU  H	 62   PHE  H	   4.23 	   #peak    24 #SUP  0.64  #QF  0.64
 53  CYSS H	 53   CYSS HB2     4.03 	   #peak    25 #SUP  0.97  #QF  0.97
 53  CYSS H	 53   CYSS HB3     4.03 	   #peak    26 #SUP  0.99  #QF  0.29
 62  PHE  HA	 63   CYSS H	   3.41 	   #peak    28 #SUP  0.97  #QF  0.97
105  LEU  HB2	106   GLU  H	   5.02 	   #peak    31 #SUP  0.88  #QF  0.64
105  LEU  HB3	106   GLU  H	   5.02 	   #peak    31 #SUP  0.88  #QF  0.64
 79  CYSS HB2	 80   CYSS H	   4.40 	   #peak    32 #SUP  0.90  #QF  0.90
 80  CYSS H	 80   CYSS HB2     3.95 	   #peak    33 #SUP  0.99  #QF  0.99
 80  CYSS H	 80   CYSS HB3     3.95 	   #peak    35 #SUP  0.86  #QF  0.86
 79  CYSS HB3	 80   CYSS H	   4.40 	   #peak    36 #SUP  0.76  #QF  0.76
 51  LYS  H	 51   LYS  HB3     4.06 	   #peak    41 #SUP  1.00
 51  LYS  H	 51   LYS  HB2     4.06 	   #peak    42 #SUP  0.98  #QF  0.98
 49  THR  HA	 51   LYS  H	   4.99 	   #peak    45 #SUP  0.69  #QF  0.69
 50  ARG  H	 51   LYS  H	   3.91 	   #peak    47 #SUP  0.84  #QF  0.84
 40  GLN  HB2	 41   CYSS H	   4.39 	   #peak    53 #SUP  0.87  #QF  0.74
 40  GLN  HB3	 41   CYSS H	   4.39 	   #peak    53 #SUP  0.87  #QF  0.74
 42  LEU  HB3	 43   SER  H	   4.12 	   #peak    66 #SUP  0.98  #QF  0.98
 42  LEU  HB2	 43   SER  H	   4.12 	   #peak    67 #SUP  0.92  #QF  0.92
 43  SER  H	 46   ASP  HB3     4.48 	   #peak    68 #SUP  0.94  #QF  0.94
 43  SER  H	 46   ASP  HB2     4.48 	   #peak    70 #SUP  0.90  #QF  0.90
 41  CYSS HA	 43   SER  H	   4.02 	   #peak    73 #SUP  0.95  #QF  0.95
 42  LEU  H	 43   SER  H	   3.33 	   #peak    74 #SUP  0.92  #QF  0.92
 47  CYSS H	 47   CYSS HB2     3.74 	   #peak    75 #SUP  0.95  #QF  0.95
 47  CYSS H	 47   CYSS HB3     3.74 	   #peak    76 #SUP  0.94  #QF  0.94
 97  THR  H	 98   GLU  H	   4.03 	   #peak    83 #SUP  0.75  #QF  0.75
 48  ASN  HB2	 49   THR  H	   4.38 	   #peak    88 #SUP  0.88  #QF  0.88
 48  ASN  HB3	 49   THR  H	   4.38 	   #peak    89 #SUP  0.93  #QF  0.93
 96  ALA  QB	 97   THR  H	   4.00 	   #peak    90 #SUP  0.85  #QF  0.85
 97  THR  H	 97   THR  QG2     4.15 	   #peak    91 #SUP  0.99  #QF  0.99
 51  LYS  HB3	 52   PHE  H	   4.15 	   #peak    92 #SUP  0.95  #QF  0.95
 51  LYS  HB2	 52   PHE  H	   4.15 	   #peak    94 #SUP  0.97  #QF  0.97
 52  PHE  H	 52   PHE  QD	   3.97 	   #peak    99 #SUP  0.79  #QF  0.79
 52  PHE  QD	 53   CYSS H	   4.17 	   #peak   101 #SUP  0.99  #QF  0.99
 44  ASP  HA	 53   CYSS H	   4.10 	   #peak   104 #SUP  0.74  #QF  0.74
 52  PHE  HB2	 53   CYSS H	   4.35 	   #peak   105 #SUP  0.97  #QF  0.97
 52  PHE  HB3	 53   CYSS H	   4.35 	   #peak   106 #SUP  0.78  #QF  0.78
 54  LEU  H	 54   LEU  HB3     3.76 	   #peak   107 #SUP  0.98  #QF  0.98
 54  LEU  H	 54   LEU  HB2     3.81 	   #peak   108 #SUP  0.98  #QF  0.98
 55  GLN  H	 55   GLN  HG2     4.49 	   #peak   110 #SUP  0.88  #QF  0.64
 55  GLN  H	 55   GLN  HG3     4.49 	   #peak   110 #SUP  0.88  #QF  0.64
 55  GLN  H	 55   GLN  HB2     3.92 	   #peak   111 #SUP  0.99  #QF  0.99
 55  GLN  H	 55   GLN  HB3     3.92 	   #peak   112 #SUP  0.94  #QF  0.94
 54  LEU  HG	 55   GLN  H	   5.08 	   #peak   113 #SUP  0.88  #QF  0.88
 54  LEU  QD1	 55   GLN  H	   4.41 	   #peak   114 #SUP  0.79  #QF  0.79
 54  LEU  QD2	 55   GLN  H	   4.41 	   #peak   115 #SUP  0.98  #QF  0.88
 57  ARG  HB2	 58   ASP  H	   4.96 	   #peak   120 #SUP  0.89  #QF  0.48
 57  ARG  HB3	 58   ASP  H	   4.96 	   #peak   120 #SUP  0.89  #QF  0.48
 56  PRO  HB3	 59   GLU  H	   4.11 	   #peak   122 #SUP  0.25  #QF  0.25
 59  GLU  H	 59   GLU  HB3     4.05 	   #peak   123 #SUP  0.97  #QF  0.97
 59  GLU  H	 59   GLU  HB2     4.05 	   #peak   124 #SUP  0.99  #QF  0.99
 59  GLU  H	 59   GLU  HG2     5.50 	   #peak   125 #SUP  0.97  #QF  0.78
 59  GLU  H	 59   GLU  HG3     5.50 	   #peak   125 #SUP  0.97  #QF  0.78
 56  PRO  HB2	 59   GLU  H	   4.11 	   #peak   126 #SUP  0.88  #QF  0.88
 58  ASP  HB2	 59   GLU  H	   5.42 	   #peak   127 #SUP  1.00
 58  ASP  HB3	 59   GLU  H	   5.42 	   #peak   127 #SUP  1.00
 57  ARG  HA	 59   GLU  H	   4.32 	   #peak   128 #SUP  0.50  #QF  0.50
 58  ASP  H	 59   GLU  H	   4.01 	   #peak   131 #SUP  0.96  #QF  0.61
 59  GLU  HA	 60   LYS  H	   3.39 	   #peak   132 #SUP  0.97  #QF  0.97
 59  GLU  HB3	 60   LYS  H	   3.89 	   #peak   135 #SUP  0.96  #QF  0.96
 59  GLU  HB2	 60   LYS  H	   3.89 	   #peak   136 #SUP  0.97  #QF  0.97
 59  GLU  HG2	 60   LYS  H	   4.69 	   #peak   137 #SUP  0.91  #QF  0.84
 59  GLU  HG3	 60   LYS  H	   4.69 	   #peak   137 #SUP  0.91  #QF  0.84
 54  LEU  HB3	 62   PHE  H	   4.57 	   #peak   138 #SUP  0.75  #QF  0.55
 61  PRO  HB3	 62   PHE  H	   4.04 	   #peak   139 #SUP  0.99  #QF  0.99
 61  PRO  HB2	 62   PHE  H	   4.04 	   #peak   140 #SUP  0.99  #QF  0.99
 53  CYSS HA	 62   PHE  H	   5.50 	   #peak   142 #SUP  0.83  #QF  0.83
 61  PRO  HA	 62   PHE  H	   3.30 	   #peak   143 #SUP  0.97  #QF  0.97
 72  ARG  HA	 73   CYSS H	   3.10 	   #peak   145 #SUP  0.92  #QF  0.92
 55  GLN  HA	 62   PHE  H	   4.07 	   #peak   146 #SUP  0.64  #QF  0.64
 62  PHE  H	 62   PHE  QD	   3.84 	   #peak   147 #SUP  0.68  #QF  0.68
 62  PHE  H	 63   CYSS H	   5.10 	   #peak   148 #SUP  0.98  #QF  0.76
 62  PHE  QD	 63   CYSS H	   4.12 	   #peak   149 #SUP  0.98  #QF  0.98
 63  CYSS H	 63   CYSS HB2     3.89 	   #peak   151 #SUP  0.95  #QF  0.95
 63  CYSS H	 63   CYSS HB3     3.89 	   #peak   153 #SUP  0.96  #QF  0.96
 64  ALA  H	 64   ALA  QB	   3.66 	   #peak   154 #SUP  1.00
 63  CYSS HA	 64   ALA  H	   3.44 	   #peak   156 #SUP  0.90  #QF  0.90
 54  LEU  H	 64   ALA  H	   4.37 	   #peak   157 #SUP  0.39  #QF  0.39
 52  PHE  H	 64   ALA  H	   4.30 	   #peak   158 #SUP  0.88  #QF  0.88
 64  ALA  HA	 65   THR  H	   3.37 	   #peak   159 #SUP  0.76  #QF  0.76
 65  THR  H	 65   THR  HB	   4.02 	   #peak   160 #SUP  1.00  #QF  0.99
 65  THR  H	 65   THR  QG2     4.20 	   #peak   161 #SUP  1.00
 64  ALA  QB	 65   THR  H	   3.65 	   #peak   162 #SUP  0.99  #QF  0.99
 65  THR  QG2	 66   CYSS H	   3.68 	   #peak   164 #SUP  0.90  #QF  0.90
 66  CYSS H	 66   CYSS HB3     3.99 	   #peak   165 #SUP  1.00
 66  CYSS H	 66   CYSS HB2     3.99 	   #peak   166 #SUP  0.98  #QF  0.98
 65  THR  HA	 66   CYSS H	   3.18 	   #peak   167 #SUP  0.90  #QF  0.86
 65  THR  HB	 66   CYSS H	   3.66 	   #peak   167 #SUP  0.90  #QF  0.86
 51  LYS  HA	 66   CYSS H	   4.26 	   #peak   170 #SUP  0.79  #QF  0.79
 67  ARG  H	 79   CYSS HA	   4.10 	   #peak   171 #SUP  0.73  #QF  0.73
 66  CYSS HB2	 67   ARG  H	   4.15 	   #peak   174 #SUP  0.93  #QF  0.93
 66  CYSS HB3	 67   ARG  H	   4.15 	   #peak   175 #SUP  0.90  #QF  0.90
 67  ARG  H	 67   ARG  HB2     3.75 	   #peak   176 #SUP  0.97  #QF  0.94
 67  ARG  HA	 68   GLY  H	   3.57 	   #peak   180 #SUP  1.00
 68  GLY  H	 69   LEU  H	   4.60 	   #peak   181 #SUP  1.00
 69  LEU  H	 69   LEU  HG	   3.41 	   #peak   182 #SUP  0.99  #QF  0.99
 69  LEU  H	 69   LEU  HB2     3.67 	   #peak   183 #SUP  0.92  #QF  0.92
 69  LEU  H	 69   LEU  HB3     3.67 	   #peak   184 #SUP  0.99  #QF  0.99
 69  LEU  H	 69   LEU  QD1     3.98 	   #peak   185 #SUP  1.00
 69  LEU  H	 69   LEU  QD2     3.90 	   #peak   186 #SUP  1.00
 69  LEU  QD2	 70   ARG  H	   4.79 	   #peak   187 #SUP  0.98  #QF  0.98
 70  ARG  H	 70   ARG  HG2     4.36 	   #peak   189 #SUP  0.95  #QF  0.83
 70  ARG  H	 70   ARG  HG3     4.36 	   #peak   189 #SUP  0.95  #QF  0.83
 70  ARG  H	 71   ARG  H	   3.74 	   #peak   196 #SUP  0.81  #QF  0.81
 68  GLY  H	 71   ARG  H	   4.16 	   #peak   197 #SUP  0.55  #QF  0.55
 68  GLY  HA3	 71   ARG  H	   4.02 	   #peak   199 #SUP  0.40  #QF  0.40
 71  ARG  H	 71   ARG  HG3     4.37 	   #peak   202 #SUP  0.99  #QF  0.99
 71  ARG  H	 71   ARG  HB3     3.89 	   #peak   203 #SUP  1.00
 71  ARG  H	 71   ARG  HB2     3.89 	   #peak   204 #SUP  0.98  #QF  0.98
 67  ARG  HB3	 71   ARG  H	   5.36 	   #peak   205 #SUP  0.91  #QF  0.60
 70  ARG  HG2	 71   ARG  H	   5.50 	   #peak   205 #SUP  0.91  #QF  0.60
 70  ARG  HG3	 71   ARG  H	   5.50 	   #peak   205 #SUP  0.91  #QF  0.60
 71  ARG  H	 71   ARG  HG2     4.37 	   #peak   206 #SUP  0.94  #QF  0.94
 72  ARG  H	 72   ARG  HG3     3.77 	   #peak   209 #SUP  0.92  #QF  0.92
 72  ARG  H	 72   ARG  HG2     3.77 	   #peak   210 #SUP  0.87  #QF  0.64
 72  ARG  H	 72   ARG  HD2     5.50 	   #peak   213 #SUP  0.99  #QF  0.91
 72  ARG  H	 72   ARG  HD3     5.50 	   #peak   213 #SUP  0.99  #QF  0.91
 71  ARG  HA	 72   ARG  H	   3.23 	   #peak   214 #SUP  0.93  #QF  0.93
 73  CYSS H	 89   VAL  HA	   3.69 	   #peak   216 #SUP  0.90  #QF  0.90
 73  CYSS H	 88   ASP  HA	   4.61 	   #peak   218 #SUP  0.77  #QF  0.77
 73  CYSS H	 89   VAL  HB	   5.50 	   #peak   222 #SUP  0.98  #QF  0.96
 73  CYSS H	 89   VAL  QG1     5.50 	   #peak   223 #SUP  0.92  #QF  0.58
 73  CYSS H	 89   VAL  QG2     5.50 	   #peak   223 #SUP  0.92  #QF  0.58
 74  GLN  H	 74   GLN  HB3     3.97 	   #peak   224 #SUP  0.93  #QF  0.93
 74  GLN  H	 78   MET  QE	   4.00 	   #peak   225 #SUP  0.90  #QF  0.90
 74  GLN  H	 74   GLN  HB2     3.97 	   #peak   226 #SUP  0.99  #QF  0.98
 79  CYSS H	 79   CYSS HB3     3.82 	   #peak   227 #SUP  0.90  #QF  0.90
 73  CYSS HB2	 74   GLN  H	   4.20 	   #peak   228 #SUP  0.98  #QF  0.98
 73  CYSS HB3	 74   GLN  H	   4.20 	   #peak   229 #SUP  0.93  #QF  0.93
 73  CYSS HA	 74   GLN  H	   3.50 	   #peak   230 #SUP  1.00  #QF  0.74
 74  GLN  H	 75   ARG  H	   3.49 	   #peak   231 #SUP  0.93  #QF  0.93
 74  GLN  HB2	 75   ARG  H	   4.47 	   #peak   235 #SUP  0.96  #QF  0.94
 74  GLN  HB3	 75   ARG  H	   4.47 	   #peak   237 #SUP  0.97  #QF  0.95
 75  ARG  H	 78   MET  HG2     4.73 	   #peak   237 #SUP  0.97  #QF  0.95
 75  ARG  H	 78   MET  HG3     4.73 	   #peak   240 #SUP  0.78  #QF  0.78
 76  ASP  HB2	 77   ALA  H	   4.35 	   #peak   242 #SUP  0.99  #QF  0.99
 76  ASP  HB3	 77   ALA  H	   4.35 	   #peak   243 #SUP  0.89  #QF  0.89
 77  ALA  H	 77   ALA  QB	   3.30 	   #peak   244 #SUP  1.00
 78  MET  H	 78   MET  HG2     4.19 	   #peak   249 #SUP  0.98  #QF  0.98
 77  ALA  QB	 78   MET  H	   3.94 	   #peak   251 #SUP  1.00  #QF  0.96
 78  MET  H	 78   MET  HG3     4.19 	   #peak   252 #SUP  0.99  #QF  0.99
 77  ALA  QB	 79   CYSS H	   4.75 	   #peak   253 #SUP  0.97  #QF  0.24
 77  ALA  HA	 79   CYSS H	   4.10 	   #peak   254 #SUP  0.60  #QF  0.60
 79  CYSS H	 79   CYSS HB2     3.82 	   #peak   255 #SUP  0.94  #QF  0.94
 78  MET  H	 79   CYSS H	   3.68 	   #peak   257 #SUP  0.92  #QF  0.92
 67  ARG  H	 80   CYSS H	   4.30 	   #peak   258 #SUP  0.71  #QF  0.71
 83  THR  H	 84   LEU  H	   4.48 	   #peak   259 #SUP  1.00
 83  THR  H	 83   THR  QG2     3.70 	   #peak   265 #SUP  0.91  #QF  0.91
 84  LEU  H	 91   THR  H	   4.00 	   #peak   266 #SUP  0.94  #QF  0.94
 83  THR  HA	 84   LEU  H	   3.32 	   #peak   267 #SUP  0.96  #QF  0.96
 84  LEU  H	 90   CYSS HA	   4.66 	   #peak   268 #SUP  0.70  #QF  0.70
 84  LEU  H	 92   THR  HA	   4.31 	   #peak   270 #SUP  0.90  #QF  0.90
 83  THR  HB	 84   LEU  H	   3.48 	   #peak   271 #SUP  0.85  #QF  0.85
 83  THR  QG2	 84   LEU  H	   3.72 	   #peak   272 #SUP  0.99  #QF  0.99
 84  LEU  H	 84   LEU  QD1     5.29 	   #peak   273 #SUP  1.00  #QF  0.69
 84  LEU  H	 84   LEU  QD2     5.29 	   #peak   273 #SUP  1.00  #QF  0.69
 84  LEU  H	 84   LEU  HB3     4.11 	   #peak   274 #SUP  0.99  #QF  0.98
 84  LEU  H	 84   LEU  HB2     4.11 	   #peak   275 #SUP  0.99  #QF  0.99
 84  LEU  HB2	 85   CYSS H	   4.33 	   #peak   277 #SUP  0.86  #QF  0.86
 84  LEU  HB3	 85   CYSS H	   4.33 	   #peak   278 #SUP  0.99  #QF  0.99
 85  CYSS H	 85   CYSS HB3     3.77 	   #peak   279 #SUP  0.98  #QF  0.98
 85  CYSS H	 85   CYSS HB2     3.77 	   #peak   280 #SUP  0.99  #QF  0.99
 76  ASP  HA	 85   CYSS H	   3.90 	   #peak   281 #SUP  0.62  #QF  0.62
 86  VAL  H	 90   CYSS HA	   4.28 	   #peak   285 #SUP  0.66  #QF  0.66
 85  CYSS HA	 86   VAL  H	   3.34 	   #peak   286 #SUP  0.91  #QF  0.91
 86  VAL  H	 86   VAL  HB	   3.72 	   #peak   288 #SUP  0.97  #QF  0.97
 86  VAL  H	 91   THR  QG2     4.90 	   #peak   289 #SUP  0.98  #QF  0.98
 86  VAL  H	 86   VAL  QG1     4.11 	   #peak   290 #SUP  1.00
 86  VAL  H	 86   VAL  QG2     3.78 	   #peak   291 #SUP  0.99  #QF  0.99
 86  VAL  QG1	 87   ASN  H	   4.08 	   #peak   292 #SUP  0.94  #QF  0.94
 86  VAL  HA	 87   ASN  H	   3.44 	   #peak   294 #SUP  0.99  #QF  0.80
 87  ASN  H	 88   ASP  H	   4.10 	   #peak   296 #SUP  0.76  #QF  0.76
 88  ASP  H	 88   ASP  HA	   2.92 	   #peak   298 #SUP  0.98  #QF  0.70
 87  ASN  HB3	 88   ASP  H	   4.69 	   #peak   300 #SUP  0.96  #QF  0.96
 87  ASN  HB2	 88   ASP  H	   4.69 	   #peak   302 #SUP  0.54  #QF  0.54
 89  VAL  H	 89   VAL  HB	   4.09 	   #peak   305 #SUP  1.00
 85  CYSS HA	 89   VAL  H	   4.31 	   #peak   307 #SUP  0.60  #QF  0.60
 86  VAL  H	 89   VAL  H	   3.99 	   #peak   309 #SUP  0.87  #QF  0.87
 88  ASP  H	 89   VAL  H	   3.80 	   #peak   310 #SUP  0.93  #QF  0.93
 90  CYSS H	 91   THR  H	   4.80 	   #peak   311 #SUP  0.86  #QF  0.86
 73  CYSS H	 90   CYSS H	   4.29 	   #peak   312 #SUP  0.90  #QF  0.90
 89  VAL  H	 90   CYSS H	   4.55 	   #peak   313 #SUP  0.74  #QF  0.74
 89  VAL  HA	 90   CYSS H	   3.19 	   #peak   314 #SUP  0.95  #QF  0.95
 72  ARG  HA	 90   CYSS H	   4.02 	   #peak   315 #SUP  0.94  #QF  0.94
 90  CYSS H	 90   CYSS HB2     3.92 	   #peak   316 #SUP  0.90  #QF  0.90
 90  CYSS H	 90   CYSS HB3     3.92 	   #peak   317 #SUP  1.00
 89  VAL  HB	 90   CYSS H	   4.00 	   #peak   318 #SUP  0.99  #QF  0.99
 91  THR  H	 91   THR  QG2     4.12 	   #peak   320 #SUP  1.00
 69  LEU  QD2	 91   THR  H	   4.82 	   #peak   321 #SUP  0.98  #QF  0.81
 83  THR  QG2	 91   THR  H	   5.18 	   #peak   321 #SUP  0.98  #QF  0.81
 86  VAL  QG2	 91   THR  H	   4.37 	   #peak   322 #SUP  0.76  #QF  0.76
 90  CYSS HB2	 91   THR  H	   4.62 	   #peak   323 #SUP  0.98  #QF  0.98
 90  CYSS HB3	 91   THR  H	   4.62 	   #peak   324 #SUP  0.96  #QF  0.96
 83  THR  HB	 91   THR  H	   4.32 	   #peak   325 #SUP  0.95  #QF  0.54
 85  CYSS HA	 91   THR  H	   4.64 	   #peak   326 #SUP  0.83  #QF  0.48
 90  CYSS HA	 91   THR  H	   3.31 	   #peak   327 #SUP  0.91  #QF  0.91
 91  THR  HA	 92   THR  H	   3.53 	   #peak   329 #SUP  0.90  #QF  0.90
 69  LEU  QD2	 92   THR  H	   4.07 	   #peak   332 #SUP  0.98  #QF  0.89
 83  THR  QG2	 92   THR  H	   4.68 	   #peak   332 #SUP  0.98  #QF  0.89
 69  LEU  QD1	 92   THR  H	   4.18 	   #peak   333 #SUP  0.94  #QF  0.94
 91  THR  QG2	 92   THR  H	   3.92 	   #peak   334 #SUP  0.95  #QF  0.67
 92  THR  H	 92   THR  QG2     4.09 	   #peak   334 #SUP  0.95  #QF  0.67
 83  THR  QG2	 93   MET  H	   4.07 	   #peak   335 #SUP  0.96  #QF  0.96
 92  THR  QG2	 93   MET  H	   4.02 	   #peak   336 #SUP  0.83  #QF  0.83
 93  MET  H	 93   MET  HB2     3.95 	   #peak   337 #SUP  1.00
 93  MET  H	 93   MET  HB3     3.95 	   #peak   338 #SUP  0.97  #QF  0.97
 93  MET  H	 93   MET  HG2     5.32 	   #peak   339 #SUP  1.00  #QF  0.99
 93  MET  H	 93   MET  HG3     5.32 	   #peak   339 #SUP  1.00  #QF  0.99
 92  THR  HA	 93   MET  H	   3.34 	   #peak   340 #SUP  1.00  #QF  0.84
 83  THR  HA	 93   MET  H	   4.16 	   #peak   342 #SUP  0.81  #QF  0.81
 93  MET  H	 94   GLU  H	   4.40 	   #peak   343 #SUP  0.82  #QF  0.82
 92  THR  HB	 94   GLU  H	   3.66 	   #peak   344 #SUP  0.98  #QF  0.23
 94  GLU  HB2	 95   ASP  H	   4.10 	   #peak   348 #SUP  0.88  #QF  0.88
 94  GLU  HB3	 95   ASP  H	   4.10 	   #peak   349 #SUP  0.90  #QF  0.90
 93  MET  HA	 95   ASP  H	   4.25 	   #peak   350 #SUP  0.30  #QF  0.30
 94  GLU  H	 95   ASP  H	   4.39 	   #peak   353 #SUP  0.97  #QF  0.97
 95  ASP  H	 96   ALA  H	   4.01 	   #peak   354 #SUP  0.59  #QF  0.59
 93  MET  HA	 96   ALA  H	   4.31 	   #peak   356 #SUP  0.92  #QF  0.55
 96  ALA  H	 96   ALA  QB	   3.26 	   #peak   359 #SUP  1.00
 91  THR  QG2	 96   ALA  H	   4.36 	   #peak   360 #SUP  0.93  #QF  0.93
 49  THR  H	 49   THR  QG2     4.25 	   #peak   361 #SUP  0.62  #QF  0.62
 98  GLU  H	 98   GLU  HB3     4.04 	   #peak   362 #SUP  0.94  #QF  0.94
 99  ASN  HB2	100   LEU  H	   5.15 	   #peak   367 #SUP  0.98  #QF  0.82
 99  ASN  HB3	100   LEU  H	   5.15 	   #peak   367 #SUP  0.98  #QF  0.82
100  LEU  H	100   LEU  HB2     3.93 	   #peak   368 #SUP  0.91  #QF  0.91
100  LEU  H	100   LEU  HB3     3.93 	   #peak   369 #SUP  0.99  #QF  0.99
100  LEU  HB2	101   TYR  H	   4.25 	   #peak   370 #SUP  0.98  #QF  0.98
100  LEU  HB3	101   TYR  H	   4.25 	   #peak   371 #SUP  0.99  #QF  0.99
100  LEU  HA	101   TYR  H	   3.48 	   #peak   374 #SUP  0.97  #QF  0.97
102  PHE  H	102   PHE  HB2     4.01 	   #peak   375 #SUP  0.95  #QF  0.95
102  PHE  H	102   PHE  HB3     4.01 	   #peak   376 #SUP  0.98  #QF  0.98
101  TYR  HB2	102   PHE  H	   4.87 	   #peak   377 #SUP  0.95  #QF  0.88
101  TYR  HB3	102   PHE  H	   4.87 	   #peak   377 #SUP  0.95  #QF  0.88
 98  GLU  H	 98   GLU  HB2     4.04 	   #peak   384 #SUP  1.00
 69  LEU  HG	 92   THR  QG2     5.24 	   #peak    10 #SUP  0.88  #QF  0.59
 83  THR  HA	 92   THR  HA	   3.78 	   #peak    17 #SUP  0.99  #QF  0.99
 69  LEU  QD2	 92   THR  HB	   4.64 	   #peak    43 #SUP  1.00  #QF  0.33
 92  THR  HA	 92   THR  QG2     3.65 	   #peak    45 #SUP  0.99  #QF  0.99
 84  LEU  HB3	 86   VAL  QG2     4.24 	   #peak    67 #SUP  0.50  #QF  0.50
 72  ARG  HA	 89   VAL  HA	   3.54 	   #peak    81 #SUP  0.98  #QF  0.98
 62  PHE  QD	 64   ALA  QB	   4.18 	   #peak   103 #SUP  0.30  #QF  0.30
 41  CYSS HA	 46   ASP  HB2     4.30 	   #peak   151 #SUP  0.76  #QF  0.76
 41  CYSS HA	 46   ASP  HB3     4.30 	   #peak   152 #SUP  0.86  #QF  0.86
 53  CYSS HA	 63   CYSS HA	   4.06 	   #peak   168 #SUP  0.42  #QF  0.42
 76  ASP  HA	 85   CYSS HB3     4.35 	   #peak   169 #SUP  0.96  #QF  0.96
 85  CYSS HA	 90   CYSS HA	   3.70 	   #peak   172 #SUP  0.53  #QF  0.53
 67  ARG  HB2	 79   CYSS HA	   4.42 	   #peak   192 #SUP  0.60  #QF  0.60
 56  PRO  HD2	 61   PRO  HA	   4.16 	   #peak   237 #SUP  1.00
 56  PRO  HD3	 61   PRO  HA	   4.16 	   #peak   238 #SUP  0.96  #QF  0.96
 60  LYS  HA	 61   PRO  HD3     3.51 	   #peak   259 #SUP  0.99  #QF  0.99
 60  LYS  HA	 61   PRO  HD2     3.75 	   #peak   260 #SUP  1.00
 51  LYS  HE2	 65   THR  QG2     5.50 	   #peak   313 #SUP  0.88  #QF  0.62
 51  LYS  HE3	 65   THR  QG2     5.50 	   #peak   313 #SUP  0.88  #QF  0.62
 51  LYS  HG2	 65   THR  HA	   4.32 	   #peak   329 #SUP  0.89  #QF  0.83
 51  LYS  HD3	 65   THR  HA	   4.89 	   #peak   329 #SUP  0.89  #QF  0.83
 76  ASP  HA	 85   CYSS HB2     4.35 	   #peak   347 #SUP  0.96  #QF  0.96
 91  THR  QG2	 95   ASP  HB3     4.23 	   #peak   358 #SUP  0.88  #QF  0.88
 67  ARG  HB3	 71   ARG  HB2     4.21 	   #peak   446 #SUP  0.89  #QF  0.89
 94  GLU  HB2	 95   ASP  HA	   4.83 	   #peak   492 #SUP  0.85  #QF  0.85
 69  LEU  HA	 90   CYSS HB3     4.39 	   #peak   547 #SUP  0.86  #QF  0.86
 69  LEU  HA	 90   CYSS HB2     4.39 	   #peak   548 #SUP  0.96  #QF  0.96
 69  LEU  HB2	 69   LEU  QD2     3.74 	   #peak   553 #SUP  1.00
 55  GLN  HA	 56   PRO  HD3     3.99 	   #peak   596 #SUP  0.99  #QF  0.99
 55  GLN  HA	 56   PRO  HD2     3.99 	   #peak   597 #SUP  1.00
 55  GLN  HA	 61   PRO  HA	   4.10 	   #peak   598 #SUP  0.98  #QF  0.98
 74  GLN  HA	 74   GLN  HG2     3.86 	   #peak   616 #SUP  0.59  #QF  0.59
 74  GLN  HA	 74   GLN  HG3     3.86 	   #peak   617 #SUP  0.99  #QF  0.99
 71  ARG  HA	 71   ARG  HD2     3.71 	   #peak   646 #SUP  0.99  #QF  0.99
 45  THR  HA	 45   THR  QG2     3.24 	   #peak     6 #SUP  0.98  #QF  0.98
 49  THR  HA	 49   THR  QG2     3.26 	   #peak    10 #SUP  0.94  #QF  0.44
 65  THR  HA	 65   THR  QG2     3.35 	   #peak    14 #SUP  0.99  #QF  0.59
 83  THR  HB	 92   THR  HA	   4.20 	   #peak    19 #SUP  0.96  #QF  0.96
 83  THR  HA	 83   THR  QG2     3.35 	   #peak    21 #SUP  0.99  #QF  0.99
 83  THR  QG2	 92   THR  HA	   3.50 	   #peak    22 #SUP  0.98  #QF  0.98
 83  THR  QG2	 92   THR  HB	   4.21 	   #peak    23 #SUP  1.00
 83  THR  QG2	 92   THR  QG2     3.58 	   #peak    25 #SUP  0.98  #QF  0.98
 91  THR  QG2	 96   ALA  HA	   3.87 	   #peak    33 #SUP  0.66  #QF  0.66
 91  THR  QG2	 95   ASP  HB2     4.23 	   #peak    34 #SUP  0.89  #QF  0.89
 86  VAL  HB	 91   THR  QG2     3.71 	   #peak    36 #SUP  0.96  #QF  0.96
 86  VAL  QG1	 91   THR  QG2     3.49 	   #peak    37 #SUP  0.99  #QF  0.99
 86  VAL  QG2	 91   THR  QG2     3.33 	   #peak    38 #SUP  0.98  #QF  0.98
 69  LEU  QD1	 92   THR  QG2     3.38 	   #peak    46 #SUP  0.99  #QF  0.99
 69  LEU  QD2	 92   THR  QG2     3.31 	   #peak    47 #SUP  0.96  #QF  0.84
 97  THR  HA	 97   THR  QG2     3.50 	   #peak    48 #SUP  0.99  #QF  0.99
 26  ILE  HA	 26   ILE  QG2     3.94 	   #peak    59 #SUP  1.00
 86  VAL  HA	 86   VAL  QG2     3.29 	   #peak    65 #SUP  1.00
 86  VAL  HA	 86   VAL  QG1     3.06 	   #peak    66 #SUP  0.93  #QF  0.93
 86  VAL  QG1	 96   ALA  HA	   4.48 	   #peak    67 #SUP  0.98  #QF  0.98
 86  VAL  QG2	 91   THR  HB	   3.73 	   #peak    68 #SUP  0.99  #QF  0.99
 86  VAL  QG1	 91   THR  HB	   4.64 	   #peak    69 #SUP  0.87  #QF  0.87
 84  LEU  HB2	 86   VAL  QG2     4.24 	   #peak    72 #SUP  0.81  #QF  0.81
 86  VAL  QG2	 96   ALA  QB	   3.70 	   #peak    73 #SUP  0.89  #QF  0.89
 86  VAL  HB	 91   THR  HB	   4.06 	   #peak    83 #SUP  0.97  #QF  0.97
 89  VAL  HA	 89   VAL  QG1     3.92 	   #peak    91 #SUP  1.00
 72  ARG  HD2	 89   VAL  QG2     5.50 	   #peak    96 #SUP  0.97  #QF  0.74
 72  ARG  HD3	 89   VAL  QG2     5.50 	   #peak    96 #SUP  0.97  #QF  0.74
 89  VAL  HA	 89   VAL  QG2     3.92 	   #peak    98 #SUP  1.00
 72  ARG  HA	 89   VAL  QG2     4.28 	   #peak    99 #SUP  0.96  #QF  0.96
 75  ARG  HD2	 77   ALA  QB	   5.26 	   #peak   107 #SUP  0.69  #QF  0.30
 75  ARG  HD3	 77   ALA  QB	   5.26 	   #peak   107 #SUP  0.69  #QF  0.30
 93  MET  QE	 96   ALA  QB	   5.50 	   #peak   113 #SUP  0.54  #QF  0.32
 86  VAL  QG1	 96   ALA  QB	   3.86 	   #peak   116 #SUP  0.69  #QF  0.69
 54  LEU  HA	 64   ALA  QB	   4.46 	   #peak   121 #SUP  0.79  #QF  0.79
101  TYR  HA	101   TYR  QD	   4.08 	   #peak   143 #SUP  0.99  #QF  0.99
 93  MET  HA	 96   ALA  QB	   3.95 	   #peak   157 #SUP  0.75  #QF  0.75
 93  MET  HG2	 93   MET  QE	   4.11 	   #peak   161 #SUP  1.00  #QF  0.98
 93  MET  HG3	 93   MET  QE	   4.11 	   #peak   161 #SUP  1.00  #QF  0.98
 93  MET  HG2	 96   ALA  QB	   5.50 	   #peak   163 #SUP  0.98  #QF  0.44
 93  MET  HG3	 96   ALA  QB	   5.50 	   #peak   163 #SUP  0.98  #QF  0.44
 44  ASP  HA	 53   CYSS HB2     4.35 	   #peak   185 #SUP  0.98  #QF  0.98
 44  ASP  HA	 53   CYSS HB3     4.35 	   #peak   186 #SUP  0.96  #QF  0.96
 72  ARG  HA	 72   ARG  HD2     5.42 	   #peak   218 #SUP  0.99  #QF  0.93
 72  ARG  HA	 72   ARG  HD3     5.42 	   #peak   218 #SUP  0.99  #QF  0.93
 55  GLN  HA	 61   PRO  HD3     4.67 	   #peak   287 #SUP  0.92  #QF  0.92
 51  LYS  HA	 65   THR  HA	   4.17 	   #peak   336 #SUP  0.73  #QF  0.73
 51  LYS  HG3	 65   THR  HA	   4.32 	   #peak   339 #SUP  0.93  #QF  0.93
 51  LYS  HE2	 65   THR  HA	   4.93 	   #peak   351 #SUP  0.74  #QF  0.57
 51  LYS  HE3	 65   THR  HA	   4.93 	   #peak   351 #SUP  0.74  #QF  0.57
 83  THR  QG2	 91   THR  HA	   4.54 	   #peak   378 #SUP  0.73  #QF  0.73
 57  ARG  HA	 57   ARG  HG2     4.23 	   #peak   472 #SUP  0.99  #QF  0.99
 57  ARG  HA	 57   ARG  HG3     4.23 	   #peak   483 #SUP  0.99  #QF  0.99
 70  ARG  HA	 70   ARG  HG2     3.80 	   #peak   514 #SUP  0.95  #QF  0.95
 70  ARG  HA	 70   ARG  HD2     4.61 	   #peak   535 #SUP  0.98  #QF  0.98
 70  ARG  HA	 70   ARG  HD3     4.61 	   #peak   536 #SUP  1.00
 72  ARG  HD2	 89   VAL  QG1     5.50 	   #peak   538 #SUP  0.61  #QF  0.36
 72  ARG  HD3	 89   VAL  QG1     5.50 	   #peak   538 #SUP  0.61  #QF  0.36
 71  ARG  HA	 71   ARG  HG3     4.21 	   #peak   554 #SUP  0.92  #QF  0.92
 71  ARG  HA	 71   ARG  HG2     4.21 	   #peak   555 #SUP  1.00
 75  ARG  HA	 75   ARG  HD2     5.50 	   #peak   581 #SUP  0.98  #QF  0.89
 75  ARG  HA	 75   ARG  HD3     5.50 	   #peak   581 #SUP  0.98  #QF  0.89
 94  GLU  HB3	 95   ASP  HA	   4.83 	   #peak   611 #SUP  0.98  #QF  0.98
 69  LEU  HA	 69   LEU  QD2     3.34 	   #peak   642 #SUP  0.97  #QF  0.97
 69  LEU  QD2	 83   THR  HB	   4.13 	   #peak   643 #SUP  0.38  #QF  0.38
 21  LEU  HA	 21   LEU  QD2     4.86 	   #peak   645 #SUP  0.85  #QF  0.85
 42  LEU  HA	 42   LEU  QD1     3.78 	   #peak   650 #SUP  0.94  #QF  0.37
 42  LEU  HB2	 42   LEU  QD1     3.91 	   #peak   656 #SUP  1.00
 42  LEU  HB2	 42   LEU  QD2     3.91 	   #peak   656 #SUP  1.00
 42  LEU  HB3	 42   LEU  QD1     3.91 	   #peak   657 #SUP  1.00
 42  LEU  HB3	 42   LEU  QD2     3.91 	   #peak   657 #SUP  1.00
 42  LEU  HA	 42   LEU  HG	   3.90 	   #peak   658 #SUP  0.99  #QF  0.99
 42  LEU  HA	 42   LEU  QD2     3.78 	   #peak   662 #SUP  0.93  #QF  0.93
 54  LEU  HB2	 64   ALA  QB	   4.00 	   #peak   672 #SUP  1.00
 54  LEU  HA	 54   LEU  QD1     4.24 	   #peak   682 #SUP  0.99  #QF  0.99
 54  LEU  HA	 54   LEU  QD2     4.24 	   #peak   691 #SUP  0.97  #QF  0.97
 52  PHE  QE	 54   LEU  QD2     4.36 	   #peak   695 #SUP  1.00
 69  LEU  HA	 69   LEU  HG	   4.01 	   #peak   699 #SUP  0.99  #QF  0.99
 69  LEU  HB3	 69   LEU  QD2     3.74 	   #peak   711 #SUP  1.00
 69  LEU  HB3	 69   LEU  QD1     3.57 	   #peak   713 #SUP  0.98  #QF  0.98
 69  LEU  HB2	 69   LEU  QD1     3.57 	   #peak   715 #SUP  0.95  #QF  0.95
 69  LEU  HA	 69   LEU  QD1     3.83 	   #peak   717 #SUP  0.98  #QF  0.98
 69  LEU  QD1	 92   THR  HA	   4.38 	   #peak   718 #SUP  0.96  #QF  0.96
 69  LEU  QD2	 92   THR  HA	   4.92 	   #peak   719 #SUP  1.00  #QF  0.98
 21  LEU  HA	 21   LEU  QD1     4.86 	   #peak   720 #SUP  0.99  #QF  0.95
 69  LEU  QD2	 91   THR  HA	   3.59 	   #peak   721 #SUP  0.72  #QF  0.72
 69  LEU  QD1	 91   THR  HA	   4.12 	   #peak   722 #SUP  0.90  #QF  0.90
 84  LEU  HB2	 84   LEU  QD1     4.19 	   #peak   732 #SUP  1.00  #QF  0.95
 84  LEU  HB2	 84   LEU  QD2     4.19 	   #peak   732 #SUP  1.00  #QF  0.95
 84  LEU  HB3	 84   LEU  QD1     4.19 	   #peak   734 #SUP  1.00  #QF  0.98
 84  LEU  HB3	 84   LEU  QD2     4.19 	   #peak   734 #SUP  1.00  #QF  0.98
 84  LEU  HA	 84   LEU  QD1     4.40 	   #peak   745 #SUP  1.00
 84  LEU  HA	 84   LEU  QD2     4.40 	   #peak   751 #SUP  0.88  #QF  0.88
100  LEU  HB2	100   LEU  QD1     4.23 	   #peak   755 #SUP  0.84  #QF  0.84
100  LEU  HB2	100   LEU  QD2     4.23 	   #peak   756 #SUP  0.96  #QF  0.83
 32  LEU  HA	 32   LEU  QD1     4.91 	   #peak   771 #SUP  0.93  #QF  0.65
 32  LEU  HA	 32   LEU  QD2     4.91 	   #peak   771 #SUP  0.93  #QF  0.65
100  LEU  HA	100   LEU  QD1     4.48 	   #peak   772 #SUP  1.00
 37  LYS  HA	 37   LYS  HD2     5.42 	   #peak   775 #SUP  0.97  #QF  0.90
 37  LYS  HA	 37   LYS  HD3     5.42 	   #peak   775 #SUP  0.97  #QF  0.90
100  LEU  HB3	100   LEU  QD1     4.23 	   #peak   782 #SUP  0.90  #QF  0.90
100  LEU  HB3	100   LEU  QD2     4.23 	   #peak   787 #SUP  0.92  #QF  0.92
100  LEU  HA	100   LEU  QD2     4.48 	   #peak   788 #SUP  0.64  #QF  0.64
 78  MET  HG3	 78   MET  QE	   4.15 	   #peak   834 #SUP  1.00
 78  MET  HG2	 78   MET  QE	   4.15 	   #peak   835 #SUP  1.00
 78  MET  HB2	 78   MET  QE	   4.24 	   #peak   837 #SUP  0.99  #QF  0.99
 78  MET  HA	 78   MET  QE	   4.30 	   #peak   838 #SUP  0.97  #QF  0.97
 73  CYSS HA	 78   MET  QE	   3.57 	   #peak   839 #SUP  0.85  #QF  0.85
 84  LEU  QD1	 93   MET  QE	   4.73 	   #peak   842 #SUP  0.85  #QF  0.78
 84  LEU  QD2	 93   MET  QE	   4.73 	   #peak   842 #SUP  0.85  #QF  0.78
 73  CYSS HB2	 78   MET  QE	   4.59 	   #peak   844 #SUP  0.96  #QF  0.96
 73  CYSS HB3	 78   MET  QE	   4.59 	   #peak   845 #SUP  0.99  #QF  0.99
 52  PHE  QE	 78   MET  QE	   4.15 	   #peak   846 #SUP  0.95  #QF  0.95
 52  PHE  QD	 78   MET  QE	   4.91 	   #peak   848 #SUP  0.93  #QF  0.93
101  TYR  HA	102   PHE  QD	   4.37 	   #peak   855 #SUP  0.35  #QF  0.35
 78  MET  HB3	 78   MET  QE	   4.24 	   #peak   878 #SUP  0.99  #QF  0.99
 51  LYS  HD2	 65   THR  HA	   4.89 	   #peak   889 #SUP  0.85  #QF  0.85
 67  ARG  HB3	 71   ARG  HB3     4.21 	   #peak   901 #SUP  0.38  #QF  0.38
 71  ARG  HA	 71   ARG  HD3     3.71 	   #peak   908 #SUP  0.92  #QF  0.92
 70  ARG  HA	 70   ARG  HG3     3.80 	   #peak   914 #SUP  0.99  #QF  0.99
 52  PHE  QD	 78   MET  HA	   4.17 	   #peak    12 #SUP  0.34  #QF  0.34
 52  PHE  HZ	 64   ALA  QB	   4.26 	   #peak    14 #SUP  0.57  #QF  0.57
 52  PHE  QE	 54   LEU  HA	   4.29 	   #peak    19 #SUP  0.40  #QF  0.40
 52  PHE  HZ	 78   MET  QE	   4.38 	   #peak    21 #SUP  0.43  #QF  0.43
 52  PHE  QE	 54   LEU  QD1     4.36 	   #peak    22 #SUP  0.69  #QF  0.69
 52  PHE  QD	 53   CYSS HA	   4.27 	   #peak    26 #SUP  0.36  #QF  0.36
 52  PHE  QE	 54   LEU  HB3     4.21 	   #peak    27 #SUP  0.95  #QF  0.95
 52  PHE  QE	 64   ALA  QB	   4.01 	   #peak    28 #SUP  0.78  #QF  0.36
 52  PHE  QE	 54   LEU  HB2     4.47 	   #peak    29 #SUP  0.58  #QF  0.58
102  PHE  HA	102   PHE  QD	   5.03 	   #peak    30 #SUP  0.99  #QF  0.65
 54  LEU  HB3	 62   PHE  QE	   4.67 	   #peak    31 #SUP  0.77  #QF  0.41
 72  ARG  HA	 89   VAL  QG1     4.28 	   #peak    53 #SUP  0.76  #QF  0.23
 91  THR  HA	 91   THR  QG2     3.66 	   #peak    54 #SUP  0.62  #QF  0.62
 21  LEU  HA	 21   LEU  QQD     3.66 	   #peak   645
 27  ARG  QB	 27   ARG  QD	   3.26 	   #peak   380
 32  LEU  HA	 32   LEU  QQD     4.16 	   #peak   771
 37  LYS  HA	 37   LYS  QD	   4.65 	   #peak   775
 40  GLN  HA	 40   GLN  QG	   3.61 	   #peak   590
 40  GLN  QB	 41   CYSS H	   3.65 	   #peak    53
 40  GLN  QG	 41   CYSS H	   5.15 	   #peak    55
 41  CYSS HA	 46   ASP  QB	   3.73 	   #peak   151
 41  CYSS QB	 42   LEU  H	   3.87 	   #peak    62
 41  CYSS QB	 43   SER  H	   3.75 	   #peak    69
 41  CYSS QB	 46   ASP  H	   4.20 	   #peak    15
 41  CYSS QB	 46   ASP  QB	   3.74 	   #peak   155
 42  LEU  H	 42   LEU  QB	   3.64 	   #peak    64
 42  LEU  H	 42   LEU  QQD     4.36 	   #peak    65
 42  LEU  HA	 42   LEU  QQD     3.03 	   #peak   662
 42  LEU  QB	 43   SER  H	   3.54 	   #peak    67
 43  SER  H	 46   ASP  QB	   3.93 	   #peak    68
 44  ASP  HA	 53   CYSS QB	   3.80 	   #peak   186
 44  ASP  QB	 53   CYSS QB	   4.06 	   #peak   416
 46  ASP  H	 46   ASP  QB	   3.29 	   #peak    14
 47  CYSS QB	 51   LYS  H	   4.25 	   #peak    43
 47  CYSS QB	 51   LYS  HA	   5.34 	   #peak   335
 47  CYSS QB	 51   LYS  QB	   3.87 	   #peak   161
 48  ASN  QB	 49   THR  H	   3.72 	   #peak    88
 49  THR  QG2	 50   ARG  QG	   4.10 	   #peak    11
 49  THR  QG2	 50   ARG  QD	   4.27 	   #peak   383
 51  LYS  H	 51   LYS  QG	   5.00 	   #peak    40
 51  LYS  H	 51   LYS  QD	   5.34 	   #peak    40
 51  LYS  QB	 52   PHE  H	   3.63 	   #peak    92
 51  LYS  QG	 52   PHE  H	   4.82 	   #peak    93
 51  LYS  QG	 65   THR  HA	   3.66 	   #peak   339
 51  LYS  QG	 66   CYSS H	   4.03 	   #peak   163
 51  LYS  QD	 52   PHE  H	   5.34 	   #peak    93
 51  LYS  QD	 65   THR  HA	   4.20 	   #peak   889
 51  LYS  QE	 65   THR  HA	   4.22 	   #peak   351
 51  LYS  QE	 65   THR  QG2     4.77 	   #peak   313
 52  PHE  H	 52   PHE  QB	   3.68 	   #peak    95
 52  PHE  QB	 53   CYSS H	   3.71 	   #peak   105
 52  PHE  QE	 54   LEU  QQD     3.56 	   #peak    22
 52  PHE  HZ	 54   LEU  QQD     4.11 	   #peak    15
 53  CYSS H	 53   CYSS QB	   3.52 	   #peak    25
 54  LEU  HA	 54   LEU  QQD     3.54 	   #peak   682
 54  LEU  QQD	 55   GLN  H	   3.48 	   #peak   114
 54  LEU  QQD	 56   PRO  QG	   4.06 	   #peak   689
 54  LEU  QQD	 56   PRO  QD	   4.35 	   #peak   692
 54  LEU  QQD	 62   PHE  H	   5.07 	   #peak   138
 54  LEU  QQD	 62   PHE  QD	   3.74 	   #peak   693
 54  LEU  QQD	 62   PHE  QE	   3.84 	   #peak   694
 54  LEU  QQD	 64   ALA  QB	   3.79 	   #peak   123
 54  LEU  QQD	 78   MET  QE	   3.84 	   #peak   836
 55  GLN  H	 55   GLN  QG	   3.76 	   #peak   110
 55  GLN  HA	 56   PRO  QD	   3.48 	   #peak   596
 55  GLN  HA	 61   PRO  QB	   4.43 	   #peak   260
 55  GLN  HA	 61   PRO  QG	   5.09 	   #peak   273
 55  GLN  QB	 61   PRO  QG	   4.42 	   #peak   522
 56  PRO  QB	 59   GLU  H	   3.48 	   #peak   122
 56  PRO  QG	 59   GLU  H	   4.33 	   #peak   121
 56  PRO  QD	 61   PRO  HA	   3.61 	   #peak   238
 56  PRO  QD	 61   PRO  QB	   4.52 	   #peak   251
 56  PRO  QD	 62   PHE  H	   4.26 	   #peak   141
 57  ARG  HA	 57   ARG  QG	   3.63 	   #peak   483
 57  ARG  QB	 57   ARG  QD	   3.28 	   #peak   490
 57  ARG  QB	 58   ASP  H	   4.30 	   #peak   120
 58  ASP  H	 58   ASP  QB	   3.63 	   #peak   152
 59  GLU  H	 59   GLU  QB	   3.47 	   #peak   123
 59  GLU  H	 59   GLU  QG	   4.78 	   #peak   125
 59  GLU  QB	 60   LYS  H	   3.32 	   #peak   136
 59  GLU  QG	 60   LYS  H	   3.92 	   #peak   137
 60  LYS  H	 60   LYS  QB	   3.27 	   #peak   134
 60  LYS  H	 60   LYS  QG	   3.60 	   #peak   133
 60  LYS  HA	 60   LYS  QD	   4.26 	   #peak   895
 60  LYS  HA	 61   PRO  QG	   4.49 	   #peak   272
 60  LYS  QB	 61   PRO  HD2     4.11 	   #peak   266
 60  LYS  QB	 61   PRO  HD3     4.41 	   #peak   267
 61  PRO  QB	 62   PHE  H	   3.55 	   #peak   139
 62  PHE  QB	 63   CYSS H	   3.81 	   #peak   150
 66  CYSS H	 66   CYSS QB	   3.50 	   #peak   166
 67  ARG  H	 67   ARG  QG	   4.16 	   #peak   177
 67  ARG  HA	 67   ARG  QG	   3.68 	   #peak   508
 67  ARG  HA	 67   ARG  QD	   3.94 	   #peak   510
 67  ARG  HB3	 71   ARG  QB	   3.38 	   #peak   901
 67  ARG  QG	 71   ARG  QB	   4.51 	   #peak   809
 67  ARG  QD	 71   ARG  QB	   4.62 	   #peak   547
 67  ARG  QD	 71   ARG  QG	   4.17 	   #peak   384
 68  GLY  H	 71   ARG  QG	   4.22 	   #peak   179
 69  LEU  H	 69   LEU  QB	   3.14 	   #peak   184
 69  LEU  HA	 90   CYSS QB	   3.83 	   #peak   548
 69  LEU  QB	 69   LEU  QD1     3.10 	   #peak   715
 69  LEU  QB	 69   LEU  QD2     3.26 	   #peak   711
 69  LEU  QB	 70   ARG  H	   4.15 	   #peak   188
 69  LEU  QB	 70   ARG  QG	   3.86 	   #peak   433
 70  ARG  H	 70   ARG  QG	   3.58 	   #peak   189
 70  ARG  H	 90   CYSS QB	   4.50 	   #peak   192
 70  ARG  HA	 70   ARG  QG	   3.24 	   #peak   514
 70  ARG  HA	 70   ARG  QD	   3.75 	   #peak   535
 70  ARG  HA	 89   VAL  QQG     3.83 	   #peak    97
 71  ARG  H	 71   ARG  QB	   3.35 	   #peak   204
 71  ARG  H	 71   ARG  QG	   3.84 	   #peak   202
 71  ARG  H	 71   ARG  QD	   4.62 	   #peak   201
 71  ARG  H	 89   VAL  QQG     5.16 	   #peak   207
 71  ARG  HA	 71   ARG  QD	   3.22 	   #peak   908
 71  ARG  HA	 72   ARG  QG	   4.49 	   #peak   573
 71  ARG  QB	 72   ARG  H	   3.84 	   #peak   211
 71  ARG  QG	 72   ARG  H	   4.79 	   #peak   208
 71  ARG  QD	 72   ARG  H	   3.96 	   #peak   212
 72  ARG  H	 72   ARG  QB	   3.18 	   #peak   210
 72  ARG  H	 72   ARG  QG	   3.28 	   #peak   210
 72  ARG  HA	 72   ARG  QD	   4.64 	   #peak   218
 72  ARG  HA	 89   VAL  QQG     3.45 	   #peak    99
 72  ARG  QB	 72   ARG  QD	   3.18 	   #peak   537
 72  ARG  QB	 73   CYSS H	   3.43 	   #peak   221
 72  ARG  QB	 89   VAL  HA	   4.46 	   #peak    80
 72  ARG  QB	 89   VAL  QQG     4.76 	   #peak   571
 72  ARG  QG	 73   CYSS H	   5.34 	   #peak   222
 72  ARG  QG	 89   VAL  HA	   5.04 	   #peak    80
 72  ARG  QG	 89   VAL  QQG     5.06 	   #peak    95
 72  ARG  QD	 89   VAL  QQG     3.91 	   #peak   538
 73  CYSS H	 88   ASP  QB	   4.82 	   #peak   220
 73  CYSS H	 89   VAL  QQG     4.76 	   #peak   223
 73  CYSS QB	 74   GLN  H	   3.61 	   #peak   228
 73  CYSS QB	 75   ARG  H	   3.75 	   #peak   233
 73  CYSS QB	 78   MET  QE	   3.86 	   #peak   844
 74  GLN  H	 74   GLN  QB	   3.45 	   #peak   224
 74  GLN  HA	 74   GLN  QG	   3.39 	   #peak   616
 74  GLN  QB	 75   ARG  H	   3.86 	   #peak   237
 74  GLN  QG	 75   ARG  H	   4.92 	   #peak   235
 75  ARG  H	 78   MET  QB	   4.30 	   #peak   239
 75  ARG  H	 78   MET  QG	   3.94 	   #peak   240
 75  ARG  QB	 75   ARG  QD	   3.34 	   #peak   472
 75  ARG  QB	 77   ALA  QB	   4.26 	   #peak   112
 75  ARG  QB	 78   MET  QB	   4.31 	   #peak   470
 75  ARG  QD	 77   ALA  QB	   4.59 	   #peak   107
 75  ARG  QD	 78   MET  QB	   4.21 	   #peak   583
 75  ARG  QD	 78   MET  QG	   4.17 	   #peak   471
 76  ASP  HA	 85   CYSS QB	   3.79 	   #peak   347
 76  ASP  QB	 77   ALA  H	   3.66 	   #peak   243
 76  ASP  QB	 77   ALA  QB	   4.21 	   #peak    97
 76  ASP  QB	 84   LEU  QQD     4.00 	   #peak   749
 76  ASP  QB	 85   CYSS QB	   3.70 	   #peak   633
 77  ALA  H	 78   MET  QG	   4.89 	   #peak   245
 77  ALA  QB	 78   MET  QG	   4.31 	   #peak   117
 78  MET  H	 78   MET  QB	   3.56 	   #peak   250
 78  MET  H	 78   MET  QG	   3.66 	   #peak   252
 78  MET  QB	 78   MET  QE	   3.73 	   #peak   837
 78  MET  QG	 78   MET  QE	   3.53 	   #peak   835
 79  CYSS H	 79   CYSS QB	   3.27 	   #peak   227
 79  CYSS QB	 80   CYSS H	   3.74 	   #peak    32
 80  CYSS H	 80   CYSS QB	   3.36 	   #peak    35
 80  CYSS QB	 81   PRO  QD	   3.79 	   #peak   187
 82  GLY  QA	 83   THR  QG2     4.19 	   #peak   377
 83  THR  HB	 90   CYSS QB	   4.34 	   #peak    21
 84  LEU  H	 84   LEU  QB	   3.43 	   #peak   274
 84  LEU  H	 84   LEU  QQD     4.35 	   #peak   273
 84  LEU  HA	 84   LEU  QQD     3.26 	   #peak   751
 84  LEU  QB	 85   CYSS H	   3.59 	   #peak   277
 84  LEU  HG	 93   MET  QG	   5.34 	   #peak   163
 84  LEU  QQD	 85   CYSS H	   3.70 	   #peak   276
 84  LEU  QQD	 85   CYSS QB	   5.28 	   #peak   750
 84  LEU  QQD	 93   MET  HA	   4.09 	   #peak   159
 84  LEU  QQD	 93   MET  QB	   4.84 	   #peak   742
 84  LEU  QQD	 93   MET  QG	   4.61 	   #peak   141
 84  LEU  QQD	 93   MET  QE	   3.91 	   #peak   842
 84  LEU  QQD	 96   ALA  QB	   4.21 	   #peak   114
 87  ASN  QB	 88   ASP  H	   4.02 	   #peak   302
 88  ASP  H	 89   VAL  QQG     4.47 	   #peak   303
 88  ASP  QB	 89   VAL  H	   4.31 	   #peak   306
 89  VAL  H	 89   VAL  QQG     3.26 	   #peak   304
 89  VAL  QQG	 90   CYSS H	   3.64 	   #peak   319
 90  CYSS H	 90   CYSS QB	   3.38 	   #peak   316
 90  CYSS QB	 91   THR  H	   3.96 	   #peak   324
 91  THR  QG2	 95   ASP  QB	   3.67 	   #peak   358
 93  MET  H	 93   MET  QB	   3.42 	   #peak   338
 93  MET  H	 93   MET  QG	   4.61 	   #peak   339
 93  MET  HA	 93   MET  QG	   3.71 	   #peak   160
 93  MET  QB	 93   MET  QE	   4.21 	   #peak   840
 93  MET  QB	 94   GLU  H	   4.00 	   #peak   347
 93  MET  QB	 96   ALA  QB	   5.34 	   #peak   113
 93  MET  QG	 93   MET  QE	   3.61 	   #peak   161
 94  GLU  H	 94   GLU  QB	   3.42 	   #peak   346
 94  GLU  HA	 94   GLU  QG	   3.66 	   #peak   617
 94  GLU  QB	 95   ASP  H	   3.52 	   #peak   348
 94  GLU  QB	 95   ASP  HA	   4.01 	   #peak   492
 95  ASP  H	 95   ASP  QB	   3.27 	   #peak   383
 95  ASP  QB	 96   ALA  H	   3.91 	   #peak   357
 98  GLU  H	 98   GLU  QB	   3.50 	   #peak   362
 98  GLU  HA	 98   GLU  QG	   3.69 	   #peak   618
 99  ASN  QB	100   LEU  H	   4.45 	   #peak   367
100  LEU  H	100   LEU  QB	   3.22 	   #peak   368
100  LEU  HA 	100   LEU  QQD     3.29 	   #peak   788
101  TYR  H	101   TYR  QB	   3.63 	   #peak   372
101  TYR  HA	102   PHE  QB	   4.20 	   #peak   851
101  TYR  QB	102   PHE  H	   4.23 	   #peak   377
102  PHE  H	102   PHE  QB	   3.52 	   #peak   376
105  LEU  HA	105   LEU  QQD     3.59 	   #peak   790
105  LEU  QB	106   GLU  H	   4.35 	   #peak    31
106  GLU  H	106   GLU  QB	   3.58 	   #peak    20
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET  18           H        MET  18 -59.233 -34.619  -7.203
    2    HA   MET  18           HA       MET  18 -59.294 -33.032  -8.845
    3    HB2  MET  18           HB1      MET  18 -61.727 -32.059  -7.331
    4    HB3  MET  18           HB2      MET  18 -61.169 -31.375  -8.865
    5    HG2  MET  18           HG1      MET  18 -62.107 -33.001 -10.066
    6    HG3  MET  18           HG2      MET  18 -61.463 -34.254  -9.001
    7    HE1  MET  18           HE1      MET  18 -65.246 -32.189  -9.419
    8    HE2  MET  18           HE2      MET  18 -64.821 -31.578  -7.820
    9    HE3  MET  18           HE3      MET  18 -63.711 -31.356  -9.173
   10    H    LEU  19           H        LEU  19 -57.744 -32.795  -6.433
   11    HA   LEU  19           HA       LEU  19 -57.594 -29.867  -6.150
   12    HB2  LEU  19           HB1      LEU  19 -57.326 -32.088  -4.252
   13    HB3  LEU  19           HB2      LEU  19 -56.034 -30.881  -4.141
   14    HG   LEU  19           HG       LEU  19 -57.842 -30.439  -2.552
   15   HD11  LEU  19          HD11      LEU  19 -57.251 -28.318  -2.775
   16   HD12  LEU  19          HD12      LEU  19 -58.409 -28.134  -4.094
   17   HD13  LEU  19          HD13      LEU  19 -56.748 -28.617  -4.439
   18   HD21  LEU  19          HD21      LEU  19 -59.714 -31.376  -3.744
   19   HD22  LEU  19          HD22      LEU  19 -59.544 -30.179  -5.029
   20   HD23  LEU  19          HD23      LEU  19 -60.033 -29.674  -3.411
   21    H    VAL  20           H        VAL  20 -56.104 -29.102  -7.505
   22    HA   VAL  20           HA       VAL  20 -53.907 -30.595  -8.487
   23    HB   VAL  20           HB       VAL  20 -53.129 -28.513  -9.480
   24   HG11  VAL  20          HG11      VAL  20 -54.995 -28.068 -10.895
   25   HG12  VAL  20          HG12      VAL  20 -55.065 -29.775 -10.454
   26   HG13  VAL  20          HG13      VAL  20 -56.134 -28.614  -9.665
   27   HG21  VAL  20          HG21      VAL  20 -55.059 -26.621  -8.871
   28   HG22  VAL  20          HG22      VAL  20 -54.665 -27.348  -7.314
   29   HG23  VAL  20          HG23      VAL  20 -53.390 -26.637  -8.303
   30    H    LEU  21           H        LEU  21 -51.754 -30.572  -7.950
   31    HA   LEU  21           HA       LEU  21 -51.086 -30.100  -5.245
   32    HB2  LEU  21           HB1      LEU  21 -49.743 -31.081  -7.667
   33    HB3  LEU  21           HB2      LEU  21 -48.674 -30.264  -6.513
   34    HG   LEU  21           HG       LEU  21 -50.446 -32.614  -5.847
   35   HD11  LEU  21          HD11      LEU  21 -48.671 -34.030  -6.147
   36   HD12  LEU  21          HD12      LEU  21 -47.473 -32.751  -5.950
   37   HD13  LEU  21          HD13      LEU  21 -48.390 -32.877  -7.452
   38   HD21  LEU  21          HD21      LEU  21 -48.494 -30.960  -4.291
   39   HD22  LEU  21          HD22      LEU  21 -48.789 -32.646  -3.864
   40   HD23  LEU  21          HD23      LEU  21 -50.118 -31.485  -3.846
   41    H    ASP  22           H        ASP  22 -49.938 -28.485  -4.264
   42    HA   ASP  22           HA       ASP  22 -49.111 -26.200  -5.911
   43    HB2  ASP  22           HB1      ASP  22 -50.204 -24.613  -4.572
   44    HB3  ASP  22           HB2      ASP  22 -51.401 -25.898  -4.777
   45    HD2  ASP  22           HD       ASP  22 -51.354 -26.705  -1.416
   46    H    PHE  23           H        PHE  23 -47.640 -24.713  -4.753
   47    HA   PHE  23           HA       PHE  23 -46.025 -26.161  -2.759
   48    HB2  PHE  23           HB1      PHE  23 -45.278 -24.727  -5.242
   49    HB3  PHE  23           HB2      PHE  23 -44.240 -24.432  -3.845
   50    HD1  PHE  23           HD1      PHE  23 -42.523 -25.890  -3.340
   51    HD2  PHE  23           HD2      PHE  23 -45.741 -27.232  -5.782
   52    HE1  PHE  23           HE1      PHE  23 -41.331 -28.005  -3.744
   53    HE2  PHE  23           HE2      PHE  23 -44.555 -29.348  -6.188
   54    HZ   PHE  23           HZ       PHE  23 -42.348 -29.737  -5.169
   55    H    ASN  24           H        ASN  24 -46.405 -22.840  -4.010
   56    HA   ASN  24           HA       ASN  24 -47.296 -21.758  -1.565
   57    HB2  ASN  24           HB1      ASN  24 -44.489 -22.204  -1.699
   58    HB3  ASN  24           HB2      ASN  24 -44.756 -20.460  -1.802
   59   HD21  ASN  24          HD21      ASN  24 -44.410 -19.625   0.124
   60   HD22  ASN  24          HD22      ASN  24 -45.036 -20.224   1.618
   61    H    ASN  25           H        ASN  25 -45.245 -20.961  -4.366
   62    HA   ASN  25           HA       ASN  25 -45.349 -19.291  -5.906
   63    HB2  ASN  25           HB1      ASN  25 -48.200 -19.834  -5.224
   64    HB3  ASN  25           HB2      ASN  25 -47.851 -18.368  -6.149
   65   HD21  ASN  25          HD21      ASN  25 -47.743 -21.843  -6.152
   66   HD22  ASN  25          HD22      ASN  25 -47.503 -22.035  -7.852
   67    H    ILE  26           H        ILE  26 -44.060 -17.965  -4.482
   68    HA   ILE  26           HA       ILE  26 -45.414 -15.480  -3.837
   69    HB   ILE  26           HB       ILE  26 -44.263 -15.383  -1.584
   70   HG12  ILE  26          HG11      ILE  26 -44.348 -18.347  -1.467
   71   HG13  ILE  26          HG12      ILE  26 -42.993 -17.636  -2.359
   72   HG21  ILE  26          HG21      ILE  26 -46.447 -17.429  -1.952
   73   HG22  ILE  26          HG22      ILE  26 -46.054 -16.594  -0.450
   74   HG23  ILE  26          HG23      ILE  26 -46.672 -15.684  -1.828
   75   HD11  ILE  26          HD11      ILE  26 -42.910 -16.138  -0.129
   76   HD12  ILE  26          HD12      ILE  26 -43.542 -17.649   0.525
   77   HD13  ILE  26          HD13      ILE  26 -42.009 -17.638  -0.345
   78    H    ARG  27           H        ARG  27 -43.992 -15.187  -5.812
   79    HA   ARG  27           HA       ARG  27 -41.162 -14.862  -5.187
   80    HB2  ARG  27           HB1      ARG  27 -42.793 -15.045  -7.659
   81    HB3  ARG  27           HB2      ARG  27 -41.345 -14.028  -7.739
   82    HG2  ARG  27           HG1      ARG  27 -39.901 -15.789  -7.466
   83    HG3  ARG  27           HG2      ARG  27 -41.104 -16.771  -6.613
   84    HD2  ARG  27           HD1      ARG  27 -41.062 -17.858  -8.636
   85    HD3  ARG  27           HD2      ARG  27 -42.354 -16.683  -8.921
   86    HE   ARG  27           HE       ARG  27 -39.938 -15.514  -9.697
   87   HH11  ARG  27          HH11      ARG  27 -42.038 -18.124 -10.643
   88   HH12  ARG  27          HH12      ARG  27 -41.592 -18.050 -12.315
   89   HH21  ARG  27          HH21      ARG  27 -39.341 -15.408 -11.896
   90   HH22  ARG  27          HH22      ARG  27 -40.057 -16.505 -13.027
   91    H    SER  28           H        SER  28 -40.564 -13.020  -4.263
   92    HA   SER  28           HA       SER  28 -41.143 -10.499  -5.472
   93    HB2  SER  28           HB1      SER  28 -42.066  -9.674  -3.101
   94    HB3  SER  28           HB2      SER  28 -43.143 -10.280  -4.371
   95    HG   SER  28           HG       SER  28 -42.154 -11.693  -2.123
   96    H    SER  29           H        SER  29 -39.172  -9.656  -5.408
   97    HA   SER  29           HA       SER  29 -37.845  -9.318  -2.847
   98    HB2  SER  29           HB1      SER  29 -35.641 -10.094  -4.052
   99    HB3  SER  29           HB2      SER  29 -36.723 -11.294  -3.323
  100    HG   SER  29           HG       SER  29 -35.911 -11.390  -5.723
  101    H    ALA  30           H        ALA  30 -37.084  -7.317  -2.724
  102    HA   ALA  30           HA       ALA  30 -35.697  -6.026  -4.846
  103    HB1  ALA  30           HB1      ALA  30 -37.558  -4.087  -4.714
  104    HB2  ALA  30           HB2      ALA  30 -37.538  -5.341  -5.954
  105    HB3  ALA  30           HB3      ALA  30 -38.583  -5.513  -4.543
  106    H    ASP  31           H        ASP  31 -34.113  -5.448  -3.450
  107    HA   ASP  31           HA       ASP  31 -34.526  -3.184  -1.783
  108    HB2  ASP  31           HB1      ASP  31 -35.342  -5.305  -0.448
  109    HB3  ASP  31           HB2      ASP  31 -33.609  -5.552  -0.198
  110    HD2  ASP  31           HD       ASP  31 -33.619  -3.265   2.330
  111    H    LEU  32           H        LEU  32 -32.844  -2.381  -3.058
  112    HA   LEU  32           HA       LEU  32 -30.194  -3.163  -2.147
  113    HB2  LEU  32           HB1      LEU  32 -30.902  -4.411  -4.317
  114    HB3  LEU  32           HB2      LEU  32 -30.620  -2.842  -5.091
  115    HG   LEU  32           HG       LEU  32 -28.475  -4.098  -3.423
  116   HD11  LEU  32          HD11      LEU  32 -29.581  -5.183  -5.859
  117   HD12  LEU  32          HD12      LEU  32 -28.344  -5.844  -4.789
  118   HD13  LEU  32          HD13      LEU  32 -27.893  -4.715  -6.068
  119   HD21  LEU  32          HD21      LEU  32 -28.700  -1.996  -5.519
  120   HD22  LEU  32          HD22      LEU  32 -27.195  -2.906  -5.390
  121   HD23  LEU  32          HD23      LEU  32 -27.795  -1.991  -4.006
  122    H    HIS  33           H        HIS  33 -29.183  -1.368  -1.568
  123    HA   HIS  33           HA       HIS  33 -28.895   0.890  -3.227
  124    HB2  HIS  33           HB1      HIS  33 -30.120   2.539  -1.790
  125    HB3  HIS  33           HB2      HIS  33 -31.166   1.440  -2.693
  126    HD1  HIS  33           HD1      HIS  33 -32.476  -0.356  -1.349
  127    HD2  HIS  33           HD2      HIS  33 -30.263   2.266   0.993
  128    HE1  HIS  33           HE1      HIS  33 -33.308  -0.688   1.002
  129    HE2  HIS  33           HE2      HIS  33 -31.956   0.916   2.433
  130    H    GLY  34           H        GLY  34 -27.548   2.538  -2.281
  131    HA2  GLY  34           HA2      GLY  34 -26.608   3.016   0.138
  132    HA3  GLY  34           HA3      GLY  34 -25.882   1.440  -0.143
  133    HA1  GLY  34           HA1      GLY  34 -26.718   3.319  -0.683
  134    H    ALA  35           H        ALA  35 -25.652   4.795  -0.691
  135    HA   ALA  35           HA       ALA  35 -22.999   4.608  -1.657
  136    HB1  ALA  35           HB1      ALA  35 -23.224   4.558  -3.862
  137    HB2  ALA  35           HB2      ALA  35 -24.965   4.362  -3.657
  138    HB3  ALA  35           HB3      ALA  35 -24.273   5.975  -3.820
  139    H    ARG  36           H        ARG  36 -22.096   6.294  -0.694
  140    HA   ARG  36           HA       ARG  36 -23.027   8.961  -1.124
  141    HB2  ARG  36           HB1      ARG  36 -23.257   9.437   1.374
  142    HB3  ARG  36           HB2      ARG  36 -24.595   8.586   0.588
  143    HG2  ARG  36           HG1      ARG  36 -23.708   6.441   1.431
  144    HG3  ARG  36           HG2      ARG  36 -22.441   7.340   2.282
  145    HD2  ARG  36           HD1      ARG  36 -23.909   8.253   3.817
  146    HD3  ARG  36           HD2      ARG  36 -25.292   8.089   2.729
  147    HE   ARG  36           HE       ARG  36 -24.654   5.523   3.227
  148   HH11  ARG  36          HH11      ARG  36 -25.159   8.269   5.309
  149   HH12  ARG  36          HH12      ARG  36 -25.746   7.320   6.635
  150   HH21  ARG  36          HH21      ARG  36 -25.425   4.264   4.966
  151   HH22  ARG  36          HH22      ARG  36 -25.896   5.043   6.439
  152    H    LYS  37           H        LYS  37 -21.099   9.785  -1.627
  153    HA   LYS  37           HA       LYS  37 -19.071   9.989   0.399
  154    HB2  LYS  37           HB1      LYS  37 -18.903   7.835  -1.416
  155    HB3  LYS  37           HB2      LYS  37 -17.703   9.027  -1.944
  156    HG2  LYS  37           HG1      LYS  37 -16.331   8.138  -0.440
  157    HG3  LYS  37           HG2      LYS  37 -17.338   8.929   0.787
  158    HD2  LYS  37           HD1      LYS  37 -18.373   6.998   1.403
  159    HD3  LYS  37           HD2      LYS  37 -18.295   6.319  -0.232
  160    HE2  LYS  37           HE1      LYS  37 -16.191   5.453   0.061
  161    HE3  LYS  37           HE2      LYS  37 -15.740   6.696   1.238
  162    HZ1  LYS  37           HZ1      LYS  37 -17.031   4.137   1.661
  163    HZ2  LYS  37           HZ2      LYS  37 -17.673   5.416   2.562
  164    HZ3  LYS  37           HZ3      LYS  37 -16.031   5.031   2.693
  165    H    GLY  38           H        GLY  38 -18.539  12.064   0.293
  166    HA2  GLY  38           HA2      GLY  38 -18.657  13.436  -2.300
  167    HA3  GLY  38           HA3      GLY  38 -18.650  14.213  -0.724
  168    HA1  GLY  38           HA1      GLY  38 -18.094  12.768  -2.180
  169    H    SER  39           H        SER  39 -16.426  11.664  -1.640
  170    HA   SER  39           HA       SER  39 -14.290  13.537  -2.214
  171    HB2  SER  39           HB1      SER  39 -14.610  12.997   0.403
  172    HB3  SER  39           HB2      SER  39 -13.609  11.608  -0.058
  173    HG   SER  39           HG       SER  39 -11.952  12.882  -0.227
  174    H    GLN  40           H        GLN  40 -12.147  12.204  -2.447
  175    HA   GLN  40           HA       GLN  40 -12.779  10.020  -4.259
  176    HB2  GLN  40           HB1      GLN  40 -10.687  11.993  -4.014
  177    HB3  GLN  40           HB2      GLN  40  -9.991  10.370  -4.134
  178    HG2  GLN  40           HG1      GLN  40 -12.026  11.477  -6.065
  179    HG3  GLN  40           HG2      GLN  40 -10.275  11.538  -6.310
  180   HE21  GLN  40          HE21      GLN  40 -13.083   9.691  -6.648
  181   HE22  GLN  40          HE22      GLN  40 -12.349   8.221  -7.182
  182    H    CYS  41           H        CYS  41 -10.603  10.566  -1.490
  183    HA   CYS  41           HA       CYS  41 -11.127   7.966  -0.427
  184    HB2  CYS  41           HB1      CYS  41  -8.950   6.983  -0.667
  185    HB3  CYS  41           HB2      CYS  41  -9.528   7.435  -2.272
  186    H    LEU  42           H        LEU  42 -10.315   7.698   1.674
  187    HA   LEU  42           HA       LEU  42  -9.474  10.200   2.931
  188    HB2  LEU  42           HB1      LEU  42 -10.920   7.766   3.797
  189    HB3  LEU  42           HB2      LEU  42  -9.867   8.528   5.002
  190    HG   LEU  42           HG       LEU  42 -11.139  10.692   4.474
  191   HD11  LEU  42          HD11      LEU  42 -13.038  10.665   3.248
  192   HD12  LEU  42          HD12      LEU  42 -13.435   9.005   3.693
  193   HD13  LEU  42          HD13      LEU  42 -12.224   9.320   2.450
  194   HD21  LEU  42          HD21      LEU  42 -11.971   8.352   6.060
  195   HD22  LEU  42          HD22      LEU  42 -13.206   9.585   5.805
  196   HD23  LEU  42          HD23      LEU  42 -11.671  10.017   6.559
  197    H    SER  43           H        SER  43  -8.383   6.945   2.316
  198    HA   SER  43           HA       SER  43  -5.698   7.685   3.110
  199    HB2  SER  43           HB1      SER  43  -5.461   5.590   4.522
  200    HB3  SER  43           HB2      SER  43  -6.441   6.884   5.233
  201    HG   SER  43           HG       SER  43  -7.363   4.710   5.334
  202    H    ASP  44           H        ASP  44  -4.226   5.635   2.796
  203    HA   ASP  44           HA       ASP  44  -4.454   4.893   0.076
  204    HB2  ASP  44           HB1      ASP  44  -2.440   3.645   0.390
  205    HB3  ASP  44           HB2      ASP  44  -2.309   5.106   1.379
  206    HD2  ASP  44           HD       ASP  44  -2.867   3.105   4.317
  207    H    THR  45           H        THR  45  -5.526   3.431   3.030
  208    HA   THR  45           HA       THR  45  -5.780   0.764   2.222
  209    HB   THR  45           HB       THR  45  -7.497   0.553   3.984
  210    HG1  THR  45           HG1      THR  45  -8.623   2.284   4.416
  211   HG21  THR  45          HG21      THR  45  -5.107   2.227   4.765
  212   HG22  THR  45          HG22      THR  45  -5.150   0.469   4.624
  213   HG23  THR  45          HG23      THR  45  -6.093   1.278   5.876
  214    H    ASP  46           H        ASP  46  -7.664   3.569   1.451
  215    HA   ASP  46           HA       ASP  46 -10.022   2.207   0.614
  216    HB2  ASP  46           HB1      ASP  46  -8.967   4.967   0.515
  217    HB3  ASP  46           HB2      ASP  46 -10.092   4.541  -0.783
  218    HD2  ASP  46           HD       ASP  46 -11.511   4.636   2.923
  219    H    CYS  47           H        CYS  47  -6.987   2.998  -0.895
  220    HA   CYS  47           HA       CYS  47  -7.769   2.701  -3.591
  221    HB2  CYS  47           HB1      CYS  47  -5.446   3.393  -2.251
  222    HB3  CYS  47           HB2      CYS  47  -5.030   1.857  -3.014
  223    H    ASN  48           H        ASN  48  -6.293   0.869  -4.828
  224    HA   ASN  48           HA       ASN  48  -7.726  -1.502  -4.559
  225    HB2  ASN  48           HB1      ASN  48  -5.326  -0.615  -6.047
  226    HB3  ASN  48           HB2      ASN  48  -5.453  -2.358  -5.784
  227   HD21  ASN  48          HD21      ASN  48  -7.092  -3.518  -6.752
  228   HD22  ASN  48          HD22      ASN  48  -8.075  -2.864  -8.013
  229    H    THR  49           H        THR  49  -4.215  -1.321  -4.013
  230    HA   THR  49           HA       THR  49  -4.406  -2.524  -1.411
  231    HB   THR  49           HB       THR  49  -3.035  -4.182  -3.524
  232    HG1  THR  49           HG1      THR  49  -4.975  -5.576  -3.120
  233   HG21  THR  49          HG21      THR  49  -3.692  -4.518  -0.619
  234   HG22  THR  49          HG22      THR  49  -2.159  -4.773  -1.451
  235   HG23  THR  49          HG23      THR  49  -3.475  -5.928  -1.655
  236    H    ARG  50           H        ARG  50  -2.000  -2.600  -4.045
  237    HA   ARG  50           HA       ARG  50  -0.017  -1.503  -2.204
  238    HB2  ARG  50           HB1      ARG  50   0.159  -2.819  -4.913
  239    HB3  ARG  50           HB2      ARG  50   1.543  -1.997  -4.179
  240    HG2  ARG  50           HG1      ARG  50   1.907  -3.631  -2.668
  241    HG3  ARG  50           HG2      ARG  50   0.181  -3.971  -2.470
  242    HD2  ARG  50           HD1      ARG  50   0.101  -5.395  -4.302
  243    HD3  ARG  50           HD2      ARG  50   1.538  -4.672  -5.037
  244    HE   ARG  50           HE       ARG  50   2.803  -6.198  -3.918
  245   HH11  ARG  50          HH11      ARG  50  -0.250  -5.878  -2.276
  246   HH12  ARG  50          HH12      ARG  50   0.084  -7.139  -1.134
  247   HH21  ARG  50          HH21      ARG  50   3.254  -7.859  -2.421
  248   HH22  ARG  50          HH22      ARG  50   2.078  -8.264  -1.217
  249    H    LYS  51           H        LYS  51  -1.711   0.450  -2.624
  250    HA   LYS  51           HA       LYS  51  -0.238   2.283  -4.358
  251    HB2  LYS  51           HB1      LYS  51  -3.196   1.713  -4.522
  252    HB3  LYS  51           HB2      LYS  51  -2.500   3.236  -5.098
  253    HG2  LYS  51           HG1      LYS  51  -1.214   2.139  -6.763
  254    HG3  LYS  51           HG2      LYS  51  -1.578   0.547  -6.074
  255    HD2  LYS  51           HD1      LYS  51  -3.728   0.511  -6.905
  256    HD3  LYS  51           HD2      LYS  51  -3.839   2.279  -6.959
  257    HE2  LYS  51           HE1      LYS  51  -3.202   2.312  -9.096
  258    HE3  LYS  51           HE2      LYS  51  -1.737   1.401  -8.697
  259    HZ1  LYS  51           HZ1      LYS  51  -2.638  -0.203  -9.930
  260    HZ2  LYS  51           HZ2      LYS  51  -4.181   0.491  -9.901
  261    HZ3  LYS  51           HZ3      LYS  51  -3.672  -0.493  -8.623
  262    H    PHE  52           H        PHE  52  -0.254   4.414  -3.679
  263    HA   PHE  52           HA       PHE  52  -1.395   4.848  -1.005
  264    HB2  PHE  52           HB1      PHE  52   0.297   6.627  -0.754
  265    HB3  PHE  52           HB2      PHE  52   1.028   5.054  -1.075
  266    HD1  PHE  52           HD1      PHE  52   2.150   4.580  -3.161
  267    HD2  PHE  52           HD2      PHE  52   0.390   8.386  -2.429
  268    HE1  PHE  52           HE1      PHE  52   3.389   5.517  -5.069
  269    HE2  PHE  52           HE2      PHE  52   1.626   9.328  -4.336
  270    HZ   PHE  52           HZ       PHE  52   3.127   7.894  -5.660
  271    H    CYS  53           H        CYS  53  -2.545   6.717  -0.535
  272    HA   CYS  53           HA       CYS  53  -3.810   7.965  -2.840
  273    HB2  CYS  53           HB1      CYS  53  -4.495   7.503  -0.022
  274    HB3  CYS  53           HB2      CYS  53  -4.970   9.096  -0.617
  275    H    LEU  54           H        LEU  54  -2.315   9.407  -3.641
  276    HA   LEU  54           HA       LEU  54  -0.879  11.235  -1.987
  277    HB2  LEU  54           HB1      LEU  54   0.022  10.528  -4.119
  278    HB3  LEU  54           HB2      LEU  54  -1.385  11.205  -4.959
  279    HG   LEU  54           HG       LEU  54  -0.252  13.335  -3.523
  280   HD11  LEU  54          HD11      LEU  54   1.734  11.532  -3.652
  281   HD12  LEU  54          HD12      LEU  54   1.992  13.275  -3.721
  282   HD13  LEU  54          HD13      LEU  54   1.946  12.331  -5.210
  283   HD21  LEU  54          HD21      LEU  54   0.095  12.705  -6.447
  284   HD22  LEU  54          HD22      LEU  54   0.053  14.293  -5.681
  285   HD23  LEU  54          HD23      LEU  54  -1.409  13.306  -5.748
  286    H    GLN  55           H        GLN  55  -1.365  13.268  -1.379
  287    HA   GLN  55           HA       GLN  55  -3.807  14.492  -2.472
  288    HB2  GLN  55           HB1      GLN  55  -4.154  15.436  -0.122
  289    HB3  GLN  55           HB2      GLN  55  -4.523  13.722  -0.367
  290    HG2  GLN  55           HG1      GLN  55  -2.808  13.003   0.934
  291    HG3  GLN  55           HG2      GLN  55  -1.786  14.390   0.533
  292   HE21  GLN  55          HE21      GLN  55  -1.432  15.721   2.146
  293   HE22  GLN  55          HE22      GLN  55  -2.489  16.021   3.478
  294    HA   PRO  56           HA       PRO  56  -0.373  17.483  -2.965
  295    HB2  PRO  56           HB1      PRO  56  -1.376  18.578  -5.268
  296    HB3  PRO  56           HB2      PRO  56  -0.402  17.109  -5.231
  297    HG2  PRO  56           HG1      PRO  56  -3.385  17.411  -5.337
  298    HG3  PRO  56           HG2      PRO  56  -2.315  16.319  -6.292
  299    HD2  PRO  56           HD1      PRO  56  -3.755  15.460  -4.157
  300    HD3  PRO  56           HD2      PRO  56  -2.162  14.799  -4.566
  301    H    ARG  57           H        ARG  57  -0.349  19.761  -2.763
  302    HA   ARG  57           HA       ARG  57  -2.654  20.825  -1.385
  303    HB2  ARG  57           HB1      ARG  57   0.132  21.825  -1.925
  304    HB3  ARG  57           HB2      ARG  57  -1.107  22.891  -1.249
  305    HG2  ARG  57           HG1      ARG  57  -1.308  21.607   0.720
  306    HG3  ARG  57           HG2      ARG  57  -0.400  20.261   0.013
  307    HD2  ARG  57           HD1      ARG  57   1.607  21.742  -0.111
  308    HD3  ARG  57           HD2      ARG  57   0.679  22.979   0.747
  309    HE   ARG  57           HE       ARG  57   1.873  20.623   1.875
  310   HH11  ARG  57          HH11      ARG  57  -0.621  23.023   2.245
  311   HH12  ARG  57          HH12      ARG  57  -0.741  22.823   3.962
  312   HH21  ARG  57          HH21      ARG  57   1.725  20.349   4.135
  313   HH22  ARG  57          HH22      ARG  57   0.594  21.302   5.035
  314    H    ASP  58           H        ASP  58  -1.106  21.167  -4.491
  315    HA   ASP  58           HA       ASP  58  -2.696  23.485  -5.214
  316    HB2  ASP  58           HB1      ASP  58  -0.240  22.435  -6.060
  317    HB3  ASP  58           HB2      ASP  58  -1.334  22.207  -7.430
  318    HD2  ASP  58           HD       ASP  58  -1.784  25.710  -7.731
  319    H    GLU  59           H        GLU  59  -2.840  20.052  -5.495
  320    HA   GLU  59           HA       GLU  59  -5.183  20.308  -7.265
  321    HB2  GLU  59           HB1      GLU  59  -2.822  18.801  -7.655
  322    HB3  GLU  59           HB2      GLU  59  -4.110  17.644  -7.287
  323    HG2  GLU  59           HG1      GLU  59  -5.442  19.084  -9.058
  324    HG3  GLU  59           HG2      GLU  59  -3.804  19.465  -9.610
  325    HE2  GLU  59           HE       GLU  59  -3.311  16.269 -10.849
  326    H    LYS  60           H        LYS  60  -6.456  18.048  -7.070
  327    HA   LYS  60           HA       LYS  60  -7.236  17.914  -4.262
  328    HB2  LYS  60           HB1      LYS  60  -8.534  17.333  -6.869
  329    HB3  LYS  60           HB2      LYS  60  -9.033  16.333  -5.494
  330    HG2  LYS  60           HG1      LYS  60  -9.179  18.768  -4.354
  331    HG3  LYS  60           HG2      LYS  60  -9.530  19.185  -6.041
  332    HD2  LYS  60           HD1      LYS  60 -11.040  16.892  -5.589
  333    HD3  LYS  60           HD2      LYS  60 -11.185  17.819  -4.086
  334    HE2  LYS  60           HE1      LYS  60 -11.480  19.313  -6.645
  335    HE3  LYS  60           HE2      LYS  60 -12.790  18.220  -6.174
  336    HZ1  LYS  60           HZ1      LYS  60 -11.712  20.182  -4.252
  337    HZ2  LYS  60           HZ2      LYS  60 -13.226  19.429  -4.263
  338    HZ3  LYS  60           HZ3      LYS  60 -12.877  20.642  -5.390
  339    HA   PRO  61           HA       PRO  61  -5.579  13.938  -3.426
  340    HB2  PRO  61           HB1      PRO  61  -7.555  12.773  -1.932
  341    HB3  PRO  61           HB2      PRO  61  -6.534  14.081  -1.340
  342    HG2  PRO  61           HG1      PRO  61  -9.293  14.204  -2.510
  343    HG3  PRO  61           HG2      PRO  61  -8.636  15.028  -1.045
  344    HD2  PRO  61           HD1      PRO  61  -8.950  16.298  -3.424
  345    HD3  PRO  61           HD2      PRO  61  -7.631  16.677  -2.304
  346    H    PHE  62           H        PHE  62  -5.493  11.880  -4.228
  347    HA   PHE  62           HA       PHE  62  -7.759  10.542  -5.339
  348    HB2  PHE  62           HB1      PHE  62  -7.143  10.532  -7.655
  349    HB3  PHE  62           HB2      PHE  62  -7.223  12.213  -7.127
  350    HD1  PHE  62           HD1      PHE  62  -5.136   9.651  -8.529
  351    HD2  PHE  62           HD2      PHE  62  -5.103  13.448  -6.606
  352    HE1  PHE  62           HE1      PHE  62  -2.841  10.033  -9.330
  353    HE2  PHE  62           HE2      PHE  62  -2.809  13.837  -7.405
  354    HZ   PHE  62           HZ       PHE  62  -1.675  12.129  -8.770
  355    H    CYS  63           H        CYS  63  -7.006   8.507  -6.560
  356    HA   CYS  63           HA       CYS  63  -5.025   7.217  -4.892
  357    HB2  CYS  63           HB1      CYS  63  -7.252   6.399  -6.583
  358    HB3  CYS  63           HB2      CYS  63  -5.824   5.394  -6.842
  359    H    ALA  64           H        ALA  64  -2.952   7.019  -5.393
  360    HA   ALA  64           HA       ALA  64  -2.120   7.492  -8.170
  361    HB1  ALA  64           HB1      ALA  64  -0.168   7.437  -5.923
  362    HB2  ALA  64           HB2      ALA  64  -0.163   8.400  -7.402
  363    HB3  ALA  64           HB3      ALA  64  -1.249   8.822  -6.078
  364    H    THR  65           H        THR  65  -0.023   6.301  -8.755
  365    HA   THR  65           HA       THR  65  -0.433   3.462  -8.140
  366    HB   THR  65           HB       THR  65   1.182   3.183 -10.141
  367    HG1  THR  65           HG1      THR  65   0.241   5.766 -10.820
  368   HG21  THR  65          HG21      THR  65  -1.671   3.807 -10.042
  369   HG22  THR  65          HG22      THR  65  -0.826   2.505 -10.881
  370   HG23  THR  65          HG23      THR  65  -0.946   4.100 -11.622
  371    H    CYS  66           H        CYS  66   1.578   2.097  -8.114
  372    HA   CYS  66           HA       CYS  66   3.253   2.856  -6.018
  373    HB2  CYS  66           HB1      CYS  66   2.788   0.514  -6.805
  374    HB3  CYS  66           HB2      CYS  66   3.901   0.806  -8.141
  375    H    ARG  67           H        ARG  67   5.401   3.525  -5.922
  376    HA   ARG  67           HA       ARG  67   6.348   4.897  -8.342
  377    HB2  ARG  67           HB1      ARG  67   6.854   5.380  -5.405
  378    HB3  ARG  67           HB2      ARG  67   7.803   6.160  -6.678
  379    HG2  ARG  67           HG1      ARG  67   5.648   7.066  -7.609
  380    HG3  ARG  67           HG2      ARG  67   4.863   6.468  -6.137
  381    HD2  ARG  67           HD1      ARG  67   6.348   7.850  -4.760
  382    HD3  ARG  67           HD2      ARG  67   7.152   8.431  -6.224
  383    HE   ARG  67           HE       ARG  67   4.630   9.312  -5.175
  384   HH11  ARG  67          HH11      ARG  67   6.569   8.997  -8.049
  385   HH12  ARG  67          HH12      ARG  67   5.764  10.280  -8.889
  386   HH21  ARG  67          HH21      ARG  67   3.563  11.003  -6.271
  387   HH22  ARG  67          HH22      ARG  67   4.056  11.422  -7.877
  388    H    GLY  68           H        GLY  68   8.237   4.360  -9.273
  389    HA2  GLY  68           HA2      GLY  68   9.653   2.049  -8.204
  390    HA3  GLY  68           HA3      GLY  68   9.868   2.758  -9.797
  391    HA1  GLY  68           HA1      GLY  68   9.585   2.764  -7.690
  392    H    LEU  69           H        LEU  69  12.139   2.140  -8.740
  393    HA   LEU  69           HA       LEU  69  13.320   3.841  -6.869
  394    HB2  LEU  69           HB1      LEU  69  14.594   2.427  -9.219
  395    HB3  LEU  69           HB2      LEU  69  15.465   3.133  -7.847
  396    HG   LEU  69           HG       LEU  69  13.610   0.756  -7.789
  397   HD11  LEU  69          HD11      LEU  69  15.431  -0.524  -7.879
  398   HD12  LEU  69          HD12      LEU  69  16.298   0.482  -6.720
  399   HD13  LEU  69          HD13      LEU  69  16.286   0.917  -8.429
  400   HD21  LEU  69          HD21      LEU  69  13.207   1.285  -5.665
  401   HD22  LEU  69          HD22      LEU  69  14.383   2.599  -5.694
  402   HD23  LEU  69          HD23      LEU  69  14.909   0.951  -5.347
  403    H    ARG  70           H        ARG  70  12.583   4.320 -10.221
  404    HA   ARG  70           HA       ARG  70  14.313   6.623 -10.499
  405    HB2  ARG  70           HB1      ARG  70  12.216   5.417 -12.315
  406    HB3  ARG  70           HB2      ARG  70  13.191   6.833 -12.734
  407    HG2  ARG  70           HG1      ARG  70  14.673   5.434 -13.613
  408    HG3  ARG  70           HG2      ARG  70  15.058   4.944 -11.954
  409    HD2  ARG  70           HD1      ARG  70  13.835   3.005 -12.079
  410    HD3  ARG  70           HD2      ARG  70  12.711   3.680 -13.266
  411    HE   ARG  70           HE       ARG  70  15.091   2.221 -13.816
  412   HH11  ARG  70          HH11      ARG  70  13.067   4.795 -15.000
  413   HH12  ARG  70          HH12      ARG  70  13.534   4.577 -16.655
  414   HH21  ARG  70          HH21      ARG  70  15.713   1.924 -15.990
  415   HH22  ARG  70          HH22      ARG  70  15.039   2.942 -17.215
  416    H    ARG  71           H        ARG  71  11.005   5.946  -9.687
  417    HA   ARG  71           HA       ARG  71   9.886   8.475 -10.225
  418    HB2  ARG  71           HB1      ARG  71   9.149   6.147  -8.497
  419    HB3  ARG  71           HB2      ARG  71   8.286   7.679  -8.281
  420    HG2  ARG  71           HG1      ARG  71   8.529   6.237 -10.922
  421    HG3  ARG  71           HG2      ARG  71   7.158   6.081  -9.812
  422    HD2  ARG  71           HD1      ARG  71   7.392   8.803 -10.030
  423    HD3  ARG  71           HD2      ARG  71   7.855   8.254 -11.648
  424    HE   ARG  71           HE       ARG  71   5.239   8.241 -10.530
  425   HH11  ARG  71          HH11      ARG  71   7.353   6.505 -12.685
  426   HH12  ARG  71          HH12      ARG  71   6.059   5.837 -13.624
  427   HH21  ARG  71          HH21      ARG  71   3.529   7.367 -11.759
  428   HH22  ARG  71          HH22      ARG  71   3.885   6.328 -13.097
  429    H    ARG  72           H        ARG  72   9.556  10.272  -8.938
  430    HA   ARG  72           HA       ARG  72  11.520  10.648  -6.835
  431    HB2  ARG  72           HB1      ARG  72   9.497  12.659  -7.832
  432    HB3  ARG  72           HB2      ARG  72  11.020  12.975  -6.988
  433    HG2  ARG  72           HG1      ARG  72  11.959  11.664  -9.150
  434    HG3  ARG  72           HG2      ARG  72  10.514  12.428  -9.834
  435    HD2  ARG  72           HD1      ARG  72  12.804  13.802  -8.414
  436    HD3  ARG  72           HD2      ARG  72  12.389  13.904 -10.131
  437    HE   ARG  72           HE       ARG  72  11.154  15.338  -7.963
  438   HH11  ARG  72          HH11      ARG  72  10.769  14.161 -11.216
  439   HH12  ARG  72          HH12      ARG  72   9.565  15.333 -11.637
  440   HH21  ARG  72          HH21      ARG  72   9.569  16.886  -8.505
  441   HH22  ARG  72          HH22      ARG  72   8.883  16.883 -10.093
  442    H    CYS  73           H        CYS  73  10.969  11.543  -4.755
  443    HA   CYS  73           HA       CYS  73   8.208  11.275  -3.877
  444    HB2  CYS  73           HB1      CYS  73   8.879   9.842  -1.943
  445    HB3  CYS  73           HB2      CYS  73   8.987   9.034  -3.508
  446    H    GLN  74           H        GLN  74   7.940  12.015  -1.596
  447    HA   GLN  74           HA       GLN  74   9.932  14.091  -0.954
  448    HB2  GLN  74           HB1      GLN  74   6.945  14.116  -0.961
  449    HB3  GLN  74           HB2      GLN  74   7.793  15.099   0.244
  450    HG2  GLN  74           HG1      GLN  74   7.506  16.605  -1.468
  451    HG3  GLN  74           HG2      GLN  74   9.132  15.986  -1.788
  452   HE21  GLN  74          HE21      GLN  74   9.475  15.687  -3.857
  453   HE22  GLN  74          HE22      GLN  74   8.329  15.107  -5.013
  454    H    ARG  75           H        ARG  75   7.934  11.505   0.237
  455    HA   ARG  75           HA       ARG  75   9.312  11.700   2.827
  456    HB2  ARG  75           HB1      ARG  75   6.391  11.010   2.429
  457    HB3  ARG  75           HB2      ARG  75   7.257  11.003   3.973
  458    HG2  ARG  75           HG1      ARG  75   7.161  13.242   4.210
  459    HG3  ARG  75           HG2      ARG  75   7.371  13.531   2.475
  460    HD2  ARG  75           HD1      ARG  75   4.922  12.402   2.445
  461    HD3  ARG  75           HD2      ARG  75   4.900  13.149   4.049
  462    HE   ARG  75           HE       ARG  75   5.824  15.079   2.284
  463   HH11  ARG  75          HH11      ARG  75   2.930  13.208   2.787
  464   HH12  ARG  75          HH12      ARG  75   1.878  14.420   2.134
  465   HH21  ARG  75          HH21      ARG  75   4.449  16.680   1.421
  466   HH22  ARG  75          HH22      ARG  75   2.742  16.394   1.356
  467    H    ASP  76           H        ASP  76   8.772   9.534   4.099
  468    HA   ASP  76           HA       ASP  76   9.848   7.424   2.460
  469    HB2  ASP  76           HB1      ASP  76  10.756   7.526   4.637
  470    HB3  ASP  76           HB2      ASP  76   9.158   7.658   5.382
  471    HD2  ASP  76           HD       ASP  76  10.432   4.051   4.338
  472    H    ALA  77           H        ALA  77   6.768   8.209   3.944
  473    HA   ALA  77           HA       ALA  77   5.573   5.661   3.366
  474    HB1  ALA  77           HB1      ALA  77   4.254   8.265   4.126
  475    HB2  ALA  77           HB2      ALA  77   3.508   6.666   4.152
  476    HB3  ALA  77           HB3      ALA  77   4.830   7.041   5.258
  477    H    MET  78           H        MET  78   5.964   8.680   1.707
  478    HA   MET  78           HA       MET  78   3.847   8.584  -0.101
  479    HB2  MET  78           HB1      MET  78   6.580   9.797  -0.127
  480    HB3  MET  78           HB2      MET  78   5.644   9.776  -1.630
  481    HG2  MET  78           HG1      MET  78   4.320  10.787   0.842
  482    HG3  MET  78           HG2      MET  78   5.526  11.802   0.045
  483    HE1  MET  78           HE1      MET  78   4.776  11.185  -3.338
  484    HE2  MET  78           HE2      MET  78   4.165  12.834  -3.210
  485    HE3  MET  78           HE3      MET  78   5.591  12.348  -2.292
  486    H    CYS  79           H        CYS  79   6.937   6.919  -0.107
  487    HA   CYS  79           HA       CYS  79   6.497   5.824  -2.759
  488    HB2  CYS  79           HB1      CYS  79   8.729   6.029  -0.875
  489    HB3  CYS  79           HB2      CYS  79   8.635   4.453  -1.664
  490    H    CYS  80           H        CYS  80   6.585   3.481  -3.129
  491    HA   CYS  80           HA       CYS  80   4.600   2.107  -1.742
  492    HB2  CYS  80           HB1      CYS  80   6.592   1.470  -3.814
  493    HB3  CYS  80           HB2      CYS  80   6.079   0.084  -2.852
  494    HA   PRO  81           HA       PRO  81   6.464   0.328   1.807
  495    HB2  PRO  81           HB1      PRO  81   5.354  -2.175   1.870
  496    HB3  PRO  81           HB2      PRO  81   4.454  -0.702   2.232
  497    HG2  PRO  81           HG1      PRO  81   4.607  -2.257  -0.329
  498    HG3  PRO  81           HG2      PRO  81   3.163  -1.569   0.502
  499    HD2  PRO  81           HD1      PRO  81   4.327  -0.376  -1.640
  500    HD3  PRO  81           HD2      PRO  81   3.571   0.543  -0.327
  501    H    GLY  82           H        GLY  82   8.519  -0.279   2.029
  502    HA2  GLY  82           HA2      GLY  82  10.087  -2.141   2.048
  503    HA3  GLY  82           HA3      GLY  82   9.463  -2.602   0.470
  504    HA1  GLY  82           HA1      GLY  82  10.038  -1.261   2.017
  505    H    THR  83           H        THR  83   9.953   0.752   1.051
  506    HA   THR  83           HA       THR  83  12.629   0.739  -0.101
  507    HB   THR  83           HB       THR  83  11.679   2.645  -1.693
  508    HG1  THR  83           HG1      THR  83   9.602   2.320  -2.288
  509   HG21  THR  83          HG21      THR  83  11.105  -0.081  -2.706
  510   HG22  THR  83          HG22      THR  83  12.734   0.224  -2.102
  511   HG23  THR  83          HG23      THR  83  12.081   1.207  -3.412
  512    H    LEU  84           H        LEU  84  13.520   3.002  -0.233
  513    HA   LEU  84           HA       LEU  84  12.404   4.676   1.919
  514    HB2  LEU  84           HB1      LEU  84  15.142   3.655   1.457
  515    HB3  LEU  84           HB2      LEU  84  15.012   5.350   1.959
  516    HG   LEU  84           HG       LEU  84  13.504   3.374   3.569
  517   HD11  LEU  84          HD11      LEU  84  16.475   3.395   3.314
  518   HD12  LEU  84          HD12      LEU  84  15.372   2.036   3.523
  519   HD13  LEU  84          HD13      LEU  84  15.736   3.092   4.887
  520   HD21  LEU  84          HD21      LEU  84  14.930   5.961   3.937
  521   HD22  LEU  84          HD22      LEU  84  14.738   4.894   5.329
  522   HD23  LEU  84          HD23      LEU  84  13.317   5.474   4.459
  523    H    CYS  85           H        CYS  85  12.849   6.961   1.756
  524    HA   CYS  85           HA       CYS  85  13.002   7.831  -1.042
  525    HB2  CYS  85           HB1      CYS  85  10.996   8.410   0.392
  526    HB3  CYS  85           HB2      CYS  85  12.070   9.451   1.330
  527    H    VAL  86           H        VAL  86  15.083   8.200  -1.551
  528    HA   VAL  86           HA       VAL  86  16.635   9.947   0.248
  529    HB   VAL  86           HB       VAL  86  17.709   7.882  -1.679
  530   HG11  VAL  86          HG11      VAL  86  19.290   9.626  -1.564
  531   HG12  VAL  86          HG12      VAL  86  19.051   9.835   0.172
  532   HG13  VAL  86          HG13      VAL  86  19.864   8.394  -0.440
  533   HG21  VAL  86          HG21      VAL  86  18.389   6.648   0.306
  534   HG22  VAL  86          HG22      VAL  86  17.653   7.873   1.338
  535   HG23  VAL  86          HG23      VAL  86  16.641   6.881   0.288
  536    H    ASN  87           H        ASN  87  17.445  11.795  -0.561
  537    HA   ASN  87           HA       ASN  87  17.717  13.558  -1.976
  538    HB2  ASN  87           HB1      ASN  87  19.265  11.606  -2.914
  539    HB3  ASN  87           HB2      ASN  87  18.162  11.726  -4.289
  540   HD21  ASN  87          HD21      ASN  87  21.029  12.417  -3.972
  541   HD22  ASN  87          HD22      ASN  87  21.157  14.058  -4.501
  542    H    ASP  88           H        ASP  88  15.053  12.601  -1.658
  543    HA   ASP  88           HA       ASP  88  12.969  12.960  -2.497
  544    HB2  ASP  88           HB1      ASP  88  14.273  14.468  -4.768
  545    HB3  ASP  88           HB2      ASP  88  12.653  14.695  -4.093
  546    HD2  ASP  88           HD       ASP  88  13.801  16.824  -1.660
  547    H    VAL  89           H        VAL  89  14.643  10.688  -3.390
  548    HA   VAL  89           HA       VAL  89  13.000   9.930  -5.692
  549    HB   VAL  89           HB       VAL  89  15.993   9.525  -5.598
  550   HG11  VAL  89          HG11      VAL  89  15.024   7.635  -6.650
  551   HG12  VAL  89          HG12      VAL  89  13.891   8.636  -7.561
  552   HG13  VAL  89          HG13      VAL  89  15.613   8.681  -7.941
  553   HG21  VAL  89          HG21      VAL  89  14.254  11.539  -6.890
  554   HG22  VAL  89          HG22      VAL  89  15.918  11.674  -6.321
  555   HG23  VAL  89          HG23      VAL  89  15.573  10.889  -7.863
  556    H    CYS  90           H        CYS  90  12.403   7.806  -5.733
  557    HA   CYS  90           HA       CYS  90  12.536   6.338  -3.324
  558    HB2  CYS  90           HB1      CYS  90  10.998   6.258  -5.619
  559    HB3  CYS  90           HB2      CYS  90  11.917   4.754  -5.708
  560    H    THR  91           H        THR  91  13.825   4.705  -2.659
  561    HA   THR  91           HA       THR  91  15.746   3.537  -4.527
  562    HB   THR  91           HB       THR  91  16.962   5.409  -3.536
  563    HG1  THR  91           HG1      THR  91  18.362   3.783  -3.839
  564   HG21  THR  91          HG21      THR  91  17.483   5.177  -1.021
  565   HG22  THR  91          HG22      THR  91  16.028   4.181  -0.962
  566   HG23  THR  91          HG23      THR  91  15.926   5.860  -1.490
  567    H    THR  92           H        THR  92  16.523   1.503  -3.922
  568    HA   THR  92           HA       THR  92  14.761  -0.052  -2.335
  569    HB   THR  92           HB       THR  92  16.617  -1.829  -2.628
  570    HG1  THR  92           HG1      THR  92  18.151  -1.317  -4.203
  571   HG21  THR  92          HG21      THR  92  14.511  -1.036  -4.205
  572   HG22  THR  92          HG22      THR  92  15.466  -2.501  -4.435
  573   HG23  THR  92          HG23      THR  92  15.861  -1.039  -5.339
  574    H    MET  93           H        MET  93  15.325  -1.336  -0.462
  575    HA   MET  93           HA       MET  93  16.527   0.202   1.586
  576    HB2  MET  93           HB1      MET  93  14.959  -2.164   1.386
  577    HB3  MET  93           HB2      MET  93  16.393  -2.545   2.352
  578    HG2  MET  93           HG1      MET  93  15.287  -0.013   3.171
  579    HG3  MET  93           HG2      MET  93  14.053  -1.274   3.197
  580    HE1  MET  93           HE1      MET  93  13.778  -1.461   6.040
  581    HE2  MET  93           HE2      MET  93  15.184  -0.860   6.917
  582    HE3  MET  93           HE3      MET  93  14.481   0.099   5.613
  583    H    GLU  94           H        GLU  94  17.742  -2.192  -0.606
  584    HA   GLU  94           HA       GLU  94  20.080  -2.860   0.894
  585    HB2  GLU  94           HB1      GLU  94  19.264  -3.267  -1.982
  586    HB3  GLU  94           HB2      GLU  94  20.854  -3.759  -1.375
  587    HG2  GLU  94           HG1      GLU  94  18.501  -4.690   0.164
  588    HG3  GLU  94           HG2      GLU  94  18.746  -5.393  -1.440
  589    HE2  GLU  94           HE       GLU  94  21.885  -6.735  -0.346
  590    H    ASP  95           H        ASP  95  19.217  -0.363  -1.356
  591    HA   ASP  95           HA       ASP  95  21.957   0.442  -1.837
  592    HB2  ASP  95           HB1      ASP  95  19.261   1.332  -2.774
  593    HB3  ASP  95           HB2      ASP  95  20.602   2.483  -2.865
  594    HD2  ASP  95           HD       ASP  95  22.101   0.778  -5.468
  595    H    ALA  96           H        ALA  96  19.116   1.802  -0.183
  596    HA   ALA  96           HA       ALA  96  20.516   4.048   0.862
  597    HB1  ALA  96           HB1      ALA  96  17.821   2.993   0.951
  598    HB2  ALA  96           HB2      ALA  96  18.322   3.654   2.507
  599    HB3  ALA  96           HB3      ALA  96  18.385   4.660   1.059
  600    H    THR  97           H        THR  97  22.357   3.308   1.922
  601    HA   THR  97           HA       THR  97  21.864   2.263   4.601
  602    HB   THR  97           HB       THR  97  24.158   0.900   3.962
  603    HG1  THR  97           HG1      THR  97  24.154   0.493   1.893
  604   HG21  THR  97          HG21      THR  97  22.848  -1.080   4.195
  605   HG22  THR  97          HG22      THR  97  21.383  -0.245   3.680
  606   HG23  THR  97          HG23      THR  97  22.120   0.145   5.233
  607    H    GLU  98           H        GLU  98  22.588   4.005   5.691
  608    HA   GLU  98           HA       GLU  98  25.280   5.006   5.032
  609    HB2  GLU  98           HB1      GLU  98  23.389   6.632   4.786
  610    HB3  GLU  98           HB2      GLU  98  23.105   6.477   6.526
  611    HG2  GLU  98           HG1      GLU  98  25.364   7.315   6.978
  612    HG3  GLU  98           HG2      GLU  98  25.629   7.491   5.237
  613    HE2  GLU  98           HE       GLU  98  24.234  10.605   5.314
  614    H    ASN  99           H        ASN  99  26.675   5.574   6.783
  615    HA   ASN  99           HA       ASN  99  27.755   5.147   8.738
  616    HB2  ASN  99           HB1      ASN  99  24.902   5.085   9.759
  617    HB3  ASN  99           HB2      ASN  99  26.330   5.075  10.803
  618   HD21  ASN  99          HD21      ASN  99  27.784   6.900  10.679
  619   HD22  ASN  99          HD22      ASN  99  27.153   8.460  10.283
  620    H    LEU 100           H        LEU 100  28.157   3.051   7.472
  621    HA   LEU 100           HA       LEU 100  26.829   0.686   8.403
  622    HB2  LEU 100           HB1      LEU 100  29.373   1.068   6.817
  623    HB3  LEU 100           HB2      LEU 100  28.609  -0.497   7.141
  624    HG   LEU 100           HG       LEU 100  26.864   1.493   5.856
  625   HD11  LEU 100          HD11      LEU 100  28.110   0.580   3.643
  626   HD12  LEU 100          HD12      LEU 100  29.485   0.776   4.730
  627   HD13  LEU 100          HD13      LEU 100  28.433   2.148   4.383
  628   HD21  LEU 100          HD21      LEU 100  26.714  -1.147   6.340
  629   HD22  LEU 100          HD22      LEU 100  27.376  -1.174   4.706
  630   HD23  LEU 100          HD23      LEU 100  25.852  -0.346   5.026
  631    H    TYR 101           H        TYR 101  28.166  -1.165   9.297
  632    HA   TYR 101           HA       TYR 101  29.387  -0.282  11.741
  633    HB2  TYR 101           HB1      TYR 101  28.014  -2.549  10.938
  634    HB3  TYR 101           HB2      TYR 101  29.674  -3.124  11.114
  635    HD1  TYR 101           HD1      TYR 101  27.258  -0.975  12.998
  636    HD2  TYR 101           HD2      TYR 101  30.308  -3.937  13.174
  637    HE1  TYR 101           HE1      TYR 101  26.971  -1.117  15.437
  638    HE2  TYR 101           HE2      TYR 101  30.029  -4.088  15.613
  639    HH   TYR 101           HH       TYR 101  27.509  -3.156  17.238
  640    H    PHE 102           H        PHE 102  31.504  -0.442  12.369
  641    HA   PHE 102           HA       PHE 102  33.455  -0.534  10.238
  642    HB2  PHE 102           HB1      PHE 102  33.439   0.285  13.107
  643    HB3  PHE 102           HB2      PHE 102  34.986  -0.182  12.398
  644    HD1  PHE 102           HD1      PHE 102  32.050   1.852  11.301
  645    HD2  PHE 102           HD2      PHE 102  36.278   1.569  11.700
  646    HE1  PHE 102           HE1      PHE 102  32.290   4.088  10.304
  647    HE2  PHE 102           HE2      PHE 102  36.525   3.805  10.705
  648    HZ   PHE 102           HZ       PHE 102  34.530   5.068  10.006
  649    H    GLN 103           H        GLN 103  33.411  -2.058  13.464
  650    HA   GLN 103           HA       GLN 103  34.176  -4.068  14.204
  651    HB2  GLN 103           HB1      GLN 103  32.642  -4.558  11.858
  652    HB3  GLN 103           HB2      GLN 103  34.033  -5.654  11.834
  653    HG2  GLN 103           HG1      GLN 103  32.827  -5.560  14.461
  654    HG3  GLN 103           HG2      GLN 103  31.650  -6.001  13.216
  655   HE21  GLN 103          HE21      GLN 103  31.507  -8.097  14.055
  656   HE22  GLN 103          HE22      GLN 103  32.748  -9.269  13.788
  657    H    SER 104           H        SER 104  35.672  -6.065  13.290
  658    HA   SER 104           HA       SER 104  37.837  -5.195  11.625
  659    HB2  SER 104           HB1      SER 104  38.427  -3.990  13.676
  660    HB3  SER 104           HB2      SER 104  38.330  -5.502  14.598
  661    HG   SER 104           HG       SER 104  40.016  -5.441  12.374
  662    H    LEU 105           H        LEU 105  37.671  -7.368  14.442
  663    HA   LEU 105           HA       LEU 105  37.295  -9.735  12.959
  664    HB2  LEU 105           HB1      LEU 105  39.583 -10.706  13.318
  665    HB3  LEU 105           HB2      LEU 105  39.469  -9.443  12.081
  666    HG   LEU 105           HG       LEU 105  40.227  -7.902  14.100
  667   HD11  LEU 105          HD11      LEU 105  41.970  -9.189  15.399
  668   HD12  LEU 105          HD12      LEU 105  41.170 -10.658  14.844
  669   HD13  LEU 105          HD13      LEU 105  40.291  -9.497  15.838
  670   HD21  LEU 105          HD21      LEU 105  42.374  -7.912  13.185
  671   HD22  LEU 105          HD22      LEU 105  41.345  -8.456  11.860
  672   HD23  LEU 105          HD23      LEU 105  42.294  -9.626  12.777
  673    H    GLU 106           H        GLU 106  38.162 -11.701  14.387
  674    HA   GLU 106           HA       GLU 106  37.229 -11.123  17.110
  675    HB2  GLU 106           HB1      GLU 106  37.099 -13.497  15.315
  676    HB3  GLU 106           HB2      GLU 106  37.199 -13.789  17.058
  677    HG2  GLU 106           HG1      GLU 106  35.088 -13.152  17.424
  678    HG3  GLU 106           HG2      GLU 106  35.220 -11.775  16.320
  679    HE2  GLU 106           HE       GLU 106  34.165 -15.239  14.667
  680    H    HIS 107           H        HIS 107  38.565 -11.256  18.793
  681    HA   HIS 107           HA       HIS 107  41.331 -11.979  18.345
  682    HB2  HIS 107           HB1      HIS 107  39.853 -10.350  20.222
  683    HB3  HIS 107           HB2      HIS 107  40.941 -11.448  21.079
  684    HD1  HIS 107           HD1      HIS 107  43.524 -11.268  20.464
  685    HD2  HIS 107           HD2      HIS 107  41.110  -8.210  19.021
  686    HE1  HIS 107           HE1      HIS 107  45.099  -9.419  19.813
  687    HE2  HIS 107           HE2      HIS 107  43.624  -7.549  18.931
  688    H    HIS 108           H        HIS 108  42.363 -13.759  19.078
  689    HA   HIS 108           HA       HIS 108  41.246 -15.462  21.101
  690    HB2  HIS 108           HB1      HIS 108  39.949 -16.095  19.054
  691    HB3  HIS 108           HB2      HIS 108  41.472 -16.576  18.299
  692    HD1  HIS 108           HD1      HIS 108  40.165 -17.361  21.787
  693    HD2  HIS 108           HD2      HIS 108  41.433 -19.280  18.327
  694    HE1  HIS 108           HE1      HIS 108  40.141 -19.815  22.332
  695    HE2  HIS 108           HE2      HIS 108  40.915 -20.990  20.218
  696    H    HIS 109           H        HIS 109  42.874 -16.355  22.189
  697    HA   HIS 109           HA       HIS 109  45.516 -16.443  20.903
  698    HB2  HIS 109           HB1      HIS 109  44.577 -15.675  23.551
  699    HB3  HIS 109           HB2      HIS 109  45.885 -16.861  23.632
  700    HD1  HIS 109           HD1      HIS 109  47.746 -15.336  24.387
  701    HD2  HIS 109           HD2      HIS 109  45.822 -13.965  20.969
  702    HE1  HIS 109           HE1      HIS 109  49.142 -13.416  23.554
  703    HE2  HIS 109           HE2      HIS 109  47.966 -12.577  21.466
  704    H    HIS 110           H        HIS 110  46.974 -18.215  21.746
  705    HA   HIS 110           HA       HIS 110  45.941 -20.581  22.855
  706    HB2  HIS 110           HB1      HIS 110  45.024 -20.302  20.308
  707    HB3  HIS 110           HB2      HIS 110  46.524 -21.192  20.025
  708    HD1  HIS 110           HD1      HIS 110  43.769 -22.496  19.510
  709    HD2  HIS 110           HD2      HIS 110  45.943 -22.900  23.027
  710    HE1  HIS 110           HE1      HIS 110  42.952 -24.627  20.564
  711    HE2  HIS 110           HE2      HIS 110  44.281 -24.876  22.714
  712    H    HIS 111           H        HIS 111  47.607 -21.730  23.608
  713    HA   HIS 111           HA       HIS 111  50.040 -22.120  22.195
  714    HB2  HIS 111           HB1      HIS 111  49.922 -19.672  23.465
  715    HB3  HIS 111           HB2      HIS 111  50.745 -20.688  24.653
  716    HD1  HIS 111           HD1      HIS 111  53.184 -20.438  24.447
  717    HD2  HIS 111           HD2      HIS 111  51.313 -20.327  20.738
  718    HE1  HIS 111           HE1      HIS 111  55.037 -20.188  22.765
  719    HE2  HIS 111           HE2      HIS 111  53.894 -20.119  20.498
  720    H    HIS 112           H        HIS 112  51.789 -22.926  23.943
  721    HA   HIS 112           HA       HIS 112  50.368 -24.960  25.506
  722    HB2  HIS 112           HB1      HIS 112  52.527 -25.122  23.747
  723    HB3  HIS 112           HB2      HIS 112  53.255 -25.283  25.350
  724    HD1  HIS 112           HD1      HIS 112  50.061 -26.742  23.861
  725    HD2  HIS 112           HD2      HIS 112  53.499 -27.914  25.877
  726    HE1  HIS 112           HE1      HIS 112  49.822 -29.221  24.211
  727    HE2  HIS 112           HE2      HIS 112  51.924 -29.938  25.443
  Start of MODEL    2
    1    H1   MET  18           H        MET  18   6.020  -8.644  -1.575
    2    HA   MET  18           HA       MET  18   5.290  -9.749   1.046
    3    HB2  MET  18           HB1      MET  18   6.790  -7.154   0.604
    4    HB3  MET  18           HB2      MET  18   6.199  -7.754   2.161
    5    HG2  MET  18           HG1      MET  18   7.706  -9.624   2.097
    6    HG3  MET  18           HG2      MET  18   8.203  -9.207   0.455
    7    HE1  MET  18           HE1      MET  18   8.035  -8.270   4.074
    8    HE2  MET  18           HE2      MET  18   9.637  -9.006   4.035
    9    HE3  MET  18           HE3      MET  18   9.465  -7.284   4.377
   10    H    LEU  19           H        LEU  19   3.124  -9.703   0.300
   11    HA   LEU  19           HA       LEU  19   1.888  -7.083   0.585
   12    HB2  LEU  19           HB1      LEU  19   0.433  -7.501  -1.409
   13    HB3  LEU  19           HB2      LEU  19   2.133  -7.150  -1.770
   14    HG   LEU  19           HG       LEU  19   1.433 -10.011  -1.582
   15   HD11  LEU  19          HD11      LEU  19   0.313  -8.202  -3.703
   16   HD12  LEU  19          HD12      LEU  19  -0.532  -9.396  -2.719
   17   HD13  LEU  19          HD13      LEU  19   0.592  -9.922  -3.972
   18   HD21  LEU  19          HD21      LEU  19   3.356 -10.156  -2.678
   19   HD22  LEU  19          HD22      LEU  19   3.501  -8.400  -2.602
   20   HD23  LEU  19          HD23      LEU  19   2.725  -9.162  -3.991
   21    H    VAL  20           H        VAL  20   1.932  -9.235   2.363
   22    HA   VAL  20           HA       VAL  20  -0.328 -10.921   2.153
   23    HB   VAL  20           HB       VAL  20  -0.008 -11.383   4.532
   24   HG11  VAL  20          HG11      VAL  20   2.778 -11.216   3.507
   25   HG12  VAL  20          HG12      VAL  20   1.930 -12.565   4.266
   26   HG13  VAL  20          HG13      VAL  20   1.601 -12.151   2.583
   27   HG21  VAL  20          HG21      VAL  20   0.463  -9.266   5.463
   28   HG22  VAL  20          HG22      VAL  20   1.929 -10.220   5.684
   29   HG23  VAL  20          HG23      VAL  20   1.845  -9.018   4.395
   30    H    LEU  21           H        LEU  21  -2.361 -10.790   3.088
   31    HA   LEU  21           HA       LEU  21  -3.472  -8.169   3.275
   32    HB2  LEU  21           HB1      LEU  21  -4.502 -10.961   3.545
   33    HB3  LEU  21           HB2      LEU  21  -5.490  -9.618   4.142
   34    HG   LEU  21           HG       LEU  21  -5.004  -8.688   1.691
   35   HD11  LEU  21          HD11      LEU  21  -3.926 -10.200   0.455
   36   HD12  LEU  21          HD12      LEU  21  -5.458 -11.070   0.414
   37   HD13  LEU  21          HD13      LEU  21  -4.233 -11.497   1.608
   38   HD21  LEU  21          HD21      LEU  21  -7.093 -10.763   2.348
   39   HD22  LEU  21          HD22      LEU  21  -7.170  -9.589   1.034
   40   HD23  LEU  21          HD23      LEU  21  -7.201  -9.040   2.711
   41    H    ASP  22           H        ASP  22  -4.236  -7.064   5.045
   42    HA   ASP  22           HA       ASP  22  -3.676  -8.220   7.690
   43    HB2  ASP  22           HB1      ASP  22  -1.836  -6.748   7.298
   44    HB3  ASP  22           HB2      ASP  22  -2.906  -5.479   6.687
   45    HD2  ASP  22           HD       ASP  22  -3.610  -4.328   9.852
   46    H    PHE  23           H        PHE  23  -5.636  -8.478   8.551
   47    HA   PHE  23           HA       PHE  23  -7.496  -6.196   8.444
   48    HB2  PHE  23           HB1      PHE  23  -9.369  -7.780   8.463
   49    HB3  PHE  23           HB2      PHE  23  -8.337  -8.026   7.052
   50    HD1  PHE  23           HD1      PHE  23  -6.757  -9.940   6.978
   51    HD2  PHE  23           HD2      PHE  23  -9.665  -9.514  10.056
   52    HE1  PHE  23           HE1      PHE  23  -6.494 -12.319   7.551
   53    HE2  PHE  23           HE2      PHE  23  -9.406 -11.891  10.636
   54    HZ   PHE  23           HZ       PHE  23  -7.819 -13.296   9.383
   55    H    ASN  24           H        ASN  24  -5.470  -6.838  10.440
   56    HA   ASN  24           HA       ASN  24  -6.875  -7.889  12.730
   57    HB2  ASN  24           HB1      ASN  24  -4.112  -6.972  12.126
   58    HB3  ASN  24           HB2      ASN  24  -4.641  -6.841  13.807
   59   HD21  ASN  24          HD21      ASN  24  -3.583  -8.442  14.783
   60   HD22  ASN  24          HD22      ASN  24  -3.676 -10.109  14.338
   61    H    ASN  25           H        ASN  25  -8.022  -6.769  14.168
   62    HA   ASN  25           HA       ASN  25  -7.899  -3.830  14.046
   63    HB2  ASN  25           HB1      ASN  25 -10.080  -5.433  13.688
   64    HB3  ASN  25           HB2      ASN  25 -10.196  -5.073  15.415
   65   HD21  ASN  25          HD21      ASN  25 -10.087  -3.670  12.212
   66   HD22  ASN  25          HD22      ASN  25 -10.803  -2.158  12.642
   67    H    ILE  26           H        ILE  26  -8.363  -2.699  16.109
   68    HA   ILE  26           HA       ILE  26  -7.020  -4.084  18.328
   69    HB   ILE  26           HB       ILE  26  -6.565  -1.837  19.240
   70   HG12  ILE  26          HG11      ILE  26  -7.590  -0.779  16.600
   71   HG13  ILE  26          HG12      ILE  26  -8.560  -0.779  18.083
   72   HG21  ILE  26          HG21      ILE  26  -4.844  -2.841  17.934
   73   HG22  ILE  26          HG22      ILE  26  -5.639  -2.383  16.429
   74   HG23  ILE  26          HG23      ILE  26  -4.937  -1.143  17.467
   75   HD11  ILE  26          HD11      ILE  26  -6.804   0.593  19.172
   76   HD12  ILE  26          HD12      ILE  26  -5.985   0.700  17.614
   77   HD13  ILE  26          HD13      ILE  26  -7.597   1.386  17.811
   78    H    ARG  27           H        ARG  27  -9.889  -4.293  17.633
   79    HA   ARG  27           HA       ARG  27 -11.911  -4.343  18.671
   80    HB2  ARG  27           HB1      ARG  27 -10.261  -5.291  20.462
   81    HB3  ARG  27           HB2      ARG  27 -10.575  -3.758  21.289
   82    HG2  ARG  27           HG1      ARG  27 -12.948  -5.274  20.367
   83    HG3  ARG  27           HG2      ARG  27 -12.018  -5.962  21.709
   84    HD2  ARG  27           HD1      ARG  27 -13.039  -4.560  23.106
   85    HD3  ARG  27           HD2      ARG  27 -12.271  -3.214  22.253
   86    HE   ARG  27           HE       ARG  27 -14.271  -2.752  21.231
   87   HH11  ARG  27          HH11      ARG  27 -14.422  -5.908  22.693
   88   HH12  ARG  27          HH12      ARG  27 -16.124  -6.094  22.426
   89   HH21  ARG  27          HH21      ARG  27 -16.512  -2.985  20.875
   90   HH22  ARG  27          HH22      ARG  27 -17.312  -4.430  21.392
   91    H    SER  28           H        SER  28 -12.310  -2.282  17.551
   92    HA   SER  28           HA       SER  28 -12.052   0.173  19.016
   93    HB2  SER  28           HB1      SER  28 -13.226   1.198  17.129
   94    HB3  SER  28           HB2      SER  28 -11.949   0.113  16.548
   95    HG   SER  28           HG       SER  28 -13.916  -0.193  15.414
   96    H    SER  29           H        SER  29 -13.795   1.511  19.724
   97    HA   SER  29           HA       SER  29 -16.479   0.604  19.845
   98    HB2  SER  29           HB1      SER  29 -16.664   0.116  22.224
   99    HB3  SER  29           HB2      SER  29 -15.476  -0.970  21.482
  100    HG   SER  29           HG       SER  29 -14.624  -0.148  23.390
  101    H    ALA  30           H        ALA  30 -17.653   2.394  19.906
  102    HA   ALA  30           HA       ALA  30 -16.640   4.701  21.432
  103    HB1  ALA  30           HB1      ALA  30 -17.438   4.536  18.598
  104    HB2  ALA  30           HB2      ALA  30 -18.023   5.941  19.489
  105    HB3  ALA  30           HB3      ALA  30 -16.292   5.613  19.397
  106    H    ASP  31           H        ASP  31 -19.582   3.699  19.672
  107    HA   ASP  31           HA       ASP  31 -21.186   3.632  22.016
  108    HB2  ASP  31           HB1      ASP  31 -20.737   6.199  21.101
  109    HB3  ASP  31           HB2      ASP  31 -22.279   5.776  20.345
  110    HD2  ASP  31           HD       ASP  31 -22.181   6.055  24.302
  111    H    LEU  32           H        LEU  32 -21.273   4.254  18.516
  112    HA   LEU  32           HA       LEU  32 -22.724   1.873  17.985
  113    HB2  LEU  32           HB1      LEU  32 -24.799   2.873  17.159
  114    HB3  LEU  32           HB2      LEU  32 -24.573   3.144  18.896
  115    HG   LEU  32           HG       LEU  32 -23.510   5.385  17.492
  116   HD11  LEU  32          HD11      LEU  32 -25.330   4.303  15.853
  117   HD12  LEU  32          HD12      LEU  32 -25.083   6.041  16.009
  118   HD13  LEU  32          HD13      LEU  32 -26.395   5.255  16.885
  119   HD21  LEU  32          HD21      LEU  32 -25.695   4.829  19.449
  120   HD22  LEU  32          HD22      LEU  32 -25.564   6.429  18.718
  121   HD23  LEU  32          HD23      LEU  32 -24.217   5.771  19.649
  122    H    HIS  33           H        HIS  33 -20.355   3.215  17.071
  123    HA   HIS  33           HA       HIS  33 -19.217   3.618  15.143
  124    HB2  HIS  33           HB1      HIS  33 -21.159   1.671  14.533
  125    HB3  HIS  33           HB2      HIS  33 -21.195   2.826  13.196
  126    HD1  HIS  33           HD1      HIS  33 -19.798   1.972  11.356
  127    HD2  HIS  33           HD2      HIS  33 -18.084   1.209  15.063
  128    HE1  HIS  33           HE1      HIS  33 -17.598   0.858  10.863
  129    HE2  HIS  33           HE2      HIS  33 -16.549   0.392  13.128
  130    H    GLY  34           H        GLY  34 -19.586   4.654  12.799
  131    HA2  GLY  34           HA2      GLY  34 -20.622   6.350  11.524
  132    HA3  GLY  34           HA3      GLY  34 -21.600   6.771  12.922
  133    HA1  GLY  34           HA1      GLY  34 -19.835   6.185  11.891
  134    H    ALA  35           H        ALA  35 -18.513   7.172  11.347
  135    HA   ALA  35           HA       ALA  35 -18.139   9.692  12.724
  136    HB1  ALA  35           HB1      ALA  35 -16.288   7.365  13.104
  137    HB2  ALA  35           HB2      ALA  35 -15.720   9.028  13.261
  138    HB3  ALA  35           HB3      ALA  35 -16.998   8.428  14.319
  139    H    ARG  36           H        ARG  36 -17.355  11.159  11.353
  140    HA   ARG  36           HA       ARG  36 -15.449  10.470   9.307
  141    HB2  ARG  36           HB1      ARG  36 -18.191  10.334   8.673
  142    HB3  ARG  36           HB2      ARG  36 -17.595  11.835   7.954
  143    HG2  ARG  36           HG1      ARG  36 -16.622  10.735   6.296
  144    HG3  ARG  36           HG2      ARG  36 -15.730   9.723   7.444
  145    HD2  ARG  36           HD1      ARG  36 -18.070   8.511   7.686
  146    HD3  ARG  36           HD2      ARG  36 -18.329   9.211   6.083
  147    HE   ARG  36           HE       ARG  36 -15.835   7.942   6.092
  148   HH11  ARG  36          HH11      ARG  36 -19.219   7.153   6.288
  149   HH12  ARG  36          HH12      ARG  36 -19.029   5.588   5.570
  150   HH21  ARG  36          HH21      ARG  36 -15.572   5.884   5.145
  151   HH22  ARG  36          HH22      ARG  36 -16.954   4.867   4.921
  152    H    LYS  37           H        LYS  37 -14.957  12.458   7.925
  153    HA   LYS  37           HA       LYS  37 -15.344  14.921   9.488
  154    HB2  LYS  37           HB1      LYS  37 -12.907  13.505   9.061
  155    HB3  LYS  37           HB2      LYS  37 -12.826  15.024   8.153
  156    HG2  LYS  37           HG1      LYS  37 -13.900  15.528  10.766
  157    HG3  LYS  37           HG2      LYS  37 -12.375  14.632  10.892
  158    HD2  LYS  37           HD1      LYS  37 -11.138  16.366  10.165
  159    HD3  LYS  37           HD2      LYS  37 -12.329  16.809   8.929
  160    HE2  LYS  37           HE1      LYS  37 -13.680  17.475  11.195
  161    HE3  LYS  37           HE2      LYS  37 -12.007  17.793  11.682
  162    HZ1  LYS  37           HZ1      LYS  37 -13.277  18.885   9.229
  163    HZ2  LYS  37           HZ2      LYS  37 -11.732  19.254   9.813
  164    HZ3  LYS  37           HZ3      LYS  37 -13.102  19.735  10.682
  165    H    GLY  38           H        GLY  38 -14.354  13.576   6.348
  166    HA2  GLY  38           HA2      GLY  38 -15.938  14.553   4.553
  167    HA3  GLY  38           HA3      GLY  38 -15.224  16.075   5.063
  168    HA1  GLY  38           HA1      GLY  38 -15.298  13.976   4.736
  169    H    SER  39           H        SER  39 -13.677  12.915   4.627
  170    HA   SER  39           HA       SER  39 -12.142  14.040   2.385
  171    HB2  SER  39           HB1      SER  39 -10.143  12.740   3.326
  172    HB3  SER  39           HB2      SER  39 -10.607  14.224   4.178
  173    HG   SER  39           HG       SER  39 -10.945  13.066   5.885
  174    H    GLN  40           H        GLN  40 -11.349  12.519   0.875
  175    HA   GLN  40           HA       GLN  40 -13.078  10.321   0.418
  176    HB2  GLN  40           HB1      GLN  40 -10.994  11.722  -0.995
  177    HB3  GLN  40           HB2      GLN  40 -10.764   9.973  -1.153
  178    HG2  GLN  40           HG1      GLN  40 -13.447  11.217  -1.650
  179    HG3  GLN  40           HG2      GLN  40 -12.194  11.206  -2.899
  180   HE21  GLN  40          HE21      GLN  40 -12.875   9.754  -4.326
  181   HE22  GLN  40          HE22      GLN  40 -13.294   8.117  -3.966
  182    H    CYS  41           H        CYS  41  -9.732  10.574   1.550
  183    HA   CYS  41           HA       CYS  41  -9.972   7.910   2.716
  184    HB2  CYS  41           HB1      CYS  41  -7.913   7.098   1.799
  185    HB3  CYS  41           HB2      CYS  41  -8.923   7.643   0.459
  186    H    LEU  42           H        LEU  42  -8.824   7.641   4.588
  187    HA   LEU  42           HA       LEU  42  -7.654  10.063   5.714
  188    HB2  LEU  42           HB1      LEU  42  -8.646   7.468   6.846
  189    HB3  LEU  42           HB2      LEU  42  -7.581   8.516   7.798
  190    HG   LEU  42           HG       LEU  42  -9.590  10.218   6.911
  191   HD11  LEU  42          HD11      LEU  42 -11.664   9.178   7.362
  192   HD12  LEU  42          HD12      LEU  42 -10.884   7.712   7.957
  193   HD13  LEU  42          HD13      LEU  42 -10.811   8.115   6.242
  194   HD21  LEU  42          HD21      LEU  42  -8.995   8.820   9.495
  195   HD22  LEU  42          HD22      LEU  42 -10.361   9.927   9.352
  196   HD23  LEU  42          HD23      LEU  42  -8.721  10.505   9.052
  197    H    SER  43           H        SER  43  -6.733   6.926   4.565
  198    HA   SER  43           HA       SER  43  -3.933   7.626   4.886
  199    HB2  SER  43           HB1      SER  43  -5.039   6.122   6.873
  200    HB3  SER  43           HB2      SER  43  -4.492   4.860   5.755
  201    HG   SER  43           HG       SER  43  -2.761   5.279   7.032
  202    H    ASP  44           H        ASP  44  -2.555   5.729   3.940
  203    HA   ASP  44           HA       ASP  44  -3.339   5.407   1.245
  204    HB2  ASP  44           HB1      ASP  44  -1.339   3.883   1.107
  205    HB3  ASP  44           HB2      ASP  44  -1.003   5.497   1.751
  206    HD2  ASP  44           HD       ASP  44   0.221   4.189   4.655
  207    H    THR  45           H        THR  45  -3.785   3.466   4.081
  208    HA   THR  45           HA       THR  45  -4.159   0.939   2.990
  209    HB   THR  45           HB       THR  45  -6.039   1.714   5.144
  210    HG1  THR  45           HG1      THR  45  -3.205   1.847   5.436
  211   HG21  THR  45          HG21      THR  45  -4.545  -0.304   6.107
  212   HG22  THR  45          HG22      THR  45  -4.315  -0.563   4.378
  213   HG23  THR  45          HG23      THR  45  -5.941  -0.551   5.060
  214    H    ASP  46           H        ASP  46  -6.178   3.749   2.839
  215    HA   ASP  46           HA       ASP  46  -8.624   2.451   2.218
  216    HB2  ASP  46           HB1      ASP  46  -7.762   5.092   2.653
  217    HB3  ASP  46           HB2      ASP  46  -8.409   5.066   1.007
  218    HD2  ASP  46           HD       ASP  46 -10.980   5.323   3.790
  219    H    CYS  47           H        CYS  47  -5.819   3.305   0.365
  220    HA   CYS  47           HA       CYS  47  -7.192   2.825  -2.166
  221    HB2  CYS  47           HB1      CYS  47  -4.651   4.095  -1.328
  222    HB3  CYS  47           HB2      CYS  47  -4.601   3.230  -2.864
  223    H    ASN  48           H        ASN  48  -5.655   1.565  -3.789
  224    HA   ASN  48           HA       ASN  48  -5.762  -1.115  -3.133
  225    HB2  ASN  48           HB1      ASN  48  -5.299   0.196  -5.413
  226    HB3  ASN  48           HB2      ASN  48  -3.632  -0.248  -5.028
  227   HD21  ASN  48          HD21      ASN  48  -5.326  -1.155  -7.210
  228   HD22  ASN  48          HD22      ASN  48  -5.405  -2.876  -7.074
  229    H    THR  49           H        THR  49  -4.243  -2.657  -2.502
  230    HA   THR  49           HA       THR  49  -2.512  -1.994  -0.448
  231    HB   THR  49           HB       THR  49  -3.370  -4.287  -0.893
  232    HG1  THR  49           HG1      THR  49  -1.597  -3.995   0.524
  233   HG21  THR  49          HG21      THR  49  -2.213  -5.717  -2.485
  234   HG22  THR  49          HG22      THR  49  -1.191  -4.369  -2.982
  235   HG23  THR  49          HG23      THR  49  -2.921  -4.333  -3.316
  236    H    ARG  50           H        ARG  50  -1.936  -2.098  -3.892
  237    HA   ARG  50           HA       ARG  50   0.912  -1.527  -3.454
  238    HB2  ARG  50           HB1      ARG  50   1.238  -2.081  -5.807
  239    HB3  ARG  50           HB2      ARG  50   0.415  -3.400  -4.961
  240    HG2  ARG  50           HG1      ARG  50  -1.748  -2.596  -5.857
  241    HG3  ARG  50           HG2      ARG  50  -0.863  -1.367  -6.776
  242    HD2  ARG  50           HD1      ARG  50   0.465  -3.720  -7.400
  243    HD3  ARG  50           HD2      ARG  50  -1.238  -4.195  -7.334
  244    HE   ARG  50           HE       ARG  50  -1.212  -1.901  -8.829
  245   HH11  ARG  50          HH11      ARG  50   0.346  -5.009  -9.017
  246   HH12  ARG  50          HH12      ARG  50   0.441  -5.002 -10.747
  247   HH21  ARG  50          HH21      ARG  50  -1.091  -1.880 -11.106
  248   HH22  ARG  50          HH22      ARG  50  -0.376  -3.221 -11.934
  249    H    LYS  51           H        LYS  51  -1.226   0.420  -3.035
  250    HA   LYS  51           HA       LYS  51  -0.196   2.500  -4.809
  251    HB2  LYS  51           HB1      LYS  51  -3.109   1.787  -4.469
  252    HB3  LYS  51           HB2      LYS  51  -2.588   3.391  -5.009
  253    HG2  LYS  51           HG1      LYS  51  -1.459   2.395  -6.936
  254    HG3  LYS  51           HG2      LYS  51  -1.976   0.788  -6.397
  255    HD2  LYS  51           HD1      LYS  51  -4.265   1.275  -6.776
  256    HD3  LYS  51           HD2      LYS  51  -3.932   3.006  -6.959
  257    HE2  LYS  51           HE1      LYS  51  -3.012   2.751  -9.083
  258    HE3  LYS  51           HE2      LYS  51  -2.661   1.037  -8.818
  259    HZ1  LYS  51           HZ1      LYS  51  -5.379   2.192  -9.133
  260    HZ2  LYS  51           HZ2      LYS  51  -5.014   0.552  -8.936
  261    HZ3  LYS  51           HZ3      LYS  51  -4.523   1.366 -10.337
  262    H    PHE  52           H        PHE  52  -0.659   4.682  -4.019
  263    HA   PHE  52           HA       PHE  52  -1.160   4.744  -1.117
  264    HB2  PHE  52           HB1      PHE  52   0.495   6.594  -0.968
  265    HB3  PHE  52           HB2      PHE  52   1.210   5.061  -1.472
  266    HD1  PHE  52           HD1      PHE  52   0.337   8.444  -2.533
  267    HD2  PHE  52           HD2      PHE  52   2.055   4.734  -3.713
  268    HE1  PHE  52           HE1      PHE  52   1.292   9.524  -4.526
  269    HE2  PHE  52           HE2      PHE  52   3.014   5.808  -5.708
  270    HZ   PHE  52           HZ       PHE  52   2.633   8.207  -6.116
  271    H    CYS  53           H        CYS  53  -1.943   6.805  -0.292
  272    HA   CYS  53           HA       CYS  53  -3.813   8.020  -2.169
  273    HB2  CYS  53           HB1      CYS  53  -3.787   7.457   0.658
  274    HB3  CYS  53           HB2      CYS  53  -4.116   9.169   0.391
  275    H    LEU  54           H        LEU  54  -3.005   9.654  -3.323
  276    HA   LEU  54           HA       LEU  54  -1.091  11.490  -2.097
  277    HB2  LEU  54           HB1      LEU  54  -0.512  10.587  -4.277
  278    HB3  LEU  54           HB2      LEU  54  -2.034  11.197  -4.945
  279    HG   LEU  54           HG       LEU  54  -0.828  13.471  -3.946
  280   HD11  LEU  54          HD11      LEU  54   1.437  13.420  -4.941
  281   HD12  LEU  54          HD12      LEU  54   1.258  11.681  -5.182
  282   HD13  LEU  54          HD13      LEU  54   1.262  12.350  -3.550
  283   HD21  LEU  54          HD21      LEU  54  -1.999  13.476  -5.998
  284   HD22  LEU  54          HD22      LEU  54  -0.928  12.263  -6.700
  285   HD23  LEU  54          HD23      LEU  54  -0.331  13.895  -6.390
  286    H    GLN  55           H        GLN  55  -1.685  13.403  -1.330
  287    HA   GLN  55           HA       GLN  55  -4.256  14.531  -2.225
  288    HB2  GLN  55           HB1      GLN  55  -4.313  15.652   0.040
  289    HB3  GLN  55           HB2      GLN  55  -4.528  13.893   0.045
  290    HG2  GLN  55           HG1      GLN  55  -1.736  14.581   0.303
  291    HG3  GLN  55           HG2      GLN  55  -2.713  15.376   1.546
  292   HE21  GLN  55          HE21      GLN  55  -0.756  13.205   1.760
  293   HE22  GLN  55          HE22      GLN  55  -1.588  11.894   2.516
  294    HA   PRO  56           HA       PRO  56  -1.078  17.553  -3.547
  295    HB2  PRO  56           HB1      PRO  56  -2.493  18.405  -5.733
  296    HB3  PRO  56           HB2      PRO  56  -1.466  16.971  -5.736
  297    HG2  PRO  56           HG1      PRO  56  -4.436  17.184  -5.363
  298    HG3  PRO  56           HG2      PRO  56  -3.494  16.036  -6.386
  299    HD2  PRO  56           HD1      PRO  56  -4.523  15.341  -3.971
  300    HD3  PRO  56           HD2      PRO  56  -2.995  14.687  -4.586
  301    H    ARG  57           H        ARG  57  -1.091  19.821  -3.475
  302    HA   ARG  57           HA       ARG  57  -3.220  20.947  -1.878
  303    HB2  ARG  57           HB1      ARG  57  -0.703  22.227  -2.975
  304    HB3  ARG  57           HB2      ARG  57  -1.790  22.941  -1.774
  305    HG2  ARG  57           HG1      ARG  57  -1.279  21.079  -0.231
  306    HG3  ARG  57           HG2      ARG  57  -0.123  20.460  -1.420
  307    HD2  ARG  57           HD1      ARG  57   0.789  22.967  -1.266
  308    HD3  ARG  57           HD2      ARG  57   0.055  22.842   0.339
  309    HE   ARG  57           HE       ARG  57   2.449  21.559  -0.559
  310   HH11  ARG  57          HH11      ARG  57  -0.241  21.306   1.637
  311   HH12  ARG  57          HH12      ARG  57   0.610  20.309   2.770
  312   HH21  ARG  57          HH21      ARG  57   3.579  20.246   0.925
  313   HH22  ARG  57          HH22      ARG  57   2.783  19.707   2.364
  314    H    ASP  58           H        ASP  58  -1.804  21.522  -5.082
  315    HA   ASP  58           HA       ASP  58  -3.664  23.591  -5.752
  316    HB2  ASP  58           HB1      ASP  58  -1.323  22.360  -6.934
  317    HB3  ASP  58           HB2      ASP  58  -2.609  22.549  -8.134
  318    HD2  ASP  58           HD       ASP  58  -2.272  25.978  -8.193
  319    H    GLU  59           H        GLU  59  -3.669  20.149  -5.916
  320    HA   GLU  59           HA       GLU  59  -6.165  20.233  -7.482
  321    HB2  GLU  59           HB1      GLU  59  -3.936  18.210  -7.433
  322    HB3  GLU  59           HB2      GLU  59  -5.560  17.778  -7.989
  323    HG2  GLU  59           HG1      GLU  59  -4.582  20.218  -9.234
  324    HG3  GLU  59           HG2      GLU  59  -3.528  18.827  -9.527
  325    HE2  GLU  59           HE       GLU  59  -7.260  18.355 -10.815
  326    H    LYS  60           H        LYS  60  -7.317  17.929  -7.069
  327    HA   LYS  60           HA       LYS  60  -7.900  17.945  -4.212
  328    HB2  LYS  60           HB1      LYS  60  -9.329  17.123  -6.680
  329    HB3  LYS  60           HB2      LYS  60  -9.685  16.194  -5.214
  330    HG2  LYS  60           HG1      LYS  60 -10.951  17.817  -4.371
  331    HG3  LYS  60           HG2      LYS  60  -9.715  19.042  -4.706
  332    HD2  LYS  60           HD1      LYS  60 -11.477  19.759  -6.032
  333    HD3  LYS  60           HD2      LYS  60 -10.506  18.810  -7.169
  334    HE2  LYS  60           HE1      LYS  60 -12.154  16.895  -6.092
  335    HE3  LYS  60           HE2      LYS  60 -13.200  18.320  -6.136
  336    HZ1  LYS  60           HZ1      LYS  60 -12.090  16.774  -8.329
  337    HZ2  LYS  60           HZ2      LYS  60 -12.111  18.450  -8.555
  338    HZ3  LYS  60           HZ3      LYS  60 -13.551  17.622  -8.231
  339    HA   PRO  61           HA       PRO  61  -5.981  14.124  -3.228
  340    HB2  PRO  61           HB1      PRO  61  -7.792  12.969  -1.530
  341    HB3  PRO  61           HB2      PRO  61  -6.806  14.365  -1.097
  342    HG2  PRO  61           HG1      PRO  61  -9.638  14.270  -2.082
  343    HG3  PRO  61           HG2      PRO  61  -8.934  15.225  -0.724
  344    HD2  PRO  61           HD1      PRO  61  -9.469  16.309  -3.155
  345    HD3  PRO  61           HD2      PRO  61  -8.102  16.830  -2.154
  346    H    PHE  62           H        PHE  62  -5.729  12.263  -4.290
  347    HA   PHE  62           HA       PHE  62  -8.024  10.652  -5.035
  348    HB2  PHE  62           HB1      PHE  62  -7.231  10.471  -7.414
  349    HB3  PHE  62           HB2      PHE  62  -7.909  12.042  -6.979
  350    HD1  PHE  62           HD1      PHE  62  -4.649  10.276  -7.274
  351    HD2  PHE  62           HD2      PHE  62  -6.730  13.988  -7.401
  352    HE1  PHE  62           HE1      PHE  62  -2.598  11.396  -8.042
  353    HE2  PHE  62           HE2      PHE  62  -4.683  15.113  -8.170
  354    HZ   PHE  62           HZ       PHE  62  -2.613  13.818  -8.492
  355    H    CYS  63           H        CYS  63  -7.091   8.684  -6.418
  356    HA   CYS  63           HA       CYS  63  -4.969   7.565  -4.756
  357    HB2  CYS  63           HB1      CYS  63  -7.267   6.452  -5.384
  358    HB3  CYS  63           HB2      CYS  63  -6.418   6.007  -6.864
  359    H    ALA  64           H        ALA  64  -2.953   7.239  -5.444
  360    HA   ALA  64           HA       ALA  64  -2.367   7.751  -8.280
  361    HB1  ALA  64           HB1      ALA  64  -0.055   7.635  -6.532
  362    HB2  ALA  64           HB2      ALA  64  -0.582   8.915  -7.627
  363    HB3  ALA  64           HB3      ALA  64  -1.241   8.825  -5.993
  364    H    THR  65           H        THR  65  -0.437   6.535  -9.141
  365    HA   THR  65           HA       THR  65  -0.773   3.702  -8.495
  366    HB   THR  65           HB       THR  65   0.947   4.510 -10.771
  367    HG1  THR  65           HG1      THR  65  -0.863   5.025 -12.046
  368   HG21  THR  65          HG21      THR  65  -0.657   2.711 -11.800
  369   HG22  THR  65          HG22      THR  65  -1.027   2.367 -10.111
  370   HG23  THR  65          HG23      THR  65   0.630   2.225 -10.698
  371    H    CYS  66           H        CYS  66   1.212   2.317  -8.649
  372    HA   CYS  66           HA       CYS  66   3.072   3.027  -6.702
  373    HB2  CYS  66           HB1      CYS  66   2.490   0.703  -7.575
  374    HB3  CYS  66           HB2      CYS  66   3.608   1.033  -8.901
  375    H    ARG  67           H        ARG  67   5.231   3.673  -6.780
  376    HA   ARG  67           HA       ARG  67   6.027   4.975  -9.301
  377    HB2  ARG  67           HB1      ARG  67   5.830   5.974  -6.627
  378    HB3  ARG  67           HB2      ARG  67   7.529   6.005  -7.120
  379    HG2  ARG  67           HG1      ARG  67   7.196   7.818  -8.344
  380    HG3  ARG  67           HG2      ARG  67   5.922   6.997  -9.260
  381    HD2  ARG  67           HD1      ARG  67   4.365   7.517  -7.314
  382    HD3  ARG  67           HD2      ARG  67   5.647   8.583  -6.720
  383    HE   ARG  67           HE       ARG  67   4.951   9.118  -9.443
  384   HH11  ARG  67          HH11      ARG  67   4.056   9.695  -6.129
  385   HH12  ARG  67          HH12      ARG  67   3.242  11.186  -6.473
  386   HH21  ARG  67          HH21      ARG  67   3.883  11.079  -9.908
  387   HH22  ARG  67          HH22      ARG  67   3.143  11.971  -8.623
  388    H    GLY  68           H        GLY  68   8.023   4.590 -10.142
  389    HA2  GLY  68           HA2      GLY  68   9.390   2.233  -9.299
  390    HA3  GLY  68           HA3      GLY  68   9.897   3.325 -10.578
  391    HA1  GLY  68           HA1      GLY  68   9.200   2.790  -8.643
  392    H    LEU  69           H        LEU  69  11.999   2.569  -9.473
  393    HA   LEU  69           HA       LEU  69  12.676   3.785  -6.976
  394    HB2  LEU  69           HB1      LEU  69  14.335   2.498  -9.144
  395    HB3  LEU  69           HB2      LEU  69  15.014   3.126  -7.632
  396    HG   LEU  69           HG       LEU  69  13.046   0.854  -7.901
  397   HD11  LEU  69          HD11      LEU  69  15.932   1.007  -7.913
  398   HD12  LEU  69          HD12      LEU  69  14.874  -0.364  -8.241
  399   HD13  LEU  69          HD13      LEU  69  15.337   0.014  -6.582
  400   HD21  LEU  69          HD21      LEU  69  12.495   1.874  -5.872
  401   HD22  LEU  69          HD22      LEU  69  14.174   2.280  -5.514
  402   HD23  LEU  69          HD23      LEU  69  13.632   0.604  -5.420
  403    H    ARG  70           H        ARG  70  13.692   4.415 -10.336
  404    HA   ARG  70           HA       ARG  70  15.238   6.669  -9.856
  405    HB2  ARG  70           HB1      ARG  70  13.674   5.685 -12.215
  406    HB3  ARG  70           HB2      ARG  70  14.416   7.292 -12.271
  407    HG2  ARG  70           HG1      ARG  70  16.133   5.020 -11.421
  408    HG3  ARG  70           HG2      ARG  70  15.676   5.128 -13.129
  409    HD2  ARG  70           HD1      ARG  70  16.947   7.371 -11.544
  410    HD3  ARG  70           HD2      ARG  70  17.820   6.260 -12.609
  411    HE   ARG  70           HE       ARG  70  15.938   7.261 -14.249
  412   HH11  ARG  70          HH11      ARG  70  18.198   8.765 -12.070
  413   HH12  ARG  70          HH12      ARG  70  18.344  10.211 -13.012
  414   HH21  ARG  70          HH21      ARG  70  16.122   9.160 -15.498
  415   HH22  ARG  70          HH22      ARG  70  17.163  10.436 -14.961
  416    H    ARG  71           H        ARG  71  11.790   6.303  -9.899
  417    HA   ARG  71           HA       ARG  71  10.986   8.935 -10.369
  418    HB2  ARG  71           HB1      ARG  71   9.804   6.494  -9.345
  419    HB3  ARG  71           HB2      ARG  71   9.197   7.912  -8.478
  420    HG2  ARG  71           HG1      ARG  71   7.780   7.314 -10.391
  421    HG3  ARG  71           HG2      ARG  71   8.488   8.930 -10.551
  422    HD2  ARG  71           HD1      ARG  71   9.964   8.277 -12.223
  423    HD3  ARG  71           HD2      ARG  71   9.880   6.573 -11.751
  424    HE   ARG  71           HE       ARG  71   7.354   7.152 -12.591
  425   HH11  ARG  71          HH11      ARG  71  10.528   7.436 -13.991
  426   HH12  ARG  71          HH12      ARG  71   9.975   7.207 -15.616
  427   HH21  ARG  71          HH21      ARG  71   6.612   6.850 -14.727
  428   HH22  ARG  71          HH22      ARG  71   7.747   6.875 -16.033
  429    H    ARG  72           H        ARG  72  10.568  10.683  -9.033
  430    HA   ARG  72           HA       ARG  72  12.227  10.839  -6.672
  431    HB2  ARG  72           HB1      ARG  72  10.403  12.922  -7.897
  432    HB3  ARG  72           HB2      ARG  72  11.638  13.208  -6.662
  433    HG2  ARG  72           HG1      ARG  72  13.105  12.020  -8.637
  434    HG3  ARG  72           HG2      ARG  72  11.912  12.950  -9.558
  435    HD2  ARG  72           HD1      ARG  72  13.220  14.324  -7.268
  436    HD3  ARG  72           HD2      ARG  72  14.210  14.001  -8.698
  437    HE   ARG  72           HE       ARG  72  12.108  15.928  -8.461
  438   HH11  ARG  72          HH11      ARG  72  13.823  13.868 -10.683
  439   HH12  ARG  72          HH12      ARG  72  13.479  14.853 -12.066
  440   HH21  ARG  72          HH21      ARG  72  11.649  17.233 -10.274
  441   HH22  ARG  72          HH22      ARG  72  12.242  16.768 -11.832
  442    H    CYS  73           H        CYS  73  11.433  11.656  -4.619
  443    HA   CYS  73           HA       CYS  73   8.587  11.350  -4.094
  444    HB2  CYS  73           HB1      CYS  73   9.013   9.809  -2.181
  445    HB3  CYS  73           HB2      CYS  73   9.341   9.088  -3.757
  446    H    GLN  74           H        GLN  74   7.949  12.168  -2.005
  447    HA   GLN  74           HA       GLN  74   9.874  14.135  -0.963
  448    HB2  GLN  74           HB1      GLN  74   7.121  14.334  -1.759
  449    HB3  GLN  74           HB2      GLN  74   7.270  14.736  -0.041
  450    HG2  GLN  74           HG1      GLN  74   7.816  16.789  -0.686
  451    HG3  GLN  74           HG2      GLN  74   9.367  16.100  -1.186
  452   HE21  GLN  74          HE21      GLN  74   7.949  18.360  -2.302
  453   HE22  GLN  74          HE22      GLN  74   7.665  17.991  -3.965
  454    H    ARG  75           H        ARG  75   7.817  11.467  -0.150
  455    HA   ARG  75           HA       ARG  75   8.891  11.513   2.575
  456    HB2  ARG  75           HB1      ARG  75   5.973  11.197   1.840
  457    HB3  ARG  75           HB2      ARG  75   6.639  10.805   3.433
  458    HG2  ARG  75           HG1      ARG  75   7.019  13.012   3.986
  459    HG3  ARG  75           HG2      ARG  75   7.076  13.524   2.290
  460    HD2  ARG  75           HD1      ARG  75   4.548  12.667   2.345
  461    HD3  ARG  75           HD2      ARG  75   4.738  13.064   4.058
  462    HE   ARG  75           HE       ARG  75   5.691  15.236   2.620
  463   HH11  ARG  75          HH11      ARG  75   2.683  13.541   3.062
  464   HH12  ARG  75          HH12      ARG  75   1.701  14.941   2.781
  465   HH21  ARG  75          HH21      ARG  75   4.410  17.087   2.246
  466   HH22  ARG  75          HH22      ARG  75   2.685  16.956   2.315
  467    H    ASP  76           H        ASP  76   8.093   9.343   3.695
  468    HA   ASP  76           HA       ASP  76   9.248   7.234   2.160
  469    HB2  ASP  76           HB1      ASP  76   8.543   5.818   4.158
  470    HB3  ASP  76           HB2      ASP  76   9.650   7.157   4.492
  471    HD2  ASP  76           HD       ASP  76   7.289   8.849   6.383
  472    H    ALA  77           H        ALA  77   5.974   7.765   3.462
  473    HA   ALA  77           HA       ALA  77   4.815   5.492   2.269
  474    HB1  ALA  77           HB1      ALA  77   2.807   6.246   3.090
  475    HB2  ALA  77           HB2      ALA  77   3.939   7.097   4.141
  476    HB3  ALA  77           HB3      ALA  77   3.193   7.940   2.784
  477    H    MET  78           H        MET  78   5.591   8.632   1.030
  478    HA   MET  78           HA       MET  78   3.820   8.885  -1.087
  479    HB2  MET  78           HB1      MET  78   6.599   9.826  -0.550
  480    HB3  MET  78           HB2      MET  78   5.974   9.985  -2.199
  481    HG2  MET  78           HG1      MET  78   4.576  11.070   0.246
  482    HG3  MET  78           HG2      MET  78   5.675  12.002  -0.774
  483    HE1  MET  78           HE1      MET  78   3.959  12.911  -3.818
  484    HE2  MET  78           HE2      MET  78   5.480  12.474  -3.040
  485    HE3  MET  78           HE3      MET  78   4.615  11.285  -4.014
  486    H    CYS  79           H        CYS  79   6.543   6.761  -0.707
  487    HA   CYS  79           HA       CYS  79   6.259   5.868  -3.497
  488    HB2  CYS  79           HB1      CYS  79   8.528   6.648  -2.488
  489    HB3  CYS  79           HB2      CYS  79   8.528   5.071  -1.696
  490    H    CYS  80           H        CYS  80   6.319   3.573  -3.922
  491    HA   CYS  80           HA       CYS  80   4.496   2.091  -2.462
  492    HB2  CYS  80           HB1      CYS  80   6.482   1.519  -4.579
  493    HB3  CYS  80           HB2      CYS  80   5.952   0.123  -3.638
  494    HA   PRO  81           HA       PRO  81   6.560   0.364   1.002
  495    HB2  PRO  81           HB1      PRO  81   5.556  -2.183   1.081
  496    HB3  PRO  81           HB2      PRO  81   4.612  -0.753   1.488
  497    HG2  PRO  81           HG1      PRO  81   4.735  -2.281  -1.090
  498    HG3  PRO  81           HG2      PRO  81   3.295  -1.658  -0.201
  499    HD2  PRO  81           HD1      PRO  81   4.330  -0.401  -2.372
  500    HD3  PRO  81           HD2      PRO  81   3.585   0.474  -1.025
  501    H    GLY  82           H        GLY  82   8.196  -1.094   1.702
  502    HA2  GLY  82           HA2      GLY  82   9.788  -2.812   1.391
  503    HA3  GLY  82           HA3      GLY  82   9.391  -2.837  -0.321
  504    HA1  GLY  82           HA1      GLY  82   9.774  -1.946   1.572
  505    H    THR  83           H        THR  83   9.589   0.213  -0.240
  506    HA   THR  83           HA       THR  83  12.532   0.333  -0.378
  507    HB   THR  83           HB       THR  83  11.850   2.393  -1.950
  508    HG1  THR  83           HG1      THR  83   9.734   0.498  -2.208
  509   HG21  THR  83          HG21      THR  83  12.689  -0.330  -2.342
  510   HG22  THR  83          HG22      THR  83  13.115   1.112  -3.263
  511   HG23  THR  83          HG23      THR  83  11.672   0.192  -3.684
  512    H    LEU  84           H        LEU  84  13.303   2.716  -0.286
  513    HA   LEU  84           HA       LEU  84  11.763   4.213   1.718
  514    HB2  LEU  84           HB1      LEU  84  14.062   2.774   2.287
  515    HB3  LEU  84           HB2      LEU  84  14.639   4.437   2.072
  516    HG   LEU  84           HG       LEU  84  12.399   4.642   3.738
  517   HD11  LEU  84          HD11      LEU  84  13.007   2.059   3.932
  518   HD12  LEU  84          HD12      LEU  84  12.458   3.011   5.311
  519   HD13  LEU  84          HD13      LEU  84  14.178   2.697   5.085
  520   HD21  LEU  84          HD21      LEU  84  13.942   5.523   5.296
  521   HD22  LEU  84          HD22      LEU  84  14.578   5.922   3.700
  522   HD23  LEU  84          HD23      LEU  84  15.275   4.587   4.619
  523    H    CYS  85           H        CYS  85  11.884   6.427   1.578
  524    HA   CYS  85           HA       CYS  85  12.725   7.495  -0.946
  525    HB2  CYS  85           HB1      CYS  85  10.688   8.206   0.417
  526    HB3  CYS  85           HB2      CYS  85  11.817   9.084   1.451
  527    H    VAL  86           H        VAL  86  14.853   7.705  -1.288
  528    HA   VAL  86           HA       VAL  86  16.447   9.074   0.782
  529    HB   VAL  86           HB       VAL  86  17.428   7.061  -1.249
  530   HG11  VAL  86          HG11      VAL  86  19.556   7.213  -0.006
  531   HG12  VAL  86          HG12      VAL  86  19.114   8.731  -0.790
  532   HG13  VAL  86          HG13      VAL  86  18.879   8.533   0.948
  533   HG21  VAL  86          HG21      VAL  86  16.553   5.621   0.248
  534   HG22  VAL  86          HG22      VAL  86  18.008   6.003   1.171
  535   HG23  VAL  86          HG23      VAL  86  16.491   6.828   1.531
  536    H    ASN  87           H        ASN  87  17.433  10.914   0.219
  537    HA   ASN  87           HA       ASN  87  18.004  12.748  -1.003
  538    HB2  ASN  87           HB1      ASN  87  18.644  10.601  -3.044
  539    HB3  ASN  87           HB2      ASN  87  19.147  12.291  -3.176
  540   HD21  ASN  87          HD21      ASN  87  20.689   9.768  -2.916
  541   HD22  ASN  87          HD22      ASN  87  21.744  10.023  -1.572
  542    H    ASP  88           H        ASP  88  15.262  12.078  -1.025
  543    HA   ASP  88           HA       ASP  88  13.321  12.697  -2.040
  544    HB2  ASP  88           HB1      ASP  88  14.942  14.732  -2.541
  545    HB3  ASP  88           HB2      ASP  88  14.788  14.147  -4.201
  546    HD2  ASP  88           HD       ASP  88  11.402  15.043  -4.333
  547    H    VAL  89           H        VAL  89  14.861  10.312  -2.910
  548    HA   VAL  89           HA       VAL  89  13.359   9.822  -5.370
  549    HB   VAL  89           HB       VAL  89  16.302   9.196  -5.099
  550   HG11  VAL  89          HG11      VAL  89  16.095   8.418  -7.439
  551   HG12  VAL  89          HG12      VAL  89  15.165   7.440  -6.302
  552   HG13  VAL  89          HG13      VAL  89  14.348   8.624  -7.323
  553   HG21  VAL  89          HG21      VAL  89  16.335  10.704  -7.201
  554   HG22  VAL  89          HG22      VAL  89  14.784  11.295  -6.602
  555   HG23  VAL  89          HG23      VAL  89  16.233  11.460  -5.611
  556    H    CYS  90           H        CYS  90  12.693   7.715  -5.641
  557    HA   CYS  90           HA       CYS  90  12.498   6.118  -3.311
  558    HB2  CYS  90           HB1      CYS  90  11.884   5.513  -6.212
  559    HB3  CYS  90           HB2      CYS  90  11.493   4.425  -4.878
  560    H    THR  91           H        THR  91  14.232   5.157  -2.461
  561    HA   THR  91           HA       THR  91  15.992   3.631  -4.269
  562    HB   THR  91           HB       THR  91  16.820   4.829  -1.622
  563    HG1  THR  91           HG1      THR  91  16.309   6.234  -3.655
  564   HG21  THR  91          HG21      THR  91  19.110   4.419  -2.588
  565   HG22  THR  91          HG22      THR  91  18.326   3.493  -3.869
  566   HG23  THR  91          HG23      THR  91  18.195   2.965  -2.192
  567    H    THR  92           H        THR  92  16.623   1.581  -3.648
  568    HA   THR  92           HA       THR  92  14.820   0.108  -2.061
  569    HB   THR  92           HB       THR  92  16.628  -1.712  -2.228
  570    HG1  THR  92           HG1      THR  92  18.265  -1.259  -3.752
  571   HG21  THR  92          HG21      THR  92  15.199  -2.250  -3.860
  572   HG22  THR  92          HG22      THR  92  16.270  -1.386  -4.962
  573   HG23  THR  92          HG23      THR  92  14.891  -0.556  -4.241
  574    H    MET  93           H        MET  93  15.140  -0.976  -0.074
  575    HA   MET  93           HA       MET  93  16.436   0.576   1.913
  576    HB2  MET  93           HB1      MET  93  14.455  -1.325   1.899
  577    HB3  MET  93           HB2      MET  93  15.803  -2.193   2.647
  578    HG2  MET  93           HG1      MET  93  15.924  -0.738   4.460
  579    HG3  MET  93           HG2      MET  93  15.041   0.531   3.607
  580    HE1  MET  93           HE1      MET  93  14.315  -2.262   6.452
  581    HE2  MET  93           HE2      MET  93  14.901  -0.599   6.422
  582    HE3  MET  93           HE3      MET  93  13.228  -0.937   6.869
  583    H    GLU  94           H        GLU  94  17.313  -2.328   0.151
  584    HA   GLU  94           HA       GLU  94  19.463  -3.166   1.744
  585    HB2  GLU  94           HB1      GLU  94  19.075  -3.450  -1.245
  586    HB3  GLU  94           HB2      GLU  94  20.245  -4.358  -0.273
  587    HG2  GLU  94           HG1      GLU  94  18.067  -5.000   1.096
  588    HG3  GLU  94           HG2      GLU  94  17.300  -4.650  -0.460
  589    HE2  GLU  94           HE       GLU  94  18.623  -8.143  -0.184
  590    H    ASP  95           H        ASP  95  19.258  -0.794  -0.846
  591    HA   ASP  95           HA       ASP  95  22.104  -0.330  -0.893
  592    HB2  ASP  95           HB1      ASP  95  19.786   0.454  -2.471
  593    HB3  ASP  95           HB2      ASP  95  20.869   1.819  -2.168
  594    HD2  ASP  95           HD       ASP  95  23.504  -0.074  -3.794
  595    H    ALA  96           H        ALA  96  19.255   1.208   0.485
  596    HA   ALA  96           HA       ALA  96  20.279   3.650   1.263
  597    HB1  ALA  96           HB1      ALA  96  18.590   2.412   3.302
  598    HB2  ALA  96           HB2      ALA  96  18.343   3.884   2.362
  599    HB3  ALA  96           HB3      ALA  96  17.930   2.316   1.669
  600    H    THR  97           H        THR  97  20.851   0.490   2.627
  601    HA   THR  97           HA       THR  97  22.062   1.465   5.044
  602    HB   THR  97           HB       THR  97  22.481  -1.301   3.942
  603    HG1  THR  97           HG1      THR  97  20.119  -0.120   4.874
  604   HG21  THR  97          HG21      THR  97  22.464  -0.013   6.648
  605   HG22  THR  97          HG22      THR  97  23.688  -1.047   5.914
  606   HG23  THR  97          HG23      THR  97  22.169  -1.743   6.478
  607    H    GLU  98           H        GLU  98  23.586   2.950   4.035
  608    HA   GLU  98           HA       GLU  98  25.631   2.177   2.294
  609    HB2  GLU  98           HB1      GLU  98  24.862   4.532   3.259
  610    HB3  GLU  98           HB2      GLU  98  26.202   4.229   4.377
  611    HG2  GLU  98           HG1      GLU  98  27.587   5.048   2.859
  612    HG3  GLU  98           HG2      GLU  98  27.221   3.639   1.851
  613    HE2  GLU  98           HE       GLU  98  26.329   6.904   0.253
  614    H    ASN  99           H        ASN  99  27.989   2.120   2.864
  615    HA   ASN  99           HA       ASN  99  29.735   1.050   3.854
  616    HB2  ASN  99           HB1      ASN  99  28.509   2.581   5.835
  617    HB3  ASN  99           HB2      ASN  99  28.720   0.992   6.580
  618   HD21  ASN  99          HD21      ASN  99  30.545   0.737   7.621
  619   HD22  ASN  99          HD22      ASN  99  32.045   1.516   7.263
  620    H    LEU 100           H        LEU 100  30.131  -0.772   5.721
  621    HA   LEU 100           HA       LEU 100  28.233  -2.928   5.065
  622    HB2  LEU 100           HB1      LEU 100  31.161  -3.179   5.771
  623    HB3  LEU 100           HB2      LEU 100  30.069  -4.488   5.284
  624    HG   LEU 100           HG       LEU 100  29.851  -2.975   3.105
  625   HD11  LEU 100          HD11      LEU 100  32.193  -2.149   2.589
  626   HD12  LEU 100          HD12      LEU 100  32.497  -2.237   4.324
  627   HD13  LEU 100          HD13      LEU 100  31.237  -1.171   3.702
  628   HD21  LEU 100          HD21      LEU 100  30.627  -5.358   3.354
  629   HD22  LEU 100          HD22      LEU 100  32.263  -4.724   3.540
  630   HD23  LEU 100          HD23      LEU 100  31.376  -4.448   2.041
  631    H    TYR 101           H        TYR 101  28.894  -4.846   6.811
  632    HA   TYR 101           HA       TYR 101  28.555  -3.606   9.462
  633    HB2  TYR 101           HB1      TYR 101  26.606  -4.989   8.135
  634    HB3  TYR 101           HB2      TYR 101  27.359  -6.272   9.084
  635    HD1  TYR 101           HD1      TYR 101  26.203  -6.751  11.013
  636    HD2  TYR 101           HD2      TYR 101  26.482  -2.695   9.758
  637    HE1  TYR 101           HE1      TYR 101  24.945  -6.052  13.009
  638    HE2  TYR 101           HE2      TYR 101  25.227  -1.986  11.751
  639    HH   TYR 101           HH       TYR 101  24.623  -4.068  14.380
  640    H    PHE 102           H        PHE 102  28.912  -5.355  11.234
  641    HA   PHE 102           HA       PHE 102  30.944  -7.310  10.557
  642    HB2  PHE 102           HB1      PHE 102  32.589  -6.439  12.156
  643    HB3  PHE 102           HB2      PHE 102  32.273  -5.279  10.865
  644    HD1  PHE 102           HD1      PHE 102  31.932  -5.953  14.426
  645    HD2  PHE 102           HD2      PHE 102  31.036  -3.223  11.285
  646    HE1  PHE 102           HE1      PHE 102  31.398  -4.219  16.089
  647    HE2  PHE 102           HE2      PHE 102  30.502  -1.485  12.942
  648    HZ   PHE 102           HZ       PHE 102  30.684  -1.982  15.347
  649    H    GLN 103           H        GLN 103  31.606  -8.582  12.514
  650    HA   GLN 103           HA       GLN 103  30.056  -8.462  14.889
  651    HB2  GLN 103           HB1      GLN 103  28.748 -10.511  14.600
  652    HB3  GLN 103           HB2      GLN 103  28.291  -9.282  13.411
  653    HG2  GLN 103           HG1      GLN 103  30.110 -10.568  11.953
  654    HG3  GLN 103           HG2      GLN 103  29.625 -11.893  13.020
  655   HE21  GLN 103          HE21      GLN 103  28.713 -13.013  11.284
  656   HE22  GLN 103          HE22      GLN 103  27.199 -12.546  10.595
  657    H    SER 104           H        SER 104  31.074  -9.542  16.475
  658    HA   SER 104           HA       SER 104  33.044 -11.592  15.710
  659    HB2  SER 104           HB1      SER 104  34.534 -10.731  17.510
  660    HB3  SER 104           HB2      SER 104  34.269  -9.556  16.211
  661    HG   SER 104           HG       SER 104  33.430  -9.491  18.857
  662    H    LEU 105           H        LEU 105  32.764 -13.464  16.719
  663    HA   LEU 105           HA       LEU 105  31.097 -13.513  19.142
  664    HB2  LEU 105           HB1      LEU 105  31.198 -15.132  16.745
  665    HB3  LEU 105           HB2      LEU 105  31.394 -16.123  18.200
  666    HG   LEU 105           HG       LEU 105  29.246 -14.580  18.874
  667   HD11  LEU 105          HD11      LEU 105  27.821 -15.077  16.689
  668   HD12  LEU 105          HD12      LEU 105  29.382 -14.789  15.923
  669   HD13  LEU 105          HD13      LEU 105  28.658 -13.546  16.942
  670   HD21  LEU 105          HD21      LEU 105  29.675 -17.320  17.862
  671   HD22  LEU 105          HD22      LEU 105  28.012 -16.734  17.862
  672   HD23  LEU 105          HD23      LEU 105  28.937 -16.765  19.364
  673    H    GLU 106           H        GLU 106  31.896 -14.259  21.014
  674    HA   GLU 106           HA       GLU 106  34.693 -14.686  21.286
  675    HB2  GLU 106           HB1      GLU 106  32.431 -14.272  23.010
  676    HB3  GLU 106           HB2      GLU 106  33.383 -15.643  23.602
  677    HG2  GLU 106           HG1      GLU 106  34.613 -14.104  24.646
  678    HG3  GLU 106           HG2      GLU 106  35.332 -13.827  23.054
  679    HE2  GLU 106           HE       GLU 106  33.886 -10.736  24.554
  680    H    HIS 107           H        HIS 107  35.860 -16.517  21.390
  681    HA   HIS 107           HA       HIS 107  34.399 -19.075  21.286
  682    HB2  HIS 107           HB1      HIS 107  36.526 -17.978  19.559
  683    HB3  HIS 107           HB2      HIS 107  36.772 -19.652  20.070
  684    HD1  HIS 107           HD1      HIS 107  33.854 -17.662  18.630
  685    HD2  HIS 107           HD2      HIS 107  35.655 -21.395  18.347
  686    HE1  HIS 107           HE1      HIS 107  32.548 -18.908  16.880
  687    HE2  HIS 107           HE2      HIS 107  33.648 -21.191  16.707
  688    H    HIS 108           H        HIS 108  35.925 -20.961  21.848
  689    HA   HIS 108           HA       HIS 108  38.076 -20.406  23.657
  690    HB2  HIS 108           HB1      HIS 108  37.050 -21.361  25.666
  691    HB3  HIS 108           HB2      HIS 108  36.189 -19.912  25.138
  692    HD1  HIS 108           HD1      HIS 108  35.811 -23.670  25.144
  693    HD2  HIS 108           HD2      HIS 108  33.522 -20.249  24.576
  694    HE1  HIS 108           HE1      HIS 108  33.428 -24.465  25.036
  695    HE2  HIS 108           HE2      HIS 108  32.027 -22.375  24.688
  696    H    HIS 109           H        HIS 109  39.187 -22.303  24.331
  697    HA   HIS 109           HA       HIS 109  38.270 -24.828  23.163
  698    HB2  HIS 109           HB1      HIS 109  40.652 -23.267  22.374
  699    HB3  HIS 109           HB2      HIS 109  40.943 -24.986  22.658
  700    HD1  HIS 109           HD1      HIS 109  40.754 -26.324  20.601
  701    HD2  HIS 109           HD2      HIS 109  38.182 -23.062  20.545
  702    HE1  HIS 109           HE1      HIS 109  39.567 -26.443  18.389
  703    HE2  HIS 109           HE2      HIS 109  37.992 -24.450  18.353
  704    H    HIS 110           H        HIS 110  39.070 -26.691  24.171
  705    HA   HIS 110           HA       HIS 110  41.006 -26.589  26.263
  706    HB2  HIS 110           HB1      HIS 110  38.235 -26.080  26.934
  707    HB3  HIS 110           HB2      HIS 110  38.813 -27.548  27.729
  708    HD1  HIS 110           HD1      HIS 110  41.425 -27.053  28.814
  709    HD2  HIS 110           HD2      HIS 110  38.665 -23.959  28.556
  710    HE1  HIS 110           HE1      HIS 110  42.189 -25.330  30.478
  711    HE2  HIS 110           HE2      HIS 110  40.501 -23.438  30.321
  712    H    HIS 111           H        HIS 111  41.868 -28.560  26.552
  713    HA   HIS 111           HA       HIS 111  40.292 -30.932  25.877
  714    HB2  HIS 111           HB1      HIS 111  42.958 -30.196  24.656
  715    HB3  HIS 111           HB2      HIS 111  42.298 -31.833  24.616
  716    HD1  HIS 111           HD1      HIS 111  42.489 -28.976  22.556
  717    HD2  HIS 111           HD2      HIS 111  39.485 -31.712  23.420
  718    HE1  HIS 111           HE1      HIS 111  40.846 -28.790  20.662
  719    HE2  HIS 111           HE2      HIS 111  39.009 -30.461  21.189
  720    H    HIS 112           H        HIS 112  40.286 -31.890  27.822
  721    HA   HIS 112           HA       HIS 112  41.012 -32.917  29.719
  722    HB2  HIS 112           HB1      HIS 112  43.569 -33.162  28.114
  723    HB3  HIS 112           HB2      HIS 112  43.215 -34.051  29.599
  724    HD1  HIS 112           HD1      HIS 112  43.776 -35.847  27.370
  725    HD2  HIS 112           HD2      HIS 112  39.974 -34.273  27.939
  726    HE1  HIS 112           HE1      HIS 112  42.216 -37.403  26.159
  727    HE2  HIS 112           HE2      HIS 112  39.892 -36.444  26.506
  Start of MODEL    3
    1    H1   MET  18           H        MET  18 -76.496  15.671  -6.045
    2    HA   MET  18           HA       MET  18 -75.036  13.502  -5.954
    3    HB2  MET  18           HB1      MET  18 -76.762  12.276  -7.242
    4    HB3  MET  18           HB2      MET  18 -76.428  13.318  -8.632
    5    HG2  MET  18           HG1      MET  18 -75.006  11.722  -9.271
    6    HG3  MET  18           HG2      MET  18 -73.941  12.392  -8.034
    7    HE1  MET  18           HE1      MET  18 -73.297  11.581  -6.101
    8    HE2  MET  18           HE2      MET  18 -73.701  10.064  -5.298
    9    HE3  MET  18           HE3      MET  18 -72.640  10.061  -6.708
   10    H    LEU  19           H        LEU  19 -73.431  15.030  -5.840
   11    HA   LEU  19           HA       LEU  19 -72.729  16.387  -8.359
   12    HB2  LEU  19           HB1      LEU  19 -71.975  17.185  -5.542
   13    HB3  LEU  19           HB2      LEU  19 -71.615  18.077  -7.030
   14    HG   LEU  19           HG       LEU  19 -74.420  17.574  -6.055
   15   HD11  LEU  19          HD11      LEU  19 -74.426  19.736  -5.068
   16   HD12  LEU  19          HD12      LEU  19 -72.807  20.086  -5.671
   17   HD13  LEU  19          HD13      LEU  19 -73.035  18.869  -4.416
   18   HD21  LEU  19          HD21      LEU  19 -73.766  18.209  -8.507
   19   HD22  LEU  19          HD22      LEU  19 -73.543  19.816  -7.817
   20   HD23  LEU  19          HD23      LEU  19 -75.113  19.018  -7.705
   21    H    VAL  20           H        VAL  20 -70.984  15.643  -9.350
   22    HA   VAL  20           HA       VAL  20 -69.307  13.654  -8.253
   23    HB   VAL  20           HB       VAL  20 -67.872  14.060 -10.260
   24   HG11  VAL  20          HG11      VAL  20 -69.936  13.662 -11.891
   25   HG12  VAL  20          HG12      VAL  20 -69.384  12.433 -10.750
   26   HG13  VAL  20          HG13      VAL  20 -70.771  13.448 -10.352
   27   HG21  VAL  20          HG21      VAL  20 -69.240  16.546 -10.249
   28   HG22  VAL  20          HG22      VAL  20 -67.964  16.000 -11.338
   29   HG23  VAL  20          HG23      VAL  20 -69.655  15.703 -11.742
   30    H    LEU  21           H        LEU  21 -67.547  13.797  -7.023
   31    HA   LEU  21           HA       LEU  21 -66.503  16.438  -6.368
   32    HB2  LEU  21           HB1      LEU  21 -66.665  13.837  -5.053
   33    HB3  LEU  21           HB2      LEU  21 -65.075  14.603  -4.888
   34    HG   LEU  21           HG       LEU  21 -67.540  16.163  -4.232
   35   HD11  LEU  21          HD11      LEU  21 -67.783  14.037  -3.043
   36   HD12  LEU  21          HD12      LEU  21 -67.444  15.367  -1.937
   37   HD13  LEU  21          HD13      LEU  21 -66.166  14.231  -2.369
   38   HD21  LEU  21          HD21      LEU  21 -65.079  17.010  -4.358
   39   HD22  LEU  21          HD22      LEU  21 -64.923  16.216  -2.790
   40   HD23  LEU  21          HD23      LEU  21 -66.112  17.502  -3.014
   41    H    ASP  22           H        ASP  22 -64.335  17.018  -6.559
   42    HA   ASP  22           HA       ASP  22 -62.886  15.556  -8.636
   43    HB2  ASP  22           HB1      ASP  22 -62.228  18.264  -7.451
   44    HB3  ASP  22           HB2      ASP  22 -61.587  17.562  -8.940
   45    HD2  ASP  22           HD       ASP  22 -65.142  19.269  -9.041
   46    H    PHE  23           H        PHE  23 -62.284  13.831  -7.166
   47    HA   PHE  23           HA       PHE  23 -60.213  14.574  -5.219
   48    HB2  PHE  23           HB1      PHE  23 -60.543  12.392  -4.215
   49    HB3  PHE  23           HB2      PHE  23 -62.099  13.208  -4.377
   50    HD1  PHE  23           HD1      PHE  23 -60.092  10.377  -5.429
   51    HD2  PHE  23           HD2      PHE  23 -63.724  12.502  -6.076
   52    HE1  PHE  23           HE1      PHE  23 -61.000   8.445  -6.653
   53    HE2  PHE  23           HE2      PHE  23 -64.638  10.573  -7.299
   54    HZ   PHE  23           HZ       PHE  23 -63.276   8.541  -7.588
   55    H    ASN  24           H        ASN  24 -58.191  13.564  -5.229
   56    HA   ASN  24           HA       ASN  24 -57.538  11.846  -7.502
   57    HB2  ASN  24           HB1      ASN  24 -56.878  14.621  -7.374
   58    HB3  ASN  24           HB2      ASN  24 -55.384  13.691  -7.198
   59   HD21  ASN  24          HD21      ASN  24 -54.409  13.090  -8.986
   60   HD22  ASN  24          HD22      ASN  24 -55.140  12.950 -10.546
   61    H    ASN  25           H        ASN  25 -55.207  11.057  -7.309
   62    HA   ASN  25           HA       ASN  25 -54.846  10.079  -4.611
   63    HB2  ASN  25           HB1      ASN  25 -53.095   9.527  -7.015
   64    HB3  ASN  25           HB2      ASN  25 -53.248   8.558  -5.545
   65   HD21  ASN  25          HD21      ASN  25 -54.214   8.852  -8.696
   66   HD22  ASN  25          HD22      ASN  25 -55.602   7.824  -8.658
   67    H    ILE  26           H        ILE  26 -53.342  12.361  -6.777
   68    HA   ILE  26           HA       ILE  26 -51.177  12.815  -4.843
   69    HB   ILE  26           HB       ILE  26 -50.158  14.202  -6.669
   70   HG12  ILE  26          HG11      ILE  26 -52.248  12.865  -8.403
   71   HG13  ILE  26          HG12      ILE  26 -52.334  14.556  -7.881
   72   HG21  ILE  26          HG21      ILE  26 -49.571  12.174  -8.091
   73   HG22  ILE  26          HG22      ILE  26 -49.255  12.056  -6.360
   74   HG23  ILE  26          HG23      ILE  26 -50.672  11.268  -7.054
   75   HD11  ILE  26          HD11      ILE  26 -51.384  14.849  -9.920
   76   HD12  ILE  26          HD12      ILE  26 -49.923  14.643  -8.954
   77   HD13  ILE  26          HD13      ILE  26 -50.561  13.289  -9.886
   78    H    ARG  27           H        ARG  27 -50.485  15.176  -4.688
   79    HA   ARG  27           HA       ARG  27 -52.802  16.980  -4.726
   80    HB2  ARG  27           HB1      ARG  27 -50.948  16.431  -2.405
   81    HB3  ARG  27           HB2      ARG  27 -51.950  17.888  -2.506
   82    HG2  ARG  27           HG1      ARG  27 -53.784  15.912  -2.977
   83    HG3  ARG  27           HG2      ARG  27 -52.687  15.151  -1.810
   84    HD2  ARG  27           HD1      ARG  27 -54.122  16.182  -0.355
   85    HD3  ARG  27           HD2      ARG  27 -52.935  17.473  -0.579
   86    HE   ARG  27           HE       ARG  27 -54.560  18.729  -1.570
   87   HH11  ARG  27          HH11      ARG  27 -55.529  15.386  -1.653
   88   HH12  ARG  27          HH12      ARG  27 -57.102  15.722  -2.295
   89   HH21  ARG  27          HH21      ARG  27 -56.630  19.185  -2.415
   90   HH22  ARG  27          HH22      ARG  27 -57.727  17.884  -2.728
   91    H    SER  28           H        SER  28 -52.309  19.196  -4.914
   92    HA   SER  28           HA       SER  28 -50.127  19.812  -6.557
   93    HB2  SER  28           HB1      SER  28 -52.318  21.281  -5.257
   94    HB3  SER  28           HB2      SER  28 -50.850  22.246  -5.499
   95    HG   SER  28           HG       SER  28 -52.648  21.331  -7.338
   96    H    SER  29           H        SER  29 -48.121  19.403  -5.792
   97    HA   SER  29           HA       SER  29 -47.087  21.173  -3.756
   98    HB2  SER  29           HB1      SER  29 -47.814  18.461  -3.106
   99    HB3  SER  29           HB2      SER  29 -46.059  18.660  -2.970
  100    HG   SER  29           HG       SER  29 -47.391  19.213  -1.059
  101    H    ALA  30           H        ALA  30 -44.661  20.714  -3.436
  102    HA   ALA  30           HA       ALA  30 -43.483  20.552  -6.074
  103    HB1  ALA  30           HB1      ALA  30 -41.779  21.761  -5.236
  104    HB2  ALA  30           HB2      ALA  30 -42.919  22.092  -3.931
  105    HB3  ALA  30           HB3      ALA  30 -41.707  20.824  -3.743
  106    H    ASP  31           H        ASP  31 -41.106  19.478  -5.908
  107    HA   ASP  31           HA       ASP  31 -41.211  16.902  -4.565
  108    HB2  ASP  31           HB1      ASP  31 -42.314  16.844  -6.952
  109    HB3  ASP  31           HB2      ASP  31 -40.633  16.850  -7.503
  110    HD2  ASP  31           HD       ASP  31 -40.390  13.502  -6.919
  111    H    LEU  32           H        LEU  32 -39.264  16.394  -3.807
  112    HA   LEU  32           HA       LEU  32 -36.945  17.855  -4.856
  113    HB2  LEU  32           HB1      LEU  32 -35.852  17.338  -2.742
  114    HB3  LEU  32           HB2      LEU  32 -37.404  18.154  -2.486
  115    HG   LEU  32           HG       LEU  32 -38.270  15.674  -2.198
  116   HD11  LEU  32          HD11      LEU  32 -36.217  14.679  -0.756
  117   HD12  LEU  32          HD12      LEU  32 -35.339  15.457  -2.072
  118   HD13  LEU  32          HD13      LEU  32 -36.558  14.233  -2.428
  119   HD21  LEU  32          HD21      LEU  32 -38.390  17.465  -0.527
  120   HD22  LEU  32          HD22      LEU  32 -36.719  17.140  -0.064
  121   HD23  LEU  32          HD23      LEU  32 -37.962  15.917   0.202
  122    H    HIS  33           H        HIS  33 -34.984  16.778  -5.283
  123    HA   HIS  33           HA       HIS  33 -34.543  14.028  -5.006
  124    HB2  HIS  33           HB1      HIS  33 -36.359  14.604  -7.072
  125    HB3  HIS  33           HB2      HIS  33 -34.823  14.263  -7.877
  126    HD1  HIS  33           HD1      HIS  33 -33.746  11.883  -7.409
  127    HD2  HIS  33           HD2      HIS  33 -37.650  12.376  -6.075
  128    HE1  HIS  33           HE1      HIS  33 -34.605   9.560  -6.969
  129    HE2  HIS  33           HE2      HIS  33 -36.992   9.860  -6.155
  130    H    GLY  34           H        GLY  34 -32.406  14.057  -4.823
  131    HA2  GLY  34           HA2      GLY  34 -30.703  14.821  -6.955
  132    HA3  GLY  34           HA3      GLY  34 -30.710  16.072  -5.720
  133    HA1  GLY  34           HA1      GLY  34 -30.945  14.108  -6.499
  134    H    ALA  35           H        ALA  35 -28.744  13.909  -6.736
  135    HA   ALA  35           HA       ALA  35 -28.169  12.590  -4.183
  136    HB1  ALA  35           HB1      ALA  35 -27.932  11.795  -6.892
  137    HB2  ALA  35           HB2      ALA  35 -26.309  11.842  -6.200
  138    HB3  ALA  35           HB3      ALA  35 -27.564  10.865  -5.439
  139    H    ARG  36           H        ARG  36 -25.686  12.330  -3.814
  140    HA   ARG  36           HA       ARG  36 -24.259  14.814  -4.419
  141    HB2  ARG  36           HB1      ARG  36 -25.098  13.843  -1.729
  142    HB3  ARG  36           HB2      ARG  36 -23.491  14.571  -1.876
  143    HG2  ARG  36           HG1      ARG  36 -25.437  16.207  -3.225
  144    HG3  ARG  36           HG2      ARG  36 -25.936  15.887  -1.555
  145    HD2  ARG  36           HD1      ARG  36 -23.094  16.649  -2.056
  146    HD3  ARG  36           HD2      ARG  36 -24.336  17.902  -2.163
  147    HE   ARG  36           HE       ARG  36 -23.385  16.614   0.219
  148   HH11  ARG  36          HH11      ARG  36 -26.059  18.297  -1.242
  149   HH12  ARG  36          HH12      ARG  36 -26.709  18.844   0.267
  150   HH21  ARG  36          HH21      ARG  36 -24.232  17.328   2.213
  151   HH22  ARG  36          HH22      ARG  36 -25.668  18.293   2.232
  152    H    LYS  37           H        LYS  37 -22.244  14.416  -5.044
  153    HA   LYS  37           HA       LYS  37 -21.170  11.731  -4.738
  154    HB2  LYS  37           HB1      LYS  37 -20.651  14.063  -6.496
  155    HB3  LYS  37           HB2      LYS  37 -19.256  13.036  -6.120
  156    HG2  LYS  37           HG1      LYS  37 -21.125  11.165  -6.765
  157    HG3  LYS  37           HG2      LYS  37 -21.577  12.510  -7.827
  158    HD2  LYS  37           HD1      LYS  37 -20.025  11.605  -9.200
  159    HD3  LYS  37           HD2      LYS  37 -18.905  12.523  -8.177
  160    HE2  LYS  37           HE1      LYS  37 -18.043  10.673  -7.213
  161    HE3  LYS  37           HE2      LYS  37 -19.618   9.869  -7.141
  162    HZ1  LYS  37           HZ1      LYS  37 -19.429   9.177  -9.373
  163    HZ2  LYS  37           HZ2      LYS  37 -17.939   8.825  -8.654
  164    HZ3  LYS  37           HZ3      LYS  37 -18.093  10.174  -9.663
  165    H    GLY  38           H        GLY  38 -20.026  11.258  -2.981
  166    HA2  GLY  38           HA2      GLY  38 -18.886  13.243  -1.284
  167    HA3  GLY  38           HA3      GLY  38 -18.673  11.504  -1.136
  168    HA1  GLY  38           HA1      GLY  38 -18.731  13.377  -2.142
  169    H    SER  39           H        SER  39 -16.469  12.088  -0.521
  170    HA   SER  39           HA       SER  39 -14.748  13.145  -2.598
  171    HB2  SER  39           HB1      SER  39 -12.950  12.540  -0.797
  172    HB3  SER  39           HB2      SER  39 -14.057  13.893  -0.502
  173    HG   SER  39           HG       SER  39 -13.767  12.261   1.241
  174    H    GLN  40           H        GLN  40 -13.067  12.027  -3.607
  175    HA   GLN  40           HA       GLN  40 -13.604   9.406  -4.403
  176    HB2  GLN  40           HB1      GLN  40 -11.415  11.348  -4.758
  177    HB3  GLN  40           HB2      GLN  40 -10.937   9.649  -4.917
  178    HG2  GLN  40           HG1      GLN  40 -13.355  10.601  -6.382
  179    HG3  GLN  40           HG2      GLN  40 -11.750  11.029  -6.990
  180   HE21  GLN  40          HE21      GLN  40 -10.794   9.639  -8.294
  181   HE22  GLN  40          HE22      GLN  40 -11.204   7.972  -8.476
  182    H    CYS  41           H        CYS  41 -10.933  10.532  -2.319
  183    HA   CYS  41           HA       CYS  41 -11.168   8.086  -0.747
  184    HB2  CYS  41           HB1      CYS  41  -8.742   7.655  -0.869
  185    HB3  CYS  41           HB2      CYS  41  -9.528   7.490  -2.439
  186    H    LEU  42           H        LEU  42 -10.352   8.252   1.351
  187    HA   LEU  42           HA       LEU  42  -9.768  11.007   2.200
  188    HB2  LEU  42           HB1      LEU  42 -11.167   8.698   3.486
  189    HB3  LEU  42           HB2      LEU  42 -10.370   9.908   4.507
  190    HG   LEU  42           HG       LEU  42 -12.161  11.033   2.472
  191   HD11  LEU  42          HD11      LEU  42 -13.305   8.894   3.171
  192   HD12  LEU  42          HD12      LEU  42 -14.208  10.381   3.454
  193   HD13  LEU  42          HD13      LEU  42 -13.393   9.576   4.795
  194   HD21  LEU  42          HD21      LEU  42 -11.071  12.341   4.246
  195   HD22  LEU  42          HD22      LEU  42 -11.942  11.400   5.458
  196   HD23  LEU  42          HD23      LEU  42 -12.830  12.431   4.336
  197    H    SER  43           H        SER  43  -8.659   7.696   2.325
  198    HA   SER  43           HA       SER  43  -6.049   8.615   3.217
  199    HB2  SER  43           HB1      SER  43  -7.436   7.989   5.271
  200    HB3  SER  43           HB2      SER  43  -7.366   6.322   4.673
  201    HG   SER  43           HG       SER  43  -5.563   7.541   6.119
  202    H    ASP  44           H        ASP  44  -4.536   6.582   3.344
  203    HA   ASP  44           HA       ASP  44  -4.394   5.491   0.767
  204    HB2  ASP  44           HB1      ASP  44  -2.581   4.098   1.624
  205    HB3  ASP  44           HB2      ASP  44  -2.438   5.748   2.242
  206    HD2  ASP  44           HD       ASP  44  -3.288   2.860   4.819
  207    H    THR  45           H        THR  45  -6.007   4.403   3.637
  208    HA   THR  45           HA       THR  45  -6.293   1.673   2.948
  209    HB   THR  45           HB       THR  45  -8.199   1.694   4.578
  210    HG1  THR  45           HG1      THR  45  -8.692   3.604   5.617
  211   HG21  THR  45          HG21      THR  45  -6.658   2.626   6.509
  212   HG22  THR  45          HG22      THR  45  -5.454   2.659   5.220
  213   HG23  THR  45          HG23      THR  45  -6.244   1.143   5.649
  214    H    ASP  46           H        ASP  46  -7.976   4.556   1.995
  215    HA   ASP  46           HA       ASP  46 -10.360   3.327   1.069
  216    HB2  ASP  46           HB1      ASP  46  -9.761   5.858   1.532
  217    HB3  ASP  46           HB2      ASP  46  -9.311   5.836  -0.178
  218    HD2  ASP  46           HD       ASP  46 -12.752   4.983  -0.946
  219    H    CYS  47           H        CYS  47  -7.188   3.747  -0.281
  220    HA   CYS  47           HA       CYS  47  -7.879   3.329  -3.006
  221    HB2  CYS  47           HB1      CYS  47  -5.354   3.299  -1.405
  222    HB3  CYS  47           HB2      CYS  47  -5.332   2.587  -3.020
  223    H    ASN  48           H        ASN  48  -6.667   1.384  -4.154
  224    HA   ASN  48           HA       ASN  48  -8.119  -0.917  -3.662
  225    HB2  ASN  48           HB1      ASN  48  -5.902  -0.132  -5.370
  226    HB3  ASN  48           HB2      ASN  48  -5.743  -1.811  -4.836
  227   HD21  ASN  48          HD21      ASN  48  -6.656  -0.222  -7.370
  228   HD22  ASN  48          HD22      ASN  48  -8.025  -1.135  -7.901
  229    H    THR  49           H        THR  49  -4.591  -0.803  -3.204
  230    HA   THR  49           HA       THR  49  -4.648  -1.684  -0.513
  231    HB   THR  49           HB       THR  49  -5.384  -3.805  -1.343
  232    HG1  THR  49           HG1      THR  49  -3.961  -4.701  -0.072
  233   HG21  THR  49          HG21      THR  49  -4.247  -5.035  -3.089
  234   HG22  THR  49          HG22      THR  49  -3.034  -3.763  -3.241
  235   HG23  THR  49          HG23      THR  49  -4.706  -3.447  -3.702
  236    H    ARG  50           H        ARG  50  -2.862  -1.644  -3.561
  237    HA   ARG  50           HA       ARG  50  -0.390  -1.118  -2.052
  238    HB2  ARG  50           HB1      ARG  50   0.811  -1.771  -4.107
  239    HB3  ARG  50           HB2      ARG  50  -0.225  -3.066  -3.490
  240    HG2  ARG  50           HG1      ARG  50  -1.736  -2.895  -5.228
  241    HG3  ARG  50           HG2      ARG  50  -1.262  -1.227  -5.598
  242    HD2  ARG  50           HD1      ARG  50  -0.084  -2.132  -7.285
  243    HD3  ARG  50           HD2      ARG  50   1.074  -2.568  -6.020
  244    HE   ARG  50           HE       ARG  50   0.485  -4.766  -6.275
  245   HH11  ARG  50          HH11      ARG  50  -1.909  -2.752  -7.805
  246   HH12  ARG  50          HH12      ARG  50  -2.741  -4.079  -8.544
  247   HH21  ARG  50          HH21      ARG  50  -0.604  -6.521  -7.243
  248   HH22  ARG  50          HH22      ARG  50  -1.999  -6.223  -8.223
  249    H    LYS  51           H        LYS  51  -2.383   0.894  -2.514
  250    HA   LYS  51           HA       LYS  51  -0.731   2.807  -3.984
  251    HB2  LYS  51           HB1      LYS  51  -3.692   2.384  -4.447
  252    HB3  LYS  51           HB2      LYS  51  -2.769   3.764  -5.060
  253    HG2  LYS  51           HG1      LYS  51  -1.570   2.467  -6.576
  254    HG3  LYS  51           HG2      LYS  51  -1.943   0.963  -5.715
  255    HD2  LYS  51           HD1      LYS  51  -3.981   0.733  -6.692
  256    HD3  LYS  51           HD2      LYS  51  -4.258   2.481  -6.756
  257    HE2  LYS  51           HE1      LYS  51  -2.307   2.407  -8.532
  258    HE3  LYS  51           HE2      LYS  51  -2.814   0.718  -8.678
  259    HZ1  LYS  51           HZ1      LYS  51  -4.888   2.782  -8.769
  260    HZ2  LYS  51           HZ2      LYS  51  -4.816   1.290  -9.562
  261    HZ3  LYS  51           HZ3      LYS  51  -3.899   2.594 -10.128
  262    H    PHE  52           H        PHE  52  -1.025   4.985  -3.353
  263    HA   PHE  52           HA       PHE  52  -2.340   5.269  -0.737
  264    HB2  PHE  52           HB1      PHE  52  -0.811   7.253  -0.455
  265    HB3  PHE  52           HB2      PHE  52   0.001   5.688  -0.529
  266    HD1  PHE  52           HD1      PHE  52  -0.784   8.713  -2.497
  267    HD2  PHE  52           HD2      PHE  52   1.585   5.188  -2.195
  268    HE1  PHE  52           HE1      PHE  52   0.639   9.515  -4.337
  269    HE2  PHE  52           HE2      PHE  52   3.011   5.986  -4.034
  270    HZ   PHE  52           HZ       PHE  52   2.540   8.152  -5.107
  271    H    CYS  53           H        CYS  53  -3.487   7.206  -0.267
  272    HA   CYS  53           HA       CYS  53  -4.896   8.252  -2.576
  273    HB2  CYS  53           HB1      CYS  53  -6.225   7.604  -0.669
  274    HB3  CYS  53           HB2      CYS  53  -5.286   8.652   0.394
  275    H    LEU  54           H        LEU  54  -3.575   9.669  -3.635
  276    HA   LEU  54           HA       LEU  54  -2.097  11.698  -2.218
  277    HB2  LEU  54           HB1      LEU  54  -1.256  10.635  -4.287
  278    HB3  LEU  54           HB2      LEU  54  -2.595  11.383  -5.176
  279    HG   LEU  54           HG       LEU  54  -1.313  13.509  -3.903
  280   HD11  LEU  54          HD11      LEU  54   0.535  11.730  -3.589
  281   HD12  LEU  54          HD12      LEU  54   0.970  13.312  -4.234
  282   HD13  LEU  54          HD13      LEU  54   0.800  11.934  -5.321
  283   HD21  LEU  54          HD21      LEU  54  -2.306  12.997  -6.324
  284   HD22  LEU  54          HD22      LEU  54  -0.589  12.844  -6.696
  285   HD23  LEU  54          HD23      LEU  54  -1.213  14.345  -6.009
  286    H    GLN  55           H        GLN  55  -2.642  13.781  -1.901
  287    HA   GLN  55           HA       GLN  55  -5.083  14.792  -3.191
  288    HB2  GLN  55           HB1      GLN  55  -5.540  15.994  -0.982
  289    HB3  GLN  55           HB2      GLN  55  -5.864  14.253  -1.039
  290    HG2  GLN  55           HG1      GLN  55  -4.405  13.820   0.579
  291    HG3  GLN  55           HG2      GLN  55  -3.155  14.804  -0.193
  292   HE21  GLN  55          HE21      GLN  55  -6.178  15.172   1.624
  293   HE22  GLN  55          HE22      GLN  55  -5.657  16.534   2.549
  294    HA   PRO  56           HA       PRO  56  -1.701  17.796  -3.908
  295    HB2  PRO  56           HB1      PRO  56  -2.637  18.588  -6.357
  296    HB3  PRO  56           HB2      PRO  56  -1.634  17.160  -6.114
  297    HG2  PRO  56           HG1      PRO  56  -4.615  17.370  -6.362
  298    HG3  PRO  56           HG2      PRO  56  -3.486  16.201  -7.143
  299    HD2  PRO  56           HD1      PRO  56  -4.988  15.561  -4.974
  300    HD3  PRO  56           HD2      PRO  56  -3.366  14.896  -5.247
  301    H    ARG  57           H        ARG  57  -1.737  20.084  -3.986
  302    HA   ARG  57           HA       ARG  57  -4.112  21.239  -2.817
  303    HB2  ARG  57           HB1      ARG  57  -1.368  22.331  -3.446
  304    HB3  ARG  57           HB2      ARG  57  -2.669  23.330  -2.781
  305    HG2  ARG  57           HG1      ARG  57  -2.756  22.033  -0.774
  306    HG3  ARG  57           HG2      ARG  57  -1.635  20.840  -1.449
  307    HD2  ARG  57           HD1      ARG  57  -0.177  22.070  -0.172
  308    HD3  ARG  57           HD2      ARG  57  -0.068  22.939  -1.709
  309    HE   ARG  57           HE       ARG  57  -2.091  24.174  -0.320
  310   HH11  ARG  57          HH11      ARG  57   1.288  23.526   0.205
  311   HH12  ARG  57          HH12      ARG  57   1.543  24.938   1.174
  312   HH21  ARG  57          HH21      ARG  57  -1.768  26.038   0.956
  313   HH22  ARG  57          HH22      ARG  57  -0.197  26.366   1.602
  314    H    ASP  58           H        ASP  58  -2.527  21.178  -5.905
  315    HA   ASP  58           HA       ASP  58  -4.132  23.370  -6.947
  316    HB2  ASP  58           HB1      ASP  58  -2.788  23.310  -8.867
  317    HB3  ASP  58           HB2      ASP  58  -1.672  22.903  -7.555
  318    HD2  ASP  58           HD       ASP  58  -1.901  20.408 -10.441
  319    H    GLU  59           H        GLU  59  -4.157  19.926  -6.816
  320    HA   GLU  59           HA       GLU  59  -6.439  19.884  -8.681
  321    HB2  GLU  59           HB1      GLU  59  -4.044  18.206  -8.519
  322    HB3  GLU  59           HB2      GLU  59  -5.549  17.278  -8.570
  323    HG2  GLU  59           HG1      GLU  59  -5.220  19.487 -10.532
  324    HG3  GLU  59           HG2      GLU  59  -4.275  18.009 -10.765
  325    HE2  GLU  59           HE       GLU  59  -7.159  17.075 -12.482
  326    H    LYS  60           H        LYS  60  -7.676  17.651  -8.258
  327    HA   LYS  60           HA       LYS  60  -8.579  17.842  -5.498
  328    HB2  LYS  60           HB1      LYS  60  -9.700  16.859  -8.058
  329    HB3  LYS  60           HB2      LYS  60 -10.209  15.985  -6.601
  330    HG2  LYS  60           HG1      LYS  60 -10.969  18.095  -5.599
  331    HG3  LYS  60           HG2      LYS  60 -10.491  18.946  -7.079
  332    HD2  LYS  60           HD1      LYS  60 -12.561  18.569  -7.832
  333    HD3  LYS  60           HD2      LYS  60 -12.075  16.872  -8.002
  334    HE2  LYS  60           HE1      LYS  60 -12.857  16.403  -5.725
  335    HE3  LYS  60           HE2      LYS  60 -13.325  18.100  -5.545
  336    HZ1  LYS  60           HZ1      LYS  60 -14.853  16.031  -6.580
  337    HZ2  LYS  60           HZ2      LYS  60 -14.490  17.042  -7.886
  338    HZ3  LYS  60           HZ3      LYS  60 -15.254  17.673  -6.516
  339    HA   PRO  61           HA       PRO  61  -6.783  14.126  -4.009
  340    HB2  PRO  61           HB1      PRO  61  -8.785  13.076  -2.461
  341    HB3  PRO  61           HB2      PRO  61  -7.862  14.511  -2.017
  342    HG2  PRO  61           HG1      PRO  61 -10.551  14.310  -3.329
  343    HG3  PRO  61           HG2      PRO  61 -10.023  15.370  -1.970
  344    HD2  PRO  61           HD1      PRO  61 -10.260  16.268  -4.521
  345    HD3  PRO  61           HD2      PRO  61  -9.027  16.877  -3.402
  346    H    PHE  62           H        PHE  62  -6.506  12.027  -4.585
  347    HA   PHE  62           HA       PHE  62  -8.596  10.323  -5.469
  348    HB2  PHE  62           HB1      PHE  62  -8.120  10.143  -7.804
  349    HB3  PHE  62           HB2      PHE  62  -8.357  11.856  -7.449
  350    HD1  PHE  62           HD1      PHE  62  -6.149  13.174  -6.831
  351    HD2  PHE  62           HD2      PHE  62  -6.293   9.568  -9.088
  352    HE1  PHE  62           HE1      PHE  62  -3.960  13.708  -7.819
  353    HE2  PHE  62           HE2      PHE  62  -4.104  10.095 -10.078
  354    HZ   PHE  62           HZ       PHE  62  -2.934  12.167  -9.444
  355    H    CYS  63           H        CYS  63  -7.680   8.254  -6.424
  356    HA   CYS  63           HA       CYS  63  -5.422   7.460  -4.804
  357    HB2  CYS  63           HB1      CYS  63  -7.530   6.084  -5.153
  358    HB3  CYS  63           HB2      CYS  63  -6.937   5.756  -6.782
  359    H    ALA  64           H        ALA  64  -3.401   7.658  -5.478
  360    HA   ALA  64           HA       ALA  64  -2.856   7.586  -8.370
  361    HB1  ALA  64           HB1      ALA  64  -1.617   9.396  -8.053
  362    HB2  ALA  64           HB2      ALA  64  -2.028   9.377  -6.337
  363    HB3  ALA  64           HB3      ALA  64  -0.600   8.516  -6.912
  364    H    THR  65           H        THR  65  -1.252   6.273  -9.194
  365    HA   THR  65           HA       THR  65  -0.755   3.847  -7.815
  366    HB   THR  65           HB       THR  65   0.992   4.546 -10.108
  367    HG1  THR  65           HG1      THR  65  -1.823   4.185 -10.396
  368   HG21  THR  65          HG21      THR  65   0.262   2.234  -8.819
  369   HG22  THR  65          HG22      THR  65   0.987   2.323 -10.425
  370   HG23  THR  65          HG23      THR  65  -0.764   2.214 -10.252
  371    H    CYS  66           H        CYS  66   1.345   2.936  -7.308
  372    HA   CYS  66           HA       CYS  66   2.882   4.587  -5.642
  373    HB2  CYS  66           HB1      CYS  66   2.612   1.929  -5.878
  374    HB3  CYS  66           HB2      CYS  66   4.133   2.127  -6.752
  375    H    ARG  67           H        ARG  67   5.248   4.955  -5.837
  376    HA   ARG  67           HA       ARG  67   5.894   5.816  -8.574
  377    HB2  ARG  67           HB1      ARG  67   6.308   6.974  -5.908
  378    HB3  ARG  67           HB2      ARG  67   7.743   7.029  -6.942
  379    HG2  ARG  67           HG1      ARG  67   6.707   9.050  -7.395
  380    HG3  ARG  67           HG2      ARG  67   6.162   8.010  -8.722
  381    HD2  ARG  67           HD1      ARG  67   4.008   7.943  -7.990
  382    HD3  ARG  67           HD2      ARG  67   4.485   8.028  -6.288
  383    HE   ARG  67           HE       ARG  67   5.099  10.495  -7.272
  384   HH11  ARG  67          HH11      ARG  67   2.226   8.531  -7.185
  385   HH12  ARG  67          HH12      ARG  67   1.145   9.884  -7.141
  386   HH21  ARG  67          HH21      ARG  67   3.686  12.284  -7.213
  387   HH22  ARG  67          HH22      ARG  67   1.977  12.019  -7.156
  388    H    GLY  68           H        GLY  68   7.690   5.100  -9.595
  389    HA2  GLY  68           HA2      GLY  68   8.944   2.731  -8.690
  390    HA3  GLY  68           HA3      GLY  68   9.443   3.695 -10.073
  391    HA1  GLY  68           HA1      GLY  68   8.865   3.340  -8.058
  392    H    LEU  69           H        LEU  69  11.611   3.037  -9.335
  393    HA   LEU  69           HA       LEU  69  12.638   4.067  -6.875
  394    HB2  LEU  69           HB1      LEU  69  14.018   3.004  -9.345
  395    HB3  LEU  69           HB2      LEU  69  14.847   3.440  -7.840
  396    HG   LEU  69           HG       LEU  69  12.848   1.211  -8.217
  397   HD11  LEU  69          HD11      LEU  69  14.899  -0.109  -7.424
  398   HD12  LEU  69          HD12      LEU  69  15.823   1.327  -7.868
  399   HD13  LEU  69          HD13      LEU  69  14.878   0.473  -9.089
  400   HD21  LEU  69          HD21      LEU  69  12.422   1.397  -6.044
  401   HD22  LEU  69          HD22      LEU  69  13.639   2.659  -5.849
  402   HD23  LEU  69          HD23      LEU  69  14.104   0.961  -5.742
  403    H    ARG  70           H        ARG  70  13.299   4.916 -10.279
  404    HA   ARG  70           HA       ARG  70  14.862   7.150  -9.841
  405    HB2  ARG  70           HB1      ARG  70  12.929   6.476 -12.057
  406    HB3  ARG  70           HB2      ARG  70  13.923   7.938 -12.087
  407    HG2  ARG  70           HG1      ARG  70  15.551   6.765 -13.023
  408    HG3  ARG  70           HG2      ARG  70  15.689   5.845 -11.515
  409    HD2  ARG  70           HD1      ARG  70  14.004   4.252 -12.312
  410    HD3  ARG  70           HD2      ARG  70  13.850   5.178 -13.811
  411    HE   ARG  70           HE       ARG  70  15.872   3.274 -13.188
  412   HH11  ARG  70          HH11      ARG  70  15.267   6.234 -14.919
  413   HH12  ARG  70          HH12      ARG  70  16.528   5.966 -16.077
  414   HH21  ARG  70          HH21      ARG  70  17.534   2.911 -14.707
  415   HH22  ARG  70          HH22      ARG  70  17.816   4.075 -15.956
  416    H    ARG  71           H        ARG  71  11.406   6.790  -9.580
  417    HA   ARG  71           HA       ARG  71  10.590   9.448  -9.726
  418    HB2  ARG  71           HB1      ARG  71   9.523   7.092  -8.172
  419    HB3  ARG  71           HB2      ARG  71   8.724   8.672  -8.157
  420    HG2  ARG  71           HG1      ARG  71   9.266   7.031 -10.634
  421    HG3  ARG  71           HG2      ARG  71   7.720   7.116  -9.772
  422    HD2  ARG  71           HD1      ARG  71   8.260   9.764 -10.138
  423    HD3  ARG  71           HD2      ARG  71   8.977   9.050 -11.590
  424    HE   ARG  71           HE       ARG  71   6.175   9.227 -10.944
  425   HH11  ARG  71          HH11      ARG  71   8.601   7.589 -12.830
  426   HH12  ARG  71          HH12      ARG  71   7.486   7.061 -14.045
  427   HH21  ARG  71          HH21      ARG  71   4.697   8.536 -12.539
  428   HH22  ARG  71          HH22      ARG  71   5.266   7.601 -13.880
  429    H    ARG  72           H        ARG  72  10.303  11.072  -8.201
  430    HA   ARG  72           HA       ARG  72  12.229  11.075  -6.057
  431    HB2  ARG  72           HB1      ARG  72  10.184  13.186  -6.777
  432    HB3  ARG  72           HB2      ARG  72  11.613  13.399  -5.756
  433    HG2  ARG  72           HG1      ARG  72  12.414  12.362  -8.309
  434    HG3  ARG  72           HG2      ARG  72  11.402  13.799  -8.524
  435    HD2  ARG  72           HD1      ARG  72  12.989  14.646  -6.506
  436    HD3  ARG  72           HD2      ARG  72  14.088  13.535  -7.335
  437    HE   ARG  72           HE       ARG  72  14.285  15.065  -9.012
  438   HH11  ARG  72          HH11      ARG  72  11.357  15.724  -7.248
  439   HH12  ARG  72          HH12      ARG  72  11.003  17.178  -8.121
  440   HH21  ARG  72          HH21      ARG  72  13.830  16.976 -10.170
  441   HH22  ARG  72          HH22      ARG  72  12.410  17.889  -9.784
  442    H    CYS  73           H        CYS  73  11.748  11.493  -3.845
  443    HA   CYS  73           HA       CYS  73   9.004  11.185  -2.949
  444    HB2  CYS  73           HB1      CYS  73   9.370   9.250  -1.599
  445    HB3  CYS  73           HB2      CYS  73   9.916   8.860  -3.230
  446    H    GLN  74           H        GLN  74   8.668  11.844  -0.802
  447    HA   GLN  74           HA       GLN  74  10.957  13.258   0.397
  448    HB2  GLN  74           HB1      GLN  74   8.122  14.022  -0.024
  449    HB3  GLN  74           HB2      GLN  74   8.847  14.504   1.517
  450    HG2  GLN  74           HG1      GLN  74  10.381  15.914   0.528
  451    HG3  GLN  74           HG2      GLN  74  10.290  15.076  -1.028
  452   HE21  GLN  74          HE21      GLN  74   9.728  16.675  -2.369
  453   HE22  GLN  74          HE22      GLN  74   8.297  17.633  -2.223
  454    H    ARG  75           H        ARG  75   8.348  11.033   0.903
  455    HA   ARG  75           HA       ARG  75   9.235  10.681   3.690
  456    HB2  ARG  75           HB1      ARG  75   6.757  11.564   2.954
  457    HB3  ARG  75           HB2      ARG  75   6.493   9.817   3.062
  458    HG2  ARG  75           HG1      ARG  75   7.889  10.321   5.365
  459    HG3  ARG  75           HG2      ARG  75   6.906  11.782   5.178
  460    HD2  ARG  75           HD1      ARG  75   4.913  10.651   5.390
  461    HD3  ARG  75           HD2      ARG  75   5.599   9.139   4.781
  462    HE   ARG  75           HE       ARG  75   6.129   8.563   6.926
  463   HH11  ARG  75          HH11      ARG  75   5.566  11.995   6.790
  464   HH12  ARG  75          HH12      ARG  75   5.671  12.212   8.506
  465   HH21  ARG  75          HH21      ARG  75   6.269   8.835   9.186
  466   HH22  ARG  75          HH22      ARG  75   6.072  10.414   9.868
  467    H    ASP  76           H        ASP  76   9.600   8.623   4.385
  468    HA   ASP  76           HA       ASP  76  10.221   6.637   2.520
  469    HB2  ASP  76           HB1      ASP  76  11.104   6.855   4.884
  470    HB3  ASP  76           HB2      ASP  76   9.578   6.146   5.429
  471    HD2  ASP  76           HD       ASP  76  11.504   3.248   5.139
  472    H    ALA  77           H        ALA  77   7.248   7.389   4.146
  473    HA   ALA  77           HA       ALA  77   5.979   4.868   3.633
  474    HB1  ALA  77           HB1      ALA  77   5.447   6.811   5.381
  475    HB2  ALA  77           HB2      ALA  77   4.330   7.281   4.099
  476    HB3  ALA  77           HB3      ALA  77   4.222   5.674   4.818
  477    H    MET  78           H        MET  78   6.152   7.990   2.025
  478    HA   MET  78           HA       MET  78   4.074   7.722   0.201
  479    HB2  MET  78           HB1      MET  78   6.583   9.279   0.358
  480    HB3  MET  78           HB2      MET  78   5.918   9.067  -1.268
  481    HG2  MET  78           HG1      MET  78   4.114   9.972   0.937
  482    HG3  MET  78           HG2      MET  78   5.236  11.116   0.196
  483    HE1  MET  78           HE1      MET  78   4.097  11.249  -3.502
  484    HE2  MET  78           HE2      MET  78   5.109  11.976  -2.254
  485    HE3  MET  78           HE3      MET  78   5.421  10.326  -2.791
  486    H    CYS  79           H        CYS  79   7.280   6.317   0.199
  487    HA   CYS  79           HA       CYS  79   6.916   5.237  -2.484
  488    HB2  CYS  79           HB1      CYS  79   9.122   6.195  -1.398
  489    HB3  CYS  79           HB2      CYS  79   9.258   4.558  -0.750
  490    H    CYS  80           H        CYS  80   6.728   3.069  -2.959
  491    HA   CYS  80           HA       CYS  80   5.260   1.444  -1.277
  492    HB2  CYS  80           HB1      CYS  80   6.894   0.986  -3.729
  493    HB3  CYS  80           HB2      CYS  80   6.381  -0.433  -2.814
  494    HA   PRO  81           HA       PRO  81   7.979  -0.434   1.606
  495    HB2  PRO  81           HB1      PRO  81   7.049  -3.009   1.708
  496    HB3  PRO  81           HB2      PRO  81   6.179  -1.632   2.382
  497    HG2  PRO  81           HG1      PRO  81   5.826  -2.994  -0.267
  498    HG3  PRO  81           HG2      PRO  81   4.574  -2.469   0.920
  499    HD2  PRO  81           HD1      PRO  81   5.154  -1.053  -1.322
  500    HD3  PRO  81           HD2      PRO  81   4.668  -0.282   0.198
  501    H    GLY  82           H        GLY  82   9.870  -1.609   1.782
  502    HA2  GLY  82           HA2      GLY  82  11.352  -3.367   1.084
  503    HA3  GLY  82           HA3      GLY  82  10.642  -3.274  -0.521
  504    HA1  GLY  82           HA1      GLY  82  11.355  -2.524   1.336
  505    H    THR  83           H        THR  83  10.793  -0.227  -0.193
  506    HA   THR  83           HA       THR  83  13.649   0.005  -0.889
  507    HB   THR  83           HB       THR  83  12.699   2.151  -2.123
  508    HG1  THR  83           HG1      THR  83  10.501   0.336  -2.220
  509   HG21  THR  83          HG21      THR  83  12.074   0.246  -4.011
  510   HG22  THR  83          HG22      THR  83  13.159  -0.617  -2.921
  511   HG23  THR  83          HG23      THR  83  13.685   0.883  -3.686
  512    H    LEU  84           H        LEU  84  14.385   2.395  -0.723
  513    HA   LEU  84           HA       LEU  84  13.295   3.590   1.736
  514    HB2  LEU  84           HB1      LEU  84  15.689   2.296   1.620
  515    HB3  LEU  84           HB2      LEU  84  16.169   3.963   1.259
  516    HG   LEU  84           HG       LEU  84  15.009   4.651   3.385
  517   HD11  LEU  84          HD11      LEU  84  13.594   3.074   4.148
  518   HD12  LEU  84          HD12      LEU  84  15.038   2.471   4.959
  519   HD13  LEU  84          HD13      LEU  84  14.516   1.747   3.439
  520   HD21  LEU  84          HD21      LEU  84  17.436   4.418   3.227
  521   HD22  LEU  84          HD22      LEU  84  17.302   2.705   3.626
  522   HD23  LEU  84          HD23      LEU  84  16.847   3.927   4.816
  523    H    CYS  85           H        CYS  85  13.838   5.891   2.002
  524    HA   CYS  85           HA       CYS  85  13.806   7.242  -0.601
  525    HB2  CYS  85           HB1      CYS  85  12.669   7.827   2.084
  526    HB3  CYS  85           HB2      CYS  85  13.182   9.212   1.119
  527    H    VAL  86           H        VAL  86  15.758   7.862  -1.260
  528    HA   VAL  86           HA       VAL  86  17.474   9.297   0.648
  529    HB   VAL  86           HB       VAL  86  18.441   7.275  -1.378
  530   HG11  VAL  86          HG11      VAL  86  19.795   9.396   0.158
  531   HG12  VAL  86          HG12      VAL  86  20.591   7.822   0.144
  532   HG13  VAL  86          HG13      VAL  86  20.236   8.645  -1.375
  533   HG21  VAL  86          HG21      VAL  86  18.687   7.169   1.621
  534   HG22  VAL  86          HG22      VAL  86  17.383   6.383   0.729
  535   HG23  VAL  86          HG23      VAL  86  19.057   5.897   0.457
  536    H    ASN  87           H        ASN  87  18.433  11.113  -0.120
  537    HA   ASN  87           HA       ASN  87  18.756  12.924  -1.461
  538    HB2  ASN  87           HB1      ASN  87  20.139  11.008  -2.581
  539    HB3  ASN  87           HB2      ASN  87  18.897  11.095  -3.836
  540   HD21  ASN  87          HD21      ASN  87  21.521  12.763  -2.293
  541   HD22  ASN  87          HD22      ASN  87  21.696  14.006  -3.480
  542    H    ASP  88           H        ASP  88  16.039  12.082  -1.016
  543    HA   ASP  88           HA       ASP  88  13.935  12.632  -1.680
  544    HB2  ASP  88           HB1      ASP  88  15.124  14.261  -3.921
  545    HB3  ASP  88           HB2      ASP  88  13.629  14.547  -3.021
  546    HD2  ASP  88           HD       ASP  88  16.500  16.601  -1.805
  547    H    VAL  89           H        VAL  89  15.427  10.373  -2.898
  548    HA   VAL  89           HA       VAL  89  13.612   9.942  -5.159
  549    HB   VAL  89           HB       VAL  89  16.560   9.281  -5.245
  550   HG11  VAL  89          HG11      VAL  89  15.535   7.615  -6.492
  551   HG12  VAL  89          HG12      VAL  89  14.263   8.692  -7.072
  552   HG13  VAL  89          HG13      VAL  89  15.903   8.840  -7.705
  553   HG21  VAL  89          HG21      VAL  89  16.634  11.507  -5.712
  554   HG22  VAL  89          HG22      VAL  89  16.228  10.912  -7.322
  555   HG23  VAL  89          HG23      VAL  89  14.964  11.559  -6.276
  556    H    CYS  90           H        CYS  90  12.969   7.818  -5.470
  557    HA   CYS  90           HA       CYS  90  13.075   6.140  -3.164
  558    HB2  CYS  90           HB1      CYS  90  11.868   5.901  -5.907
  559    HB3  CYS  90           HB2      CYS  90  11.903   4.506  -4.827
  560    H    THR  91           H        THR  91  14.884   5.087  -2.657
  561    HA   THR  91           HA       THR  91  16.412   3.793  -4.818
  562    HB   THR  91           HB       THR  91  17.658   5.478  -3.468
  563    HG1  THR  91           HG1      THR  91  19.430   3.991  -3.016
  564   HG21  THR  91          HG21      THR  91  16.563   5.126  -1.315
  565   HG22  THR  91          HG22      THR  91  18.305   4.891  -1.169
  566   HG23  THR  91          HG23      THR  91  17.228   3.495  -1.229
  567    H    THR  92           H        THR  92  17.584   1.769  -4.086
  568    HA   THR  92           HA       THR  92  15.629  -0.041  -2.973
  569    HB   THR  92           HB       THR  92  17.249  -1.814  -3.521
  570    HG1  THR  92           HG1      THR  92  19.230  -1.273  -4.429
  571   HG21  THR  92          HG21      THR  92  17.492  -1.076  -6.056
  572   HG22  THR  92          HG22      THR  92  16.394   0.202  -5.536
  573   HG23  THR  92          HG23      THR  92  15.926  -1.489  -5.361
  574    H    MET  93           H        MET  93  15.841  -1.273  -1.114
  575    HA   MET  93           HA       MET  93  17.029  -0.079   1.107
  576    HB2  MET  93           HB1      MET  93  15.607  -2.568   0.519
  577    HB3  MET  93           HB2      MET  93  16.792  -2.735   1.824
  578    HG2  MET  93           HG1      MET  93  15.755  -0.982   3.094
  579    HG3  MET  93           HG2      MET  93  14.671  -0.606   1.753
  580    HE1  MET  93           HE1      MET  93  13.765  -1.313   4.894
  581    HE2  MET  93           HE2      MET  93  13.561  -3.041   5.188
  582    HE3  MET  93           HE3      MET  93  15.176  -2.372   4.947
  583    H    GLU  94           H        GLU  94  18.242  -2.514  -1.108
  584    HA   GLU  94           HA       GLU  94  20.480  -3.313   0.429
  585    HB2  GLU  94           HB1      GLU  94  19.705  -3.521  -2.460
  586    HB3  GLU  94           HB2      GLU  94  21.355  -3.935  -1.965
  587    HG2  GLU  94           HG1      GLU  94  20.696  -5.946  -1.334
  588    HG3  GLU  94           HG2      GLU  94  19.558  -5.221  -0.188
  589    HE2  GLU  94           HE       GLU  94  17.011  -6.521  -2.063
  590    H    ASP  95           H        ASP  95  19.897  -0.662  -1.768
  591    HA   ASP  95           HA       ASP  95  22.680   0.079  -1.953
  592    HB2  ASP  95           HB1      ASP  95  20.101   1.093  -3.042
  593    HB3  ASP  95           HB2      ASP  95  21.425   2.255  -2.891
  594    HD2  ASP  95           HD       ASP  95  22.552  -0.766  -5.148
  595    H    ALA  96           H        ALA  96  19.789   1.319  -0.313
  596    HA   ALA  96           HA       ALA  96  21.182   3.469   0.962
  597    HB1  ALA  96           HB1      ALA  96  19.156   4.078   1.857
  598    HB2  ALA  96           HB2      ALA  96  18.637   3.190   0.425
  599    HB3  ALA  96           HB3      ALA  96  18.596   2.412   2.007
  600    H    THR  97           H        THR  97  22.770   2.975   2.349
  601    HA   THR  97           HA       THR  97  22.084   1.381   4.696
  602    HB   THR  97           HB       THR  97  24.432   0.315   4.527
  603    HG1  THR  97           HG1      THR  97  25.324   0.232   2.522
  604   HG21  THR  97          HG21      THR  97  22.505  -1.074   4.398
  605   HG22  THR  97          HG22      THR  97  23.529  -1.511   3.029
  606   HG23  THR  97          HG23      THR  97  22.112  -0.492   2.781
  607    H    GLU  98           H        GLU  98  25.064   2.773   3.313
  608    HA   GLU  98           HA       GLU  98  25.161   5.032   4.961
  609    HB2  GLU  98           HB1      GLU  98  25.796   2.638   6.333
  610    HB3  GLU  98           HB2      GLU  98  27.316   3.514   6.089
  611    HG2  GLU  98           HG1      GLU  98  26.080   5.562   7.009
  612    HG3  GLU  98           HG2      GLU  98  24.867   4.400   7.567
  613    HE2  GLU  98           HE       GLU  98  27.408   2.938   9.694
  614    H    ASN  99           H        ASN  99  26.836   6.370   4.402
  615    HA   ASN  99           HA       ASN  99  28.516   5.428   2.203
  616    HB2  ASN  99           HB1      ASN  99  27.133   7.842   2.739
  617    HB3  ASN  99           HB2      ASN  99  28.860   8.224   2.775
  618   HD21  ASN  99          HD21      ASN  99  26.390   8.415   0.824
  619   HD22  ASN  99          HD22      ASN  99  27.120   8.065  -0.703
  620    H    LEU 100           H        LEU 100  28.781   7.055   5.340
  621    HA   LEU 100           HA       LEU 100  31.653   7.101   5.267
  622    HB2  LEU 100           HB1      LEU 100  29.536   7.857   7.233
  623    HB3  LEU 100           HB2      LEU 100  31.192   7.607   7.814
  624    HG   LEU 100           HG       LEU 100  30.524   9.525   5.593
  625   HD11  LEU 100          HD11      LEU 100  31.149  10.800   8.086
  626   HD12  LEU 100          HD12      LEU 100  29.733   9.766   8.268
  627   HD13  LEU 100          HD13      LEU 100  29.752  11.024   7.032
  628   HD21  LEU 100          HD21      LEU 100  32.909   8.538   6.219
  629   HD22  LEU 100          HD22      LEU 100  32.835   9.818   7.430
  630   HD23  LEU 100          HD23      LEU 100  32.689  10.213   5.717
  631    H    TYR 101           H        TYR 101  33.070   5.905   6.584
  632    HA   TYR 101           HA       TYR 101  32.164   3.783   8.262
  633    HB2  TYR 101           HB1      TYR 101  31.761   2.889   5.926
  634    HB3  TYR 101           HB2      TYR 101  33.511   2.924   5.699
  635    HD1  TYR 101           HD1      TYR 101  31.020   1.609   8.160
  636    HD2  TYR 101           HD2      TYR 101  34.709   1.001   6.129
  637    HE1  TYR 101           HE1      TYR 101  31.221  -0.610   9.201
  638    HE2  TYR 101           HE2      TYR 101  34.918  -1.222   7.163
  639    HH   TYR 101           HH       TYR 101  33.126  -2.970   8.149
  640    H    PHE 102           H        PHE 102  33.884   2.705   9.343
  641    HA   PHE 102           HA       PHE 102  36.516   3.979   8.984
  642    HB2  PHE 102           HB1      PHE 102  36.853   4.013  11.358
  643    HB3  PHE 102           HB2      PHE 102  35.292   4.768  11.024
  644    HD1  PHE 102           HD1      PHE 102  36.974   1.987  12.620
  645    HD2  PHE 102           HD2      PHE 102  33.189   3.581  11.504
  646    HE1  PHE 102           HE1      PHE 102  35.866   0.436  14.175
  647    HE2  PHE 102           HE2      PHE 102  32.075   2.032  13.058
  648    HZ   PHE 102           HZ       PHE 102  33.414   0.458  14.397
  649    H    GLN 103           H        GLN 103  38.206   2.624  10.347
  650    HA   GLN 103           HA       GLN 103  37.731  -0.230  10.251
  651    HB2  GLN 103           HB1      GLN 103  38.541   0.776   7.923
  652    HB3  GLN 103           HB2      GLN 103  40.122   0.656   8.712
  653    HG2  GLN 103           HG1      GLN 103  40.230  -1.514   8.303
  654    HG3  GLN 103           HG2      GLN 103  38.681  -1.777   9.118
  655   HE21  GLN 103          HE21      GLN 103  39.924  -0.479   6.056
  656   HE22  GLN 103          HE22      GLN 103  38.717  -1.207   5.060
  657    H    SER 104           H        SER 104  38.966  -1.321  11.686
  658    HA   SER 104           HA       SER 104  41.103   0.198  13.035
  659    HB2  SER 104           HB1      SER 104  39.180  -1.835  14.209
  660    HB3  SER 104           HB2      SER 104  40.535  -1.097  15.083
  661    HG   SER 104           HG       SER 104  38.072  -0.101  14.619
  662    H    LEU 105           H        LEU 105  43.016  -0.826  13.481
  663    HA   LEU 105           HA       LEU 105  43.362  -3.469  12.237
  664    HB2  LEU 105           HB1      LEU 105  44.926  -1.013  12.231
  665    HB3  LEU 105           HB2      LEU 105  45.886  -2.429  12.694
  666    HG   LEU 105           HG       LEU 105  45.994  -1.885  10.275
  667   HD11  LEU 105          HD11      LEU 105  44.657  -4.534  10.770
  668   HD12  LEU 105          HD12      LEU 105  46.326  -4.187  11.218
  669   HD13  LEU 105          HD13      LEU 105  45.839  -4.131   9.525
  670   HD21  LEU 105          HD21      LEU 105  43.367  -3.034   9.704
  671   HD22  LEU 105          HD22      LEU 105  44.190  -1.657   8.970
  672   HD23  LEU 105          HD23      LEU 105  43.303  -1.452  10.481
  673    H    GLU 106           H        GLU 106  44.943  -4.919  13.247
  674    HA   GLU 106           HA       GLU 106  44.804  -4.718  16.177
  675    HB2  GLU 106           HB1      GLU 106  44.841  -7.015  14.258
  676    HB3  GLU 106           HB2      GLU 106  45.467  -7.253  15.895
  677    HG2  GLU 106           HG1      GLU 106  42.928  -5.899  15.991
  678    HG3  GLU 106           HG2      GLU 106  42.807  -7.392  15.050
  679    HE2  GLU 106           HE       GLU 106  43.204  -9.373  17.848
  680    H    HIS 107           H        HIS 107  46.625  -3.515  16.614
  681    HA   HIS 107           HA       HIS 107  49.197  -4.692  15.788
  682    HB2  HIS 107           HB1      HIS 107  50.198  -2.505  16.017
  683    HB3  HIS 107           HB2      HIS 107  48.788  -2.386  14.962
  684    HD1  HIS 107           HD1      HIS 107  50.263  -0.845  17.875
  685    HD2  HIS 107           HD2      HIS 107  46.412  -1.353  16.397
  686    HE1  HIS 107           HE1      HIS 107  48.849   0.850  19.082
  687    HE2  HIS 107           HE2      HIS 107  46.497   0.541  18.178
  688    H    HIS 108           H        HIS 108  47.240  -3.613  18.454
  689    HA   HIS 108           HA       HIS 108  49.190  -3.524  20.468
  690    HB2  HIS 108           HB1      HIS 108  46.229  -3.828  20.377
  691    HB3  HIS 108           HB2      HIS 108  47.041  -4.267  21.884
  692    HD1  HIS 108           HD1      HIS 108  46.257  -1.313  19.732
  693    HD2  HIS 108           HD2      HIS 108  48.134  -2.145  23.345
  694    HE1  HIS 108           HE1      HIS 108  46.583   0.916  20.850
  695    HE2  HIS 108           HE2      HIS 108  47.730   0.409  23.058
  696    H    HIS 109           H        HIS 109  47.573  -6.188  18.929
  697    HA   HIS 109           HA       HIS 109  48.070  -8.166  20.886
  698    HB2  HIS 109           HB1      HIS 109  46.758  -8.048  18.438
  699    HB3  HIS 109           HB2      HIS 109  48.096  -9.164  18.146
  700    HD1  HIS 109           HD1      HIS 109  45.127  -8.755  20.454
  701    HD2  HIS 109           HD2      HIS 109  47.770 -11.686  19.158
  702    HE1  HIS 109           HE1      HIS 109  44.230 -10.920  21.367
  703    HE2  HIS 109           HE2      HIS 109  45.845 -12.713  20.575
  704    H    HIS 110           H        HIS 110  49.907  -9.097  21.481
  705    HA   HIS 110           HA       HIS 110  51.942  -9.916  19.722
  706    HB2  HIS 110           HB1      HIS 110  52.080  -7.198  20.226
  707    HB3  HIS 110           HB2      HIS 110  53.221  -7.882  21.388
  708    HD1  HIS 110           HD1      HIS 110  55.494  -7.689  20.446
  709    HD2  HIS 110           HD2      HIS 110  52.717  -8.779  17.554
  710    HE1  HIS 110           HE1      HIS 110  56.821  -8.038  18.339
  711    HE2  HIS 110           HE2      HIS 110  55.125  -8.704  16.570
  712    H    HIS 111           H        HIS 111  53.473 -11.206  20.736
  713    HA   HIS 111           HA       HIS 111  53.019 -11.635  23.614
  714    HB2  HIS 111           HB1      HIS 111  53.625 -13.530  21.360
  715    HB3  HIS 111           HB2      HIS 111  54.043 -13.962  23.021
  716    HD1  HIS 111           HD1      HIS 111  52.046 -15.753  21.779
  717    HD2  HIS 111           HD2      HIS 111  50.935 -12.242  23.704
  718    HE1  HIS 111           HE1      HIS 111  49.635 -16.071  22.418
  719    HE2  HIS 111           HE2      HIS 111  48.954 -13.927  23.596
  720    H    HIS 112           H        HIS 112  54.910  -9.768  22.301
  721    HA   HIS 112           HA       HIS 112  57.376 -10.811  23.522
  722    HB2  HIS 112           HB1      HIS 112  57.125  -9.242  20.945
  723    HB3  HIS 112           HB2      HIS 112  58.656  -9.564  21.765
  724    HD1  HIS 112           HD1      HIS 112  59.168 -12.251  22.105
  725    HD2  HIS 112           HD2      HIS 112  56.478 -11.164  19.131
  726    HE1  HIS 112           HE1      HIS 112  59.027 -14.236  20.567
  727    HE2  HIS 112           HE2      HIS 112  57.384 -13.572  18.748
  Start of MODEL    4
    1    H1   MET  18           H        MET  18 -52.050  46.477  42.746
    2    HA   MET  18           HA       MET  18 -49.628  46.879  42.119
    3    HB2  MET  18           HB1      MET  18 -49.445  44.745  43.999
    4    HB3  MET  18           HB2      MET  18 -48.832  44.162  42.445
    5    HG2  MET  18           HG1      MET  18 -47.802  46.796  42.988
    6    HG3  MET  18           HG2      MET  18 -47.484  45.708  44.343
    7    HE1  MET  18           HE1      MET  18 -46.394  47.265  41.621
    8    HE2  MET  18           HE2      MET  18 -44.742  46.664  41.761
    9    HE3  MET  18           HE3      MET  18 -45.744  46.180  40.392
   10    H    LEU  19           H        LEU  19 -49.755  46.857  39.981
   11    HA   LEU  19           HA       LEU  19 -50.732  44.425  38.646
   12    HB2  LEU  19           HB1      LEU  19 -52.241  46.645  38.797
   13    HB3  LEU  19           HB2      LEU  19 -51.288  47.025  37.353
   14    HG   LEU  19           HG       LEU  19 -53.359  46.058  36.658
   15   HD11  LEU  19          HD11      LEU  19 -51.076  44.105  36.424
   16   HD12  LEU  19          HD12      LEU  19 -51.480  45.415  35.315
   17   HD13  LEU  19          HD13      LEU  19 -52.559  44.030  35.472
   18   HD21  LEU  19          HD21      LEU  19 -53.090  43.394  37.709
   19   HD22  LEU  19          HD22      LEU  19 -54.450  44.510  37.820
   20   HD23  LEU  19          HD23      LEU  19 -53.157  44.572  39.018
   21    H    VAL  20           H        VAL  20 -48.854  43.662  37.844
   22    HA   VAL  20           HA       VAL  20 -46.971  45.478  36.556
   23    HB   VAL  20           HB       VAL  20 -46.728  42.489  36.915
   24   HG11  VAL  20          HG11      VAL  20 -44.774  44.653  36.167
   25   HG12  VAL  20          HG12      VAL  20 -44.277  43.044  36.696
   26   HG13  VAL  20          HG13      VAL  20 -45.238  43.234  35.228
   27   HG21  VAL  20          HG21      VAL  20 -46.450  42.876  39.088
   28   HG22  VAL  20          HG22      VAL  20 -44.993  43.781  38.679
   29   HG23  VAL  20          HG23      VAL  20 -46.533  44.622  38.847
   30    H    LEU  21           H        LEU  21 -46.880  45.783  34.431
   31    HA   LEU  21           HA       LEU  21 -48.756  44.792  32.639
   32    HB2  LEU  21           HB1      LEU  21 -45.973  45.749  31.958
   33    HB3  LEU  21           HB2      LEU  21 -47.382  45.717  30.886
   34    HG   LEU  21           HG       LEU  21 -48.234  47.288  32.985
   35   HD11  LEU  21          HD11      LEU  21 -45.296  47.520  32.659
   36   HD12  LEU  21          HD12      LEU  21 -46.303  47.766  34.085
   37   HD13  LEU  21          HD13      LEU  21 -46.224  49.009  32.837
   38   HD21  LEU  21          HD21      LEU  21 -48.315  49.002  31.397
   39   HD22  LEU  21          HD22      LEU  21 -48.425  47.523  30.444
   40   HD23  LEU  21          HD23      LEU  21 -46.898  48.399  30.538
   41    H    ASP  22           H        ASP  22 -48.699  43.227  31.021
   42    HA   ASP  22           HA       ASP  22 -46.881  41.001  31.576
   43    HB2  ASP  22           HB1      ASP  22 -49.404  40.701  31.501
   44    HB3  ASP  22           HB2      ASP  22 -49.290  40.976  29.757
   45    HD2  ASP  22           HD       ASP  22 -48.190  37.484  31.188
   46    H    PHE  23           H        PHE  23 -45.064  42.036  30.543
   47    HA   PHE  23           HA       PHE  23 -45.047  41.532  27.666
   48    HB2  PHE  23           HB1      PHE  23 -45.521  43.987  28.111
   49    HB3  PHE  23           HB2      PHE  23 -43.900  44.083  28.804
   50    HD1  PHE  23           HD1      PHE  23 -45.403  42.614  25.715
   51    HD2  PHE  23           HD2      PHE  23 -42.332  45.013  27.427
   52    HE1  PHE  23           HE1      PHE  23 -44.447  42.982  23.478
   53    HE2  PHE  23           HE2      PHE  23 -41.372  45.385  25.192
   54    HZ   PHE  23           HZ       PHE  23 -42.430  44.370  23.214
   55    H    ASN  24           H        ASN  24 -43.883  39.662  28.611
   56    HA   ASN  24           HA       ASN  24 -41.040  40.323  28.998
   57    HB2  ASN  24           HB1      ASN  24 -42.565  38.083  30.358
   58    HB3  ASN  24           HB2      ASN  24 -40.841  38.427  30.544
   59   HD21  ASN  24          HD21      ASN  24 -43.648  38.701  32.077
   60   HD22  ASN  24          HD22      ASN  24 -43.367  40.123  33.017
   61    H    ASN  25           H        ASN  25 -39.644  38.298  28.616
   62    HA   ASN  25           HA       ASN  25 -38.831  36.769  27.142
   63    HB2  ASN  25           HB1      ASN  25 -41.331  35.843  27.922
   64    HB3  ASN  25           HB2      ASN  25 -41.380  35.746  26.158
   65   HD21  ASN  25          HD21      ASN  25 -41.079  33.771  28.483
   66   HD22  ASN  25          HD22      ASN  25 -39.783  32.750  27.972
   67    H    ILE  26           H        ILE  26 -39.045  35.995  24.767
   68    HA   ILE  26           HA       ILE  26 -40.455  37.556  22.893
   69    HB   ILE  26           HB       ILE  26 -38.981  39.361  23.569
   70   HG12  ILE  26          HG11      ILE  26 -37.812  38.447  20.964
   71   HG13  ILE  26          HG12      ILE  26 -39.551  38.770  21.070
   72   HG21  ILE  26          HG21      ILE  26 -36.623  39.248  23.535
   73   HG22  ILE  26          HG22      ILE  26 -37.165  37.798  24.379
   74   HG23  ILE  26          HG23      ILE  26 -36.635  37.695  22.700
   75   HD11  ILE  26          HD11      ILE  26 -37.384  40.623  20.805
   76   HD12  ILE  26          HD12      ILE  26 -39.122  40.904  20.695
   77   HD13  ILE  26          HD13      ILE  26 -38.315  40.974  22.261
   78    H    ARG  27           H        ARG  27 -37.595  35.628  23.592
   79    HA   ARG  27           HA       ARG  27 -36.613  33.893  22.497
   80    HB2  ARG  27           HB1      ARG  27 -39.160  33.790  20.868
   81    HB3  ARG  27           HB2      ARG  27 -37.990  32.484  21.099
   82    HG2  ARG  27           HG1      ARG  27 -38.532  32.479  23.524
   83    HG3  ARG  27           HG2      ARG  27 -39.797  33.672  23.190
   84    HD2  ARG  27           HD1      ARG  27 -41.204  32.013  22.715
   85    HD3  ARG  27           HD2      ARG  27 -40.173  31.591  21.339
   86    HE   ARG  27           HE       ARG  27 -38.974  30.417  23.507
   87   HH11  ARG  27          HH11      ARG  27 -42.112  30.274  22.004
   88   HH12  ARG  27          HH12      ARG  27 -42.406  28.633  22.472
   89   HH21  ARG  27          HH21      ARG  27 -39.351  28.255  24.129
   90   HH22  ARG  27          HH22      ARG  27 -40.835  27.486  23.682
   91    H    SER  28           H        SER  28 -36.149  33.063  20.117
   92    HA   SER  28           HA       SER  28 -36.088  35.187  18.152
   93    HB2  SER  28           HB1      SER  28 -33.383  34.162  18.430
   94    HB3  SER  28           HB2      SER  28 -33.953  35.841  18.384
   95    HG   SER  28           HG       SER  28 -34.295  34.302  20.715
   96    H    SER  29           H        SER  29 -35.162  34.456  16.084
   97    HA   SER  29           HA       SER  29 -35.370  31.531  15.782
   98    HB2  SER  29           HB1      SER  29 -36.122  32.181  13.369
   99    HB3  SER  29           HB2      SER  29 -37.288  32.304  14.698
  100    HG   SER  29           HG       SER  29 -36.434  34.234  13.075
  101    H    ALA  30           H        ALA  30 -33.369  30.791  15.485
  102    HA   ALA  30           HA       ALA  30 -31.675  32.158  13.498
  103    HB1  ALA  30           HB1      ALA  30 -29.781  31.042  14.966
  104    HB2  ALA  30           HB2      ALA  30 -30.449  32.625  15.364
  105    HB3  ALA  30           HB3      ALA  30 -31.006  31.192  16.226
  106    H    ASP  31           H        ASP  31 -30.202  30.788  12.327
  107    HA   ASP  31           HA       ASP  31 -30.164  27.985  12.525
  108    HB2  ASP  31           HB1      ASP  31 -32.578  28.742  11.573
  109    HB3  ASP  31           HB2      ASP  31 -31.667  28.644  10.059
  110    HD2  ASP  31           HD       ASP  31 -31.099  25.153  10.658
  111    H    LEU  32           H        LEU  32 -28.995  26.969  10.748
  112    HA   LEU  32           HA       LEU  32 -27.744  28.737   8.812
  113    HB2  LEU  32           HB1      LEU  32 -25.465  28.057   9.455
  114    HB3  LEU  32           HB2      LEU  32 -26.287  29.007  10.705
  115    HG   LEU  32           HG       LEU  32 -26.850  26.538  11.593
  116   HD11  LEU  32          HD11      LEU  32 -24.071  25.965  10.943
  117   HD12  LEU  32          HD12      LEU  32 -25.129  25.961   9.533
  118   HD13  LEU  32          HD13      LEU  32 -25.487  24.913  10.905
  119   HD21  LEU  32          HD21      LEU  32 -25.737  28.472  12.755
  120   HD22  LEU  32          HD22      LEU  32 -24.203  27.867  12.131
  121   HD23  LEU  32          HD23      LEU  32 -25.162  26.873  13.228
  122    H    HIS  33           H        HIS  33 -26.112  27.404   7.458
  123    HA   HIS  33           HA       HIS  33 -26.662  24.575   7.303
  124    HB2  HIS  33           HB1      HIS  33 -28.586  25.658   6.109
  125    HB3  HIS  33           HB2      HIS  33 -27.424  26.328   4.961
  126    HD1  HIS  33           HD1      HIS  33 -26.885  22.847   6.163
  127    HD2  HIS  33           HD2      HIS  33 -28.538  24.785   2.881
  128    HE1  HIS  33           HE1      HIS  33 -27.203  21.064   4.418
  129    HE2  HIS  33           HE2      HIS  33 -28.212  22.247   2.411
  130    H    GLY  34           H        GLY  34 -24.591  23.939   7.259
  131    HA2  GLY  34           HA2      GLY  34 -22.934  24.921   5.035
  132    HA3  GLY  34           HA3      GLY  34 -22.276  24.926   6.665
  133    HA1  GLY  34           HA1      GLY  34 -23.519  24.263   5.073
  134    H    ALA  35           H        ALA  35 -21.955  23.350   3.941
  135    HA   ALA  35           HA       ALA  35 -21.036  20.943   5.217
  136    HB1  ALA  35           HB1      ALA  35 -22.414  19.516   3.555
  137    HB2  ALA  35           HB2      ALA  35 -23.187  20.101   5.030
  138    HB3  ALA  35           HB3      ALA  35 -23.483  20.918   3.496
  139    H    ARG  36           H        ARG  36 -19.313  20.157   4.161
  140    HA   ARG  36           HA       ARG  36 -19.005  20.614   1.303
  141    HB2  ARG  36           HB1      ARG  36 -16.636  21.447   1.709
  142    HB3  ARG  36           HB2      ARG  36 -17.946  22.583   2.062
  143    HG2  ARG  36           HG1      ARG  36 -17.399  22.738   4.218
  144    HG3  ARG  36           HG2      ARG  36 -17.196  20.984   4.372
  145    HD2  ARG  36           HD1      ARG  36 -14.970  21.109   4.161
  146    HD3  ARG  36           HD2      ARG  36 -15.097  22.197   2.773
  147    HE   ARG  36           HE       ARG  36 -15.686  23.565   5.189
  148   HH11  ARG  36          HH11      ARG  36 -13.055  22.294   3.296
  149   HH12  ARG  36          HH12      ARG  36 -11.894  23.422   3.913
  150   HH21  ARG  36          HH21      ARG  36 -14.166  25.056   6.010
  151   HH22  ARG  36          HH22      ARG  36 -12.527  24.991   5.457
  152    H    LYS  37           H        LYS  37 -19.512  18.208   2.175
  153    HA   LYS  37           HA       LYS  37 -17.048  16.796   2.813
  154    HB2  LYS  37           HB1      LYS  37 -19.617  16.382   3.589
  155    HB3  LYS  37           HB2      LYS  37 -19.496  15.249   2.234
  156    HG2  LYS  37           HG1      LYS  37 -17.238  14.586   3.467
  157    HG3  LYS  37           HG2      LYS  37 -18.134  15.209   4.865
  158    HD2  LYS  37           HD1      LYS  37 -19.661  13.521   4.830
  159    HD3  LYS  37           HD2      LYS  37 -19.596  13.365   3.067
  160    HE2  LYS  37           HE1      LYS  37 -18.619  11.381   3.858
  161    HE3  LYS  37           HE2      LYS  37 -17.252  12.410   3.406
  162    HZ1  LYS  37           HZ1      LYS  37 -16.483  12.168   5.453
  163    HZ2  LYS  37           HZ2      LYS  37 -17.849  11.288   5.919
  164    HZ3  LYS  37           HZ3      LYS  37 -17.840  12.974   6.062
  165    H    GLY  38           H        GLY  38 -15.721  16.329   1.184
  166    HA2  GLY  38           HA2      GLY  38 -16.883  15.153  -1.249
  167    HA3  GLY  38           HA3      GLY  38 -15.745  16.485  -1.398
  168    HA1  GLY  38           HA1      GLY  38 -16.636  14.783  -0.487
  169    H    SER  39           H        SER  39 -13.749  15.882  -1.854
  170    HA   SER  39           HA       SER  39 -11.833  14.665  -2.006
  171    HB2  SER  39           HB1      SER  39 -12.885  14.028   0.701
  172    HB3  SER  39           HB2      SER  39 -11.640  12.939   0.061
  173    HG   SER  39           HG       SER  39 -11.333  15.751   0.037
  174    H    GLN  40           H        GLN  40 -10.984  12.296  -2.013
  175    HA   GLN  40           HA       GLN  40 -13.092  10.593  -3.169
  176    HB2  GLN  40           HB1      GLN  40 -10.430  11.369  -4.135
  177    HB3  GLN  40           HB2      GLN  40 -10.749   9.628  -4.220
  178    HG2  GLN  40           HG1      GLN  40 -13.064  10.873  -5.202
  179    HG3  GLN  40           HG2      GLN  40 -11.694  11.735  -5.918
  180   HE21  GLN  40          HE21      GLN  40 -10.415  10.728  -7.404
  181   HE22  GLN  40          HE22      GLN  40 -10.758   9.167  -8.057
  182    H    CYS  41           H        CYS  41 -10.004  10.569  -1.421
  183    HA   CYS  41           HA       CYS  41 -10.897   8.171  -0.001
  184    HB2  CYS  41           HB1      CYS  41  -8.749   7.063  -0.272
  185    HB3  CYS  41           HB2      CYS  41  -9.467   7.386  -1.851
  186    H    LEU  42           H        LEU  42 -10.182   8.015   2.099
  187    HA   LEU  42           HA       LEU  42  -9.028  10.450   3.203
  188    HB2  LEU  42           HB1      LEU  42 -11.017   8.737   4.051
  189    HB3  LEU  42           HB2      LEU  42  -9.635   8.294   5.070
  190    HG   LEU  42           HG       LEU  42  -9.574  10.969   5.359
  191   HD11  LEU  42          HD11      LEU  42 -12.493  10.578   5.538
  192   HD12  LEU  42          HD12      LEU  42 -11.825  10.785   3.920
  193   HD13  LEU  42          HD13      LEU  42 -11.559  12.023   5.148
  194   HD21  LEU  42          HD21      LEU  42 -11.009   8.821   6.867
  195   HD22  LEU  42          HD22      LEU  42 -11.069  10.495   7.421
  196   HD23  LEU  42          HD23      LEU  42  -9.517   9.668   7.274
  197    H    SER  43           H        SER  43  -8.243   7.075   2.739
  198    HA   SER  43           HA       SER  43  -5.477   7.636   3.432
  199    HB2  SER  43           HB1      SER  43  -7.164   6.447   5.326
  200    HB3  SER  43           HB2      SER  43  -6.241   5.104   4.629
  201    HG   SER  43           HG       SER  43  -5.419   6.901   6.399
  202    H    ASP  44           H        ASP  44  -4.169   5.480   3.109
  203    HA   ASP  44           HA       ASP  44  -4.512   4.733   0.401
  204    HB2  ASP  44           HB1      ASP  44  -2.816   3.303   2.460
  205    HB3  ASP  44           HB2      ASP  44  -2.586   3.332   0.706
  206    HD2  ASP  44           HD       ASP  44  -0.380   5.789   2.266
  207    H    THR  45           H        THR  45  -5.591   3.368   3.403
  208    HA   THR  45           HA       THR  45  -6.087   0.728   2.540
  209    HB   THR  45           HB       THR  45  -8.048   1.356   4.459
  210    HG1  THR  45           HG1      THR  45  -6.557   2.362   6.044
  211   HG21  THR  45          HG21      THR  45  -6.239   0.246   5.983
  212   HG22  THR  45          HG22      THR  45  -5.378   0.007   4.462
  213   HG23  THR  45          HG23      THR  45  -6.985  -0.686   4.686
  214    H    ASP  46           H        ASP  46  -7.797   3.705   2.074
  215    HA   ASP  46           HA       ASP  46 -10.345   2.607   1.468
  216    HB2  ASP  46           HB1      ASP  46  -9.631   5.070   2.019
  217    HB3  ASP  46           HB2      ASP  46  -9.383   5.181   0.271
  218    HD2  ASP  46           HD       ASP  46 -12.807   6.113   0.915
  219    H    CYS  47           H        CYS  47  -7.420   3.067  -0.353
  220    HA   CYS  47           HA       CYS  47  -8.690   2.652  -2.915
  221    HB2  CYS  47           HB1      CYS  47  -6.327   3.827  -2.093
  222    HB3  CYS  47           HB2      CYS  47  -5.785   2.309  -2.812
  223    H    ASN  48           H        ASN  48  -9.248   0.726  -3.661
  224    HA   ASN  48           HA       ASN  48  -8.782  -1.699  -2.414
  225    HB2  ASN  48           HB1      ASN  48 -10.554  -1.617  -3.969
  226    HB3  ASN  48           HB2      ASN  48  -9.503  -1.009  -5.255
  227   HD21  ASN  48          HD21      ASN  48  -9.522  -2.501  -6.785
  228   HD22  ASN  48          HD22      ASN  48  -9.203  -4.183  -6.555
  229    H    THR  49           H        THR  49  -7.307  -0.742  -5.518
  230    HA   THR  49           HA       THR  49  -5.396  -2.742  -5.631
  231    HB   THR  49           HB       THR  49  -4.444  -0.171  -6.679
  232    HG1  THR  49           HG1      THR  49  -6.159  -0.088  -8.252
  233   HG21  THR  49          HG21      THR  49  -3.467  -2.182  -7.491
  234   HG22  THR  49          HG22      THR  49  -4.464  -1.546  -8.799
  235   HG23  THR  49          HG23      THR  49  -5.045  -2.894  -7.822
  236    H    ARG  50           H        ARG  50  -3.052  -2.595  -5.363
  237    HA   ARG  50           HA       ARG  50  -2.385  -1.574  -2.763
  238    HB2  ARG  50           HB1      ARG  50  -0.128  -2.536  -3.257
  239    HB3  ARG  50           HB2      ARG  50  -1.461  -3.693  -3.394
  240    HG2  ARG  50           HG1      ARG  50  -0.885  -4.183  -5.474
  241    HG3  ARG  50           HG2      ARG  50  -1.031  -2.478  -5.938
  242    HD2  ARG  50           HD1      ARG  50   1.208  -3.253  -6.436
  243    HD3  ARG  50           HD2      ARG  50   1.261  -2.082  -5.112
  244    HE   ARG  50           HE       ARG  50   1.119  -4.491  -3.852
  245   HH11  ARG  50          HH11      ARG  50   3.223  -3.113  -6.258
  246   HH12  ARG  50          HH12      ARG  50   4.607  -4.032  -5.762
  247   HH21  ARG  50          HH21      ARG  50   2.933  -5.705  -3.189
  248   HH22  ARG  50          HH22      ARG  50   4.439  -5.506  -4.017
  249    H    LYS  51           H        LYS  51  -2.936   0.690  -3.606
  250    HA   LYS  51           HA       LYS  51  -0.432   1.953  -4.501
  251    HB2  LYS  51           HB1      LYS  51  -3.211   2.851  -5.299
  252    HB3  LYS  51           HB2      LYS  51  -1.672   3.541  -5.841
  253    HG2  LYS  51           HG1      LYS  51  -1.133   1.576  -7.090
  254    HG3  LYS  51           HG2      LYS  51  -2.523   0.712  -6.410
  255    HD2  LYS  51           HD1      LYS  51  -4.039   2.352  -7.489
  256    HD3  LYS  51           HD2      LYS  51  -2.622   3.115  -8.235
  257    HE2  LYS  51           HE1      LYS  51  -2.080   0.853  -9.247
  258    HE3  LYS  51           HE2      LYS  51  -3.681   0.334  -8.699
  259    HZ1  LYS  51           HZ1      LYS  51  -3.506   2.796 -10.272
  260    HZ2  LYS  51           HZ2      LYS  51  -4.732   1.633 -10.222
  261    HZ3  LYS  51           HZ3      LYS  51  -3.310   1.325 -11.084
  262    H    PHE  52           H        PHE  52  -0.149   4.160  -3.799
  263    HA   PHE  52           HA       PHE  52  -1.336   4.597  -1.168
  264    HB2  PHE  52           HB1      PHE  52   0.452   6.185  -0.792
  265    HB3  PHE  52           HB2      PHE  52   1.131   4.685  -1.427
  266    HD1  PHE  52           HD1      PHE  52   2.066   4.562  -3.658
  267    HD2  PHE  52           HD2      PHE  52   0.481   8.205  -2.130
  268    HE1  PHE  52           HE1      PHE  52   3.181   5.802  -5.468
  269    HE2  PHE  52           HE2      PHE  52   1.592   9.451  -3.937
  270    HZ   PHE  52           HZ       PHE  52   2.944   8.250  -5.610
  271    H    CYS  53           H        CYS  53  -2.488   6.404  -0.599
  272    HA   CYS  53           HA       CYS  53  -3.723   7.847  -2.791
  273    HB2  CYS  53           HB1      CYS  53  -4.333   7.315   0.049
  274    HB3  CYS  53           HB2      CYS  53  -4.825   8.908  -0.532
  275    H    LEU  54           H        LEU  54  -2.808   9.628  -3.554
  276    HA   LEU  54           HA       LEU  54  -1.128  11.257  -1.794
  277    HB2  LEU  54           HB1      LEU  54  -0.120  10.563  -3.886
  278    HB3  LEU  54           HB2      LEU  54  -1.477  11.256  -4.789
  279    HG   LEU  54           HG       LEU  54  -0.629  13.465  -3.527
  280   HD11  LEU  54          HD11      LEU  54   2.043  12.642  -4.198
  281   HD12  LEU  54          HD12      LEU  54   1.380  11.622  -2.922
  282   HD13  LEU  54          HD13      LEU  54   1.432  13.373  -2.713
  283   HD21  LEU  54          HD21      LEU  54   0.802  13.827  -5.628
  284   HD22  LEU  54          HD22      LEU  54  -0.921  13.517  -5.840
  285   HD23  LEU  54          HD23      LEU  54   0.247  12.224  -6.113
  286    H    GLN  55           H        GLN  55  -1.557  13.364  -1.318
  287    HA   GLN  55           HA       GLN  55  -4.049  14.501  -2.398
  288    HB2  GLN  55           HB1      GLN  55  -3.035  14.775   0.440
  289    HB3  GLN  55           HB2      GLN  55  -4.524  15.475  -0.213
  290    HG2  GLN  55           HG1      GLN  55  -5.390  13.646   0.826
  291    HG3  GLN  55           HG2      GLN  55  -5.073  12.969  -0.778
  292   HE21  GLN  55          HE21      GLN  55  -5.301  11.158   1.068
  293   HE22  GLN  55          HE22      GLN  55  -3.777  10.519   1.571
  294    HA   PRO  56           HA       PRO  56  -0.683  17.466  -3.329
  295    HB2  PRO  56           HB1      PRO  56  -1.829  18.366  -5.648
  296    HB3  PRO  56           HB2      PRO  56  -0.839  16.911  -5.553
  297    HG2  PRO  56           HG1      PRO  56  -3.825  17.185  -5.507
  298    HG3  PRO  56           HG2      PRO  56  -2.802  16.026  -6.434
  299    HD2  PRO  56           HD1      PRO  56  -4.104  15.333  -4.156
  300    HD3  PRO  56           HD2      PRO  56  -2.532  14.651  -4.603
  301    H    ARG  57           H        ARG  57  -0.651  19.721  -3.192
  302    HA   ARG  57           HA       ARG  57  -2.937  20.882  -1.859
  303    HB2  ARG  57           HB1      ARG  57  -0.216  22.007  -2.555
  304    HB3  ARG  57           HB2      ARG  57  -1.447  22.871  -1.624
  305    HG2  ARG  57           HG1      ARG  57  -1.234  21.480   0.224
  306    HG3  ARG  57           HG2      ARG  57  -0.483  20.188  -0.727
  307    HD2  ARG  57           HD1      ARG  57   1.595  21.128  -0.647
  308    HD3  ARG  57           HD2      ARG  57   0.951  22.775  -0.621
  309    HE   ARG  57           HE       ARG  57   1.547  21.113   1.648
  310   HH11  ARG  57          HH11      ARG  57  -0.319  23.812   0.483
  311   HH12  ARG  57          HH12      ARG  57  -0.515  24.520   2.051
  312   HH21  ARG  57          HH21      ARG  57   1.295  22.036   3.718
  313   HH22  ARG  57          HH22      ARG  57   0.404  23.511   3.891
  314    H    ASP  58           H        ASP  58  -1.161  21.363  -4.881
  315    HA   ASP  58           HA       ASP  58  -2.836  23.538  -5.732
  316    HB2  ASP  58           HB1      ASP  58  -1.620  23.304  -7.894
  317    HB3  ASP  58           HB2      ASP  58  -0.546  23.480  -6.499
  318    HD2  ASP  58           HD       ASP  58   0.906  20.422  -7.045
  319    H    GLU  59           H        GLU  59  -2.919  20.099  -5.948
  320    HA   GLU  59           HA       GLU  59  -5.193  20.279  -7.815
  321    HB2  GLU  59           HB1      GLU  59  -2.812  18.702  -7.955
  322    HB3  GLU  59           HB2      GLU  59  -4.195  17.619  -7.734
  323    HG2  GLU  59           HG1      GLU  59  -5.278  18.456  -9.688
  324    HG3  GLU  59           HG2      GLU  59  -4.081  19.750  -9.851
  325    HE2  GLU  59           HE       GLU  59  -3.072  16.107 -11.049
  326    H    LYS  60           H        LYS  60  -6.445  17.995  -7.586
  327    HA   LYS  60           HA       LYS  60  -7.425  18.020  -4.845
  328    HB2  LYS  60           HB1      LYS  60  -8.476  17.203  -7.489
  329    HB3  LYS  60           HB2      LYS  60  -9.021  16.235  -6.110
  330    HG2  LYS  60           HG1      LYS  60 -10.462  17.799  -5.483
  331    HG3  LYS  60           HG2      LYS  60  -9.189  19.034  -5.485
  332    HD2  LYS  60           HD1      LYS  60  -9.466  19.338  -7.903
  333    HD3  LYS  60           HD2      LYS  60 -10.734  18.099  -7.906
  334    HE2  LYS  60           HE1      LYS  60 -11.001  20.438  -6.059
  335    HE3  LYS  60           HE2      LYS  60 -11.342  20.653  -7.782
  336    HZ1  LYS  60           HZ1      LYS  60 -13.357  20.096  -6.652
  337    HZ2  LYS  60           HZ2      LYS  60 -12.658  18.726  -5.947
  338    HZ3  LYS  60           HZ3      LYS  60 -12.919  18.778  -7.617
  339    HA   PRO  61           HA       PRO  61  -5.672  14.216  -3.537
  340    HB2  PRO  61           HB1      PRO  61  -7.715  13.078  -2.114
  341    HB3  PRO  61           HB2      PRO  61  -6.804  14.481  -1.556
  342    HG2  PRO  61           HG1      PRO  61  -9.458  14.368  -2.952
  343    HG3  PRO  61           HG2      PRO  61  -8.964  15.340  -1.515
  344    HD2  PRO  61           HD1      PRO  61  -9.132  16.394  -4.011
  345    HD3  PRO  61           HD2      PRO  61  -7.930  16.930  -2.826
  346    H    PHE  62           H        PHE  62  -5.330  12.222  -4.342
  347    HA   PHE  62           HA       PHE  62  -7.459  10.628  -5.442
  348    HB2  PHE  62           HB1      PHE  62  -6.291  10.409  -7.686
  349    HB3  PHE  62           HB2      PHE  62  -7.141  11.927  -7.398
  350    HD1  PHE  62           HD1      PHE  62  -6.082  13.885  -7.944
  351    HD2  PHE  62           HD2      PHE  62  -3.733  10.487  -6.916
  352    HE1  PHE  62           HE1      PHE  62  -4.034  15.156  -8.436
  353    HE2  PHE  62           HE2      PHE  62  -1.681  11.754  -7.405
  354    HZ   PHE  62           HZ       PHE  62  -1.829  14.091  -8.166
  355    H    CYS  63           H        CYS  63  -6.324   8.651  -6.661
  356    HA   CYS  63           HA       CYS  63  -4.359   7.633  -4.742
  357    HB2  CYS  63           HB1      CYS  63  -6.662   6.514  -5.671
  358    HB3  CYS  63           HB2      CYS  63  -5.477   5.798  -6.765
  359    H    ALA  64           H        ALA  64  -2.293   7.447  -5.277
  360    HA   ALA  64           HA       ALA  64  -1.558   7.616  -8.118
  361    HB1  ALA  64           HB1      ALA  64   0.773   8.071  -6.971
  362    HB2  ALA  64           HB2      ALA  64  -0.428   9.351  -7.154
  363    HB3  ALA  64           HB3      ALA  64  -0.251   8.523  -5.607
  364    H    THR  65           H        THR  65  -0.696   5.911  -9.106
  365    HA   THR  65           HA       THR  65  -0.537   3.382  -7.957
  366    HB   THR  65           HB       THR  65   1.304   3.865 -10.218
  367    HG1  THR  65           HG1      THR  65  -1.501   4.173 -10.592
  368   HG21  THR  65          HG21      THR  65   0.842   1.708 -10.523
  369   HG22  THR  65          HG22      THR  65  -0.860   2.094 -10.778
  370   HG23  THR  65          HG23      THR  65  -0.266   1.760  -9.153
  371    H    CYS  66           H        CYS  66   1.522   2.015  -7.976
  372    HA   CYS  66           HA       CYS  66   3.225   2.820  -5.959
  373    HB2  CYS  66           HB1      CYS  66   2.896   0.481  -6.828
  374    HB3  CYS  66           HB2      CYS  66   3.968   0.895  -8.168
  375    H    ARG  67           H        ARG  67   5.386   3.536  -5.903
  376    HA   ARG  67           HA       ARG  67   6.143   5.141  -8.244
  377    HB2  ARG  67           HB1      ARG  67   6.978   5.370  -5.344
  378    HB3  ARG  67           HB2      ARG  67   7.557   6.414  -6.651
  379    HG2  ARG  67           HG1      ARG  67   4.691   6.383  -6.671
  380    HG3  ARG  67           HG2      ARG  67   5.280   6.761  -5.044
  381    HD2  ARG  67           HD1      ARG  67   5.379   8.873  -5.852
  382    HD3  ARG  67           HD2      ARG  67   6.927   8.313  -6.500
  383    HE   ARG  67           HE       ARG  67   5.058   7.682  -8.417
  384   HH11  ARG  67          HH11      ARG  67   6.161  10.574  -6.822
  385   HH12  ARG  67          HH12      ARG  67   5.823  11.604  -8.174
  386   HH21  ARG  67          HH21      ARG  67   4.609   9.029 -10.203
  387   HH22  ARG  67          HH22      ARG  67   4.940  10.724 -10.095
  388    H    GLY  68           H        GLY  68   7.795   4.491  -9.452
  389    HA2  GLY  68           HA2      GLY  68   9.355   2.207  -8.743
  390    HA3  GLY  68           HA3      GLY  68   9.568   3.209 -10.170
  391    HA1  GLY  68           HA1      GLY  68   9.286   2.808  -8.103
  392    H    LEU  69           H        LEU  69  11.853   2.454  -9.325
  393    HA   LEU  69           HA       LEU  69  12.998   3.839  -7.143
  394    HB2  LEU  69           HB1      LEU  69  14.254   2.589  -9.592
  395    HB3  LEU  69           HB2      LEU  69  15.166   3.219  -8.209
  396    HG   LEU  69           HG       LEU  69  13.276   0.869  -8.210
  397   HD11  LEU  69          HD11      LEU  69  15.069  -0.442  -8.403
  398   HD12  LEU  69          HD12      LEU  69  16.002   0.515  -7.253
  399   HD13  LEU  69          HD13      LEU  69  15.921   1.004  -8.946
  400   HD21  LEU  69          HD21      LEU  69  13.048   2.106  -6.131
  401   HD22  LEU  69          HD22      LEU  69  14.799   2.122  -5.926
  402   HD23  LEU  69          HD23      LEU  69  13.917   0.596  -5.856
  403    H    ARG  70           H        ARG  70  12.396   4.703 -10.447
  404    HA   ARG  70           HA       ARG  70  14.187   6.974 -10.407
  405    HB2  ARG  70           HB1      ARG  70  12.157   5.979 -12.411
  406    HB3  ARG  70           HB2      ARG  70  13.094   7.464 -12.639
  407    HG2  ARG  70           HG1      ARG  70  14.597   4.970 -12.032
  408    HG3  ARG  70           HG2      ARG  70  13.873   5.143 -13.640
  409    HD2  ARG  70           HD1      ARG  70  15.061   7.208 -14.028
  410    HD3  ARG  70           HD2      ARG  70  15.667   7.203 -12.365
  411    HE   ARG  70           HE       ARG  70  16.533   4.837 -13.490
  412   HH11  ARG  70          HH11      ARG  70  16.923   8.241 -14.110
  413   HH12  ARG  70          HH12      ARG  70  18.502   8.067 -14.801
  414   HH21  ARG  70          HH21      ARG  70  18.611   4.595 -14.397
  415   HH22  ARG  70          HH22      ARG  70  19.461   5.993 -14.964
  416    H    ARG  71           H        ARG  71  10.854   6.300  -9.746
  417    HA   ARG  71           HA       ARG  71   9.748   8.852 -10.084
  418    HB2  ARG  71           HB1      ARG  71   8.991   6.335  -8.834
  419    HB3  ARG  71           HB2      ARG  71   8.397   7.731  -7.923
  420    HG2  ARG  71           HG1      ARG  71   6.754   6.928  -9.559
  421    HG3  ARG  71           HG2      ARG  71   7.276   8.590  -9.886
  422    HD2  ARG  71           HD1      ARG  71   8.567   7.965 -11.734
  423    HD3  ARG  71           HD2      ARG  71   8.627   6.274 -11.221
  424    HE   ARG  71           HE       ARG  71   5.978   6.746 -11.689
  425   HH11  ARG  71          HH11      ARG  71   8.907   7.056 -13.545
  426   HH12  ARG  71          HH12      ARG  71   8.132   6.747 -15.063
  427   HH21  ARG  71          HH21      ARG  71   4.946   6.340 -13.682
  428   HH22  ARG  71          HH22      ARG  71   5.879   6.340 -15.140
  429    H    ARG  72           H        ARG  72   9.503  10.601  -8.738
  430    HA   ARG  72           HA       ARG  72  11.505  10.892  -6.677
  431    HB2  ARG  72           HB1      ARG  72   9.410  12.808  -7.730
  432    HB3  ARG  72           HB2      ARG  72  10.660  13.229  -6.550
  433    HG2  ARG  72           HG1      ARG  72  11.882  12.012  -8.843
  434    HG3  ARG  72           HG2      ARG  72  10.828  13.343  -9.346
  435    HD2  ARG  72           HD1      ARG  72  12.625  13.801  -7.013
  436    HD3  ARG  72           HD2      ARG  72  13.351  13.740  -8.626
  437    HE   ARG  72           HE       ARG  72  11.220  15.449  -8.870
  438   HH11  ARG  72          HH11      ARG  72  14.083  15.289  -6.897
  439   HH12  ARG  72          HH12      ARG  72  14.228  17.008  -6.739
  440   HH21  ARG  72          HH21      ARG  72  11.400  17.714  -8.669
  441   HH22  ARG  72          HH22      ARG  72  12.700  18.386  -7.746
  442    H    CYS  73           H        CYS  73  11.016  11.686  -4.526
  443    HA   CYS  73           HA       CYS  73   8.320  11.287  -3.530
  444    HB2  CYS  73           HB1      CYS  73   9.026   9.698  -1.781
  445    HB3  CYS  73           HB2      CYS  73   9.213   9.028  -3.403
  446    H    GLN  74           H        GLN  74   8.073  11.991  -1.292
  447    HA   GLN  74           HA       GLN  74  10.151  13.934  -0.523
  448    HB2  GLN  74           HB1      GLN  74   7.146  14.082  -0.406
  449    HB3  GLN  74           HB2      GLN  74   8.153  15.096   0.639
  450    HG2  GLN  74           HG1      GLN  74   9.317  15.896  -1.465
  451    HG3  GLN  74           HG2      GLN  74   8.013  15.100  -2.358
  452   HE21  GLN  74          HE21      GLN  74   8.562  17.850  -2.459
  453   HE22  GLN  74          HE22      GLN  74   7.208  18.696  -1.796
  454    H    ARG  75           H        ARG  75   8.031  11.382   0.510
  455    HA   ARG  75           HA       ARG  75   9.327  11.439   3.152
  456    HB2  ARG  75           HB1      ARG  75   6.419  11.117   2.466
  457    HB3  ARG  75           HB2      ARG  75   7.078  10.387   3.939
  458    HG2  ARG  75           HG1      ARG  75   7.657  12.483   4.858
  459    HG3  ARG  75           HG2      ARG  75   7.404  13.303   3.308
  460    HD2  ARG  75           HD1      ARG  75   4.976  12.010   3.877
  461    HD3  ARG  75           HD2      ARG  75   5.512  12.734   5.400
  462    HE   ARG  75           HE       ARG  75   5.830  14.702   3.506
  463   HH11  ARG  75          HH11      ARG  75   3.198  12.769   4.714
  464   HH12  ARG  75          HH12      ARG  75   1.998  13.982   4.411
  465   HH21  ARG  75          HH21      ARG  75   4.261  16.305   3.104
  466   HH22  ARG  75          HH22      ARG  75   2.603  15.992   3.495
  467    H    ASP  76           H        ASP  76   8.819   9.220   4.295
  468    HA   ASP  76           HA       ASP  76   9.985   7.204   2.616
  469    HB2  ASP  76           HB1      ASP  76   9.739   5.775   4.706
  470    HB3  ASP  76           HB2      ASP  76  10.742   7.223   4.863
  471    HD2  ASP  76           HD       ASP  76   8.519   8.714   7.070
  472    H    ALA  77           H        ALA  77   6.915   7.467   4.405
  473    HA   ALA  77           HA       ALA  77   5.804   5.075   3.404
  474    HB1  ALA  77           HB1      ALA  77   3.855   5.669   4.503
  475    HB2  ALA  77           HB2      ALA  77   5.088   6.535   5.423
  476    HB3  ALA  77           HB3      ALA  77   4.107   7.395   4.234
  477    H    MET  78           H        MET  78   6.046   8.279   2.098
  478    HA   MET  78           HA       MET  78   3.946   8.353   0.299
  479    HB2  MET  78           HB1      MET  78   6.620   9.599   0.489
  480    HB3  MET  78           HB2      MET  78   5.905   9.573  -1.130
  481    HG2  MET  78           HG1      MET  78   4.426  10.618   1.277
  482    HG3  MET  78           HG2      MET  78   5.466  11.628   0.270
  483    HE1  MET  78           HE1      MET  78   3.900  12.676  -2.520
  484    HE2  MET  78           HE2      MET  78   5.385  11.873  -2.009
  485    HE3  MET  78           HE3      MET  78   4.281  11.063  -3.122
  486    H    CYS  79           H        CYS  79   6.943   6.565   0.147
  487    HA   CYS  79           HA       CYS  79   6.426   5.727  -2.599
  488    HB2  CYS  79           HB1      CYS  79   8.748   5.910  -0.874
  489    HB3  CYS  79           HB2      CYS  79   8.630   4.307  -1.605
  490    H    CYS  80           H        CYS  80   6.878   3.300  -3.005
  491    HA   CYS  80           HA       CYS  80   4.849   1.829  -1.677
  492    HB2  CYS  80           HB1      CYS  80   6.777   1.365  -3.865
  493    HB3  CYS  80           HB2      CYS  80   6.283  -0.083  -2.987
  494    HA   PRO  81           HA       PRO  81   6.933  -0.125   1.651
  495    HB2  PRO  81           HB1      PRO  81   5.892  -2.658   1.599
  496    HB3  PRO  81           HB2      PRO  81   4.974  -1.239   2.101
  497    HG2  PRO  81           HG1      PRO  81   5.039  -2.616  -0.562
  498    HG3  PRO  81           HG2      PRO  81   3.620  -2.027   0.383
  499    HD2  PRO  81           HD1      PRO  81   4.647  -0.662  -1.728
  500    HD3  PRO  81           HD2      PRO  81   3.933   0.146  -0.322
  501    H    GLY  82           H        GLY  82   8.995  -0.738   1.777
  502    HA2  GLY  82           HA2      GLY  82  10.598  -2.552   1.576
  503    HA3  GLY  82           HA3      GLY  82   9.928  -2.892  -0.012
  504    HA1  GLY  82           HA1      GLY  82  10.533  -1.673   1.622
  505    H    THR  83           H        THR  83  10.406   0.406   0.878
  506    HA   THR  83           HA       THR  83  13.024   0.547  -0.385
  507    HB   THR  83           HB       THR  83  11.934   2.598  -1.728
  508    HG1  THR  83           HG1      THR  83   9.890   1.904  -2.533
  509   HG21  THR  83          HG21      THR  83  12.554   1.411  -3.530
  510   HG22  THR  83          HG22      THR  83  11.456   0.084  -3.147
  511   HG23  THR  83          HG23      THR  83  13.038   0.174  -2.371
  512    H    LEU  84           H        LEU  84  13.793   2.905  -0.419
  513    HA   LEU  84           HA       LEU  84  12.720   4.387   1.881
  514    HB2  LEU  84           HB1      LEU  84  15.355   3.175   1.566
  515    HB3  LEU  84           HB2      LEU  84  15.429   4.909   1.927
  516    HG   LEU  84           HG       LEU  84  14.037   2.822   3.603
  517   HD11  LEU  84          HD11      LEU  84  16.578   4.362   4.109
  518   HD12  LEU  84          HD12      LEU  84  16.482   2.657   3.668
  519   HD13  LEU  84          HD13      LEU  84  15.817   3.209   5.205
  520   HD21  LEU  84          HD21      LEU  84  14.463   5.189   5.039
  521   HD22  LEU  84          HD22      LEU  84  12.922   4.517   4.502
  522   HD23  LEU  84          HD23      LEU  84  13.780   5.679   3.489
  523    H    CYS  85           H        CYS  85  12.658   6.570   1.666
  524    HA   CYS  85           HA       CYS  85  13.046   7.648  -0.969
  525    HB2  CYS  85           HB1      CYS  85  11.181   8.243   0.678
  526    HB3  CYS  85           HB2      CYS  85  12.385   9.221   1.517
  527    H    VAL  86           H        VAL  86  15.017   8.148  -1.662
  528    HA   VAL  86           HA       VAL  86  16.790   9.648   0.150
  529    HB   VAL  86           HB       VAL  86  17.677   7.572  -1.858
  530   HG11  VAL  86          HG11      VAL  86  19.621   8.651  -1.808
  531   HG12  VAL  86          HG12      VAL  86  19.057   9.738  -0.536
  532   HG13  VAL  86          HG13      VAL  86  19.761   8.177  -0.116
  533   HG21  VAL  86          HG21      VAL  86  17.414   7.515   1.133
  534   HG22  VAL  86          HG22      VAL  86  16.781   6.372  -0.051
  535   HG23  VAL  86          HG23      VAL  86  18.513   6.436   0.273
  536    H    ASN  87           H        ASN  87  17.662  11.466  -0.662
  537    HA   ASN  87           HA       ASN  87  17.972  13.237  -2.059
  538    HB2  ASN  87           HB1      ASN  87  19.231  11.068  -3.176
  539    HB3  ASN  87           HB2      ASN  87  18.215  11.630  -4.508
  540   HD21  ASN  87          HD21      ASN  87  20.878  11.736  -4.820
  541   HD22  ASN  87          HD22      ASN  87  21.436  13.369  -4.770
  542    H    ASP  88           H        ASP  88  15.276  12.435  -1.637
  543    HA   ASP  88           HA       ASP  88  13.180  12.908  -2.382
  544    HB2  ASP  88           HB1      ASP  88  14.768  14.940  -3.332
  545    HB3  ASP  88           HB2      ASP  88  13.993  14.353  -4.808
  546    HD2  ASP  88           HD       ASP  88  11.186  16.118  -4.013
  547    H    VAL  89           H        VAL  89  14.716  10.586  -3.413
  548    HA   VAL  89           HA       VAL  89  12.907   9.939  -5.614
  549    HB   VAL  89           HB       VAL  89  15.892   9.498  -5.784
  550   HG11  VAL  89          HG11      VAL  89  15.195   8.827  -8.176
  551   HG12  VAL  89          HG12      VAL  89  14.950   7.667  -6.868
  552   HG13  VAL  89          HG13      VAL  89  13.589   8.606  -7.482
  553   HG21  VAL  89          HG21      VAL  89  15.452  10.957  -7.911
  554   HG22  VAL  89          HG22      VAL  89  14.050  11.510  -6.995
  555   HG23  VAL  89          HG23      VAL  89  15.671  11.723  -6.338
  556    H    CYS  90           H        CYS  90  12.262   7.833  -5.657
  557    HA   CYS  90           HA       CYS  90  12.502   6.284  -3.336
  558    HB2  CYS  90           HB1      CYS  90  10.934   6.232  -5.610
  559    HB3  CYS  90           HB2      CYS  90  11.882   4.750  -5.753
  560    H    THR  91           H        THR  91  14.251   5.283  -2.613
  561    HA   THR  91           HA       THR  91  16.050   4.004  -4.568
  562    HB   THR  91           HB       THR  91  16.796   5.246  -1.914
  563    HG1  THR  91           HG1      THR  91  17.469   5.982  -4.586
  564   HG21  THR  91          HG21      THR  91  19.108   4.710  -2.544
  565   HG22  THR  91          HG22      THR  91  18.519   3.871  -3.979
  566   HG23  THR  91          HG23      THR  91  18.130   3.253  -2.374
  567    H    THR  92           H        THR  92  16.754   1.944  -4.156
  568    HA   THR  92           HA       THR  92  15.141   0.215  -2.704
  569    HB   THR  92           HB       THR  92  17.239  -1.335  -2.813
  570    HG1  THR  92           HG1      THR  92  18.671  -0.548  -4.522
  571   HG21  THR  92          HG21      THR  92  16.878  -1.305  -5.462
  572   HG22  THR  92          HG22      THR  92  15.496  -0.319  -4.985
  573   HG23  THR  92          HG23      THR  92  15.675  -1.953  -4.347
  574    H    MET  93           H        MET  93  15.503  -0.986  -0.776
  575    HA   MET  93           HA       MET  93  16.430   0.577   1.395
  576    HB2  MET  93           HB1      MET  93  14.868  -1.733   1.047
  577    HB3  MET  93           HB2      MET  93  16.237  -2.229   2.053
  578    HG2  MET  93           HG1      MET  93  15.699  -0.144   3.469
  579    HG3  MET  93           HG2      MET  93  14.151  -0.163   2.623
  580    HE1  MET  93           HE1      MET  93  13.211  -1.432   6.098
  581    HE2  MET  93           HE2      MET  93  14.918  -0.997   6.174
  582    HE3  MET  93           HE3      MET  93  13.796  -0.007   5.238
  583    H    GLU  94           H        GLU  94  17.784  -2.186  -0.346
  584    HA   GLU  94           HA       GLU  94  19.984  -2.658   1.326
  585    HB2  GLU  94           HB1      GLU  94  19.294  -3.279  -1.507
  586    HB3  GLU  94           HB2      GLU  94  20.983  -3.458  -1.010
  587    HG2  GLU  94           HG1      GLU  94  20.490  -5.130   0.543
  588    HG3  GLU  94           HG2      GLU  94  18.768  -4.727   0.552
  589    HE2  GLU  94           HE       GLU  94  19.863  -6.532  -2.800
  590    H    ASP  95           H        ASP  95  19.404  -0.241  -1.099
  591    HA   ASP  95           HA       ASP  95  22.183   0.554  -1.265
  592    HB2  ASP  95           HB1      ASP  95  19.637   1.334  -2.594
  593    HB3  ASP  95           HB2      ASP  95  20.903   2.566  -2.500
  594    HD2  ASP  95           HD       ASP  95  21.316  -0.331  -5.084
  595    H    ALA  96           H        ALA  96  19.160   1.944  -0.010
  596    HA   ALA  96           HA       ALA  96  20.184   4.326   0.990
  597    HB1  ALA  96           HB1      ALA  96  18.178   3.375   2.774
  598    HB2  ALA  96           HB2      ALA  96  18.049   4.608   1.518
  599    HB3  ALA  96           HB3      ALA  96  17.738   2.916   1.129
  600    H    THR  97           H        THR  97  20.678   4.962   3.176
  601    HA   THR  97           HA       THR  97  21.847   4.808   5.124
  602    HB   THR  97           HB       THR  97  21.217   1.913   5.454
  603    HG1  THR  97           HG1      THR  97  19.233   3.916   5.825
  604   HG21  THR  97          HG21      THR  97  21.736   4.270   7.115
  605   HG22  THR  97          HG22      THR  97  21.997   2.560   7.461
  606   HG23  THR  97          HG23      THR  97  20.399   3.272   7.685
  607    H    GLU  98           H        GLU  98  23.917   5.033   4.348
  608    HA   GLU  98           HA       GLU  98  25.438   2.529   4.062
  609    HB2  GLU  98           HB1      GLU  98  25.158   4.747   2.177
  610    HB3  GLU  98           HB2      GLU  98  26.846   4.367   2.554
  611    HG2  GLU  98           HG1      GLU  98  26.173   1.917   2.074
  612    HG3  GLU  98           HG2      GLU  98  24.773   2.639   1.270
  613    HE2  GLU  98           HE       GLU  98  26.989   2.539  -1.426
  614    H    ASN  99           H        ASN  99  27.731   2.728   4.568
  615    HA   ASN  99           HA       ASN  99  28.178   4.056   7.001
  616    HB2  ASN  99           HB1      ASN  99  30.075   2.787   5.017
  617    HB3  ASN  99           HB2      ASN  99  30.607   3.444   6.570
  618   HD21  ASN  99          HD21      ASN  99  30.654   0.696   5.549
  619   HD22  ASN  99          HD22      ASN  99  29.793  -0.248   6.711
  620    H    LEU 100           H        LEU 100  29.356   4.780   3.724
  621    HA   LEU 100           HA       LEU 100  30.150   6.687   2.775
  622    HB2  LEU 100           HB1      LEU 100  27.954   7.418   4.279
  623    HB3  LEU 100           HB2      LEU 100  29.214   8.539   4.821
  624    HG   LEU 100           HG       LEU 100  29.321   8.523   2.005
  625   HD11  LEU 100          HD11      LEU 100  27.128   7.568   1.881
  626   HD12  LEU 100          HD12      LEU 100  27.013   9.281   1.482
  627   HD13  LEU 100          HD13      LEU 100  26.510   8.712   3.074
  628   HD21  LEU 100          HD21      LEU 100  28.876  10.840   2.235
  629   HD22  LEU 100          HD22      LEU 100  29.790  10.360   3.665
  630   HD23  LEU 100          HD23      LEU 100  28.046  10.599   3.771
  631    H    TYR 101           H        TYR 101  31.218   8.991   3.626
  632    HA   TYR 101           HA       TYR 101  33.390   8.115   5.411
  633    HB2  TYR 101           HB1      TYR 101  33.352   9.527   2.850
  634    HB3  TYR 101           HB2      TYR 101  34.310  10.364   4.075
  635    HD1  TYR 101           HD1      TYR 101  34.610   8.150   1.484
  636    HD2  TYR 101           HD2      TYR 101  35.774   8.556   5.556
  637    HE1  TYR 101           HE1      TYR 101  36.489   6.612   1.094
  638    HE2  TYR 101           HE2      TYR 101  37.658   7.021   5.177
  639    HH   TYR 101           HH       TYR 101  37.979   4.972   3.138
  640    H    PHE 102           H        PHE 102  34.497   9.990   6.547
  641    HA   PHE 102           HA       PHE 102  32.453  11.863   7.545
  642    HB2  PHE 102           HB1      PHE 102  33.485  11.784   9.720
  643    HB3  PHE 102           HB2      PHE 102  33.168  10.130   9.190
  644    HD1  PHE 102           HD1      PHE 102  35.793  12.627   9.766
  645    HD2  PHE 102           HD2      PHE 102  34.936   8.587   8.736
  646    HE1  PHE 102           HE1      PHE 102  38.153  12.037  10.131
  647    HE2  PHE 102           HE2      PHE 102  37.294   7.990   9.100
  648    HZ   PHE 102           HZ       PHE 102  38.908   9.715   9.799
  649    H    GLN 103           H        GLN 103  33.649  13.751   8.781
  650    HA   GLN 103           HA       GLN 103  36.066  14.618   7.423
  651    HB2  GLN 103           HB1      GLN 103  33.610  15.371   6.388
  652    HB3  GLN 103           HB2      GLN 103  34.078  16.752   7.393
  653    HG2  GLN 103           HG1      GLN 103  36.313  16.706   6.200
  654    HG3  GLN 103           HG2      GLN 103  35.561  15.576   5.065
  655   HE21  GLN 103          HE21      GLN 103  35.068  16.583   3.262
  656   HE22  GLN 103          HE22      GLN 103  34.359  18.153   3.129
  657    H    SER 104           H        SER 104  37.360  15.573   8.843
  658    HA   SER 104           HA       SER 104  36.446  16.148  11.496
  659    HB2  SER 104           HB1      SER 104  38.789  16.785  11.937
  660    HB3  SER 104           HB2      SER 104  38.684  15.223  11.106
  661    HG   SER 104           HG       SER 104  39.188  17.712   9.835
  662    H    LEU 105           H        LEU 105  37.505  18.321  12.448
  663    HA   LEU 105           HA       LEU 105  36.264  20.484  10.899
  664    HB2  LEU 105           HB1      LEU 105  36.200  19.744  13.643
  665    HB3  LEU 105           HB2      LEU 105  37.014  21.313  13.519
  666    HG   LEU 105           HG       LEU 105  34.957  21.999  12.098
  667   HD11  LEU 105          HD11      LEU 105  33.468  20.026  13.737
  668   HD12  LEU 105          HD12      LEU 105  34.236  19.452  12.257
  669   HD13  LEU 105          HD13      LEU 105  33.054  20.759  12.186
  670   HD21  LEU 105          HD21      LEU 105  33.720  22.576  14.176
  671   HD22  LEU 105          HD22      LEU 105  35.434  22.992  14.229
  672   HD23  LEU 105          HD23      LEU 105  34.845  21.562  15.078
  673    H    GLU 106           H        GLU 106  37.304  22.676  11.206
  674    HA   GLU 106           HA       GLU 106  39.842  22.722  10.106
  675    HB2  GLU 106           HB1      GLU 106  37.920  24.602  10.752
  676    HB3  GLU 106           HB2      GLU 106  39.292  25.057  11.772
  677    HG2  GLU 106           HG1      GLU 106  40.605  25.652  10.017
  678    HG3  GLU 106           HG2      GLU 106  39.857  24.476   8.926
  679    HE2  GLU 106           HE       GLU 106  37.964  26.969   7.568
  680    H    HIS 107           H        HIS 107  41.808  23.768  11.093
  681    HA   HIS 107           HA       HIS 107  42.257  22.644  13.778
  682    HB2  HIS 107           HB1      HIS 107  44.694  22.655  13.110
  683    HB3  HIS 107           HB2      HIS 107  43.670  21.523  12.223
  684    HD1  HIS 107           HD1      HIS 107  43.026  22.200   9.740
  685    HD2  HIS 107           HD2      HIS 107  45.961  24.535  11.529
  686    HE1  HIS 107           HE1      HIS 107  44.129  23.452   7.859
  687    HE2  HIS 107           HE2      HIS 107  45.924  24.877   8.951
  688    H    HIS 108           H        HIS 108  43.762  23.804  15.171
  689    HA   HIS 108           HA       HIS 108  44.445  25.666  16.285
  690    HB2  HIS 108           HB1      HIS 108  45.380  25.943  13.705
  691    HB3  HIS 108           HB2      HIS 108  44.529  27.467  13.974
  692    HD1  HIS 108           HD1      HIS 108  46.393  29.076  14.365
  693    HD2  HIS 108           HD2      HIS 108  46.790  25.623  16.642
  694    HE1  HIS 108           HE1      HIS 108  48.339  29.502  15.901
  695    HE2  HIS 108           HE2      HIS 108  48.582  27.391  17.292
  696    H    HIS 109           H        HIS 109  43.883  28.038  16.694
  697    HA   HIS 109           HA       HIS 109  41.160  28.716  15.871
  698    HB2  HIS 109           HB1      HIS 109  42.030  27.974  18.612
  699    HB3  HIS 109           HB2      HIS 109  40.965  29.378  18.479
  700    HD1  HIS 109           HD1      HIS 109  38.526  28.922  18.292
  701    HD2  HIS 109           HD2      HIS 109  40.818  25.573  17.401
  702    HE1  HIS 109           HE1      HIS 109  36.884  27.039  18.004
  703    HE2  HIS 109           HE2      HIS 109  38.283  24.993  17.459
  704    H    HIS 110           H        HIS 110  40.556  30.948  16.613
  705    HA   HIS 110           HA       HIS 110  40.954  33.188  16.661
  706    HB2  HIS 110           HB1      HIS 110  43.670  32.499  17.798
  707    HB3  HIS 110           HB2      HIS 110  42.780  34.013  17.987
  708    HD1  HIS 110           HD1      HIS 110  43.716  31.504  20.079
  709    HD2  HIS 110           HD2      HIS 110  39.962  33.015  19.139
  710    HE1  HIS 110           HE1      HIS 110  42.235  30.876  22.012
  711    HE2  HIS 110           HE2      HIS 110  39.940  31.800  21.440
  712    H    HIS 111           H        HIS 111  42.399  34.926  15.768
  713    HA   HIS 111           HA       HIS 111  43.723  33.918  13.343
  714    HB2  HIS 111           HB1      HIS 111  41.688  35.755  13.589
  715    HB3  HIS 111           HB2      HIS 111  43.115  36.787  13.446
  716    HD1  HIS 111           HD1      HIS 111  41.242  34.130  11.536
  717    HD2  HIS 111           HD2      HIS 111  44.219  36.963  10.929
  718    HE1  HIS 111           HE1      HIS 111  41.630  34.176   9.051
  719    HE2  HIS 111           HE2      HIS 111  43.450  35.906   8.680
  720    H    HIS 112           H        HIS 112  44.055  36.136  16.057
  721    HA   HIS 112           HA       HIS 112  45.865  37.145  16.997
  722    HB2  HIS 112           HB1      HIS 112  46.699  34.629  16.355
  723    HB3  HIS 112           HB2      HIS 112  47.875  35.612  15.478
  724    HD1  HIS 112           HD1      HIS 112  46.521  35.306  19.015
  725    HD2  HIS 112           HD2      HIS 112  49.949  36.492  16.990
  726    HE1  HIS 112           HE1      HIS 112  48.219  35.807  20.802
  727    HE2  HIS 112           HE2      HIS 112  50.314  36.531  19.563
  Start of MODEL    5
    1    H1   MET  18           H        MET  18  -8.264 -31.609  31.107
    2    HA   MET  18           HA       MET  18  -8.376 -31.403  28.367
    3    HB2  MET  18           HB1      MET  18  -9.775 -33.781  29.405
    4    HB3  MET  18           HB2      MET  18 -10.741 -32.768  28.321
    5    HG2  MET  18           HG1      MET  18  -9.798 -33.876  26.638
    6    HG3  MET  18           HG2      MET  18  -8.337 -32.957  27.005
    7    HE1  MET  18           HE1      MET  18  -5.927 -35.360  27.077
    8    HE2  MET  18           HE2      MET  18  -7.057 -35.944  25.857
    9    HE3  MET  18           HE3      MET  18  -6.847 -34.211  26.105
   10    H    LEU  19           H        LEU  19  -8.807 -29.280  28.903
   11    HA   LEU  19           HA       LEU  19 -11.505 -28.763  29.967
   12    HB2  LEU  19           HB1      LEU  19  -9.087 -26.974  30.256
   13    HB3  LEU  19           HB2      LEU  19 -10.692 -26.730  30.967
   14    HG   LEU  19           HG       LEU  19  -8.818 -28.981  31.690
   15   HD11  LEU  19          HD11      LEU  19  -8.382 -26.402  32.305
   16   HD12  LEU  19          HD12      LEU  19  -7.958 -27.745  33.367
   17   HD13  LEU  19          HD13      LEU  19  -9.458 -26.855  33.629
   18   HD21  LEU  19          HD21      LEU  19 -11.196 -29.497  31.999
   19   HD22  LEU  19          HD22      LEU  19 -11.382 -28.038  32.972
   20   HD23  LEU  19          HD23      LEU  19 -10.351 -29.352  33.540
   21    H    VAL  20           H        VAL  20 -12.815 -27.942  28.488
   22    HA   VAL  20           HA       VAL  20 -11.665 -26.502  26.202
   23    HB   VAL  20           HB       VAL  20 -14.438 -27.657  26.523
   24   HG11  VAL  20          HG11      VAL  20 -14.049 -27.349  23.860
   25   HG12  VAL  20          HG12      VAL  20 -14.873 -26.173  24.886
   26   HG13  VAL  20          HG13      VAL  20 -13.168 -25.956  24.488
   27   HG21  VAL  20          HG21      VAL  20 -12.157 -28.685  24.842
   28   HG22  VAL  20          HG22      VAL  20 -12.593 -29.336  26.422
   29   HG23  VAL  20          HG23      VAL  20 -13.735 -29.436  25.082
   30    H    LEU  21           H        LEU  21 -11.617 -24.367  26.438
   31    HA   LEU  21           HA       LEU  21 -13.403 -22.982  28.214
   32    HB2  LEU  21           HB1      LEU  21 -11.048 -22.307  26.550
   33    HB3  LEU  21           HB2      LEU  21 -12.192 -20.994  26.870
   34    HG   LEU  21           HG       LEU  21 -10.339 -20.983  28.460
   35   HD11  LEU  21          HD11      LEU  21 -12.916 -20.566  29.022
   36   HD12  LEU  21          HD12      LEU  21 -11.633 -20.396  30.220
   37   HD13  LEU  21          HD13      LEU  21 -12.589 -21.878  30.156
   38   HD21  LEU  21          HD21      LEU  21 -10.479 -23.707  28.346
   39   HD22  LEU  21          HD22      LEU  21 -11.214 -23.367  29.913
   40   HD23  LEU  21          HD23      LEU  21  -9.587 -22.784  29.557
   41    H    ASP  22           H        ASP  22 -15.185 -21.826  27.731
   42    HA   ASP  22           HA       ASP  22 -16.396 -22.195  25.157
   43    HB2  ASP  22           HB1      ASP  22 -18.236 -20.771  26.147
   44    HB3  ASP  22           HB2      ASP  22 -17.860 -22.252  27.035
   45    HD2  ASP  22           HD       ASP  22 -17.093 -18.780  28.766
   46    H    PHE  23           H        PHE  23 -17.669 -20.020  24.420
   47    HA   PHE  23           HA       PHE  23 -15.916 -17.713  24.405
   48    HB2  PHE  23           HB1      PHE  23 -15.589 -17.615  22.031
   49    HB3  PHE  23           HB2      PHE  23 -15.058 -19.205  22.583
   50    HD1  PHE  23           HD1      PHE  23 -17.377 -17.410  20.483
   51    HD2  PHE  23           HD2      PHE  23 -16.487 -21.201  22.200
   52    HE1  PHE  23           HE1      PHE  23 -18.870 -18.494  18.856
   53    HE2  PHE  23           HE2      PHE  23 -17.978 -22.291  20.575
   54    HZ   PHE  23           HZ       PHE  23 -19.171 -20.938  18.899
   55    H    ASN  24           H        ASN  24 -16.961 -15.812  23.893
   56    HA   ASN  24           HA       ASN  24 -19.861 -15.958  23.899
   57    HB2  ASN  24           HB1      ASN  24 -17.968 -14.192  24.980
   58    HB3  ASN  24           HB2      ASN  24 -18.789 -13.274  23.713
   59   HD21  ASN  24          HD21      ASN  24 -19.028 -14.612  26.839
   60   HD22  ASN  24          HD22      ASN  24 -20.644 -14.109  27.182
   61    H    ASN  25           H        ASN  25 -21.137 -15.625  22.190
   62    HA   ASN  25           HA       ASN  25 -19.889 -15.060  19.622
   63    HB2  ASN  25           HB1      ASN  25 -21.870 -16.803  20.373
   64    HB3  ASN  25           HB2      ASN  25 -22.800 -15.470  19.681
   65   HD21  ASN  25          HD21      ASN  25 -23.426 -16.231  17.769
   66   HD22  ASN  25          HD22      ASN  25 -22.367 -16.824  16.540
   67    H    ILE  26           H        ILE  26 -21.255 -13.674  18.080
   68    HA   ILE  26           HA       ILE  26 -21.609 -11.092  19.351
   69    HB   ILE  26           HB       ILE  26 -21.809 -10.199  17.091
   70   HG12  ILE  26          HG11      ILE  26 -21.144 -12.222  15.359
   71   HG13  ILE  26          HG12      ILE  26 -22.273 -13.031  16.460
   72   HG21  ILE  26          HG21      ILE  26 -19.569 -11.012  18.227
   73   HG22  ILE  26          HG22      ILE  26 -19.539 -12.100  16.841
   74   HG23  ILE  26          HG23      ILE  26 -19.586 -10.355  16.590
   75   HD11  ILE  26          HD11      ILE  26 -23.601 -10.719  15.953
   76   HD12  ILE  26          HD12      ILE  26 -22.787 -11.010  14.416
   77   HD13  ILE  26          HD13      ILE  26 -23.851 -12.240  15.098
   78    H    ARG  27           H        ARG  27 -23.483  -9.793  19.130
   79    HA   ARG  27           HA       ARG  27 -25.943 -11.225  18.401
   80    HB2  ARG  27           HB1      ARG  27 -25.553 -11.225  20.892
   81    HB3  ARG  27           HB2      ARG  27 -25.704  -9.464  20.840
   82    HG2  ARG  27           HG1      ARG  27 -27.972  -9.547  20.239
   83    HG3  ARG  27           HG2      ARG  27 -27.865 -11.258  19.793
   84    HD2  ARG  27           HD1      ARG  27 -27.600 -10.135  22.593
   85    HD3  ARG  27           HD2      ARG  27 -29.015 -10.963  21.930
   86    HE   ARG  27           HE       ARG  27 -26.710 -12.595  21.700
   87   HH11  ARG  27          HH11      ARG  27 -29.028 -11.415  24.013
   88   HH12  ARG  27          HH12      ARG  27 -28.859 -12.776  25.072
   89   HH21  ARG  27          HH21      ARG  27 -26.478 -14.392  23.086
   90   HH22  ARG  27          HH22      ARG  27 -27.408 -14.469  24.544
   91    H    SER  28           H        SER  28 -24.919  -8.012  19.573
   92    HA   SER  28           HA       SER  28 -26.092  -6.817  17.170
   93    HB2  SER  28           HB1      SER  28 -26.598  -5.327  19.685
   94    HB3  SER  28           HB2      SER  28 -27.624  -5.526  18.253
   95    HG   SER  28           HG       SER  28 -28.538  -7.219  19.127
   96    H    SER  29           H        SER  29 -23.388  -7.226  17.710
   97    HA   SER  29           HA       SER  29 -22.458  -4.463  17.761
   98    HB2  SER  29           HB1      SER  29 -21.110  -6.585  19.453
   99    HB3  SER  29           HB2      SER  29 -20.725  -4.857  19.380
  100    HG   SER  29           HG       SER  29 -22.284  -4.456  20.735
  101    H    ALA  30           H        ALA  30 -21.379  -4.214  15.930
  102    HA   ALA  30           HA       ALA  30 -19.117  -5.740  15.237
  103    HB1  ALA  30           HB1      ALA  30 -21.241  -7.211  14.641
  104    HB2  ALA  30           HB2      ALA  30 -21.200  -6.224  13.180
  105    HB3  ALA  30           HB3      ALA  30 -19.799  -7.197  13.627
  106    H    ASP  31           H        ASP  31 -19.849  -3.003  15.484
  107    HA   ASP  31           HA       ASP  31 -19.585  -0.993  14.451
  108    HB2  ASP  31           HB1      ASP  31 -18.056  -2.736  12.502
  109    HB3  ASP  31           HB2      ASP  31 -18.048  -0.968  12.471
  110    HD2  ASP  31           HD       ASP  31 -16.570  -1.654  15.922
  111    H    LEU  32           H        LEU  32 -21.913  -1.009  14.071
  112    HA   LEU  32           HA       LEU  32 -22.545  -1.168  11.197
  113    HB2  LEU  32           HB1      LEU  32 -23.613  -2.916  12.712
  114    HB3  LEU  32           HB2      LEU  32 -24.539  -1.577  13.409
  115    HG   LEU  32           HG       LEU  32 -24.924  -1.376  10.645
  116   HD11  LEU  32          HD11      LEU  32 -24.341  -3.473   9.978
  117   HD12  LEU  32          HD12      LEU  32 -26.007  -3.783  10.465
  118   HD13  LEU  32          HD13      LEU  32 -24.681  -4.192  11.553
  119   HD21  LEU  32          HD21      LEU  32 -26.844  -2.727  12.505
  120   HD22  LEU  32          HD22      LEU  32 -27.174  -1.602  11.186
  121   HD23  LEU  32          HD23      LEU  32 -26.454  -1.017  12.688
  122    H    HIS  33           H        HIS  33 -21.704   1.122  11.428
  123    HA   HIS  33           HA       HIS  33 -24.000   2.882  11.785
  124    HB2  HIS  33           HB1      HIS  33 -22.122   2.699  13.791
  125    HB3  HIS  33           HB2      HIS  33 -21.537   4.071  12.844
  126    HD1  HIS  33           HD1      HIS  33 -24.400   3.008  15.004
  127    HD2  HIS  33           HD2      HIS  33 -23.122   6.372  12.928
  128    HE1  HIS  33           HE1      HIS  33 -25.865   4.889  15.804
  129    HE2  HIS  33           HE2      HIS  33 -25.083   6.946  14.538
  130    H    GLY  34           H        GLY  34 -20.512   2.878  11.021
  131    HA2  GLY  34           HA2      GLY  34 -19.519   3.482   8.994
  132    HA3  GLY  34           HA3      GLY  34 -21.085   4.026   8.415
  133    HA1  GLY  34           HA1      GLY  34 -19.508   3.791   9.819
  134    H    ALA  35           H        ALA  35 -19.100   5.620   7.768
  135    HA   ALA  35           HA       ALA  35 -19.740   8.068   9.065
  136    HB1  ALA  35           HB1      ALA  35 -17.075   8.305   9.533
  137    HB2  ALA  35           HB2      ALA  35 -18.276   7.894  10.758
  138    HB3  ALA  35           HB3      ALA  35 -17.354   6.618   9.963
  139    H    ARG  36           H        ARG  36 -19.434   9.717   7.684
  140    HA   ARG  36           HA       ARG  36 -17.403   9.525   5.604
  141    HB2  ARG  36           HB1      ARG  36 -20.246   9.113   5.153
  142    HB3  ARG  36           HB2      ARG  36 -19.622  10.476   4.211
  143    HG2  ARG  36           HG1      ARG  36 -18.014   7.987   4.177
  144    HG3  ARG  36           HG2      ARG  36 -19.570   7.964   3.328
  145    HD2  ARG  36           HD1      ARG  36 -18.408  10.396   2.594
  146    HD3  ARG  36           HD2      ARG  36 -17.078   9.228   2.579
  147    HE   ARG  36           HE       ARG  36 -19.364   8.189   1.249
  148   HH11  ARG  36          HH11      ARG  36 -16.705  10.407   0.877
  149   HH12  ARG  36          HH12      ARG  36 -16.668  10.276  -0.850
  150   HH21  ARG  36          HH21      ARG  36 -19.324   8.010  -1.024
  151   HH22  ARG  36          HH22      ARG  36 -18.158   8.913  -1.931
  152    H    LYS  37           H        LYS  37 -17.153  11.574   4.408
  153    HA   LYS  37           HA       LYS  37 -18.314  13.934   5.650
  154    HB2  LYS  37           HB1      LYS  37 -16.008  13.067   6.725
  155    HB3  LYS  37           HB2      LYS  37 -15.359  14.028   5.387
  156    HG2  LYS  37           HG1      LYS  37 -16.153  16.019   6.231
  157    HG3  LYS  37           HG2      LYS  37 -17.426  15.222   7.174
  158    HD2  LYS  37           HD1      LYS  37 -14.609  14.573   7.873
  159    HD3  LYS  37           HD2      LYS  37 -15.206  16.189   8.293
  160    HE2  LYS  37           HE1      LYS  37 -16.971  15.298   9.627
  161    HE3  LYS  37           HE2      LYS  37 -16.678  13.664   9.016
  162    HZ1  LYS  37           HZ1      LYS  37 -14.388  13.910  10.062
  163    HZ2  LYS  37           HZ2      LYS  37 -15.696  13.694  11.111
  164    HZ3  LYS  37           HZ3      LYS  37 -15.029  15.233  10.898
  165    H    GLY  38           H        GLY  38 -15.599  13.067   3.492
  166    HA2  GLY  38           HA2      GLY  38 -16.839  13.947   1.129
  167    HA3  GLY  38           HA3      GLY  38 -15.896  15.277   1.785
  168    HA1  GLY  38           HA1      GLY  38 -16.441  13.244   1.486
  169    H    SER  39           H        SER  39 -14.309  15.376   0.266
  170    HA   SER  39           HA       SER  39 -12.427  14.823  -0.889
  171    HB2  SER  39           HB1      SER  39 -10.744  13.961   0.386
  172    HB3  SER  39           HB2      SER  39 -11.931  14.189   1.681
  173    HG   SER  39           HG       SER  39 -12.178  12.095   1.849
  174    H    GLN  40           H        GLN  40 -11.095  12.591  -1.520
  175    HA   GLN  40           HA       GLN  40 -13.100  11.060  -2.997
  176    HB2  GLN  40           HB1      GLN  40 -10.302  11.847  -3.441
  177    HB3  GLN  40           HB2      GLN  40 -10.676  10.184  -3.916
  178    HG2  GLN  40           HG1      GLN  40 -12.789  11.611  -4.960
  179    HG3  GLN  40           HG2      GLN  40 -11.406  12.693  -5.185
  180   HE21  GLN  40          HE21      GLN  40 -12.565   9.424  -5.787
  181   HE22  GLN  40          HE22      GLN  40 -11.605   9.147  -7.196
  182    H    CYS  41           H        CYS  41 -10.199  10.506  -1.013
  183    HA   CYS  41           HA       CYS  41 -11.324   7.891  -0.264
  184    HB2  CYS  41           HB1      CYS  41  -9.098   6.904  -0.287
  185    HB3  CYS  41           HB2      CYS  41  -9.495   7.555  -1.878
  186    H    LEU  42           H        LEU  42 -11.085   7.286   1.856
  187    HA   LEU  42           HA       LEU  42 -10.469   9.407   3.714
  188    HB2  LEU  42           HB1      LEU  42 -12.029   7.003   3.711
  189    HB3  LEU  42           HB2      LEU  42 -10.914   6.982   5.088
  190    HG   LEU  42           HG       LEU  42 -11.822   9.256   5.709
  191   HD11  LEU  42          HD11      LEU  42 -13.393  10.273   4.505
  192   HD12  LEU  42          HD12      LEU  42 -14.333   8.792   4.326
  193   HD13  LEU  42          HD13      LEU  42 -13.000   9.128   3.222
  194   HD21  LEU  42          HD21      LEU  42 -12.514   6.925   6.611
  195   HD22  LEU  42          HD22      LEU  42 -14.008   7.215   5.719
  196   HD23  LEU  42          HD23      LEU  42 -13.510   8.330   6.992
  197    H    SER  43           H        SER  43  -8.999   6.452   2.586
  198    HA   SER  43           HA       SER  43  -6.485   7.183   3.765
  199    HB2  SER  43           HB1      SER  43  -7.997   4.765   4.787
  200    HB3  SER  43           HB2      SER  43  -6.249   4.975   4.990
  201    HG   SER  43           HG       SER  43  -8.358   6.403   6.157
  202    H    ASP  44           H        ASP  44  -4.761   5.601   3.194
  203    HA   ASP  44           HA       ASP  44  -4.774   5.015   0.477
  204    HB2  ASP  44           HB1      ASP  44  -2.794   3.478   1.090
  205    HB3  ASP  44           HB2      ASP  44  -2.656   5.202   1.462
  206    HD2  ASP  44           HD       ASP  44  -2.672   2.627   4.432
  207    H    THR  45           H        THR  45  -5.909   3.152   3.174
  208    HA   THR  45           HA       THR  45  -5.880   0.581   2.078
  209    HB   THR  45           HB       THR  45  -8.162   1.442   3.813
  210    HG1  THR  45           HG1      THR  45  -5.441   1.194   4.634
  211   HG21  THR  45          HG21      THR  45  -8.361  -0.773   3.964
  212   HG22  THR  45          HG22      THR  45  -6.813  -0.812   4.810
  213   HG23  THR  45          HG23      THR  45  -6.866  -1.011   3.059
  214    H    ASP  46           H        ASP  46  -7.920   3.299   1.427
  215    HA   ASP  46           HA       ASP  46 -10.121   1.898   0.311
  216    HB2  ASP  46           HB1      ASP  46  -9.638   4.503   0.981
  217    HB3  ASP  46           HB2      ASP  46  -9.547   4.572  -0.785
  218    HD2  ASP  46           HD       ASP  46 -13.055   3.742   0.865
  219    H    CYS  47           H        CYS  47  -7.006   2.835  -0.900
  220    HA   CYS  47           HA       CYS  47  -7.605   2.652  -3.671
  221    HB2  CYS  47           HB1      CYS  47  -5.451   3.494  -2.176
  222    HB3  CYS  47           HB2      CYS  47  -4.850   2.004  -2.905
  223    H    ASN  48           H        ASN  48  -5.877   0.991  -4.853
  224    HA   ASN  48           HA       ASN  48  -7.137  -1.482  -4.821
  225    HB2  ASN  48           HB1      ASN  48  -4.320  -0.812  -5.719
  226    HB3  ASN  48           HB2      ASN  48  -5.193  -2.293  -6.131
  227   HD21  ASN  48          HD21      ASN  48  -5.695  -2.190  -8.198
  228   HD22  ASN  48          HD22      ASN  48  -6.428  -0.845  -8.996
  229    H    THR  49           H        THR  49  -3.726  -1.098  -3.887
  230    HA   THR  49           HA       THR  49  -4.078  -2.356  -1.345
  231    HB   THR  49           HB       THR  49  -2.288  -4.192  -2.330
  232    HG1  THR  49           HG1      THR  49  -3.108  -3.363  -4.486
  233   HG21  THR  49          HG21      THR  49  -3.731  -5.366  -1.099
  234   HG22  THR  49          HG22      THR  49  -4.790  -5.432  -2.509
  235   HG23  THR  49          HG23      THR  49  -4.988  -4.148  -1.316
  236    H    ARG  50           H        ARG  50  -1.504  -2.329  -3.819
  237    HA   ARG  50           HA       ARG  50   0.336  -1.241  -1.828
  238    HB2  ARG  50           HB1      ARG  50   0.830  -2.298  -4.622
  239    HB3  ARG  50           HB2      ARG  50   2.086  -1.750  -3.502
  240    HG2  ARG  50           HG1      ARG  50   2.146  -3.708  -2.456
  241    HG3  ARG  50           HG2      ARG  50   0.384  -3.735  -2.276
  242    HD2  ARG  50           HD1      ARG  50   1.044  -5.652  -3.573
  243    HD3  ARG  50           HD2      ARG  50   0.203  -4.510  -4.628
  244    HE   ARG  50           HE       ARG  50   3.023  -4.109  -4.686
  245   HH11  ARG  50          HH11      ARG  50   0.458  -6.124  -5.904
  246   HH12  ARG  50          HH12      ARG  50   1.318  -6.574  -7.340
  247   HH21  ARG  50          HH21      ARG  50   4.165  -4.694  -6.572
  248   HH22  ARG  50          HH22      ARG  50   3.426  -5.761  -7.718
  249    H    LYS  51           H        LYS  51  -1.545   0.598  -2.532
  250    HA   LYS  51           HA       LYS  51   0.022   2.505  -4.133
  251    HB2  LYS  51           HB1      LYS  51  -2.854   1.741  -4.373
  252    HB3  LYS  51           HB2      LYS  51  -2.412   3.433  -4.653
  253    HG2  LYS  51           HG1      LYS  51  -2.273   2.615  -6.783
  254    HG3  LYS  51           HG2      LYS  51  -0.605   2.379  -6.232
  255    HD2  LYS  51           HD1      LYS  51  -1.413   0.035  -5.482
  256    HD3  LYS  51           HD2      LYS  51  -2.783   0.345  -6.563
  257    HE2  LYS  51           HE1      LYS  51  -1.559  -0.048  -8.396
  258    HE3  LYS  51           HE2      LYS  51  -0.247   0.988  -7.816
  259    HZ1  LYS  51           HZ1      LYS  51   0.436  -1.334  -8.110
  260    HZ2  LYS  51           HZ2      LYS  51  -0.688  -1.817  -6.943
  261    HZ3  LYS  51           HZ3      LYS  51   0.610  -0.823  -6.507
  262    H    PHE  52           H        PHE  52  -0.401   4.764  -3.629
  263    HA   PHE  52           HA       PHE  52  -1.319   5.124  -0.852
  264    HB2  PHE  52           HB1      PHE  52   0.330   6.836  -0.541
  265    HB3  PHE  52           HB2      PHE  52   1.145   5.420  -1.209
  266    HD1  PHE  52           HD1      PHE  52   0.245   8.880  -1.768
  267    HD2  PHE  52           HD2      PHE  52   1.863   5.379  -3.568
  268    HE1  PHE  52           HE1      PHE  52   1.154  10.248  -3.601
  269    HE2  PHE  52           HE2      PHE  52   2.775   6.740  -5.404
  270    HZ   PHE  52           HZ       PHE  52   2.422   9.178  -5.421
  271    H    CYS  53           H        CYS  53  -2.466   7.011  -0.339
  272    HA   CYS  53           HA       CYS  53  -3.918   8.141  -2.599
  273    HB2  CYS  53           HB1      CYS  53  -4.429   7.729   0.268
  274    HB3  CYS  53           HB2      CYS  53  -5.012   9.275  -0.350
  275    H    LEU  54           H        LEU  54  -3.344  10.010  -3.468
  276    HA   LEU  54           HA       LEU  54  -1.711  11.868  -1.884
  277    HB2  LEU  54           HB1      LEU  54  -0.690  11.062  -3.950
  278    HB3  LEU  54           HB2      LEU  54  -2.084  11.656  -4.867
  279    HG   LEU  54           HG       LEU  54  -1.290  13.948  -3.685
  280   HD11  LEU  54          HD11      LEU  54   1.012  14.133  -3.469
  281   HD12  LEU  54          HD12      LEU  54   1.318  12.651  -4.374
  282   HD13  LEU  54          HD13      LEU  54   0.669  12.565  -2.737
  283   HD21  LEU  54          HD21      LEU  54  -1.566  14.193  -5.912
  284   HD22  LEU  54          HD22      LEU  54  -0.803  12.649  -6.289
  285   HD23  LEU  54          HD23      LEU  54   0.193  14.057  -5.923
  286    H    GLN  55           H        GLN  55  -2.556  13.730  -1.227
  287    HA   GLN  55           HA       GLN  55  -4.938  14.760  -2.622
  288    HB2  GLN  55           HB1      GLN  55  -5.608  15.677  -0.330
  289    HB3  GLN  55           HB2      GLN  55  -5.800  13.936  -0.594
  290    HG2  GLN  55           HG1      GLN  55  -3.675  13.529   0.577
  291    HG3  GLN  55           HG2      GLN  55  -3.541  15.267   0.883
  292   HE21  GLN  55          HE21      GLN  55  -5.013  16.261   2.305
  293   HE22  GLN  55          HE22      GLN  55  -5.885  15.342   3.480
  294    HA   PRO  56           HA       PRO  56  -1.749  18.044  -2.791
  295    HB2  PRO  56           HB1      PRO  56  -2.596  19.039  -5.197
  296    HB3  PRO  56           HB2      PRO  56  -1.507  17.663  -5.043
  297    HG2  PRO  56           HG1      PRO  56  -4.477  17.699  -5.461
  298    HG3  PRO  56           HG2      PRO  56  -3.221  16.703  -6.287
  299    HD2  PRO  56           HD1      PRO  56  -4.794  15.726  -4.302
  300    HD3  PRO  56           HD2      PRO  56  -3.116  15.207  -4.537
  301    H    ARG  57           H        ARG  57  -1.946  20.314  -2.608
  302    HA   ARG  57           HA       ARG  57  -4.474  21.172  -1.500
  303    HB2  ARG  57           HB1      ARG  57  -1.973  21.730  -0.773
  304    HB3  ARG  57           HB2      ARG  57  -2.217  23.075  -1.897
  305    HG2  ARG  57           HG1      ARG  57  -3.229  24.205  -0.286
  306    HG3  ARG  57           HG2      ARG  57  -4.510  22.983  -0.281
  307    HD2  ARG  57           HD1      ARG  57  -3.647  21.863   1.532
  308    HD3  ARG  57           HD2      ARG  57  -1.992  22.382   1.182
  309    HE   ARG  57           HE       ARG  57  -3.930  23.757   2.795
  310   HH11  ARG  57          HH11      ARG  57  -1.067  24.108   0.846
  311   HH12  ARG  57          HH12      ARG  57  -0.550  25.562   1.635
  312   HH21  ARG  57          HH21      ARG  57  -3.261  25.670   3.842
  313   HH22  ARG  57          HH22      ARG  57  -1.798  26.449   3.339
  314    H    ASP  58           H        ASP  58  -2.674  21.577  -4.442
  315    HA   ASP  58           HA       ASP  58  -4.347  23.777  -5.349
  316    HB2  ASP  58           HB1      ASP  58  -1.732  22.895  -5.932
  317    HB3  ASP  58           HB2      ASP  58  -2.670  22.660  -7.413
  318    HD2  ASP  58           HD       ASP  58  -1.840  26.331  -6.266
  319    H    GLU  59           H        GLU  59  -4.160  20.345  -5.607
  320    HA   GLU  59           HA       GLU  59  -6.303  20.391  -7.631
  321    HB2  GLU  59           HB1      GLU  59  -3.799  18.947  -7.571
  322    HB3  GLU  59           HB2      GLU  59  -5.168  17.825  -7.634
  323    HG2  GLU  59           HG1      GLU  59  -6.036  19.263  -9.567
  324    HG3  GLU  59           HG2      GLU  59  -4.406  19.954  -9.599
  325    HE2  GLU  59           HE       GLU  59  -4.817  16.813 -11.636
  326    H    LYS  60           H        LYS  60  -7.452  18.091  -7.552
  327    HA   LYS  60           HA       LYS  60  -8.557  17.912  -4.872
  328    HB2  LYS  60           HB1      LYS  60  -9.401  17.132  -7.602
  329    HB3  LYS  60           HB2      LYS  60  -9.953  16.077  -6.291
  330    HG2  LYS  60           HG1      LYS  60 -10.633  18.383  -5.183
  331    HG3  LYS  60           HG2      LYS  60 -10.658  18.900  -6.879
  332    HD2  LYS  60           HD1      LYS  60 -12.020  16.340  -6.186
  333    HD3  LYS  60           HD2      LYS  60 -12.795  17.859  -5.701
  334    HE2  LYS  60           HE1      LYS  60 -11.779  17.721  -8.488
  335    HE3  LYS  60           HE2      LYS  60 -13.178  16.712  -8.095
  336    HZ1  LYS  60           HZ1      LYS  60 -13.348  19.428  -7.122
  337    HZ2  LYS  60           HZ2      LYS  60 -14.511  18.485  -7.908
  338    HZ3  LYS  60           HZ3      LYS  60 -13.326  19.290  -8.808
  339    HA   PRO  61           HA       PRO  61  -6.618  14.185  -3.607
  340    HB2  PRO  61           HB1      PRO  61  -8.654  12.854  -2.347
  341    HB3  PRO  61           HB2      PRO  61  -7.875  14.291  -1.686
  342    HG2  PRO  61           HG1      PRO  61 -10.432  14.056  -3.236
  343    HG3  PRO  61           HG2      PRO  61 -10.089  15.001  -1.739
  344    HD2  PRO  61           HD1      PRO  61 -10.190  16.142  -4.201
  345    HD3  PRO  61           HD2      PRO  61  -9.097  16.708  -2.927
  346    H    PHE  62           H        PHE  62  -6.151  12.172  -4.352
  347    HA   PHE  62           HA       PHE  62  -8.081  10.513  -5.663
  348    HB2  PHE  62           HB1      PHE  62  -6.824  10.453  -7.853
  349    HB3  PHE  62           HB2      PHE  62  -7.736  11.933  -7.545
  350    HD1  PHE  62           HD1      PHE  62  -6.717  13.971  -7.855
  351    HD2  PHE  62           HD2      PHE  62  -4.305  10.549  -7.089
  352    HE1  PHE  62           HE1      PHE  62  -4.693  15.322  -8.212
  353    HE2  PHE  62           HE2      PHE  62  -2.277  11.894  -7.443
  354    HZ   PHE  62           HZ       PHE  62  -2.469  14.285  -8.005
  355    H    CYS  63           H        CYS  63  -6.775   8.646  -6.856
  356    HA   CYS  63           HA       CYS  63  -4.856   7.689  -4.866
  357    HB2  CYS  63           HB1      CYS  63  -6.871   6.467  -6.579
  358    HB3  CYS  63           HB2      CYS  63  -5.321   5.630  -6.685
  359    H    ALA  64           H        ALA  64  -2.748   7.520  -5.267
  360    HA   ALA  64           HA       ALA  64  -1.824   7.968  -8.024
  361    HB1  ALA  64           HB1      ALA  64  -0.574   8.576  -5.362
  362    HB2  ALA  64           HB2      ALA  64   0.366   8.556  -6.855
  363    HB3  ALA  64           HB3      ALA  64  -0.976   9.687  -6.673
  364    H    THR  65           H        THR  65  -1.158   6.214  -9.056
  365    HA   THR  65           HA       THR  65  -0.817   3.690  -7.997
  366    HB   THR  65           HB       THR  65  -1.042   3.883 -10.355
  367    HG1  THR  65           HG1      THR  65   0.708   2.612 -11.034
  368   HG21  THR  65          HG21      THR  65   1.511   5.494 -10.304
  369   HG22  THR  65          HG22      THR  65  -0.102   6.089 -10.691
  370   HG23  THR  65          HG23      THR  65   0.697   4.943 -11.766
  371    H    CYS  66           H        CYS  66   1.139   2.378  -7.789
  372    HA   CYS  66           HA       CYS  66   2.982   3.480  -5.994
  373    HB2  CYS  66           HB1      CYS  66   2.425   1.063  -6.173
  374    HB3  CYS  66           HB2      CYS  66   3.328   0.997  -7.688
  375    H    ARG  67           H        ARG  67   5.096   4.158  -6.189
  376    HA   ARG  67           HA       ARG  67   5.902   4.934  -8.902
  377    HB2  ARG  67           HB1      ARG  67   7.065   5.924  -6.295
  378    HB3  ARG  67           HB2      ARG  67   7.242   6.643  -7.903
  379    HG2  ARG  67           HG1      ARG  67   4.577   6.755  -7.702
  380    HG3  ARG  67           HG2      ARG  67   5.003   6.827  -5.984
  381    HD2  ARG  67           HD1      ARG  67   6.450   8.741  -6.375
  382    HD3  ARG  67           HD2      ARG  67   6.139   8.635  -8.114
  383    HE   ARG  67           HE       ARG  67   4.458   9.843  -6.146
  384   HH11  ARG  67          HH11      ARG  67   4.465   8.188  -9.209
  385   HH12  ARG  67          HH12      ARG  67   2.975   8.892  -9.740
  386   HH21  ARG  67          HH21      ARG  67   2.495  10.776  -6.835
  387   HH22  ARG  67          HH22      ARG  67   1.855  10.365  -8.390
  388    H    GLY  68           H        GLY  68   7.900   4.418  -9.741
  389    HA2  GLY  68           HA2      GLY  68   9.096   2.013  -8.778
  390    HA3  GLY  68           HA3      GLY  68   9.667   2.991 -10.122
  391    HA1  GLY  68           HA1      GLY  68   8.959   2.621  -8.153
  392    H    LEU  69           H        LEU  69  11.810   2.477  -9.316
  393    HA   LEU  69           HA       LEU  69  12.615   3.579  -6.771
  394    HB2  LEU  69           HB1      LEU  69  14.188   2.326  -9.028
  395    HB3  LEU  69           HB2      LEU  69  14.888   2.860  -7.490
  396    HG   LEU  69           HG       LEU  69  12.910   0.621  -7.901
  397   HD11  LEU  69          HD11      LEU  69  15.519   0.482  -8.339
  398   HD12  LEU  69          HD12      LEU  69  14.627  -0.835  -7.578
  399   HD13  LEU  69          HD13      LEU  69  15.549   0.295  -6.586
  400   HD21  LEU  69          HD21      LEU  69  14.069   1.725  -5.344
  401   HD22  LEU  69          HD22      LEU  69  13.124   0.241  -5.484
  402   HD23  LEU  69          HD23      LEU  69  12.380   1.799  -5.847
  403    H    ARG  70           H        ARG  70  13.488   4.204 -10.172
  404    HA   ARG  70           HA       ARG  70  15.074   6.445  -9.746
  405    HB2  ARG  70           HB1      ARG  70  13.583   5.292 -12.025
  406    HB3  ARG  70           HB2      ARG  70  13.967   7.015 -12.155
  407    HG2  ARG  70           HG1      ARG  70  16.043   4.930 -11.516
  408    HG3  ARG  70           HG2      ARG  70  15.639   5.428 -13.168
  409    HD2  ARG  70           HD1      ARG  70  16.686   7.423 -12.977
  410    HD3  ARG  70           HD2      ARG  70  16.168   7.634 -11.299
  411    HE   ARG  70           HE       ARG  70  18.154   6.736 -10.610
  412   HH11  ARG  70          HH11      ARG  70  17.653   5.940 -13.962
  413   HH12  ARG  70          HH12      ARG  70  19.230   5.254 -14.169
  414   HH21  ARG  70          HH21      ARG  70  20.233   5.835 -10.870
  415   HH22  ARG  70          HH22      ARG  70  20.697   5.194 -12.409
  416    H    ARG  71           H        ARG  71  11.631   6.098  -9.649
  417    HA   ARG  71           HA       ARG  71  10.736   8.658 -10.165
  418    HB2  ARG  71           HB1      ARG  71   9.781   6.407  -8.466
  419    HB3  ARG  71           HB2      ARG  71   9.036   7.993  -8.215
  420    HG2  ARG  71           HG1      ARG  71   9.228   6.695 -10.928
  421    HG3  ARG  71           HG2      ARG  71   7.860   6.456  -9.829
  422    HD2  ARG  71           HD1      ARG  71   7.685   9.011  -9.746
  423    HD3  ARG  71           HD2      ARG  71   8.776   9.000 -11.139
  424    HE   ARG  71           HE       ARG  71   6.545   7.284 -11.555
  425   HH11  ARG  71          HH11      ARG  71   7.534  10.622 -11.567
  426   HH12  ARG  71          HH12      ARG  71   6.321  11.112 -12.703
  427   HH21  ARG  71          HH21      ARG  71   4.944   7.917 -13.052
  428   HH22  ARG  71          HH22      ARG  71   4.849   9.574 -13.547
  429    H    ARG  72           H        ARG  72  10.562  10.544  -9.026
  430    HA   ARG  72           HA       ARG  72  12.394  10.871  -6.811
  431    HB2  ARG  72           HB1      ARG  72  10.624  12.861  -8.252
  432    HB3  ARG  72           HB2      ARG  72  11.824  13.275  -7.017
  433    HG2  ARG  72           HG1      ARG  72  13.106  11.699  -9.018
  434    HG3  ARG  72           HG2      ARG  72  12.198  13.003  -9.803
  435    HD2  ARG  72           HD1      ARG  72  14.067  13.456  -7.472
  436    HD3  ARG  72           HD2      ARG  72  14.572  13.558  -9.165
  437    HE   ARG  72           HE       ARG  72  12.340  15.204  -8.833
  438   HH11  ARG  72          HH11      ARG  72  15.655  15.008  -7.787
  439   HH12  ARG  72          HH12      ARG  72  15.838  16.722  -7.614
  440   HH21  ARG  72          HH21      ARG  72  12.569  17.462  -8.609
  441   HH22  ARG  72          HH22      ARG  72  14.082  18.117  -8.081
  442    H    CYS  73           H        CYS  73  11.884  11.307  -4.718
  443    HA   CYS  73           HA       CYS  73   9.050  11.560  -3.999
  444    HB2  CYS  73           HB1      CYS  73   9.301   9.954  -2.178
  445    HB3  CYS  73           HB2      CYS  73   9.651   9.193  -3.731
  446    H    GLN  74           H        GLN  74   8.738  12.326  -1.761
  447    HA   GLN  74           HA       GLN  74  10.974  14.046  -0.910
  448    HB2  GLN  74           HB1      GLN  74   8.920  15.183  -1.882
  449    HB3  GLN  74           HB2      GLN  74   8.051  14.623  -0.445
  450    HG2  GLN  74           HG1      GLN  74   8.638  16.606   0.409
  451    HG3  GLN  74           HG2      GLN  74  10.187  15.805   0.706
  452   HE21  GLN  74          HE21      GLN  74  11.971  16.461  -0.364
  453   HE22  GLN  74          HE22      GLN  74  12.001  17.766  -1.496
  454    H    ARG  75           H        ARG  75   8.524  11.776   0.045
  455    HA   ARG  75           HA       ARG  75   9.656  11.766   2.761
  456    HB2  ARG  75           HB1      ARG  75   6.744  11.528   1.976
  457    HB3  ARG  75           HB2      ARG  75   7.367  11.168   3.593
  458    HG2  ARG  75           HG1      ARG  75   7.989  13.424   3.974
  459    HG3  ARG  75           HG2      ARG  75   7.726  13.841   2.272
  460    HD2  ARG  75           HD1      ARG  75   5.280  13.061   2.709
  461    HD3  ARG  75           HD2      ARG  75   5.709  13.280   4.411
  462    HE   ARG  75           HE       ARG  75   6.447  15.594   3.028
  463   HH11  ARG  75          HH11      ARG  75   3.571  13.856   3.938
  464   HH12  ARG  75          HH12      ARG  75   2.576  15.273   3.999
  465   HH21  ARG  75          HH21      ARG  75   5.147  17.467   3.106
  466   HH22  ARG  75          HH22      ARG  75   3.474  17.327   3.525
  467    H    ASP  76           H        ASP  76   9.030   9.675   3.933
  468    HA   ASP  76           HA       ASP  76   9.948   7.485   2.344
  469    HB2  ASP  76           HB1      ASP  76  10.467   7.840   4.787
  470    HB3  ASP  76           HB2      ASP  76   8.798   7.366   5.137
  471    HD2  ASP  76           HD       ASP  76   9.715   4.083   5.108
  472    H    ALA  77           H        ALA  77   6.867   8.256   3.939
  473    HA   ALA  77           HA       ALA  77   5.496   5.935   3.127
  474    HB1  ALA  77           HB1      ALA  77   4.922   8.173   4.678
  475    HB2  ALA  77           HB2      ALA  77   3.745   8.217   3.364
  476    HB3  ALA  77           HB3      ALA  77   3.872   6.785   4.384
  477    H    MET  78           H        MET  78   6.219   8.915   1.491
  478    HA   MET  78           HA       MET  78   4.259   8.924  -0.489
  479    HB2  MET  78           HB1      MET  78   6.998  10.041  -0.203
  480    HB3  MET  78           HB2      MET  78   6.341   9.949  -1.844
  481    HG2  MET  78           HG1      MET  78   4.262  11.115  -0.853
  482    HG3  MET  78           HG2      MET  78   5.331  11.513   0.494
  483    HE1  MET  78           HE1      MET  78   6.377  12.243  -3.786
  484    HE2  MET  78           HE2      MET  78   5.080  11.228  -3.155
  485    HE3  MET  78           HE3      MET  78   4.769  12.923  -3.534
  486    H    CYS  79           H        CYS  79   7.059   6.917  -0.096
  487    HA   CYS  79           HA       CYS  79   6.695   5.799  -2.789
  488    HB2  CYS  79           HB1      CYS  79   8.981   6.610  -1.943
  489    HB3  CYS  79           HB2      CYS  79   8.971   5.174  -0.916
  490    H    CYS  80           H        CYS  80   6.511   3.549  -3.090
  491    HA   CYS  80           HA       CYS  80   4.774   2.205  -1.419
  492    HB2  CYS  80           HB1      CYS  80   6.576   1.428  -3.648
  493    HB3  CYS  80           HB2      CYS  80   5.987   0.118  -2.623
  494    HA   PRO  81           HA       PRO  81   7.049   0.513   1.928
  495    HB2  PRO  81           HB1      PRO  81   5.944  -1.979   2.197
  496    HB3  PRO  81           HB2      PRO  81   5.103  -0.490   2.622
  497    HG2  PRO  81           HG1      PRO  81   4.936  -2.118   0.108
  498    HG3  PRO  81           HG2      PRO  81   3.606  -1.395   1.089
  499    HD2  PRO  81           HD1      PRO  81   4.507  -0.272  -1.212
  500    HD3  PRO  81           HD2      PRO  81   3.919   0.689   0.155
  501    H    GLY  82           H        GLY  82   8.882  -0.639   2.379
  502    HA2  GLY  82           HA2      GLY  82  10.304  -2.566   2.060
  503    HA3  GLY  82           HA3      GLY  82   9.755  -2.636   0.392
  504    HA1  GLY  82           HA1      GLY  82  10.331  -1.698   2.210
  505    H    THR  83           H        THR  83  10.052   0.429   0.406
  506    HA   THR  83           HA       THR  83  12.969   0.442  -0.026
  507    HB   THR  83           HB       THR  83  12.490   2.295  -1.693
  508    HG1  THR  83           HG1      THR  83  10.164   2.330  -0.789
  509   HG21  THR  83          HG21      THR  83  11.230   0.318  -3.185
  510   HG22  THR  83          HG22      THR  83  12.144  -0.570  -1.966
  511   HG23  THR  83          HG23      THR  83  12.968   0.570  -3.029
  512    H    LEU  84           H        LEU  84  13.823   2.794  -0.064
  513    HA   LEU  84           HA       LEU  84  12.542   4.362   2.069
  514    HB2  LEU  84           HB1      LEU  84  15.350   3.366   1.872
  515    HB3  LEU  84           HB2      LEU  84  15.049   4.943   2.622
  516    HG   LEU  84           HG       LEU  84  13.311   2.889   3.707
  517   HD11  LEU  84          HD11      LEU  84  16.225   2.509   4.306
  518   HD12  LEU  84          HD12      LEU  84  15.410   1.585   3.044
  519   HD13  LEU  84          HD13      LEU  84  14.863   1.467   4.716
  520   HD21  LEU  84          HD21      LEU  84  15.199   4.983   4.696
  521   HD22  LEU  84          HD22      LEU  84  14.585   3.756   5.806
  522   HD23  LEU  84          HD23      LEU  84  13.462   4.821   4.959
  523    H    CYS  85           H        CYS  85  12.466   6.521   1.750
  524    HA   CYS  85           HA       CYS  85  13.101   7.534  -0.846
  525    HB2  CYS  85           HB1      CYS  85  11.142   8.220   0.640
  526    HB3  CYS  85           HB2      CYS  85  12.309   9.174   1.559
  527    H    VAL  86           H        VAL  86  15.214   7.736  -1.321
  528    HA   VAL  86           HA       VAL  86  16.827   9.447   0.449
  529    HB   VAL  86           HB       VAL  86  17.821   7.007  -1.030
  530   HG11  VAL  86          HG11      VAL  86  19.223   9.156   0.525
  531   HG12  VAL  86          HG12      VAL  86  19.918   7.543   0.348
  532   HG13  VAL  86          HG13      VAL  86  19.594   8.526  -1.079
  533   HG21  VAL  86          HG21      VAL  86  17.694   7.485   1.943
  534   HG22  VAL  86          HG22      VAL  86  16.480   6.578   1.041
  535   HG23  VAL  86          HG23      VAL  86  18.143   5.996   1.110
  536    H    ASN  87           H        ASN  87  18.154  10.925  -0.541
  537    HA   ASN  87           HA       ASN  87  18.856  12.368  -2.153
  538    HB2  ASN  87           HB1      ASN  87  19.651   9.885  -2.957
  539    HB3  ASN  87           HB2      ASN  87  18.707  10.411  -4.356
  540   HD21  ASN  87          HD21      ASN  87  21.676  10.574  -2.811
  541   HD22  ASN  87          HD22      ASN  87  22.387  11.836  -3.753
  542    H    ASP  88           H        ASP  88  16.011  12.058  -1.687
  543    HA   ASP  88           HA       ASP  88  14.046  12.858  -2.509
  544    HB2  ASP  88           HB1      ASP  88  15.526  13.898  -4.920
  545    HB3  ASP  88           HB2      ASP  88  14.099  14.572  -4.123
  546    HD2  ASP  88           HD       ASP  88  17.199  16.339  -3.133
  547    H    VAL  89           H        VAL  89  15.211  10.232  -3.365
  548    HA   VAL  89           HA       VAL  89  13.245   9.687  -5.444
  549    HB   VAL  89           HB       VAL  89  14.937   8.302  -6.710
  550   HG11  VAL  89          HG11      VAL  89  15.878  10.272  -7.912
  551   HG12  VAL  89          HG12      VAL  89  14.134  10.356  -7.648
  552   HG13  VAL  89          HG13      VAL  89  15.228  11.301  -6.635
  553   HG21  VAL  89          HG21      VAL  89  17.289   8.883  -6.473
  554   HG22  VAL  89          HG22      VAL  89  16.901   9.974  -5.145
  555   HG23  VAL  89          HG23      VAL  89  16.655   8.238  -4.960
  556    H    CYS  90           H        CYS  90  12.737   7.433  -5.662
  557    HA   CYS  90           HA       CYS  90  12.733   6.053  -3.181
  558    HB2  CYS  90           HB1      CYS  90  11.893   5.276  -5.975
  559    HB3  CYS  90           HB2      CYS  90  11.747   4.172  -4.606
  560    H    THR  91           H        THR  91  14.551   5.218  -2.375
  561    HA   THR  91           HA       THR  91  16.299   3.681  -4.184
  562    HB   THR  91           HB       THR  91  17.025   5.073  -1.599
  563    HG1  THR  91           HG1      THR  91  17.279   5.713  -4.318
  564   HG21  THR  91          HG21      THR  91  19.343   4.433  -2.175
  565   HG22  THR  91          HG22      THR  91  18.721   3.471  -3.517
  566   HG23  THR  91          HG23      THR  91  18.317   3.035  -1.857
  567    H    THR  92           H        THR  92  16.377   1.559  -3.875
  568    HA   THR  92           HA       THR  92  14.860   0.194  -1.981
  569    HB   THR  92           HB       THR  92  17.011  -1.505  -2.670
  570    HG1  THR  92           HG1      THR  92  17.760  -0.451  -4.371
  571   HG21  THR  92          HG21      THR  92  15.318  -2.582  -4.096
  572   HG22  THR  92          HG22      THR  92  14.276  -1.172  -3.910
  573   HG23  THR  92          HG23      THR  92  14.671  -2.168  -2.509
  574    H    MET  93           H        MET  93  15.425  -0.997  -0.122
  575    HA   MET  93           HA       MET  93  17.208   0.311   1.636
  576    HB2  MET  93           HB1      MET  93  15.171  -0.936   2.340
  577    HB3  MET  93           HB2      MET  93  16.000  -2.445   1.932
  578    HG2  MET  93           HG1      MET  93  17.793  -1.782   3.586
  579    HG3  MET  93           HG2      MET  93  16.705  -0.490   4.098
  580    HE1  MET  93           HE1      MET  93  15.320  -0.477   5.604
  581    HE2  MET  93           HE2      MET  93  13.950  -1.586   5.656
  582    HE3  MET  93           HE3      MET  93  15.234  -1.715   6.858
  583    H    GLU  94           H        GLU  94  17.455  -2.653  -0.265
  584    HA   GLU  94           HA       GLU  94  19.813  -3.676   0.816
  585    HB2  GLU  94           HB1      GLU  94  18.863  -3.822  -2.056
  586    HB3  GLU  94           HB2      GLU  94  20.074  -4.876  -1.311
  587    HG2  GLU  94           HG1      GLU  94  18.449  -5.851   0.150
  588    HG3  GLU  94           HG2      GLU  94  17.227  -4.679  -0.364
  589    HE2  GLU  94           HE       GLU  94  16.904  -6.350  -3.492
  590    H    ASP  95           H        ASP  95  19.285  -1.082  -1.458
  591    HA   ASP  95           HA       ASP  95  22.114  -0.866  -2.090
  592    HB2  ASP  95           HB1      ASP  95  19.592   0.324  -3.113
  593    HB3  ASP  95           HB2      ASP  95  21.043   1.329  -3.228
  594    HD2  ASP  95           HD       ASP  95  21.774  -2.041  -5.079
  595    H    ALA  96           H        ALA  96  19.686   0.733  -0.137
  596    HA   ALA  96           HA       ALA  96  21.132   3.076   0.466
  597    HB1  ALA  96           HB1      ALA  96  18.728   1.736   1.463
  598    HB2  ALA  96           HB2      ALA  96  19.577   2.702   2.671
  599    HB3  ALA  96           HB3      ALA  96  19.036   3.447   1.166
  600    H    THR  97           H        THR  97  23.126   3.022   1.291
  601    HA   THR  97           HA       THR  97  23.541   1.808   3.882
  602    HB   THR  97           HB       THR  97  25.366   0.989   1.620
  603    HG1  THR  97           HG1      THR  97  23.449  -0.107   1.310
  604   HG21  THR  97          HG21      THR  97  25.439  -0.726   3.893
  605   HG22  THR  97          HG22      THR  97  25.628   0.939   4.444
  606   HG23  THR  97          HG23      THR  97  26.727   0.280   3.233
  607    H    GLU  98           H        GLU  98  25.451   3.079   1.143
  608    HA   GLU  98           HA       GLU  98  26.837   4.846   3.040
  609    HB2  GLU  98           HB1      GLU  98  28.637   4.984   1.464
  610    HB3  GLU  98           HB2      GLU  98  28.215   3.276   1.668
  611    HG2  GLU  98           HG1      GLU  98  26.981   3.289  -0.421
  612    HG3  GLU  98           HG2      GLU  98  27.318   5.014  -0.621
  613    HE2  GLU  98           HE       GLU  98  30.823   4.080  -1.069
  614    H    ASN  99           H        ASN  99  27.595   6.962   1.963
  615    HA   ASN  99           HA       ASN  99  25.250   8.165   0.662
  616    HB2  ASN  99           HB1      ASN  99  25.982   9.067   2.888
  617    HB3  ASN  99           HB2      ASN  99  27.490   9.578   2.121
  618   HD21  ASN  99          HD21      ASN  99  25.323  11.128   3.385
  619   HD22  ASN  99          HD22      ASN  99  24.827  12.278   2.193
  620    H    LEU 100           H        LEU 100  25.395   8.742  -1.398
  621    HA   LEU 100           HA       LEU 100  26.225   9.299  -3.440
  622    HB2  LEU 100           HB1      LEU 100  27.501  10.936  -1.646
  623    HB3  LEU 100           HB2      LEU 100  28.855  10.184  -2.510
  624    HG   LEU 100           HG       LEU 100  27.034  11.026  -4.484
  625   HD11  LEU 100          HD11      LEU 100  26.088  12.438  -2.615
  626   HD12  LEU 100          HD12      LEU 100  26.626  13.310  -4.050
  627   HD13  LEU 100          HD13      LEU 100  27.631  13.292  -2.601
  628   HD21  LEU 100          HD21      LEU 100  28.916  12.721  -4.880
  629   HD22  LEU 100          HD22      LEU 100  29.320  11.005  -4.958
  630   HD23  LEU 100          HD23      LEU 100  29.722  11.942  -3.519
  631    H    TYR 101           H        TYR 101  27.989   8.807  -5.016
  632    HA   TYR 101           HA       TYR 101  29.123   6.178  -4.387
  633    HB2  TYR 101           HB1      TYR 101  27.614   6.505  -6.389
  634    HB3  TYR 101           HB2      TYR 101  28.897   7.487  -7.101
  635    HD1  TYR 101           HD1      TYR 101  29.994   6.363  -8.785
  636    HD2  TYR 101           HD2      TYR 101  28.869   4.210  -5.292
  637    HE1  TYR 101           HE1      TYR 101  31.076   4.347  -9.687
  638    HE2  TYR 101           HE2      TYR 101  29.949   2.189  -6.185
  639    HH   TYR 101           HH       TYR 101  32.051   1.916  -8.096
  640    H    PHE 102           H        PHE 102  31.279   5.654  -5.101
  641    HA   PHE 102           HA       PHE 102  33.105   7.884  -4.691
  642    HB2  PHE 102           HB1      PHE 102  33.164   4.999  -4.259
  643    HB3  PHE 102           HB2      PHE 102  34.631   5.584  -5.044
  644    HD1  PHE 102           HD1      PHE 102  36.230   6.909  -3.892
  645    HD2  PHE 102           HD2      PHE 102  32.538   5.896  -2.034
  646    HE1  PHE 102           HE1      PHE 102  37.107   7.691  -1.731
  647    HE2  PHE 102           HE2      PHE 102  33.408   6.677   0.131
  648    HZ   PHE 102           HZ       PHE 102  35.696   7.577   0.284
  649    H    GLN 103           H        GLN 103  34.762   8.449  -6.113
  650    HA   GLN 103           HA       GLN 103  34.224   7.748  -8.904
  651    HB2  GLN 103           HB1      GLN 103  35.545   9.722  -9.479
  652    HB3  GLN 103           HB2      GLN 103  34.254  10.133  -8.338
  653    HG2  GLN 103           HG1      GLN 103  36.799   9.435  -7.062
  654    HG3  GLN 103           HG2      GLN 103  36.860  10.873  -8.091
  655   HE21  GLN 103          HE21      GLN 103  36.035   9.663  -5.073
  656   HE22  GLN 103          HE22      GLN 103  35.193  11.042  -4.465
  657    H    SER 104           H        SER 104  36.544   8.194 -10.161
  658    HA   SER 104           HA       SER 104  37.986   5.815  -9.750
  659    HB2  SER 104           HB1      SER 104  39.671   7.575 -11.172
  660    HB3  SER 104           HB2      SER 104  38.580   6.351 -11.843
  661    HG   SER 104           HG       SER 104  37.625   8.021 -12.696
  662    H    LEU 105           H        LEU 105  40.285   5.611  -9.251
  663    HA   LEU 105           HA       LEU 105  40.939   7.068  -6.851
  664    HB2  LEU 105           HB1      LEU 105  42.574   4.990  -8.313
  665    HB3  LEU 105           HB2      LEU 105  42.792   5.541  -6.642
  666    HG   LEU 105           HG       LEU 105  40.156   4.370  -7.273
  667   HD11  LEU 105          HD11      LEU 105  42.054   3.017  -8.466
  668   HD12  LEU 105          HD12      LEU 105  40.799   2.187  -7.545
  669   HD13  LEU 105          HD13      LEU 105  42.389   2.450  -6.830
  670   HD21  LEU 105          HD21      LEU 105  41.103   3.137  -5.068
  671   HD22  LEU 105          HD22      LEU 105  40.261   4.687  -5.046
  672   HD23  LEU 105          HD23      LEU 105  42.024   4.640  -5.014
  673    H    GLU 106           H        GLU 106  42.884   8.236  -6.496
  674    HA   GLU 106           HA       GLU 106  44.415   9.843  -6.997
  675    HB2  GLU 106           HB1      GLU 106  45.128   7.586  -8.412
  676    HB3  GLU 106           HB2      GLU 106  45.109   8.844  -9.658
  677    HG2  GLU 106           HG1      GLU 106  47.200   9.274  -9.019
  678    HG3  GLU 106           HG2      GLU 106  46.453  10.082  -7.633
  679    HE2  GLU 106           HE       GLU 106  47.534   7.650  -5.437
  680    H    HIS 107           H        HIS 107  45.203  11.186  -9.175
  681    HA   HIS 107           HA       HIS 107  42.723  12.470 -10.053
  682    HB2  HIS 107           HB1      HIS 107  44.185  14.356 -10.718
  683    HB3  HIS 107           HB2      HIS 107  44.335  13.946  -9.006
  684    HD1  HIS 107           HD1      HIS 107  46.203  13.404 -12.260
  685    HD2  HIS 107           HD2      HIS 107  46.874  13.420  -8.160
  686    HE1  HIS 107           HE1      HIS 107  48.693  13.177 -11.985
  687    HE2  HIS 107           HE2      HIS 107  49.104  13.187  -9.479
  688    H    HIS 108           H        HIS 108  43.169  13.628 -12.334
  689    HA   HIS 108           HA       HIS 108  44.368  11.718 -14.197
  690    HB2  HIS 108           HB1      HIS 108  41.483  12.576 -14.151
  691    HB3  HIS 108           HB2      HIS 108  42.258  12.082 -15.660
  692    HD1  HIS 108           HD1      HIS 108  42.274   9.648 -16.159
  693    HD2  HIS 108           HD2      HIS 108  41.583  10.414 -12.134
  694    HE1  HIS 108           HE1      HIS 108  41.765   7.411 -15.126
  695    HE2  HIS 108           HE2      HIS 108  41.344   7.880 -12.665
  696    H    HIS 109           H        HIS 109  44.031  12.703 -16.548
  697    HA   HIS 109           HA       HIS 109  44.595  15.590 -16.395
  698    HB2  HIS 109           HB1      HIS 109  46.203  15.208 -18.316
  699    HB3  HIS 109           HB2      HIS 109  46.719  14.588 -16.745
  700    HD1  HIS 109           HD1      HIS 109  47.209  12.130 -16.554
  701    HD2  HIS 109           HD2      HIS 109  45.327  13.119 -20.124
  702    HE1  HIS 109           HE1      HIS 109  47.291  10.045 -17.957
  703    HE2  HIS 109           HE2      HIS 109  46.141  10.649 -20.141
  704    H    HIS 110           H        HIS 110  44.610  16.489 -18.785
  705    HA   HIS 110           HA       HIS 110  42.753  15.256 -20.586
  706    HB2  HIS 110           HB1      HIS 110  41.095  17.134 -20.500
  707    HB3  HIS 110           HB2      HIS 110  41.098  16.097 -19.069
  708    HD1  HIS 110           HD1      HIS 110  41.527  17.177 -16.843
  709    HD2  HIS 110           HD2      HIS 110  42.349  19.707 -20.034
  710    HE1  HIS 110           HE1      HIS 110  41.956  19.433 -15.818
  711    HE2  HIS 110           HE2      HIS 110  42.458  20.981 -17.769
  712    H    HIS 111           H        HIS 111  42.150  16.930 -22.376
  713    HA   HIS 111           HA       HIS 111  44.428  18.732 -22.840
  714    HB2  HIS 111           HB1      HIS 111  44.364  16.396 -24.088
  715    HB3  HIS 111           HB2      HIS 111  43.240  17.251 -25.148
  716    HD1  HIS 111           HD1      HIS 111  44.365  18.207 -27.116
  717    HD2  HIS 111           HD2      HIS 111  46.849  18.202 -23.787
  718    HE1  HIS 111           HE1      HIS 111  46.537  19.202 -27.898
  719    HE2  HIS 111           HE2      HIS 111  48.057  19.199 -25.863
  720    H    HIS 112           H        HIS 112  43.904  20.705 -23.573
  721    HA   HIS 112           HA       HIS 112  41.077  21.279 -24.014
  722    HB2  HIS 112           HB1      HIS 112  43.069  22.616 -22.642
  723    HB3  HIS 112           HB2      HIS 112  42.929  23.542 -24.140
  724    HD1  HIS 112           HD1      HIS 112  39.770  23.044 -24.404
  725    HD2  HIS 112           HD2      HIS 112  41.792  24.574 -21.112
  726    HE1  HIS 112           HE1      HIS 112  38.063  24.375 -23.125
  727    HE2  HIS 112           HE2      HIS 112  39.298  25.313 -21.113
  Start of MODEL    6
    1    H1   MET  18           H        MET  18 -30.439 -48.668  13.787
    2    HA   MET  18           HA       MET  18 -28.133 -48.593  12.488
    3    HB2  MET  18           HB1      MET  18 -28.610 -49.242  10.108
    4    HB3  MET  18           HB2      MET  18 -28.518 -50.594  11.246
    5    HG2  MET  18           HG1      MET  18 -31.221 -49.499  10.864
    6    HG3  MET  18           HG2      MET  18 -30.495 -50.227   9.429
    7    HE1  MET  18           HE1      MET  18 -32.347 -52.782   9.513
    8    HE2  MET  18           HE2      MET  18 -30.881 -52.142   8.770
    9    HE3  MET  18           HE3      MET  18 -30.836 -53.687   9.621
   10    H    LEU  19           H        LEU  19 -29.621 -46.682  13.512
   11    HA   LEU  19           HA       LEU  19 -30.639 -45.141  11.215
   12    HB2  LEU  19           HB1      LEU  19 -31.324 -44.645  14.108
   13    HB3  LEU  19           HB2      LEU  19 -32.120 -43.995  12.666
   14    HG   LEU  19           HG       LEU  19 -32.473 -46.697  12.355
   15   HD11  LEU  19          HD11      LEU  19 -32.697 -47.793  14.300
   16   HD12  LEU  19          HD12      LEU  19 -33.347 -46.386  15.140
   17   HD13  LEU  19          HD13      LEU  19 -31.605 -46.552  14.916
   18   HD21  LEU  19          HD21      LEU  19 -34.696 -46.192  12.488
   19   HD22  LEU  19          HD22      LEU  19 -34.031 -44.568  12.310
   20   HD23  LEU  19          HD23      LEU  19 -34.493 -45.163  13.906
   21    H    VAL  20           H        VAL  20 -29.020 -43.865  10.560
   22    HA   VAL  20           HA       VAL  20 -27.536 -42.348  12.607
   23    HB   VAL  20           HB       VAL  20 -25.706 -42.135  11.007
   24   HG11  VAL  20          HG11      VAL  20 -25.495 -43.976  12.475
   25   HG12  VAL  20          HG12      VAL  20 -26.668 -44.931  11.566
   26   HG13  VAL  20          HG13      VAL  20 -25.083 -44.583  10.872
   27   HG21  VAL  20          HG21      VAL  20 -27.586 -43.622   9.208
   28   HG22  VAL  20          HG22      VAL  20 -26.689 -42.137   8.892
   29   HG23  VAL  20          HG23      VAL  20 -25.842 -43.682   8.954
   30    H    LEU  21           H        LEU  21 -27.496 -40.167  12.499
   31    HA   LEU  21           HA       LEU  21 -29.280 -38.902  10.581
   32    HB2  LEU  21           HB1      LEU  21 -28.111 -38.206  13.212
   33    HB3  LEU  21           HB2      LEU  21 -28.402 -36.860  12.095
   34    HG   LEU  21           HG       LEU  21 -30.602 -38.798  12.688
   35   HD11  LEU  21          HD11      LEU  21 -31.014 -38.038  14.752
   36   HD12  LEU  21          HD12      LEU  21 -30.558 -36.385  14.343
   37   HD13  LEU  21          HD13      LEU  21 -29.313 -37.567  14.748
   38   HD21  LEU  21          HD21      LEU  21 -30.972 -35.875  12.402
   39   HD22  LEU  21          HD22      LEU  21 -31.963 -37.210  11.812
   40   HD23  LEU  21          HD23      LEU  21 -30.480 -36.768  10.964
   41    H    ASP  22           H        ASP  22 -28.683 -37.150   9.257
   42    HA   ASP  22           HA       ASP  22 -25.817 -36.645   8.934
   43    HB2  ASP  22           HB1      ASP  22 -26.765 -38.463   7.327
   44    HB3  ASP  22           HB2      ASP  22 -27.515 -37.093   6.499
   45    HD2  ASP  22           HD       ASP  22 -23.648 -37.661   6.084
   46    H    PHE  23           H        PHE  23 -28.106 -35.127  10.005
   47    HA   PHE  23           HA       PHE  23 -28.576 -33.043   8.040
   48    HB2  PHE  23           HB1      PHE  23 -30.234 -33.976   9.846
   49    HB3  PHE  23           HB2      PHE  23 -29.404 -32.842  10.914
   50    HD1  PHE  23           HD1      PHE  23 -29.136 -30.399   9.939
   51    HD2  PHE  23           HD2      PHE  23 -32.093 -33.206   8.718
   52    HE1  PHE  23           HE1      PHE  23 -30.544 -28.555   9.117
   53    HE2  PHE  23           HE2      PHE  23 -33.505 -31.368   7.894
   54    HZ   PHE  23           HZ       PHE  23 -32.730 -29.038   8.093
   55    H    ASN  24           H        ASN  24 -27.408 -31.250   7.847
   56    HA   ASN  24           HA       ASN  24 -26.276 -29.809   9.975
   57    HB2  ASN  24           HB1      ASN  24 -24.779 -31.979   9.675
   58    HB3  ASN  24           HB2      ASN  24 -24.071 -31.023   8.367
   59   HD21  ASN  24          HD21      ASN  24 -22.169 -31.309   9.814
   60   HD22  ASN  24          HD22      ASN  24 -21.908 -30.112  11.032
   61    H    ASN  25           H        ASN  25 -26.418 -27.810   9.223
   62    HA   ASN  25           HA       ASN  25 -25.073 -26.920   6.905
   63    HB2  ASN  25           HB1      ASN  25 -27.659 -28.009   6.435
   64    HB3  ASN  25           HB2      ASN  25 -27.778 -26.256   6.242
   65   HD21  ASN  25          HD21      ASN  25 -27.920 -28.409   4.256
   66   HD22  ASN  25          HD22      ASN  25 -26.709 -28.042   3.079
   67    H    ILE  26           H        ILE  26 -25.190 -24.637   6.629
   68    HA   ILE  26           HA       ILE  26 -26.752 -23.132   8.581
   69    HB   ILE  26           HB       ILE  26 -24.706 -21.781   9.181
   70   HG12  ILE  26          HG11      ILE  26 -22.874 -23.994   8.777
   71   HG13  ILE  26          HG12      ILE  26 -23.513 -23.399   7.235
   72   HG21  ILE  26          HG21      ILE  26 -23.880 -23.512  10.821
   73   HG22  ILE  26          HG22      ILE  26 -25.617 -23.214  10.827
   74   HG23  ILE  26          HG23      ILE  26 -24.972 -24.652  10.035
   75   HD11  ILE  26          HD11      ILE  26 -22.665 -21.272   9.043
   76   HD12  ILE  26          HD12      ILE  26 -21.367 -22.356   8.539
   77   HD13  ILE  26          HD13      ILE  26 -22.332 -21.512   7.327
   78    H    ARG  27           H        ARG  27 -27.662 -21.464   7.591
   79    HA   ARG  27           HA       ARG  27 -26.306 -19.634   5.948
   80    HB2  ARG  27           HB1      ARG  27 -27.581 -20.138   3.809
   81    HB3  ARG  27           HB2      ARG  27 -26.256 -21.240   4.213
   82    HG2  ARG  27           HG1      ARG  27 -28.736 -22.180   5.350
   83    HG3  ARG  27           HG2      ARG  27 -28.887 -21.920   3.604
   84    HD2  ARG  27           HD1      ARG  27 -26.549 -23.168   3.564
   85    HD3  ARG  27           HD2      ARG  27 -27.148 -23.815   5.098
   86    HE   ARG  27           HE       ARG  27 -28.626 -25.109   3.932
   87   HH11  ARG  27          HH11      ARG  27 -27.471 -22.565   1.855
   88   HH12  ARG  27          HH12      ARG  27 -28.239 -23.197   0.436
   89   HH21  ARG  27          HH21      ARG  27 -29.643 -25.950   2.071
   90   HH22  ARG  27          HH22      ARG  27 -29.475 -25.121   0.560
   91    H    SER  28           H        SER  28 -27.330 -17.838   6.502
   92    HA   SER  28           HA       SER  28 -30.275 -17.868   6.594
   93    HB2  SER  28           HB1      SER  28 -29.625 -15.840   8.316
   94    HB3  SER  28           HB2      SER  28 -30.017 -17.496   8.813
   95    HG   SER  28           HG       SER  28 -27.650 -16.171   8.958
   96    H    SER  29           H        SER  29 -27.528 -15.590   6.547
   97    HA   SER  29           HA       SER  29 -28.272 -14.399   4.099
   98    HB2  SER  29           HB1      SER  29 -29.549 -12.609   4.649
   99    HB3  SER  29           HB2      SER  29 -29.940 -13.566   6.089
  100    HG   SER  29           HG       SER  29 -28.816 -11.219   6.054
  101    H    ALA  30           H        ALA  30 -27.127 -12.125   3.929
  102    HA   ALA  30           HA       ALA  30 -24.921 -11.558   5.580
  103    HB1  ALA  30           HB1      ALA  30 -23.197 -12.238   3.729
  104    HB2  ALA  30           HB2      ALA  30 -23.735 -13.413   4.931
  105    HB3  ALA  30           HB3      ALA  30 -24.431 -13.427   3.310
  106    H    ASP  31           H        ASP  31 -25.041 -11.680   2.029
  107    HA   ASP  31           HA       ASP  31 -24.933 -10.045   0.449
  108    HB2  ASP  31           HB1      ASP  31 -26.446  -8.402   2.498
  109    HB3  ASP  31           HB2      ASP  31 -26.377  -8.112   0.754
  110    HD2  ASP  31           HD       ASP  31 -28.614 -10.719   0.098
  111    H    LEU  32           H        LEU  32 -24.574  -7.381   0.414
  112    HA   LEU  32           HA       LEU  32 -22.603  -6.507   2.305
  113    HB2  LEU  32           HB1      LEU  32 -21.694  -8.054   0.161
  114    HB3  LEU  32           HB2      LEU  32 -21.348  -6.376  -0.294
  115    HG   LEU  32           HG       LEU  32 -20.448  -6.573   2.329
  116   HD11  LEU  32          HD11      LEU  32 -18.946  -8.509   2.288
  117   HD12  LEU  32          HD12      LEU  32 -19.682  -9.041   0.776
  118   HD13  LEU  32          HD13      LEU  32 -20.642  -8.991   2.255
  119   HD21  LEU  32          HD21      LEU  32 -18.180  -6.812   0.932
  120   HD22  LEU  32          HD22      LEU  32 -19.102  -5.311   1.014
  121   HD23  LEU  32          HD23      LEU  32 -19.275  -6.378  -0.380
  122    H    HIS  33           H        HIS  33 -22.502  -4.332   2.362
  123    HA   HIS  33           HA       HIS  33 -22.865  -2.626   0.146
  124    HB2  HIS  33           HB1      HIS  33 -25.277  -3.633   1.234
  125    HB3  HIS  33           HB2      HIS  33 -25.151  -1.948   1.751
  126    HD1  HIS  33           HD1      HIS  33 -26.702  -3.696  -0.791
  127    HD2  HIS  33           HD2      HIS  33 -24.199  -0.382  -0.802
  128    HE1  HIS  33           HE1      HIS  33 -27.147  -2.526  -2.971
  129    HE2  HIS  33           HE2      HIS  33 -25.616  -0.500  -2.979
  130    H    GLY  34           H        GLY  34 -21.418  -1.153   0.761
  131    HA2  GLY  34           HA2      GLY  34 -21.492   0.929   2.257
  132    HA3  GLY  34           HA3      GLY  34 -21.443  -0.244   3.564
  133    HA1  GLY  34           HA1      GLY  34 -21.074   0.501   1.608
  134    H    ALA  35           H        ALA  35 -19.580   1.916   2.208
  135    HA   ALA  35           HA       ALA  35 -17.148   0.569   2.947
  136    HB1  ALA  35           HB1      ALA  35 -16.881  -0.283   0.860
  137    HB2  ALA  35           HB2      ALA  35 -17.856   0.975   0.099
  138    HB3  ALA  35           HB3      ALA  35 -16.194   1.316   0.578
  139    H    ARG  36           H        ARG  36 -18.349   3.355   1.068
  140    HA   ARG  36           HA       ARG  36 -17.034   5.156   2.940
  141    HB2  ARG  36           HB1      ARG  36 -15.965   6.446   1.123
  142    HB3  ARG  36           HB2      ARG  36 -15.307   4.810   1.278
  143    HG2  ARG  36           HG1      ARG  36 -15.858   4.277  -0.809
  144    HG3  ARG  36           HG2      ARG  36 -17.505   4.895  -0.598
  145    HD2  ARG  36           HD1      ARG  36 -16.259   7.239  -0.742
  146    HD3  ARG  36           HD2      ARG  36 -15.078   6.267  -1.630
  147    HE   ARG  36           HE       ARG  36 -16.563   6.093  -3.371
  148   HH11  ARG  36          HH11      ARG  36 -18.211   7.306  -0.554
  149   HH12  ARG  36          HH12      ARG  36 -19.665   7.694  -1.413
  150   HH21  ARG  36          HH21      ARG  36 -18.472   6.600  -4.512
  151   HH22  ARG  36          HH22      ARG  36 -19.814   7.292  -3.663
  152    H    LYS  37           H        LYS  37 -17.885   7.257   2.948
  153    HA   LYS  37           HA       LYS  37 -20.101   7.840   1.137
  154    HB2  LYS  37           HB1      LYS  37 -20.316   7.430   4.093
  155    HB3  LYS  37           HB2      LYS  37 -21.331   8.661   3.323
  156    HG2  LYS  37           HG1      LYS  37 -22.710   7.147   2.432
  157    HG3  LYS  37           HG2      LYS  37 -21.369   6.105   1.923
  158    HD2  LYS  37           HD1      LYS  37 -21.150   5.287   4.252
  159    HD3  LYS  37           HD2      LYS  37 -22.558   6.270   4.693
  160    HE2  LYS  37           HE1      LYS  37 -23.259   3.978   4.321
  161    HE3  LYS  37           HE2      LYS  37 -23.915   5.025   3.054
  162    HZ1  LYS  37           HZ1      LYS  37 -21.437   4.093   2.175
  163    HZ2  LYS  37           HZ2      LYS  37 -22.967   3.725   1.555
  164    HZ3  LYS  37           HZ3      LYS  37 -22.290   2.757   2.767
  165    H    GLY  38           H        GLY  38 -18.051   9.194   0.607
  166    HA2  GLY  38           HA2      GLY  38 -18.551  11.847   1.678
  167    HA3  GLY  38           HA3      GLY  38 -16.945  11.205   1.986
  168    HA1  GLY  38           HA1      GLY  38 -18.793  11.406   0.955
  169    H    SER  39           H        SER  39 -15.946  12.808   0.749
  170    HA   SER  39           HA       SER  39 -16.637  13.516  -1.867
  171    HB2  SER  39           HB1      SER  39 -13.975  13.594  -0.423
  172    HB3  SER  39           HB2      SER  39 -14.239  14.299  -2.027
  173    HG   SER  39           HG       SER  39 -14.843  15.326   0.379
  174    H    GLN  40           H        GLN  40 -13.787  11.570  -0.967
  175    HA   GLN  40           HA       GLN  40 -14.368   9.736  -3.165
  176    HB2  GLN  40           HB1      GLN  40 -12.700  11.750  -3.698
  177    HB3  GLN  40           HB2      GLN  40 -11.546  10.647  -2.929
  178    HG2  GLN  40           HG1      GLN  40 -11.421  10.243  -5.254
  179    HG3  GLN  40           HG2      GLN  40 -12.296   8.882  -4.537
  180   HE21  GLN  40          HE21      GLN  40 -13.194  12.140  -5.628
  181   HE22  GLN  40          HE22      GLN  40 -14.502  11.629  -6.632
  182    H    CYS  41           H        CYS  41 -11.895  10.482  -0.703
  183    HA   CYS  41           HA       CYS  41 -12.247   7.823   0.431
  184    HB2  CYS  41           HB1      CYS  41  -9.865   7.297   0.377
  185    HB3  CYS  41           HB2      CYS  41 -10.491   7.513  -1.260
  186    H    LEU  42           H        LEU  42 -11.814   7.722   2.594
  187    HA   LEU  42           HA       LEU  42 -11.649  10.191   4.010
  188    HB2  LEU  42           HB1      LEU  42 -12.278   7.447   4.580
  189    HB3  LEU  42           HB2      LEU  42 -11.130   8.065   5.780
  190    HG   LEU  42           HG       LEU  42 -12.702   9.947   6.227
  191   HD11  LEU  42          HD11      LEU  42 -14.592   8.343   4.512
  192   HD12  LEU  42          HD12      LEU  42 -13.878   9.895   4.075
  193   HD13  LEU  42          HD13      LEU  42 -14.988   9.790   5.440
  194   HD21  LEU  42          HD21      LEU  42 -12.726   7.367   7.171
  195   HD22  LEU  42          HD22      LEU  42 -14.415   7.648   6.750
  196   HD23  LEU  42          HD23      LEU  42 -13.595   8.732   7.875
  197    H    SER  43           H        SER  43  -9.389   7.616   3.247
  198    HA   SER  43           HA       SER  43  -7.139   9.296   3.683
  199    HB2  SER  43           HB1      SER  43  -6.229   8.512   5.657
  200    HB3  SER  43           HB2      SER  43  -7.958   8.446   6.045
  201    HG   SER  43           HG       SER  43  -6.487   6.489   6.391
  202    H    ASP  44           H        ASP  44  -5.114   7.538   3.979
  203    HA   ASP  44           HA       ASP  44  -4.930   6.333   1.443
  204    HB2  ASP  44           HB1      ASP  44  -2.799   5.456   2.175
  205    HB3  ASP  44           HB2      ASP  44  -2.984   7.105   2.788
  206    HD2  ASP  44           HD       ASP  44  -2.178   4.425   5.376
  207    H    THR  45           H        THR  45  -6.084   5.166   4.494
  208    HA   THR  45           HA       THR  45  -5.802   2.410   4.162
  209    HB   THR  45           HB       THR  45  -7.671   2.165   5.738
  210    HG1  THR  45           HG1      THR  45  -8.459   4.393   6.492
  211   HG21  THR  45          HG21      THR  45  -5.791   2.543   6.983
  212   HG22  THR  45          HG22      THR  45  -6.728   3.962   7.452
  213   HG23  THR  45          HG23      THR  45  -5.470   4.103   6.225
  214    H    ASP  46           H        ASP  46  -8.014   4.652   2.700
  215    HA   ASP  46           HA       ASP  46  -9.932   2.720   1.841
  216    HB2  ASP  46           HB1      ASP  46  -9.634   5.562   1.757
  217    HB3  ASP  46           HB2      ASP  46  -9.958   4.986   0.117
  218    HD2  ASP  46           HD       ASP  46 -13.080   3.620   1.251
  219    H    CYS  47           H        CYS  47  -6.909   3.895   0.611
  220    HA   CYS  47           HA       CYS  47  -7.354   2.537  -1.952
  221    HB2  CYS  47           HB1      CYS  47  -6.286   4.993  -1.448
  222    HB3  CYS  47           HB2      CYS  47  -4.828   4.003  -1.527
  223    H    ASN  48           H        ASN  48  -6.963   1.010   0.434
  224    HA   ASN  48           HA       ASN  48  -5.767  -0.754   1.232
  225    HB2  ASN  48           HB1      ASN  48  -4.338  -0.812  -1.425
  226    HB3  ASN  48           HB2      ASN  48  -4.731  -2.168  -0.361
  227   HD21  ASN  48          HD21      ASN  48  -7.192  -2.296   0.104
  228   HD22  ASN  48          HD22      ASN  48  -8.200  -2.211  -1.297
  229    H    THR  49           H        THR  49  -3.248  -1.665   1.024
  230    HA   THR  49           HA       THR  49  -1.710   0.527   2.181
  231    HB   THR  49           HB       THR  49  -1.850  -1.601   3.423
  232    HG1  THR  49           HG1      THR  49   0.811  -1.232   2.497
  233   HG21  THR  49          HG21      THR  49  -0.514  -3.536   2.563
  234   HG22  THR  49          HG22      THR  49  -0.406  -2.703   1.013
  235   HG23  THR  49          HG23      THR  49  -1.977  -3.201   1.639
  236    H    ARG  50           H        ARG  50  -1.813  -1.458  -0.654
  237    HA   ARG  50           HA       ARG  50   0.863  -1.148  -1.505
  238    HB2  ARG  50           HB1      ARG  50  -1.620  -1.550  -3.193
  239    HB3  ARG  50           HB2      ARG  50   0.049  -1.843  -3.701
  240    HG2  ARG  50           HG1      ARG  50   0.222  -3.565  -1.885
  241    HG3  ARG  50           HG2      ARG  50  -1.520  -3.361  -1.635
  242    HD2  ARG  50           HD1      ARG  50  -0.153  -4.265  -4.180
  243    HD3  ARG  50           HD2      ARG  50  -1.120  -5.258  -3.080
  244    HE   ARG  50           HE       ARG  50  -2.806  -3.248  -3.835
  245   HH11  ARG  50          HH11      ARG  50  -0.903  -5.631  -5.513
  246   HH12  ARG  50          HH12      ARG  50  -1.991  -5.746  -6.856
  247   HH21  ARG  50          HH21      ARG  50  -4.248  -3.390  -5.598
  248   HH22  ARG  50          HH22      ARG  50  -3.893  -4.470  -6.903
  249    H    LYS  51           H        LYS  51  -2.081   0.714  -2.148
  250    HA   LYS  51           HA       LYS  51  -0.398   2.820  -3.341
  251    HB2  LYS  51           HB1      LYS  51  -3.331   2.248  -3.834
  252    HB3  LYS  51           HB2      LYS  51  -2.389   3.548  -4.582
  253    HG2  LYS  51           HG1      LYS  51  -0.970   1.915  -5.702
  254    HG3  LYS  51           HG2      LYS  51  -1.877   0.600  -4.933
  255    HD2  LYS  51           HD1      LYS  51  -3.952   1.757  -6.035
  256    HD3  LYS  51           HD2      LYS  51  -2.732   2.477  -7.098
  257    HE2  LYS  51           HE1      LYS  51  -2.838   0.617  -8.331
  258    HE3  LYS  51           HE2      LYS  51  -2.036  -0.207  -6.985
  259    HZ1  LYS  51           HZ1      LYS  51  -4.635  -0.596  -7.958
  260    HZ2  LYS  51           HZ2      LYS  51  -4.752  -0.025  -6.370
  261    HZ3  LYS  51           HZ3      LYS  51  -3.850  -1.417  -6.704
  262    H    PHE  52           H        PHE  52  -1.422   5.049  -3.114
  263    HA   PHE  52           HA       PHE  52  -2.717   5.339  -0.489
  264    HB2  PHE  52           HB1      PHE  52  -1.317   7.417  -0.166
  265    HB3  PHE  52           HB2      PHE  52  -0.436   5.891  -0.074
  266    HD1  PHE  52           HD1      PHE  52  -1.310   8.564  -2.512
  267    HD2  PHE  52           HD2      PHE  52   1.489   5.593  -1.309
  268    HE1  PHE  52           HE1      PHE  52   0.254   9.341  -4.245
  269    HE2  PHE  52           HE2      PHE  52   3.057   6.365  -3.040
  270    HZ   PHE  52           HZ       PHE  52   2.442   8.242  -4.510
  271    H    CYS  53           H        CYS  53  -3.613   7.605  -0.199
  272    HA   CYS  53           HA       CYS  53  -5.043   8.323  -2.647
  273    HB2  CYS  53           HB1      CYS  53  -5.650   8.330   0.207
  274    HB3  CYS  53           HB2      CYS  53  -6.085   9.853  -0.573
  275    H    LEU  54           H        LEU  54  -3.952   9.767  -3.834
  276    HA   LEU  54           HA       LEU  54  -2.399  11.867  -2.568
  277    HB2  LEU  54           HB1      LEU  54  -1.477  10.720  -4.507
  278    HB3  LEU  54           HB2      LEU  54  -2.880  11.212  -5.471
  279    HG   LEU  54           HG       LEU  54  -1.829  13.607  -4.537
  280   HD11  LEU  54          HD11      LEU  54   0.205  12.630  -3.791
  281   HD12  LEU  54          HD12      LEU  54   0.547  13.441  -5.321
  282   HD13  LEU  54          HD13      LEU  54   0.369  11.686  -5.273
  283   HD21  LEU  54          HD21      LEU  54  -1.168  13.918  -6.889
  284   HD22  LEU  54          HD22      LEU  54  -2.790  13.242  -6.729
  285   HD23  LEU  54          HD23      LEU  54  -1.438  12.199  -7.175
  286    H    GLN  55           H        GLN  55  -3.004  13.934  -2.339
  287    HA   GLN  55           HA       GLN  55  -5.487  14.800  -3.666
  288    HB2  GLN  55           HB1      GLN  55  -5.820  16.266  -1.609
  289    HB3  GLN  55           HB2      GLN  55  -6.093  14.529  -1.403
  290    HG2  GLN  55           HG1      GLN  55  -3.349  15.432  -0.836
  291    HG3  GLN  55           HG2      GLN  55  -4.598  16.049   0.254
  292   HE21  GLN  55          HE21      GLN  55  -6.174  14.321   1.016
  293   HE22  GLN  55          HE22      GLN  55  -5.476  12.820   1.509
  294    HA   PRO  56           HA       PRO  56  -2.198  17.694  -5.002
  295    HB2  PRO  56           HB1      PRO  56  -3.313  18.163  -7.458
  296    HB3  PRO  56           HB2      PRO  56  -2.279  16.780  -7.108
  297    HG2  PRO  56           HG1      PRO  56  -5.273  16.948  -7.167
  298    HG3  PRO  56           HG2      PRO  56  -4.188  15.692  -7.870
  299    HD2  PRO  56           HD1      PRO  56  -5.525  15.332  -5.535
  300    HD3  PRO  56           HD2      PRO  56  -3.920  14.643  -5.836
  301    H    ARG  57           H        ARG  57  -2.244  19.942  -5.248
  302    HA   ARG  57           HA       ARG  57  -4.598  21.220  -4.162
  303    HB2  ARG  57           HB1      ARG  57  -1.887  21.705  -3.987
  304    HB3  ARG  57           HB2      ARG  57  -2.449  22.978  -5.080
  305    HG2  ARG  57           HG1      ARG  57  -4.280  23.393  -3.299
  306    HG3  ARG  57           HG2      ARG  57  -3.199  22.482  -2.231
  307    HD2  ARG  57           HD1      ARG  57  -1.731  24.176  -2.063
  308    HD3  ARG  57           HD2      ARG  57  -1.826  24.531  -3.794
  309    HE   ARG  57           HE       ARG  57  -3.327  25.789  -1.681
  310   HH11  ARG  57          HH11      ARG  57  -3.182  25.091  -5.089
  311   HH12  ARG  57          HH12      ARG  57  -4.198  26.421  -5.537
  312   HH21  ARG  57          HH21      ARG  57  -4.665  27.543  -2.259
  313   HH22  ARG  57          HH22      ARG  57  -5.040  27.815  -3.926
  314    H    ASP  58           H        ASP  58  -2.760  21.286  -7.187
  315    HA   ASP  58           HA       ASP  58  -4.485  23.222  -8.415
  316    HB2  ASP  58           HB1      ASP  58  -2.013  21.834  -9.072
  317    HB3  ASP  58           HB2      ASP  58  -3.114  21.904 -10.454
  318    HD2  ASP  58           HD       ASP  58  -2.451  25.219 -10.966
  319    H    GLU  59           H        GLU  59  -4.468  19.795  -8.058
  320    HA   GLU  59           HA       GLU  59  -6.717  19.595  -9.954
  321    HB2  GLU  59           HB1      GLU  59  -4.523  17.636  -9.301
  322    HB3  GLU  59           HB2      GLU  59  -6.043  17.117 -10.041
  323    HG2  GLU  59           HG1      GLU  59  -5.286  17.656 -12.045
  324    HG3  GLU  59           HG2      GLU  59  -5.070  19.331 -11.518
  325    HE2  GLU  59           HE       GLU  59  -1.861  16.994 -11.238
  326    H    LYS  60           H        LYS  60  -7.909  17.349  -9.378
  327    HA   LYS  60           HA       LYS  60  -8.886  17.752  -6.662
  328    HB2  LYS  60           HB1      LYS  60  -9.933  16.469  -9.142
  329    HB3  LYS  60           HB2      LYS  60 -10.527  15.867  -7.585
  330    HG2  LYS  60           HG1      LYS  60 -10.843  18.491  -7.163
  331    HG3  LYS  60           HG2      LYS  60 -11.010  18.452  -8.926
  332    HD2  LYS  60           HD1      LYS  60 -12.691  16.582  -8.615
  333    HD3  LYS  60           HD2      LYS  60 -12.645  16.958  -6.884
  334    HE2  LYS  60           HE1      LYS  60 -13.371  19.248  -7.329
  335    HE3  LYS  60           HE2      LYS  60 -13.358  18.916  -9.067
  336    HZ1  LYS  60           HZ1      LYS  60 -15.219  17.913  -7.014
  337    HZ2  LYS  60           HZ2      LYS  60 -15.000  17.051  -8.452
  338    HZ3  LYS  60           HZ3      LYS  60 -15.564  18.645  -8.500
  339    HA   PRO  61           HA       PRO  61  -7.092  14.172  -4.870
  340    HB2  PRO  61           HB1      PRO  61  -9.116  13.220  -3.289
  341    HB3  PRO  61           HB2      PRO  61  -8.212  14.692  -2.933
  342    HG2  PRO  61           HG1      PRO  61 -10.875  14.372  -4.279
  343    HG3  PRO  61           HG2      PRO  61 -10.379  15.533  -2.991
  344    HD2  PRO  61           HD1      PRO  61 -10.573  16.240  -5.605
  345    HD3  PRO  61           HD2      PRO  61  -9.368  16.939  -4.511
  346    H    PHE  62           H        PHE  62  -6.890  11.960  -5.096
  347    HA   PHE  62           HA       PHE  62  -8.974  10.285  -6.072
  348    HB2  PHE  62           HB1      PHE  62  -7.792   9.707  -8.241
  349    HB3  PHE  62           HB2      PHE  62  -8.610  11.271  -8.201
  350    HD1  PHE  62           HD1      PHE  62  -5.241   9.834  -7.487
  351    HD2  PHE  62           HD2      PHE  62  -7.498  13.111  -8.998
  352    HE1  PHE  62           HE1      PHE  62  -3.157  10.966  -8.140
  353    HE2  PHE  62           HE2      PHE  62  -5.417  14.247  -9.653
  354    HZ   PHE  62           HZ       PHE  62  -3.242  13.175  -9.225
  355    H    CYS  63           H        CYS  63  -7.845   8.132  -6.962
  356    HA   CYS  63           HA       CYS  63  -5.961   7.377  -4.858
  357    HB2  CYS  63           HB1      CYS  63  -8.111   6.055  -6.298
  358    HB3  CYS  63           HB2      CYS  63  -6.632   5.092  -6.321
  359    H    ALA  64           H        ALA  64  -3.874   7.468  -5.327
  360    HA   ALA  64           HA       ALA  64  -3.013   6.755  -8.056
  361    HB1  ALA  64           HB1      ALA  64  -0.935   8.220  -7.141
  362    HB2  ALA  64           HB2      ALA  64  -2.275   8.881  -8.079
  363    HB3  ALA  64           HB3      ALA  64  -2.280   9.013  -6.321
  364    H    THR  65           H        THR  65  -0.926   5.725  -8.238
  365    HA   THR  65           HA       THR  65  -0.426   3.929  -5.987
  366    HB   THR  65           HB       THR  65  -0.765   2.944  -8.235
  367    HG1  THR  65           HG1      THR  65   0.890   1.486  -7.984
  368   HG21  THR  65          HG21      THR  65   0.319   3.647 -10.060
  369   HG22  THR  65          HG22      THR  65   1.882   3.560  -9.249
  370   HG23  THR  65          HG23      THR  65   0.886   5.006  -9.090
  371    H    CYS  66           H        CYS  66   1.957   3.258  -5.748
  372    HA   CYS  66           HA       CYS  66   3.419   5.414  -4.768
  373    HB2  CYS  66           HB1      CYS  66   5.250   3.886  -4.469
  374    HB3  CYS  66           HB2      CYS  66   3.749   3.028  -4.121
  375    H    ARG  67           H        ARG  67   5.766   5.854  -5.498
  376    HA   ARG  67           HA       ARG  67   5.669   6.508  -8.360
  377    HB2  ARG  67           HB1      ARG  67   7.246   7.714  -6.078
  378    HB3  ARG  67           HB2      ARG  67   7.466   8.164  -7.775
  379    HG2  ARG  67           HG1      ARG  67   4.759   8.448  -7.458
  380    HG3  ARG  67           HG2      ARG  67   5.394   8.956  -5.884
  381    HD2  ARG  67           HD1      ARG  67   7.038  10.419  -7.173
  382    HD3  ARG  67           HD2      ARG  67   6.045  10.077  -8.598
  383    HE   ARG  67           HE       ARG  67   4.358  10.990  -6.564
  384   HH11  ARG  67          HH11      ARG  67   6.932  12.160  -8.595
  385   HH12  ARG  67          HH12      ARG  67   6.367  13.799  -8.587
  386   HH21  ARG  67          HH21      ARG  67   3.605  13.143  -6.547
  387   HH22  ARG  67          HH22      ARG  67   4.476  14.356  -7.421
  388    H    GLY  68           H        GLY  68   7.860   6.587  -9.450
  389    HA2  GLY  68           HA2      GLY  68   9.058   4.002  -9.253
  390    HA3  GLY  68           HA3      GLY  68   9.566   5.305 -10.318
  391    HA1  GLY  68           HA1      GLY  68   8.970   4.418  -8.481
  392    H    LEU  69           H        LEU  69  11.699   4.307  -9.677
  393    HA   LEU  69           HA       LEU  69  12.667   4.839  -7.027
  394    HB2  LEU  69           HB1      LEU  69  14.053   4.009  -9.579
  395    HB3  LEU  69           HB2      LEU  69  14.877   4.201  -8.022
  396    HG   LEU  69           HG       LEU  69  12.739   2.183  -8.693
  397   HD11  LEU  69          HD11      LEU  69  14.741   0.679  -7.961
  398   HD12  LEU  69          HD12      LEU  69  15.705   2.088  -8.403
  399   HD13  LEU  69          HD13      LEU  69  14.665   1.321  -9.602
  400   HD21  LEU  69          HD21      LEU  69  13.538   1.339  -6.348
  401   HD22  LEU  69          HD22      LEU  69  12.291   2.579  -6.475
  402   HD23  LEU  69          HD23      LEU  69  13.954   3.035  -6.107
  403    H    ARG  70           H        ARG  70  13.537   6.126 -10.241
  404    HA   ARG  70           HA       ARG  70  15.239   8.143  -9.392
  405    HB2  ARG  70           HB1      ARG  70  13.421   7.949 -11.795
  406    HB3  ARG  70           HB2      ARG  70  14.545   9.296 -11.558
  407    HG2  ARG  70           HG1      ARG  70  15.477   6.436 -11.543
  408    HG3  ARG  70           HG2      ARG  70  15.315   7.375 -13.037
  409    HD2  ARG  70           HD1      ARG  70  16.797   8.661 -10.806
  410    HD3  ARG  70           HD2      ARG  70  17.576   7.289 -11.605
  411    HE   ARG  70           HE       ARG  70  16.620   9.065 -13.563
  412   HH11  ARG  70          HH11      ARG  70  19.072   8.843 -11.100
  413   HH12  ARG  70          HH12      ARG  70  20.174   9.900 -11.919
  414   HH21  ARG  70          HH21      ARG  70  18.063  10.457 -14.650
  415   HH22  ARG  70          HH22      ARG  70  19.599  10.819 -13.936
  416    H    ARG  71           H        ARG  71  11.772   7.983  -9.325
  417    HA   ARG  71           HA       ARG  71  11.135  10.699  -9.168
  418    HB2  ARG  71           HB1      ARG  71   9.814   8.177  -8.720
  419    HB3  ARG  71           HB2      ARG  71   9.360   9.334  -7.459
  420    HG2  ARG  71           HG1      ARG  71   7.803   9.377  -9.351
  421    HG3  ARG  71           HG2      ARG  71   8.631  10.927  -9.128
  422    HD2  ARG  71           HD1      ARG  71  10.193  10.388 -10.927
  423    HD3  ARG  71           HD2      ARG  71   9.422   8.808 -11.123
  424    HE   ARG  71           HE       ARG  71   8.508  11.299 -12.170
  425   HH11  ARG  71          HH11      ARG  71   7.455   8.199 -10.985
  426   HH12  ARG  71          HH12      ARG  71   5.979   8.209 -11.891
  427   HH21  ARG  71          HH21      ARG  71   6.568  11.321 -13.370
  428   HH22  ARG  71          HH22      ARG  71   5.476   9.984 -13.248
  429    H    ARG  72           H        ARG  72  10.847  12.114  -7.447
  430    HA   ARG  72           HA       ARG  72  12.635  11.702  -5.229
  431    HB2  ARG  72           HB1      ARG  72  10.763  13.985  -5.902
  432    HB3  ARG  72           HB2      ARG  72  11.929  13.995  -4.569
  433    HG2  ARG  72           HG1      ARG  72  13.194  13.305  -7.086
  434    HG3  ARG  72           HG2      ARG  72  12.370  14.871  -7.155
  435    HD2  ARG  72           HD1      ARG  72  13.583  15.121  -4.764
  436    HD3  ARG  72           HD2      ARG  72  14.719  14.030  -5.569
  437    HE   ARG  72           HE       ARG  72  15.391  15.765  -6.896
  438   HH11  ARG  72          HH11      ARG  72  12.346  16.581  -5.418
  439   HH12  ARG  72          HH12      ARG  72  12.360  18.218  -5.985
  440   HH21  ARG  72          HH21      ARG  72  15.421  17.918  -7.649
  441   HH22  ARG  72          HH22      ARG  72  14.110  18.977  -7.255
  442    H    CYS  73           H        CYS  73  12.048  11.835  -3.002
  443    HA   CYS  73           HA       CYS  73   9.235  11.434  -2.340
  444    HB2  CYS  73           HB1      CYS  73   9.799   9.455  -0.925
  445    HB3  CYS  73           HB2      CYS  73   9.971   9.167  -2.656
  446    H    GLN  74           H        GLN  74   8.779  11.676  -0.065
  447    HA   GLN  74           HA       GLN  74  10.843  13.258   1.321
  448    HB2  GLN  74           HB1      GLN  74   7.932  13.624   0.953
  449    HB3  GLN  74           HB2      GLN  74   8.548  13.969   2.577
  450    HG2  GLN  74           HG1      GLN  74   8.797  16.032   1.678
  451    HG3  GLN  74           HG2      GLN  74  10.351  15.334   1.202
  452   HE21  GLN  74          HE21      GLN  74  10.691  14.732  -0.944
  453   HE22  GLN  74          HE22      GLN  74   9.688  15.316  -2.225
  454    H    ARG  75           H        ARG  75   8.637  10.593   1.530
  455    HA   ARG  75           HA       ARG  75   9.671  10.002   4.223
  456    HB2  ARG  75           HB1      ARG  75   7.115  10.750   3.826
  457    HB3  ARG  75           HB2      ARG  75   6.963   9.011   3.533
  458    HG2  ARG  75           HG1      ARG  75   8.474   9.144   5.848
  459    HG3  ARG  75           HG2      ARG  75   7.285  10.445   6.028
  460    HD2  ARG  75           HD1      ARG  75   5.498   9.016   6.072
  461    HD3  ARG  75           HD2      ARG  75   6.306   7.823   5.045
  462    HE   ARG  75           HE       ARG  75   7.020   6.771   6.933
  463   HH11  ARG  75          HH11      ARG  75   6.290  10.082   7.724
  464   HH12  ARG  75          HH12      ARG  75   6.577   9.877   9.420
  465   HH21  ARG  75          HH21      ARG  75   7.402   6.488   9.164
  466   HH22  ARG  75          HH22      ARG  75   7.211   7.833  10.238
  467    H    ASP  76           H        ASP  76   9.221   7.610   4.775
  468    HA   ASP  76           HA       ASP  76  10.425   6.034   2.687
  469    HB2  ASP  76           HB1      ASP  76  11.160   5.729   4.988
  470    HB3  ASP  76           HB2      ASP  76   9.517   5.293   5.475
  471    HD2  ASP  76           HD       ASP  76  10.839   2.095   5.033
  472    H    ALA  77           H        ALA  77   7.345   6.005   4.454
  473    HA   ALA  77           HA       ALA  77   6.245   3.780   3.105
  474    HB1  ALA  77           HB1      ALA  77   5.406   5.657   5.100
  475    HB2  ALA  77           HB2      ALA  77   4.125   5.437   3.906
  476    HB3  ALA  77           HB3      ALA  77   4.788   4.041   4.757
  477    H    MET  78           H        MET  78   6.533   7.132   2.274
  478    HA   MET  78           HA       MET  78   4.469   7.479   0.464
  479    HB2  MET  78           HB1      MET  78   7.163   8.653   0.850
  480    HB3  MET  78           HB2      MET  78   6.427   8.893  -0.743
  481    HG2  MET  78           HG1      MET  78   5.043   9.579   1.848
  482    HG3  MET  78           HG2      MET  78   6.018  10.720   0.918
  483    HE1  MET  78           HE1      MET  78   4.646  10.278  -2.464
  484    HE2  MET  78           HE2      MET  78   4.324  11.896  -1.840
  485    HE3  MET  78           HE3      MET  78   5.822  11.068  -1.413
  486    H    CYS  79           H        CYS  79   7.406   5.641   0.149
  487    HA   CYS  79           HA       CYS  79   6.906   5.194  -2.703
  488    HB2  CYS  79           HB1      CYS  79   9.239   5.671  -1.423
  489    HB3  CYS  79           HB2      CYS  79   9.224   3.907  -1.381
  490    H    CYS  80           H        CYS  80   6.990   2.999  -3.545
  491    HA   CYS  80           HA       CYS  80   5.182   1.277  -2.366
  492    HB2  CYS  80           HB1      CYS  80   7.124   1.131  -4.570
  493    HB3  CYS  80           HB2      CYS  80   6.729  -0.433  -3.856
  494    HA   PRO  81           HA       PRO  81   7.239  -1.009   0.762
  495    HB2  PRO  81           HB1      PRO  81   6.248  -3.537   0.400
  496    HB3  PRO  81           HB2      PRO  81   5.294  -2.200   1.040
  497    HG2  PRO  81           HG1      PRO  81   5.436  -3.265  -1.760
  498    HG3  PRO  81           HG2      PRO  81   3.989  -2.809  -0.785
  499    HD2  PRO  81           HD1      PRO  81   5.028  -1.195  -2.705
  500    HD3  PRO  81           HD2      PRO  81   4.273  -0.566  -1.232
  501    H    GLY  82           H        GLY  82   9.327  -1.538   0.822
  502    HA2  GLY  82           HA2      GLY  82  10.968  -3.307   0.465
  503    HA3  GLY  82           HA3      GLY  82  10.331  -3.480  -1.164
  504    HA1  GLY  82           HA1      GLY  82  10.880  -2.442   0.607
  505    H    THR  83           H        THR  83  10.776  -0.315   0.174
  506    HA   THR  83           HA       THR  83  13.357   0.011  -1.153
  507    HB   THR  83           HB       THR  83  12.270   2.283  -2.040
  508    HG1  THR  83           HG1      THR  83  10.125   0.516  -2.508
  509   HG21  THR  83          HG21      THR  83  13.011   1.334  -3.914
  510   HG22  THR  83          HG22      THR  83  11.526   0.388  -4.001
  511   HG23  THR  83          HG23      THR  83  12.937  -0.260  -3.164
  512    H    LEU  84           H        LEU  84  14.121   2.379  -0.827
  513    HA   LEU  84           HA       LEU  84  13.200   3.451   1.740
  514    HB2  LEU  84           HB1      LEU  84  15.556   1.951   1.422
  515    HB3  LEU  84           HB2      LEU  84  16.063   3.644   1.545
  516    HG   LEU  84           HG       LEU  84  16.134   2.633   3.725
  517   HD11  LEU  84          HD11      LEU  84  13.690   4.385   3.608
  518   HD12  LEU  84          HD12      LEU  84  15.340   4.991   3.473
  519   HD13  LEU  84          HD13      LEU  84  14.814   4.188   4.952
  520   HD21  LEU  84          HD21      LEU  84  13.380   2.192   4.276
  521   HD22  LEU  84          HD22      LEU  84  14.715   1.041   4.331
  522   HD23  LEU  84          HD23      LEU  84  13.815   1.275   2.832
  523    H    CYS  85           H        CYS  85  13.387   5.650   1.957
  524    HA   CYS  85           HA       CYS  85  13.813   7.130  -0.485
  525    HB2  CYS  85           HB1      CYS  85  11.983   7.532   1.291
  526    HB3  CYS  85           HB2      CYS  85  13.252   8.340   2.213
  527    H    VAL  86           H        VAL  86  15.905   7.365  -1.036
  528    HA   VAL  86           HA       VAL  86  17.747   8.421   1.010
  529    HB   VAL  86           HB       VAL  86  18.436   6.840  -1.472
  530   HG11  VAL  86          HG11      VAL  86  20.720   6.844  -0.587
  531   HG12  VAL  86          HG12      VAL  86  20.151   8.482  -0.917
  532   HG13  VAL  86          HG13      VAL  86  20.202   7.883   0.742
  533   HG21  VAL  86          HG21      VAL  86  19.260   5.679   1.032
  534   HG22  VAL  86          HG22      VAL  86  17.517   5.942   1.010
  535   HG23  VAL  86          HG23      VAL  86  18.281   4.982  -0.258
  536    H    ASN  87           H        ASN  87  18.675  10.348   0.667
  537    HA   ASN  87           HA       ASN  87  19.079  12.389  -0.255
  538    HB2  ASN  87           HB1      ASN  87  20.342  10.585  -1.796
  539    HB3  ASN  87           HB2      ASN  87  19.250  11.272  -3.004
  540   HD21  ASN  87          HD21      ASN  87  22.193  11.439  -2.647
  541   HD22  ASN  87          HD22      ASN  87  22.550  13.130  -2.658
  542    H    ASP  88           H        ASP  88  16.356  11.685  -0.003
  543    HA   ASP  88           HA       ASP  88  14.290  12.432  -0.595
  544    HB2  ASP  88           HB1      ASP  88  15.736  14.338  -2.450
  545    HB3  ASP  88           HB2      ASP  88  14.114  14.525  -1.772
  546    HD2  ASP  88           HD       ASP  88  15.568  15.205   1.438
  547    H    VAL  89           H        VAL  89  15.688  10.321  -2.147
  548    HA   VAL  89           HA       VAL  89  13.878  10.340  -4.451
  549    HB   VAL  89           HB       VAL  89  16.806   9.618  -4.641
  550   HG11  VAL  89          HG11      VAL  89  14.512   9.370  -6.554
  551   HG12  VAL  89          HG12      VAL  89  16.172   9.523  -7.131
  552   HG13  VAL  89          HG13      VAL  89  15.716   8.164  -6.103
  553   HG21  VAL  89          HG21      VAL  89  16.885  11.901  -4.750
  554   HG22  VAL  89          HG22      VAL  89  16.560  11.532  -6.443
  555   HG23  VAL  89          HG23      VAL  89  15.245  12.039  -5.383
  556    H    CYS  90           H        CYS  90  13.018   8.377  -4.959
  557    HA   CYS  90           HA       CYS  90  13.034   6.345  -3.015
  558    HB2  CYS  90           HB1      CYS  90  11.965   6.604  -5.801
  559    HB3  CYS  90           HB2      CYS  90  11.977   5.013  -5.036
  560    H    THR  91           H        THR  91  14.818   5.221  -2.553
  561    HA   THR  91           HA       THR  91  16.326   4.041  -4.794
  562    HB   THR  91           HB       THR  91  17.385   4.816  -2.069
  563    HG1  THR  91           HG1      THR  91  18.629   6.310  -3.401
  564   HG21  THR  91          HG21      THR  91  18.735   3.037  -2.618
  565   HG22  THR  91          HG22      THR  91  19.595   4.348  -3.427
  566   HG23  THR  91          HG23      THR  91  18.537   3.283  -4.352
  567    H    THR  92           H        THR  92  16.585   1.885  -4.822
  568    HA   THR  92           HA       THR  92  14.999   0.190  -3.300
  569    HB   THR  92           HB       THR  92  16.530  -1.652  -4.103
  570    HG1  THR  92           HG1      THR  92  18.075  -0.886  -5.733
  571   HG21  THR  92          HG21      THR  92  14.585  -0.370  -5.405
  572   HG22  THR  92          HG22      THR  92  15.524  -1.664  -6.149
  573   HG23  THR  92          HG23      THR  92  15.927   0.021  -6.479
  574    H    MET  93           H        MET  93  15.467  -1.302  -1.637
  575    HA   MET  93           HA       MET  93  17.135  -0.275   0.423
  576    HB2  MET  93           HB1      MET  93  14.949  -1.788   0.474
  577    HB3  MET  93           HB2      MET  93  16.152  -3.086   0.528
  578    HG2  MET  93           HG1      MET  93  17.200  -1.902   2.492
  579    HG3  MET  93           HG2      MET  93  15.787  -0.845   2.493
  580    HE1  MET  93           HE1      MET  93  13.279  -1.754   3.656
  581    HE2  MET  93           HE2      MET  93  13.942  -2.457   5.132
  582    HE3  MET  93           HE3      MET  93  14.711  -1.045   4.403
  583    H    GLU  94           H        GLU  94  17.522  -2.717  -2.037
  584    HA   GLU  94           HA       GLU  94  19.714  -4.096  -0.931
  585    HB2  GLU  94           HB1      GLU  94  18.710  -3.716  -3.745
  586    HB3  GLU  94           HB2      GLU  94  20.188  -4.631  -3.410
  587    HG2  GLU  94           HG1      GLU  94  18.914  -6.149  -1.953
  588    HG3  GLU  94           HG2      GLU  94  17.440  -5.257  -2.355
  589    HE2  GLU  94           HE       GLU  94  18.699  -7.984  -4.842
  590    H    ASP  95           H        ASP  95  19.454  -1.063  -2.603
  591    HA   ASP  95           HA       ASP  95  22.321  -0.867  -3.038
  592    HB2  ASP  95           HB1      ASP  95  20.011   0.310  -4.200
  593    HB3  ASP  95           HB2      ASP  95  20.965   1.618  -3.486
  594    HD2  ASP  95           HD       ASP  95  23.603   1.088  -5.721
  595    H    ALA  96           H        ALA  96  19.819   0.644  -1.042
  596    HA   ALA  96           HA       ALA  96  21.392   2.586   0.202
  597    HB1  ALA  96           HB1      ALA  96  19.318   1.281   1.852
  598    HB2  ALA  96           HB2      ALA  96  19.586   2.989   1.503
  599    HB3  ALA  96           HB3      ALA  96  18.790   1.959   0.312
  600    H    THR  97           H        THR  97  22.062   2.596   2.513
  601    HA   THR  97           HA       THR  97  23.461   1.840   4.144
  602    HB   THR  97           HB       THR  97  22.119  -0.837   3.751
  603    HG1  THR  97           HG1      THR  97  20.407   0.416   4.152
  604   HG21  THR  97          HG21      THR  97  23.812  -1.204   5.279
  605   HG22  THR  97          HG22      THR  97  22.484  -0.740   6.343
  606   HG23  THR  97          HG23      THR  97  23.729   0.436   5.922
  607    H    GLU  98           H        GLU  98  25.180   2.111   2.488
  608    HA   GLU  98           HA       GLU  98  26.187  -0.100   1.036
  609    HB2  GLU  98           HB1      GLU  98  27.580   2.430   1.945
  610    HB3  GLU  98           HB2      GLU  98  28.214   1.288   0.749
  611    HG2  GLU  98           HG1      GLU  98  26.865   2.025  -0.898
  612    HG3  GLU  98           HG2      GLU  98  25.518   2.333   0.207
  613    HE2  GLU  98           HE       GLU  98  26.770   5.563   0.936
  614    H    ASN  99           H        ASN  99  27.163  -1.847   1.790
  615    HA   ASN  99           HA       ASN  99  28.734  -1.625   4.273
  616    HB2  ASN  99           HB1      ASN  99  28.094  -4.053   4.663
  617    HB3  ASN  99           HB2      ASN  99  26.799  -2.867   4.869
  618   HD21  ASN  99          HD21      ASN  99  25.220  -4.432   4.520
  619   HD22  ASN  99          HD22      ASN  99  24.883  -5.053   2.944
  620    H    LEU 100           H        LEU 100  30.437  -3.276   4.493
  621    HA   LEU 100           HA       LEU 100  31.359  -4.470   1.997
  622    HB2  LEU 100           HB1      LEU 100  32.676  -2.231   3.443
  623    HB3  LEU 100           HB2      LEU 100  33.714  -3.518   2.804
  624    HG   LEU 100           HG       LEU 100  31.739  -2.273   0.960
  625   HD11  LEU 100          HD11      LEU 100  34.134  -0.812   0.724
  626   HD12  LEU 100          HD12      LEU 100  33.654  -0.740   2.420
  627   HD13  LEU 100          HD13      LEU 100  32.533  -0.216   1.164
  628   HD21  LEU 100          HD21      LEU 100  33.059  -4.099   0.141
  629   HD22  LEU 100          HD22      LEU 100  34.546  -3.340   0.708
  630   HD23  LEU 100          HD23      LEU 100  33.634  -2.614  -0.616
  631    H    TYR 101           H        TYR 101  32.944  -6.117   2.286
  632    HA   TYR 101           HA       TYR 101  32.627  -7.551   4.748
  633    HB2  TYR 101           HB1      TYR 101  33.074  -8.304   2.169
  634    HB3  TYR 101           HB2      TYR 101  34.695  -8.466   2.851
  635    HD1  TYR 101           HD1      TYR 101  35.238 -10.593   3.529
  636    HD2  TYR 101           HD2      TYR 101  31.219  -9.275   3.987
  637    HE1  TYR 101           HE1      TYR 101  34.642 -12.771   4.504
  638    HE2  TYR 101           HE2      TYR 101  30.611 -11.449   4.964
  639    HH   TYR 101           HH       TYR 101  31.317 -13.625   5.198
  640    H    PHE 102           H        PHE 102  34.831  -8.702   5.492
  641    HA   PHE 102           HA       PHE 102  36.887  -6.633   5.838
  642    HB2  PHE 102           HB1      PHE 102  35.171  -7.815   7.892
  643    HB3  PHE 102           HB2      PHE 102  36.889  -7.975   8.260
  644    HD1  PHE 102           HD1      PHE 102  38.207  -6.122   8.908
  645    HD2  PHE 102           HD2      PHE 102  34.214  -5.540   7.559
  646    HE1  PHE 102           HE1      PHE 102  38.283  -3.794   9.702
  647    HE2  PHE 102           HE2      PHE 102  34.281  -3.211   8.350
  648    HZ   PHE 102           HZ       PHE 102  36.318  -2.335   9.422
  649    H    GLN 103           H        GLN 103  38.889  -7.355   5.500
  650    HA   GLN 103           HA       GLN 103  39.772  -9.963   6.210
  651    HB2  GLN 103           HB1      GLN 103  38.501  -9.739   3.692
  652    HB3  GLN 103           HB2      GLN 103  40.236  -9.892   3.380
  653    HG2  GLN 103           HG1      GLN 103  40.191 -11.886   4.969
  654    HG3  GLN 103           HG2      GLN 103  38.431 -11.805   4.816
  655   HE21  GLN 103          HE21      GLN 103  38.175 -13.723   3.763
  656   HE22  GLN 103          HE22      GLN 103  38.738 -14.012   2.155
  657    H    SER 104           H        SER 104  42.042 -10.332   5.609
  658    HA   SER 104           HA       SER 104  43.456  -7.791   5.127
  659    HB2  SER 104           HB1      SER 104  44.712 -10.030   6.683
  660    HB3  SER 104           HB2      SER 104  45.024  -8.288   6.770
  661    HG   SER 104           HG       SER 104  42.802  -9.710   7.801
  662    H    LEU 105           H        LEU 105  45.819  -8.239   4.455
  663    HA   LEU 105           HA       LEU 105  45.711  -9.837   2.061
  664    HB2  LEU 105           HB1      LEU 105  47.332  -7.685   3.123
  665    HB3  LEU 105           HB2      LEU 105  48.335  -8.967   2.423
  666    HG   LEU 105           HG       LEU 105  46.053  -7.901   0.827
  667   HD11  LEU 105          HD11      LEU 105  48.409  -6.369   1.684
  668   HD12  LEU 105          HD12      LEU 105  46.850  -5.814   1.077
  669   HD13  LEU 105          HD13      LEU 105  48.092  -6.361  -0.050
  670   HD21  LEU 105          HD21      LEU 105  47.738  -9.850   0.291
  671   HD22  LEU 105          HD22      LEU 105  48.781  -8.514  -0.196
  672   HD23  LEU 105          HD23      LEU 105  47.208  -8.731  -0.967
  673    H    GLU 106           H        GLU 106  47.056 -11.584   1.540
  674    HA   GLU 106           HA       GLU 106  48.622 -12.782   3.696
  675    HB2  GLU 106           HB1      GLU 106  47.584 -14.947   3.471
  676    HB3  GLU 106           HB2      GLU 106  46.338 -13.744   3.836
  677    HG2  GLU 106           HG1      GLU 106  45.201 -14.270   2.012
  678    HG3  GLU 106           HG2      GLU 106  46.625 -13.987   1.002
  679    HE2  GLU 106           HE       GLU 106  46.380 -17.719   2.326
  680    H    HIS 107           H        HIS 107  50.005 -14.558   2.937
  681    HA   HIS 107           HA       HIS 107  50.375 -14.969   0.128
  682    HB2  HIS 107           HB1      HIS 107  52.650 -14.021  -0.008
  683    HB3  HIS 107           HB2      HIS 107  51.426 -12.781   0.281
  684    HD1  HIS 107           HD1      HIS 107  51.934 -11.189   2.103
  685    HD2  HIS 107           HD2      HIS 107  53.969 -14.779   2.576
  686    HE1  HIS 107           HE1      HIS 107  53.410 -10.865   4.112
  687    HE2  HIS 107           HE2      HIS 107  54.654 -13.059   4.404
  688    H    HIS 108           H        HIS 108  51.888 -16.618  -0.337
  689    HA   HIS 108           HA       HIS 108  52.612 -18.219   2.019
  690    HB2  HIS 108           HB1      HIS 108  51.141 -18.966  -0.135
  691    HB3  HIS 108           HB2      HIS 108  52.755 -19.449  -0.667
  692    HD1  HIS 108           HD1      HIS 108  53.608 -20.180   2.399
  693    HD2  HIS 108           HD2      HIS 108  50.424 -21.681   0.192
  694    HE1  HIS 108           HE1      HIS 108  53.055 -22.401   3.441
  695    HE2  HIS 108           HE2      HIS 108  51.109 -23.319   2.092
  696    H    HIS 109           H        HIS 109  54.188 -15.977   1.006
  697    HA   HIS 109           HA       HIS 109  56.336 -15.419   0.494
  698    HB2  HIS 109           HB1      HIS 109  56.687 -18.143   1.750
  699    HB3  HIS 109           HB2      HIS 109  58.063 -17.153   1.252
  700    HD1  HIS 109           HD1      HIS 109  56.826 -17.984   4.246
  701    HD2  HIS 109           HD2      HIS 109  57.130 -14.260   2.430
  702    HE1  HIS 109           HE1      HIS 109  56.794 -16.315   6.127
  703    HE2  HIS 109           HE2      HIS 109  56.979 -14.039   5.018
  704    H    HIS 110           H        HIS 110  55.278 -15.820  -1.782
  705    HA   HIS 110           HA       HIS 110  56.070 -18.023  -3.332
  706    HB2  HIS 110           HB1      HIS 110  54.424 -15.931  -3.751
  707    HB3  HIS 110           HB2      HIS 110  55.823 -15.392  -4.683
  708    HD1  HIS 110           HD1      HIS 110  56.229 -16.464  -6.927
  709    HD2  HIS 110           HD2      HIS 110  53.287 -18.402  -4.723
  710    HE1  HIS 110           HE1      HIS 110  55.187 -18.119  -8.506
  711    HE2  HIS 110           HE2      HIS 110  53.390 -19.306  -7.162
  712    H    HIS 111           H        HIS 111  57.796 -18.383  -4.691
  713    HA   HIS 111           HA       HIS 111  59.981 -16.421  -4.651
  714    HB2  HIS 111           HB1      HIS 111  61.588 -18.359  -4.422
  715    HB3  HIS 111           HB2      HIS 111  60.656 -17.967  -2.976
  716    HD1  HIS 111           HD1      HIS 111  60.621 -20.488  -5.807
  717    HD2  HIS 111           HD2      HIS 111  59.242 -20.038  -1.913
  718    HE1  HIS 111           HE1      HIS 111  59.652 -22.721  -5.175
  719    HE2  HIS 111           HE2      HIS 111  58.809 -22.446  -2.795
  720    H    HIS 112           H        HIS 112  61.025 -16.171  -6.551
  721    HA   HIS 112           HA       HIS 112  59.910 -17.415  -8.883
  722    HB2  HIS 112           HB1      HIS 112  60.918 -15.000  -8.528
  723    HB3  HIS 112           HB2      HIS 112  62.425 -15.799  -8.987
  724    HD1  HIS 112           HD1      HIS 112  60.212 -13.758 -10.565
  725    HD2  HIS 112           HD2      HIS 112  61.524 -17.590 -11.483
  726    HE1  HIS 112           HE1      HIS 112  59.798 -14.037 -13.030
  727    HE2  HIS 112           HE2      HIS 112  60.600 -16.380 -13.592
  Start of MODEL    7
    1    H1   MET  18           H        MET  18 -81.720   1.886  -4.327
    2    HA   MET  18           HA       MET  18 -82.133   2.641  -2.183
    3    HB2  MET  18           HB1      MET  18 -83.393   1.135  -0.579
    4    HB3  MET  18           HB2      MET  18 -84.292   1.680  -2.004
    5    HG2  MET  18           HG1      MET  18 -83.788  -0.492  -3.104
    6    HG3  MET  18           HG2      MET  18 -83.036  -1.022  -1.596
    7    HE1  MET  18           HE1      MET  18 -83.970  -1.908   0.219
    8    HE2  MET  18           HE2      MET  18 -84.986  -0.654   0.931
    9    HE3  MET  18           HE3      MET  18 -85.669  -2.238   0.562
   10    H    LEU  19           H        LEU  19 -80.284   2.776  -1.110
   11    HA   LEU  19           HA       LEU  19 -79.262   0.700   0.490
   12    HB2  LEU  19           HB1      LEU  19 -77.095   0.356  -0.690
   13    HB3  LEU  19           HB2      LEU  19 -78.505  -0.328  -1.518
   14    HG   LEU  19           HG       LEU  19 -78.140   2.249  -2.588
   15   HD11  LEU  19          HD11      LEU  19 -75.815   1.975  -3.494
   16   HD12  LEU  19          HD12      LEU  19 -75.560   0.733  -2.269
   17   HD13  LEU  19          HD13      LEU  19 -75.912   2.391  -1.782
   18   HD21  LEU  19          HD21      LEU  19 -78.011  -0.566  -3.465
   19   HD22  LEU  19          HD22      LEU  19 -77.219   0.614  -4.511
   20   HD23  LEU  19          HD23      LEU  19 -78.930   0.790  -4.120
   21    H    VAL  20           H        VAL  20 -76.778   1.310   1.026
   22    HA   VAL  20           HA       VAL  20 -76.859   4.176   1.673
   23    HB   VAL  20           HB       VAL  20 -75.249   1.967   2.963
   24   HG11  VAL  20          HG11      VAL  20 -75.221   4.907   3.219
   25   HG12  VAL  20          HG12      VAL  20 -75.182   3.992   4.728
   26   HG13  VAL  20          HG13      VAL  20 -73.940   3.729   3.503
   27   HG21  VAL  20          HG21      VAL  20 -77.143   1.512   4.044
   28   HG22  VAL  20          HG22      VAL  20 -76.970   3.078   4.833
   29   HG23  VAL  20          HG23      VAL  20 -77.950   2.929   3.374
   30    H    LEU  21           H        LEU  21 -75.599   5.472   0.526
   31    HA   LEU  21           HA       LEU  21 -73.677   4.577  -1.323
   32    HB2  LEU  21           HB1      LEU  21 -74.918   7.014  -0.626
   33    HB3  LEU  21           HB2      LEU  21 -73.168   7.282  -0.526
   34    HG   LEU  21           HG       LEU  21 -73.097   6.252  -2.893
   35   HD11  LEU  21          HD11      LEU  21 -74.999   6.024  -4.103
   36   HD12  LEU  21          HD12      LEU  21 -75.843   7.303  -3.230
   37   HD13  LEU  21          HD13      LEU  21 -75.677   5.703  -2.507
   38   HD21  LEU  21          HD21      LEU  21 -74.460   8.802  -3.201
   39   HD22  LEU  21          HD22      LEU  21 -72.794   8.355  -3.573
   40   HD23  LEU  21          HD23      LEU  21 -73.234   8.832  -1.933
   41    H    ASP  22           H        ASP  22 -71.475   4.451  -1.263
   42    HA   ASP  22           HA       ASP  22 -70.243   4.705   1.399
   43    HB2  ASP  22           HB1      ASP  22 -69.042   3.121  -0.860
   44    HB3  ASP  22           HB2      ASP  22 -68.809   2.930   0.884
   45    HD2  ASP  22           HD       ASP  22 -71.503   0.815   1.172
   46    H    PHE  23           H        PHE  23 -67.884   5.241   1.365
   47    HA   PHE  23           HA       PHE  23 -67.028   6.859  -0.901
   48    HB2  PHE  23           HB1      PHE  23 -68.280   8.076   1.253
   49    HB3  PHE  23           HB2      PHE  23 -66.564   8.266   1.620
   50    HD1  PHE  23           HD1      PHE  23 -65.277   9.903   0.577
   51    HD2  PHE  23           HD2      PHE  23 -69.075   8.867  -1.041
   52    HE1  PHE  23           HE1      PHE  23 -65.126  11.799  -0.982
   53    HE2  PHE  23           HE2      PHE  23 -68.929  10.762  -2.605
   54    HZ   PHE  23           HZ       PHE  23 -66.953  12.231  -2.577
   55    H    ASN  24           H        ASN  24 -64.784   7.256  -0.959
   56    HA   ASN  24           HA       ASN  24 -63.182   5.865   1.076
   57    HB2  ASN  24           HB1      ASN  24 -62.987   5.556  -1.929
   58    HB3  ASN  24           HB2      ASN  24 -61.702   5.058  -0.819
   59   HD21  ASN  24          HD21      ASN  24 -64.815   4.327  -2.083
   60   HD22  ASN  24          HD22      ASN  24 -65.006   2.790  -1.317
   61    H    ASN  25           H        ASN  25 -61.106   6.686   1.415
   62    HA   ASN  25           HA       ASN  25 -60.319   9.064  -0.092
   63    HB2  ASN  25           HB1      ASN  25 -61.683   9.638   2.031
   64    HB3  ASN  25           HB2      ASN  25 -60.241   9.123   2.915
   65   HD21  ASN  25          HD21      ASN  25 -61.756  11.756   1.895
   66   HD22  ASN  25          HD22      ASN  25 -60.421  12.819   1.627
   67    H    ILE  26           H        ILE  26 -58.144   9.317  -0.299
   68    HA   ILE  26           HA       ILE  26 -56.468   7.257   0.970
   69    HB   ILE  26           HB       ILE  26 -54.911   7.521  -0.876
   70   HG12  ILE  26          HG11      ILE  26 -56.305   8.950  -2.819
   71   HG13  ILE  26          HG12      ILE  26 -56.488   9.921  -1.349
   72   HG21  ILE  26          HG21      ILE  26 -57.302   7.255  -2.506
   73   HG22  ILE  26          HG22      ILE  26 -56.058   6.067  -2.118
   74   HG23  ILE  26          HG23      ILE  26 -57.396   6.338  -1.003
   75   HD11  ILE  26          HD11      ILE  26 -53.856   8.980  -2.460
   76   HD12  ILE  26          HD12      ILE  26 -54.540  10.592  -2.674
   77   HD13  ILE  26          HD13      ILE  26 -54.096  10.028  -1.063
   78    H    ARG  27           H        ARG  27 -54.109   7.964   1.183
   79    HA   ARG  27           HA       ARG  27 -54.083  10.597   2.479
   80    HB2  ARG  27           HB1      ARG  27 -53.266   8.128   3.395
   81    HB3  ARG  27           HB2      ARG  27 -51.747   8.883   2.888
   82    HG2  ARG  27           HG1      ARG  27 -51.746  10.353   4.583
   83    HG3  ARG  27           HG2      ARG  27 -53.491  10.627   4.466
   84    HD2  ARG  27           HD1      ARG  27 -53.937   9.176   6.109
   85    HD3  ARG  27           HD2      ARG  27 -52.884   7.949   5.392
   86    HE   ARG  27           HE       ARG  27 -51.279   8.523   6.903
   87   HH11  ARG  27          HH11      ARG  27 -53.522  11.169   6.611
   88   HH12  ARG  27          HH12      ARG  27 -52.791  12.100   7.876
   89   HH21  ARG  27          HH21      ARG  27 -50.306   9.739   8.570
   90   HH22  ARG  27          HH22      ARG  27 -50.960  11.286   8.988
   91    H    SER  28           H        SER  28 -52.425  12.081   2.095
   92    HA   SER  28           HA       SER  28 -51.392  12.049  -0.583
   93    HB2  SER  28           HB1      SER  28 -50.894  14.011   1.679
   94    HB3  SER  28           HB2      SER  28 -50.479  14.264  -0.026
   95    HG   SER  28           HG       SER  28 -52.551  14.533  -0.525
   96    H    SER  29           H        SER  29 -49.820  10.564  -0.906
   97    HA   SER  29           HA       SER  29 -47.596  10.410   0.990
   98    HB2  SER  29           HB1      SER  29 -47.250   8.266   0.296
   99    HB3  SER  29           HB2      SER  29 -48.938   8.411  -0.227
  100    HG   SER  29           HG       SER  29 -48.147   7.932  -2.116
  101    H    ALA  30           H        ALA  30 -45.596  11.129   0.547
  102    HA   ALA  30           HA       ALA  30 -44.728  11.636  -2.160
  103    HB1  ALA  30           HB1      ALA  30 -45.858  13.756  -0.579
  104    HB2  ALA  30           HB2      ALA  30 -44.165  14.089  -0.947
  105    HB3  ALA  30           HB3      ALA  30 -45.307  13.777  -2.254
  106    H    ASP  31           H        ASP  31 -42.652  11.109  -2.273
  107    HA   ASP  31           HA       ASP  31 -41.036  11.247   0.187
  108    HB2  ASP  31           HB1      ASP  31 -41.529   8.958  -0.845
  109    HB3  ASP  31           HB2      ASP  31 -40.469   9.454  -2.171
  110    HD2  ASP  31           HD       ASP  31 -38.840   8.250   1.170
  111    H    LEU  32           H        LEU  32 -38.953  12.067   0.090
  112    HA   LEU  32           HA       LEU  32 -38.247  13.448  -2.417
  113    HB2  LEU  32           HB1      LEU  32 -38.314  14.382   0.401
  114    HB3  LEU  32           HB2      LEU  32 -36.966  14.940  -0.606
  115    HG   LEU  32           HG       LEU  32 -38.848  15.647  -2.264
  116   HD11  LEU  32          HD11      LEU  32 -40.915  16.312  -1.130
  117   HD12  LEU  32          HD12      LEU  32 -40.356  15.519   0.343
  118   HD13  LEU  32          HD13      LEU  32 -40.684  14.564  -1.102
  119   HD21  LEU  32          HD21      LEU  32 -38.969  17.830  -1.186
  120   HD22  LEU  32          HD22      LEU  32 -37.331  17.178  -1.109
  121   HD23  LEU  32          HD23      LEU  32 -38.367  17.131   0.318
  122    H    HIS  33           H        HIS  33 -36.808  11.962  -3.203
  123    HA   HIS  33           HA       HIS  33 -34.544  11.224  -1.480
  124    HB2  HIS  33           HB1      HIS  33 -36.131   9.748  -3.323
  125    HB3  HIS  33           HB2      HIS  33 -34.495   9.841  -3.985
  126    HD1  HIS  33           HD1      HIS  33 -32.544   8.892  -2.439
  127    HD2  HIS  33           HD2      HIS  33 -36.412   7.974  -1.232
  128    HE1  HIS  33           HE1      HIS  33 -32.305   7.005  -0.794
  129    HE2  HIS  33           HE2      HIS  33 -34.669   6.444  -0.056
  130    H    GLY  34           H        GLY  34 -32.439  10.909  -2.788
  131    HA2  GLY  34           HA2      GLY  34 -32.030  12.585  -5.068
  132    HA3  GLY  34           HA3      GLY  34 -31.461  13.351  -3.593
  133    HA1  GLY  34           HA1      GLY  34 -32.004  11.728  -4.856
  134    H    ALA  35           H        ALA  35 -29.453  13.164  -5.046
  135    HA   ALA  35           HA       ALA  35 -28.127  10.584  -4.514
  136    HB1  ALA  35           HB1      ALA  35 -28.520  11.473  -6.950
  137    HB2  ALA  35           HB2      ALA  35 -27.099  12.456  -6.593
  138    HB3  ALA  35           HB3      ALA  35 -26.999  10.698  -6.508
  139    H    ARG  36           H        ARG  36 -27.314  11.114  -2.492
  140    HA   ARG  36           HA       ARG  36 -25.827  13.541  -2.067
  141    HB2  ARG  36           HB1      ARG  36 -26.946  11.437  -0.452
  142    HB3  ARG  36           HB2      ARG  36 -25.254  11.699  -0.008
  143    HG2  ARG  36           HG1      ARG  36 -25.856  14.194   0.098
  144    HG3  ARG  36           HG2      ARG  36 -27.537  13.633   0.106
  145    HD2  ARG  36           HD1      ARG  36 -25.681  12.309   2.009
  146    HD3  ARG  36           HD2      ARG  36 -26.107  13.994   2.341
  147    HE   ARG  36           HE       ARG  36 -28.446  12.529   1.783
  148   HH11  ARG  36          HH11      ARG  36 -26.003  12.896   4.235
  149   HH12  ARG  36          HH12      ARG  36 -27.051  12.431   5.534
  150   HH21  ARG  36          HH21      ARG  36 -29.838  11.917   3.485
  151   HH22  ARG  36          HH22      ARG  36 -29.232  11.875   5.106
  152    H    LYS  37           H        LYS  37 -23.775  13.852  -2.591
  153    HA   LYS  37           HA       LYS  37 -22.056  11.500  -3.021
  154    HB2  LYS  37           HB1      LYS  37 -21.866  14.295  -4.171
  155    HB3  LYS  37           HB2      LYS  37 -20.693  12.999  -4.461
  156    HG2  LYS  37           HG1      LYS  37 -21.902  12.224  -6.144
  157    HG3  LYS  37           HG2      LYS  37 -23.302  12.028  -5.075
  158    HD2  LYS  37           HD1      LYS  37 -23.846  14.434  -5.411
  159    HD3  LYS  37           HD2      LYS  37 -22.519  14.522  -6.582
  160    HE2  LYS  37           HE1      LYS  37 -24.071  12.291  -7.334
  161    HE3  LYS  37           HE2      LYS  37 -25.210  13.590  -6.953
  162    HZ1  LYS  37           HZ1      LYS  37 -23.343  13.366  -9.143
  163    HZ2  LYS  37           HZ2      LYS  37 -23.361  14.888  -8.405
  164    HZ3  LYS  37           HZ3      LYS  37 -24.789  14.238  -9.038
  165    H    GLY  38           H        GLY  38 -19.687  11.929  -2.618
  166    HA2  GLY  38           HA2      GLY  38 -19.229  13.843  -0.441
  167    HA3  GLY  38           HA3      GLY  38 -18.893  12.144  -0.145
  168    HA1  GLY  38           HA1      GLY  38 -19.120  13.905  -1.314
  169    H    SER  39           H        SER  39 -16.705  12.330   0.148
  170    HA   SER  39           HA       SER  39 -15.113  13.593  -1.951
  171    HB2  SER  39           HB1      SER  39 -14.798  13.782   0.682
  172    HB3  SER  39           HB2      SER  39 -13.862  12.297   0.432
  173    HG   SER  39           HG       SER  39 -12.964  14.681   0.118
  174    H    GLN  40           H        GLN  40 -12.935  12.350  -2.342
  175    HA   GLN  40           HA       GLN  40 -13.665   9.874  -3.594
  176    HB2  GLN  40           HB1      GLN  40 -11.216  11.585  -3.483
  177    HB3  GLN  40           HB2      GLN  40 -11.055   9.903  -4.012
  178    HG2  GLN  40           HG1      GLN  40 -13.254  10.953  -5.416
  179    HG3  GLN  40           HG2      GLN  40 -11.980  12.179  -5.475
  180   HE21  GLN  40          HE21      GLN  40 -10.663  12.010  -7.127
  181   HE22  GLN  40          HE22      GLN  40 -10.244  10.555  -7.959
  182    H    CYS  41           H        CYS  41 -11.221  10.737  -1.141
  183    HA   CYS  41           HA       CYS  41 -11.750   8.284   0.295
  184    HB2  CYS  41           HB1      CYS  41  -9.470   7.442   0.210
  185    HB3  CYS  41           HB2      CYS  41 -10.136   7.553  -1.420
  186    H    LEU  42           H        LEU  42 -11.133   8.377   2.430
  187    HA   LEU  42           HA       LEU  42 -10.361  11.014   3.387
  188    HB2  LEU  42           HB1      LEU  42 -12.291   9.625   4.315
  189    HB3  LEU  42           HB2      LEU  42 -11.042   8.616   5.066
  190    HG   LEU  42           HG       LEU  42 -10.846  11.506   5.625
  191   HD11  LEU  42          HD11      LEU  42 -12.629  10.782   7.543
  192   HD12  LEU  42          HD12      LEU  42 -13.301   9.985   6.121
  193   HD13  LEU  42          HD13      LEU  42 -13.023  11.726   6.106
  194   HD21  LEU  42          HD21      LEU  42  -9.461   9.559   6.565
  195   HD22  LEU  42          HD22      LEU  42 -10.876   9.217   7.562
  196   HD23  LEU  42          HD23      LEU  42 -10.059  10.775   7.693
  197    H    SER  43           H        SER  43  -9.082   7.787   3.131
  198    HA   SER  43           HA       SER  43  -6.483   8.766   4.012
  199    HB2  SER  43           HB1      SER  43  -8.044   6.582   5.369
  200    HB3  SER  43           HB2      SER  43  -6.272   6.524   5.343
  201    HG   SER  43           HG       SER  43  -7.948   8.172   6.764
  202    H    ASP  44           H        ASP  44  -4.908   6.697   3.870
  203    HA   ASP  44           HA       ASP  44  -4.922   5.984   1.101
  204    HB2  ASP  44           HB1      ASP  44  -3.133   4.882   3.280
  205    HB3  ASP  44           HB2      ASP  44  -2.813   4.909   1.541
  206    HD2  ASP  44           HD       ASP  44  -1.306   7.796   3.371
  207    H    THR  45           H        THR  45  -5.719   4.358   4.103
  208    HA   THR  45           HA       THR  45  -5.765   1.713   3.244
  209    HB   THR  45           HB       THR  45  -7.696   1.522   4.998
  210    HG1  THR  45           HG1      THR  45  -6.647   4.018   5.825
  211   HG21  THR  45          HG21      THR  45  -5.282   0.902   5.301
  212   HG22  THR  45          HG22      THR  45  -6.094   1.436   6.773
  213   HG23  THR  45          HG23      THR  45  -5.007   2.530   5.920
  214    H    ASP  46           H        ASP  46  -7.967   4.316   2.603
  215    HA   ASP  46           HA       ASP  46 -10.172   2.702   1.778
  216    HB2  ASP  46           HB1      ASP  46  -9.504   5.558   1.877
  217    HB3  ASP  46           HB2      ASP  46 -10.509   5.112   0.492
  218    HD2  ASP  46           HD       ASP  46 -13.281   4.630   2.459
  219    H    CYS  47           H        CYS  47  -7.293   3.895   0.250
  220    HA   CYS  47           HA       CYS  47  -8.145   3.613  -2.445
  221    HB2  CYS  47           HB1      CYS  47  -6.111   4.900  -1.464
  222    HB3  CYS  47           HB2      CYS  47  -5.282   3.345  -1.570
  223    H    ASN  48           H        ASN  48  -6.877   1.414  -0.065
  224    HA   ASN  48           HA       ASN  48  -6.602  -0.843  -0.051
  225    HB2  ASN  48           HB1      ASN  48  -8.859  -0.400  -1.567
  226    HB3  ASN  48           HB2      ASN  48  -7.863  -1.385  -2.645
  227   HD21  ASN  48          HD21      ASN  48 -10.350  -1.831  -0.923
  228   HD22  ASN  48          HD22      ASN  48 -10.014  -3.319  -0.112
  229    H    THR  49           H        THR  49  -5.524  -2.653  -1.194
  230    HA   THR  49           HA       THR  49  -3.760  -3.507  -2.353
  231    HB   THR  49           HB       THR  49  -3.730  -1.513  -4.506
  232    HG1  THR  49           HG1      THR  49  -5.792  -1.658  -5.082
  233   HG21  THR  49          HG21      THR  49  -4.504  -4.352  -4.900
  234   HG22  THR  49          HG22      THR  49  -2.882  -4.028  -4.288
  235   HG23  THR  49          HG23      THR  49  -3.396  -3.342  -5.828
  236    H    ARG  50           H        ARG  50  -1.656  -2.637  -3.659
  237    HA   ARG  50           HA       ARG  50  -0.235  -1.085  -1.705
  238    HB2  ARG  50           HB1      ARG  50   0.784  -1.963  -4.409
  239    HB3  ARG  50           HB2      ARG  50   1.728  -1.590  -2.959
  240    HG2  ARG  50           HG1      ARG  50  -0.191  -3.909  -3.182
  241    HG3  ARG  50           HG2      ARG  50   1.557  -4.014  -3.456
  242    HD2  ARG  50           HD1      ARG  50   1.212  -2.687  -0.983
  243    HD3  ARG  50           HD2      ARG  50   0.110  -4.071  -0.985
  244    HE   ARG  50           HE       ARG  50   2.417  -5.160  -1.855
  245   HH11  ARG  50          HH11      ARG  50   1.633  -3.145   0.873
  246   HH12  ARG  50          HH12      ARG  50   2.876  -3.806   1.884
  247   HH21  ARG  50          HH21      ARG  50   4.057  -6.038  -0.534
  248   HH22  ARG  50          HH22      ARG  50   4.254  -5.450   1.082
  249    H    LYS  51           H        LYS  51  -1.973   0.688  -2.302
  250    HA   LYS  51           HA       LYS  51  -0.561   2.612  -3.999
  251    HB2  LYS  51           HB1      LYS  51  -3.413   1.714  -4.299
  252    HB3  LYS  51           HB2      LYS  51  -2.944   3.360  -4.752
  253    HG2  LYS  51           HG1      LYS  51  -2.475   2.520  -6.758
  254    HG3  LYS  51           HG2      LYS  51  -1.032   1.833  -5.991
  255    HD2  LYS  51           HD1      LYS  51  -2.275  -0.228  -5.486
  256    HD3  LYS  51           HD2      LYS  51  -3.706   0.459  -6.276
  257    HE2  LYS  51           HE1      LYS  51  -1.882   0.785  -8.249
  258    HE3  LYS  51           HE2      LYS  51  -1.241  -0.661  -7.454
  259    HZ1  LYS  51           HZ1      LYS  51  -4.101  -0.500  -8.149
  260    HZ2  LYS  51           HZ2      LYS  51  -3.133  -1.871  -7.930
  261    HZ3  LYS  51           HZ3      LYS  51  -2.962  -0.929  -9.325
  262    H    PHE  52           H        PHE  52  -0.719   4.730  -3.336
  263    HA   PHE  52           HA       PHE  52  -2.047   5.138  -0.743
  264    HB2  PHE  52           HB1      PHE  52  -0.452   7.072  -0.501
  265    HB3  PHE  52           HB2      PHE  52   0.308   5.479  -0.534
  266    HD1  PHE  52           HD1      PHE  52  -0.330   8.510  -2.534
  267    HD2  PHE  52           HD2      PHE  52   1.842   4.862  -2.223
  268    HE1  PHE  52           HE1      PHE  52   1.126   9.223  -4.385
  269    HE2  PHE  52           HE2      PHE  52   3.302   5.569  -4.073
  270    HZ   PHE  52           HZ       PHE  52   2.946   7.753  -5.157
  271    H    CYS  53           H        CYS  53  -3.234   7.029  -0.360
  272    HA   CYS  53           HA       CYS  53  -4.518   8.102  -2.723
  273    HB2  CYS  53           HB1      CYS  53  -5.149   7.828   0.106
  274    HB3  CYS  53           HB2      CYS  53  -5.538   9.440  -0.498
  275    H    LEU  54           H        LEU  54  -3.204   9.533  -3.744
  276    HA   LEU  54           HA       LEU  54  -1.683  11.505  -2.301
  277    HB2  LEU  54           HB1      LEU  54  -0.843  10.527  -4.381
  278    HB3  LEU  54           HB2      LEU  54  -2.230  11.204  -5.252
  279    HG   LEU  54           HG       LEU  54  -1.195  13.466  -4.224
  280   HD11  LEU  54          HD11      LEU  54   1.378  12.760  -5.004
  281   HD12  LEU  54          HD12      LEU  54   0.864  11.466  -3.923
  282   HD13  LEU  54          HD13      LEU  54   0.829  13.141  -3.372
  283   HD21  LEU  54          HD21      LEU  54  -0.863  11.999  -6.773
  284   HD22  LEU  54          HD22      LEU  54   0.189  13.389  -6.505
  285   HD23  LEU  54          HD23      LEU  54  -1.564  13.586  -6.458
  286    H    GLN  55           H        GLN  55  -2.177  13.593  -1.928
  287    HA   GLN  55           HA       GLN  55  -4.615  14.687  -3.151
  288    HB2  GLN  55           HB1      GLN  55  -5.058  15.813  -0.915
  289    HB3  GLN  55           HB2      GLN  55  -5.363  14.071  -0.996
  290    HG2  GLN  55           HG1      GLN  55  -3.842  13.606   0.564
  291    HG3  GLN  55           HG2      GLN  55  -2.652  14.696  -0.161
  292   HE21  GLN  55          HE21      GLN  55  -5.430  14.530   1.972
  293   HE22  GLN  55          HE22      GLN  55  -5.080  15.976   2.850
  294    HA   PRO  56           HA       PRO  56  -1.180  17.646  -3.804
  295    HB2  PRO  56           HB1      PRO  56  -2.124  18.536  -6.215
  296    HB3  PRO  56           HB2      PRO  56  -1.146  17.081  -6.030
  297    HG2  PRO  56           HG1      PRO  56  -4.125  17.356  -6.241
  298    HG3  PRO  56           HG2      PRO  56  -3.026  16.193  -7.071
  299    HD2  PRO  56           HD1      PRO  56  -4.519  15.511  -4.909
  300    HD3  PRO  56           HD2      PRO  56  -2.915  14.825  -5.219
  301    H    ARG  57           H        ARG  57  -1.166  19.926  -3.765
  302    HA   ARG  57           HA       ARG  57  -3.526  21.089  -2.572
  303    HB2  ARG  57           HB1      ARG  57  -2.088  23.109  -2.318
  304    HB3  ARG  57           HB2      ARG  57  -1.410  21.649  -1.581
  305    HG2  ARG  57           HG1      ARG  57   0.407  21.692  -2.873
  306    HG3  ARG  57           HG2      ARG  57  -0.544  22.023  -4.331
  307    HD2  ARG  57           HD1      ARG  57  -0.435  24.320  -4.063
  308    HD3  ARG  57           HD2      ARG  57  -0.159  24.192  -2.319
  309    HE   ARG  57           HE       ARG  57   2.073  23.083  -3.383
  310   HH11  ARG  57          HH11      ARG  57   0.424  26.111  -3.864
  311   HH12  ARG  57          HH12      ARG  57   1.867  26.985  -4.255
  312   HH21  ARG  57          HH21      ARG  57   3.980  24.223  -3.897
  313   HH22  ARG  57          HH22      ARG  57   3.891  25.909  -4.275
  314    H    ASP  58           H        ASP  58  -1.877  21.149  -5.633
  315    HA   ASP  58           HA       ASP  58  -3.419  23.420  -6.596
  316    HB2  ASP  58           HB1      ASP  58  -0.920  22.319  -7.246
  317    HB3  ASP  58           HB2      ASP  58  -1.949  21.998  -8.647
  318    HD2  ASP  58           HD       ASP  58  -1.638  25.852  -7.751
  319    H    GLU  59           H        GLU  59  -3.533  19.975  -6.627
  320    HA   GLU  59           HA       GLU  59  -5.771  20.074  -8.544
  321    HB2  GLU  59           HB1      GLU  59  -3.418  18.380  -8.442
  322    HB3  GLU  59           HB2      GLU  59  -4.906  17.421  -8.408
  323    HG2  GLU  59           HG1      GLU  59  -4.698  19.602 -10.419
  324    HG3  GLU  59           HG2      GLU  59  -3.753  18.128 -10.671
  325    HE2  GLU  59           HE       GLU  59  -7.633  17.373 -10.447
  326    H    LYS  60           H        LYS  60  -7.082  17.858  -8.223
  327    HA   LYS  60           HA       LYS  60  -8.089  18.016  -5.499
  328    HB2  LYS  60           HB1      LYS  60  -9.116  17.082  -8.116
  329    HB3  LYS  60           HB2      LYS  60  -9.703  16.206  -6.693
  330    HG2  LYS  60           HG1      LYS  60 -10.917  17.959  -5.924
  331    HG3  LYS  60           HG2      LYS  60  -9.774  19.157  -6.555
  332    HD2  LYS  60           HD1      LYS  60 -11.414  19.536  -8.067
  333    HD3  LYS  60           HD2      LYS  60 -10.689  18.132  -8.872
  334    HE2  LYS  60           HE1      LYS  60 -12.872  17.445  -8.842
  335    HE3  LYS  60           HE2      LYS  60 -12.338  16.813  -7.277
  336    HZ1  LYS  60           HZ1      LYS  60 -13.111  19.302  -6.632
  337    HZ2  LYS  60           HZ2      LYS  60 -14.094  17.933  -6.499
  338    HZ3  LYS  60           HZ3      LYS  60 -14.212  18.930  -7.862
  339    HA   PRO  61           HA       PRO  61  -6.419  14.250  -3.989
  340    HB2  PRO  61           HB1      PRO  61  -8.501  13.215  -2.542
  341    HB3  PRO  61           HB2      PRO  61  -7.574  14.627  -2.039
  342    HG2  PRO  61           HG1      PRO  61 -10.208  14.490  -3.466
  343    HG3  PRO  61           HG2      PRO  61  -9.720  15.523  -2.070
  344    HD2  PRO  61           HD1      PRO  61  -9.836  16.458  -4.615
  345    HD3  PRO  61           HD2      PRO  61  -8.641  17.031  -3.438
  346    H    PHE  62           H        PHE  62  -6.052  12.284  -4.814
  347    HA   PHE  62           HA       PHE  62  -8.210  10.650  -5.833
  348    HB2  PHE  62           HB1      PHE  62  -7.411  10.429  -8.073
  349    HB3  PHE  62           HB2      PHE  62  -7.564  12.156  -7.741
  350    HD1  PHE  62           HD1      PHE  62  -5.311   9.501  -8.645
  351    HD2  PHE  62           HD2      PHE  62  -5.529  13.509  -7.230
  352    HE1  PHE  62           HE1      PHE  62  -2.965   9.854  -9.298
  353    HE2  PHE  62           HE2      PHE  62  -3.183  13.869  -7.882
  354    HZ   PHE  62           HZ       PHE  62  -1.899  12.041  -8.918
  355    H    CYS  63           H        CYS  63  -7.306   8.521  -6.695
  356    HA   CYS  63           HA       CYS  63  -5.417   7.531  -4.748
  357    HB2  CYS  63           HB1      CYS  63  -7.393   6.397  -6.606
  358    HB3  CYS  63           HB2      CYS  63  -5.929   5.426  -6.439
  359    H    ALA  64           H        ALA  64  -3.305   7.285  -5.046
  360    HA   ALA  64           HA       ALA  64  -2.235   7.569  -7.766
  361    HB1  ALA  64           HB1      ALA  64  -0.058   7.992  -6.521
  362    HB2  ALA  64           HB2      ALA  64  -1.312   9.224  -6.377
  363    HB3  ALA  64           HB3      ALA  64  -1.041   8.084  -5.059
  364    H    THR  65           H        THR  65  -0.405   6.247  -8.389
  365    HA   THR  65           HA       THR  65  -0.638   3.531  -7.306
  366    HB   THR  65           HB       THR  65   0.849   3.123  -9.484
  367    HG1  THR  65           HG1      THR  65   1.000   4.950 -10.550
  368   HG21  THR  65          HG21      THR  65  -0.991   2.008 -10.064
  369   HG22  THR  65          HG22      THR  65  -1.831   3.514 -10.433
  370   HG23  THR  65          HG23      THR  65  -1.869   2.860  -8.795
  371    H    CYS  66           H        CYS  66   1.449   2.220  -7.450
  372    HA   CYS  66           HA       CYS  66   3.306   3.165  -5.640
  373    HB2  CYS  66           HB1      CYS  66   2.875   0.790  -6.940
  374    HB3  CYS  66           HB2      CYS  66   4.418   1.302  -7.626
  375    H    ARG  67           H        ARG  67   5.510   3.824  -5.861
  376    HA   ARG  67           HA       ARG  67   6.020   5.291  -8.364
  377    HB2  ARG  67           HB1      ARG  67   6.842   5.917  -5.522
  378    HB3  ARG  67           HB2      ARG  67   7.460   6.780  -6.938
  379    HG2  ARG  67           HG1      ARG  67   4.648   6.792  -7.162
  380    HG3  ARG  67           HG2      ARG  67   5.042   7.211  -5.485
  381    HD2  ARG  67           HD1      ARG  67   6.546   8.977  -6.245
  382    HD3  ARG  67           HD2      ARG  67   6.223   8.532  -7.927
  383    HE   ARG  67           HE       ARG  67   3.798   9.130  -6.612
  384   HH11  ARG  67          HH11      ARG  67   6.658  10.658  -7.877
  385   HH12  ARG  67          HH12      ARG  67   5.867  12.166  -8.200
  386   HH21  ARG  67          HH21      ARG  67   2.746  11.110  -7.032
  387   HH22  ARG  67          HH22      ARG  67   3.643  12.422  -7.718
  388    H    GLY  68           H        GLY  68   7.731   4.694  -9.526
  389    HA2  GLY  68           HA2      GLY  68   9.340   2.497  -8.839
  390    HA3  GLY  68           HA3      GLY  68   9.662   3.622 -10.150
  391    HA1  GLY  68           HA1      GLY  68   9.207   3.039  -8.157
  392    H    LEU  69           H        LEU  69  11.904   2.955  -9.325
  393    HA   LEU  69           HA       LEU  69  12.833   4.107  -6.888
  394    HB2  LEU  69           HB1      LEU  69  14.183   2.931  -9.306
  395    HB3  LEU  69           HB2      LEU  69  15.112   3.690  -8.001
  396    HG   LEU  69           HG       LEU  69  13.305   1.290  -7.715
  397   HD11  LEU  69          HD11      LEU  69  15.189   0.500  -8.816
  398   HD12  LEU  69          HD12      LEU  69  15.587   0.252  -7.117
  399   HD13  LEU  69          HD13      LEU  69  16.267   1.625  -7.988
  400   HD21  LEU  69          HD21      LEU  69  15.032   2.752  -5.724
  401   HD22  LEU  69          HD22      LEU  69  14.328   1.159  -5.449
  402   HD23  LEU  69          HD23      LEU  69  13.280   2.559  -5.680
  403    H    ARG  70           H        ARG  70  13.306   4.982 -10.310
  404    HA   ARG  70           HA       ARG  70  14.775   7.315  -9.882
  405    HB2  ARG  70           HB1      ARG  70  12.901   6.528 -12.120
  406    HB3  ARG  70           HB2      ARG  70  13.893   7.993 -12.156
  407    HG2  ARG  70           HG1      ARG  70  15.479   6.768 -13.114
  408    HG3  ARG  70           HG2      ARG  70  15.701   5.998 -11.534
  409    HD2  ARG  70           HD1      ARG  70  14.299   4.179 -12.093
  410    HD3  ARG  70           HD2      ARG  70  13.647   5.028 -13.501
  411    HE   ARG  70           HE       ARG  70  16.455   4.643 -13.739
  412   HH11  ARG  70          HH11      ARG  70  13.390   3.015 -14.021
  413   HH12  ARG  70          HH12      ARG  70  13.966   1.849 -15.165
  414   HH21  ARG  70          HH21      ARG  70  17.226   3.113 -15.246
  415   HH22  ARG  70          HH22      ARG  70  16.148   1.906 -15.860
  416    H    ARG  71           H        ARG  71  11.386   6.686  -9.548
  417    HA   ARG  71           HA       ARG  71  10.369   9.287  -9.787
  418    HB2  ARG  71           HB1      ARG  71   9.445   6.872  -8.236
  419    HB3  ARG  71           HB2      ARG  71   8.538   8.392  -8.242
  420    HG2  ARG  71           HG1      ARG  71   9.280   6.951 -10.781
  421    HG3  ARG  71           HG2      ARG  71   7.792   6.612  -9.879
  422    HD2  ARG  71           HD1      ARG  71   6.850   8.655 -10.366
  423    HD3  ARG  71           HD2      ARG  71   8.424   9.442 -10.550
  424    HE   ARG  71           HE       ARG  71   8.257   7.634 -12.618
  425   HH11  ARG  71          HH11      ARG  71   6.427  10.380 -11.510
  426   HH12  ARG  71          HH12      ARG  71   5.883  10.821 -13.094
  427   HH21  ARG  71          HH21      ARG  71   7.547   8.205 -14.709
  428   HH22  ARG  71          HH22      ARG  71   6.520   9.583 -14.913
  429    H    ARG  72           H        ARG  72  10.046  10.937  -8.336
  430    HA   ARG  72           HA       ARG  72  11.854  10.998  -6.081
  431    HB2  ARG  72           HB1      ARG  72  10.071  13.019  -7.419
  432    HB3  ARG  72           HB2      ARG  72  10.831  13.365  -5.859
  433    HG2  ARG  72           HG1      ARG  72  12.890  12.384  -7.490
  434    HG3  ARG  72           HG2      ARG  72  11.951  13.500  -8.496
  435    HD2  ARG  72           HD1      ARG  72  12.728  14.291  -5.708
  436    HD3  ARG  72           HD2      ARG  72  13.900  14.408  -7.027
  437    HE   ARG  72           HE       ARG  72  11.531  15.648  -7.849
  438   HH11  ARG  72          HH11      ARG  72  14.088  16.084  -5.527
  439   HH12  ARG  72          HH12      ARG  72  13.946  17.811  -5.500
  440   HH21  ARG  72          HH21      ARG  72  11.335  17.921  -7.823
  441   HH22  ARG  72          HH22      ARG  72  12.379  18.855  -6.806
  442    H    CYS  73           H        CYS  73  11.230  11.512  -3.925
  443    HA   CYS  73           HA       CYS  73   8.438  11.348  -3.190
  444    HB2  CYS  73           HB1      CYS  73   8.615   9.402  -1.791
  445    HB3  CYS  73           HB2      CYS  73   9.148   8.966  -3.415
  446    H    GLN  74           H        GLN  74   8.024  12.056  -1.079
  447    HA   GLN  74           HA       GLN  74  10.314  13.385   0.205
  448    HB2  GLN  74           HB1      GLN  74   7.759  14.338  -0.558
  449    HB3  GLN  74           HB2      GLN  74   7.789  14.304   1.212
  450    HG2  GLN  74           HG1      GLN  74  10.212  15.420   0.664
  451    HG3  GLN  74           HG2      GLN  74   9.217  16.041  -0.661
  452   HE21  GLN  74          HE21      GLN  74   7.342  17.263  -0.155
  453   HE22  GLN  74          HE22      GLN  74   7.214  18.099   1.352
  454    H    ARG  75           H        ARG  75   7.745  11.105   0.655
  455    HA   ARG  75           HA       ARG  75   8.656  10.680   3.423
  456    HB2  ARG  75           HB1      ARG  75   5.832  10.527   2.347
  457    HB3  ARG  75           HB2      ARG  75   6.317   9.959   3.951
  458    HG2  ARG  75           HG1      ARG  75   6.450  12.038   4.816
  459    HG3  ARG  75           HG2      ARG  75   7.062  12.733   3.306
  460    HD2  ARG  75           HD1      ARG  75   4.882  12.833   2.349
  461    HD3  ARG  75           HD2      ARG  75   4.211  11.836   3.647
  462    HE   ARG  75           HE       ARG  75   5.340  14.208   4.704
  463   HH11  ARG  75          HH11      ARG  75   2.584  13.028   2.935
  464   HH12  ARG  75          HH12      ARG  75   1.527  14.286   3.486
  465   HH21  ARG  75          HH21      ARG  75   3.958  15.868   5.438
  466   HH22  ARG  75          HH22      ARG  75   2.310  15.900   4.909
  467    H    ASP  76           H        ASP  76   9.055   8.610   4.025
  468    HA   ASP  76           HA       ASP  76   9.659   6.672   2.147
  469    HB2  ASP  76           HB1      ASP  76  10.493   6.681   4.477
  470    HB3  ASP  76           HB2      ASP  76   8.883   6.208   5.034
  471    HD2  ASP  76           HD       ASP  76  10.457   3.366   2.798
  472    H    ALA  77           H        ALA  77   6.617   7.389   3.681
  473    HA   ALA  77           HA       ALA  77   5.295   4.955   3.081
  474    HB1  ALA  77           HB1      ALA  77   4.382   7.703   3.830
  475    HB2  ALA  77           HB2      ALA  77   3.214   6.483   3.321
  476    HB3  ALA  77           HB3      ALA  77   4.238   6.191   4.727
  477    H    MET  78           H        MET  78   5.789   7.944   1.305
  478    HA   MET  78           HA       MET  78   3.907   7.438  -0.751
  479    HB2  MET  78           HB1      MET  78   6.253   9.269  -0.418
  480    HB3  MET  78           HB2      MET  78   5.528   9.075  -2.020
  481    HG2  MET  78           HG1      MET  78   3.681   9.637   0.235
  482    HG3  MET  78           HG2      MET  78   4.745  10.942  -0.297
  483    HE1  MET  78           HE1      MET  78   4.099  12.347  -2.909
  484    HE2  MET  78           HE2      MET  78   5.269  11.029  -2.850
  485    HE3  MET  78           HE3      MET  78   4.015  11.042  -4.092
  486    H    CYS  79           H        CYS  79   7.213   6.460  -0.215
  487    HA   CYS  79           HA       CYS  79   7.714   5.586  -2.887
  488    HB2  CYS  79           HB1      CYS  79   9.388   6.178  -0.974
  489    HB3  CYS  79           HB2      CYS  79   9.157   4.498  -0.492
  490    H    CYS  80           H        CYS  80   8.137   3.321  -3.474
  491    HA   CYS  80           HA       CYS  80   5.904   1.688  -2.976
  492    HB2  CYS  80           HB1      CYS  80   8.541   1.318  -4.342
  493    HB3  CYS  80           HB2      CYS  80   7.556  -0.107  -4.007
  494    HA   PRO  81           HA       PRO  81   6.879  -0.611   0.631
  495    HB2  PRO  81           HB1      PRO  81   5.980  -3.119  -0.006
  496    HB3  PRO  81           HB2      PRO  81   4.912  -1.755   0.318
  497    HG2  PRO  81           HG1      PRO  81   5.855  -2.846  -2.312
  498    HG3  PRO  81           HG2      PRO  81   4.195  -2.351  -1.812
  499    HD2  PRO  81           HD1      PRO  81   5.800  -0.777  -3.337
  500    HD3  PRO  81           HD2      PRO  81   4.653  -0.118  -2.157
  501    H    GLY  82           H        GLY  82   8.899  -1.075   1.236
  502    HA2  GLY  82           HA2      GLY  82  10.551  -2.853   1.444
  503    HA3  GLY  82           HA3      GLY  82  10.352  -3.153  -0.277
  504    HA1  GLY  82           HA1      GLY  82  10.443  -1.979   1.493
  505    H    THR  83           H        THR  83  10.257   0.035  -0.235
  506    HA   THR  83           HA       THR  83  13.186   0.313  -0.427
  507    HB   THR  83           HB       THR  83  12.399   2.356  -1.947
  508    HG1  THR  83           HG1      THR  83  10.360   0.406  -2.367
  509   HG21  THR  83          HG21      THR  83  13.165  -0.406  -2.451
  510   HG22  THR  83          HG22      THR  83  13.713   1.078  -3.233
  511   HG23  THR  83          HG23      THR  83  12.233   0.289  -3.777
  512    H    LEU  84           H        LEU  84  13.856   2.708  -0.271
  513    HA   LEU  84           HA       LEU  84  12.306   4.042   1.847
  514    HB2  LEU  84           HB1      LEU  84  15.256   3.480   1.705
  515    HB3  LEU  84           HB2      LEU  84  14.615   4.821   2.672
  516    HG   LEU  84           HG       LEU  84  13.574   2.050   3.104
  517   HD11  LEU  84          HD11      LEU  84  15.543   1.284   3.771
  518   HD12  LEU  84          HD12      LEU  84  15.575   2.535   5.012
  519   HD13  LEU  84          HD13      LEU  84  16.307   2.838   3.437
  520   HD21  LEU  84          HD21      LEU  84  14.110   3.964   5.288
  521   HD22  LEU  84          HD22      LEU  84  12.738   2.886   5.032
  522   HD23  LEU  84          HD23      LEU  84  12.841   4.410   4.147
  523    H    CYS  85           H        CYS  85  12.821   6.369   2.069
  524    HA   CYS  85           HA       CYS  85  13.090   7.563  -0.581
  525    HB2  CYS  85           HB1      CYS  85  11.925   8.415   2.033
  526    HB3  CYS  85           HB2      CYS  85  12.487   9.672   0.927
  527    H    VAL  86           H        VAL  86  15.220   7.722  -1.074
  528    HA   VAL  86           HA       VAL  86  16.961   9.104   0.859
  529    HB   VAL  86           HB       VAL  86  17.781   7.312  -1.431
  530   HG11  VAL  86          HG11      VAL  86  20.012   7.429  -0.242
  531   HG12  VAL  86          HG12      VAL  86  19.504   8.893  -1.086
  532   HG13  VAL  86          HG13      VAL  86  19.351   8.786   0.669
  533   HG21  VAL  86          HG21      VAL  86  17.458   6.828   1.510
  534   HG22  VAL  86          HG22      VAL  86  16.874   5.863   0.153
  535   HG23  VAL  86          HG23      VAL  86  18.592   5.878   0.549
  536    H    ASN  87           H        ASN  87  17.720  11.056   0.350
  537    HA   ASN  87           HA       ASN  87  18.070  12.996  -0.784
  538    HB2  ASN  87           HB1      ASN  87  19.555  11.158  -2.015
  539    HB3  ASN  87           HB2      ASN  87  18.461  11.533  -3.354
  540   HD21  ASN  87          HD21      ASN  87  20.040  12.479  -4.602
  541   HD22  ASN  87          HD22      ASN  87  20.736  14.013  -4.222
  542    H    ASP  88           H        ASP  88  15.381  12.135  -0.591
  543    HA   ASP  88           HA       ASP  88  13.314  12.695  -1.357
  544    HB2  ASP  88           HB1      ASP  88  15.043  14.757  -2.232
  545    HB3  ASP  88           HB2      ASP  88  13.970  14.385  -3.588
  546    HD2  ASP  88           HD       ASP  88  12.320  15.863  -0.293
  547    H    VAL  89           H        VAL  89  14.943  10.515  -2.590
  548    HA   VAL  89           HA       VAL  89  13.223  10.109  -4.926
  549    HB   VAL  89           HB       VAL  89  16.202   9.609  -4.966
  550   HG11  VAL  89          HG11      VAL  89  15.140   7.932  -6.263
  551   HG12  VAL  89          HG12      VAL  89  14.027   9.098  -6.983
  552   HG13  VAL  89          HG13      VAL  89  15.741   9.139  -7.400
  553   HG21  VAL  89          HG21      VAL  89  15.760  11.309  -7.001
  554   HG22  VAL  89          HG22      VAL  89  14.526  11.863  -5.869
  555   HG23  VAL  89          HG23      VAL  89  16.219  11.832  -5.380
  556    H    CYS  90           H        CYS  90  12.693   7.975  -5.347
  557    HA   CYS  90           HA       CYS  90  12.733   6.207  -3.139
  558    HB2  CYS  90           HB1      CYS  90  11.771   6.108  -5.955
  559    HB3  CYS  90           HB2      CYS  90  12.000   4.566  -5.129
  560    H    THR  91           H        THR  91  14.528   5.250  -2.442
  561    HA   THR  91           HA       THR  91  16.337   4.054  -4.442
  562    HB   THR  91           HB       THR  91  17.054   5.152  -1.717
  563    HG1  THR  91           HG1      THR  91  18.449   6.446  -3.323
  564   HG21  THR  91          HG21      THR  91  18.712   3.748  -3.808
  565   HG22  THR  91          HG22      THR  91  18.440   3.253  -2.138
  566   HG23  THR  91          HG23      THR  91  19.401   4.689  -2.486
  567    H    THR  92           H        THR  92  17.050   1.977  -4.118
  568    HA   THR  92           HA       THR  92  15.407   0.286  -2.516
  569    HB   THR  92           HB       THR  92  17.853  -0.990  -3.416
  570    HG1  THR  92           HG1      THR  92  17.768  -0.475  -5.541
  571   HG21  THR  92          HG21      THR  92  14.904  -1.287  -3.864
  572   HG22  THR  92          HG22      THR  92  16.030  -2.392  -3.073
  573   HG23  THR  92          HG23      THR  92  16.052  -2.214  -4.828
  574    H    MET  93           H        MET  93  15.977  -0.985  -0.735
  575    HA   MET  93           HA       MET  93  17.638   0.253   1.177
  576    HB2  MET  93           HB1      MET  93  15.651  -1.232   1.636
  577    HB3  MET  93           HB2      MET  93  16.683  -2.611   1.231
  578    HG2  MET  93           HG1      MET  93  18.221  -1.998   3.049
  579    HG3  MET  93           HG2      MET  93  17.158  -0.650   3.463
  580    HE1  MET  93           HE1      MET  93  14.503  -1.083   4.214
  581    HE2  MET  93           HE2      MET  93  14.565  -2.054   5.685
  582    HE3  MET  93           HE3      MET  93  15.768  -0.794   5.410
  583    H    GLU  94           H        GLU  94  18.149  -2.433  -1.038
  584    HA   GLU  94           HA       GLU  94  20.498  -3.485   0.007
  585    HB2  GLU  94           HB1      GLU  94  19.318  -3.343  -2.740
  586    HB3  GLU  94           HB2      GLU  94  20.971  -3.948  -2.542
  587    HG2  GLU  94           HG1      GLU  94  19.118  -5.164  -0.658
  588    HG3  GLU  94           HG2      GLU  94  18.652  -5.424  -2.343
  589    HE2  GLU  94           HE       GLU  94  21.284  -7.794  -1.048
  590    H    ASP  95           H        ASP  95  19.972  -0.618  -1.932
  591    HA   ASP  95           HA       ASP  95  22.825  -0.160  -2.259
  592    HB2  ASP  95           HB1      ASP  95  21.466   0.392  -4.159
  593    HB3  ASP  95           HB2      ASP  95  20.391   1.382  -3.165
  594    HD2  ASP  95           HD       ASP  95  23.959   2.934  -3.984
  595    H    ALA  96           H        ALA  96  20.092   1.145  -0.461
  596    HA   ALA  96           HA       ALA  96  21.564   3.328   0.665
  597    HB1  ALA  96           HB1      ALA  96  19.558   3.444   2.220
  598    HB2  ALA  96           HB2      ALA  96  19.241   3.656   0.497
  599    HB3  ALA  96           HB3      ALA  96  18.885   2.114   1.277
  600    H    THR  97           H        THR  97  23.108   3.101   2.131
  601    HA   THR  97           HA       THR  97  22.684   1.363   4.424
  602    HB   THR  97           HB       THR  97  25.366   0.874   3.793
  603    HG1  THR  97           HG1      THR  97  25.468   0.568   1.695
  604   HG21  THR  97          HG21      THR  97  24.747  -1.376   3.886
  605   HG22  THR  97          HG22      THR  97  23.156  -1.066   3.192
  606   HG23  THR  97          HG23      THR  97  23.507  -0.573   4.847
  607    H    GLU  98           H        GLU  98  22.902   2.789   6.024
  608    HA   GLU  98           HA       GLU  98  24.642   5.064   5.836
  609    HB2  GLU  98           HB1      GLU  98  23.142   3.992   8.239
  610    HB3  GLU  98           HB2      GLU  98  23.859   5.603   8.080
  611    HG2  GLU  98           HG1      GLU  98  22.281   5.721   5.962
  612    HG3  GLU  98           HG2      GLU  98  21.381   4.501   6.875
  613    HE2  GLU  98           HE       GLU  98  21.097   8.226   7.980
  614    H    ASN  99           H        ASN  99  24.841   1.862   7.156
  615    HA   ASN  99           HA       ASN  99  26.475   0.730   8.266
  616    HB2  ASN  99           HB1      ASN  99  27.688   2.244   6.202
  617    HB3  ASN  99           HB2      ASN  99  28.753   2.353   7.609
  618   HD21  ASN  99          HD21      ASN  99  27.730   0.437   5.029
  619   HD22  ASN  99          HD22      ASN  99  28.574  -1.011   5.447
  620    H    LEU 100           H        LEU 100  28.734   1.329   9.581
  621    HA   LEU 100           HA       LEU 100  27.858   3.289  11.599
  622    HB2  LEU 100           HB1      LEU 100  29.459   1.893  13.092
  623    HB3  LEU 100           HB2      LEU 100  27.835   1.286  12.728
  624    HG   LEU 100           HG       LEU 100  29.977   0.388  10.907
  625   HD11  LEU 100          HD11      LEU 100  30.262  -1.466  12.850
  626   HD12  LEU 100          HD12      LEU 100  30.108   0.000  13.818
  627   HD13  LEU 100          HD13      LEU 100  31.373  -0.119  12.594
  628   HD21  LEU 100          HD21      LEU 100  28.353  -1.634  12.150
  629   HD22  LEU 100          HD22      LEU 100  28.449  -1.158  10.454
  630   HD23  LEU 100          HD23      LEU 100  27.348  -0.316  11.546
  631    H    TYR 101           H        TYR 101  30.456   2.218   9.557
  632    HA   TYR 101           HA       TYR 101  32.193   4.329  10.648
  633    HB2  TYR 101           HB1      TYR 101  32.700   1.617   9.627
  634    HB3  TYR 101           HB2      TYR 101  33.803   2.842   8.996
  635    HD1  TYR 101           HD1      TYR 101  35.774   3.126  10.146
  636    HD2  TYR 101           HD2      TYR 101  32.304   1.951  12.309
  637    HE1  TYR 101           HE1      TYR 101  37.102   3.036  12.215
  638    HE2  TYR 101           HE2      TYR 101  33.622   1.861  14.385
  639    HH   TYR 101           HH       TYR 101  35.668   1.961  15.272
  640    H    PHE 102           H        PHE 102  33.090   5.853   9.303
  641    HA   PHE 102           HA       PHE 102  32.164   5.838   6.507
  642    HB2  PHE 102           HB1      PHE 102  31.740   8.188   6.582
  643    HB3  PHE 102           HB2      PHE 102  30.927   7.467   7.971
  644    HD1  PHE 102           HD1      PHE 102  33.274   9.926   6.905
  645    HD2  PHE 102           HD2      PHE 102  32.089   7.553  10.234
  646    HE1  PHE 102           HE1      PHE 102  34.441  11.475   8.419
  647    HE2  PHE 102           HE2      PHE 102  33.254   9.099  11.754
  648    HZ   PHE 102           HZ       PHE 102  34.431  11.063  10.847
  649    H    GLN 103           H        GLN 103  33.474   7.265   5.076
  650    HA   GLN 103           HA       GLN 103  36.170   7.854   5.951
  651    HB2  GLN 103           HB1      GLN 103  36.171   5.420   5.328
  652    HB3  GLN 103           HB2      GLN 103  35.748   5.908   3.680
  653    HG2  GLN 103           HG1      GLN 103  37.868   6.302   3.181
  654    HG3  GLN 103           HG2      GLN 103  38.022   7.401   4.558
  655   HE21  GLN 103          HE21      GLN 103  39.093   6.755   6.341
  656   HE22  GLN 103          HE22      GLN 103  39.825   5.202   6.531
  657    H    SER 104           H        SER 104  36.577   9.795   5.151
  658    HA   SER 104           HA       SER 104  36.090  10.358   2.348
  659    HB2  SER 104           HB1      SER 104  33.989  10.977   3.718
  660    HB3  SER 104           HB2      SER 104  34.976  12.300   4.363
  661    HG   SER 104           HG       SER 104  34.619  11.842   1.588
  662    H    LEU 105           H        LEU 105  37.144  11.621   5.487
  663    HA   LEU 105           HA       LEU 105  38.935  12.878   6.104
  664    HB2  LEU 105           HB1      LEU 105  39.823  11.193   3.991
  665    HB3  LEU 105           HB2      LEU 105  40.566  12.787   3.774
  666    HG   LEU 105           HG       LEU 105  41.353  12.616   6.171
  667   HD11  LEU 105          HD11      LEU 105  40.716  10.915   7.437
  668   HD12  LEU 105          HD12      LEU 105  41.388   9.768   6.279
  669   HD13  LEU 105          HD13      LEU 105  39.720  10.316   6.111
  670   HD21  LEU 105          HD21      LEU 105  42.328  10.669   4.089
  671   HD22  LEU 105          HD22      LEU 105  43.198  11.035   5.580
  672   HD23  LEU 105          HD23      LEU 105  42.912  12.306   4.391
  673    H    GLU 106           H        GLU 106  40.493  14.711   5.131
  674    HA   GLU 106           HA       GLU 106  38.853  16.450   3.413
  675    HB2  GLU 106           HB1      GLU 106  38.912  16.918   6.006
  676    HB3  GLU 106           HB2      GLU 106  40.483  17.637   5.619
  677    HG2  GLU 106           HG1      GLU 106  38.914  19.400   5.590
  678    HG3  GLU 106           HG2      GLU 106  39.313  19.043   3.905
  679    HE2  GLU 106           HE       GLU 106  36.061  18.229   3.165
  680    H    HIS 107           H        HIS 107  40.034  16.380   1.580
  681    HA   HIS 107           HA       HIS 107  42.902  16.398   1.584
  682    HB2  HIS 107           HB1      HIS 107  42.733  16.427  -0.834
  683    HB3  HIS 107           HB2      HIS 107  41.586  15.256  -0.175
  684    HD1  HIS 107           HD1      HIS 107  39.047  15.855  -0.306
  685    HD2  HIS 107           HD2      HIS 107  41.566  18.553  -2.213
  686    HE1  HIS 107           HE1      HIS 107  37.549  17.268  -1.749
  687    HE2  HIS 107           HE2      HIS 107  39.088  18.916  -2.917
  688    H    HIS 108           H        HIS 108  43.752  18.070  -0.302
  689    HA   HIS 108           HA       HIS 108  42.731  20.743   0.130
  690    HB2  HIS 108           HB1      HIS 108  45.005  21.581   0.856
  691    HB3  HIS 108           HB2      HIS 108  44.113  20.649   2.064
  692    HD1  HIS 108           HD1      HIS 108  47.263  20.669   0.157
  693    HD2  HIS 108           HD2      HIS 108  45.115  17.992   2.499
  694    HE1  HIS 108           HE1      HIS 108  48.872  18.817   0.709
  695    HE2  HIS 108           HE2      HIS 108  47.561  17.181   2.142
  696    H    HIS 109           H        HIS 109  43.484  22.249  -1.385
  697    HA   HIS 109           HA       HIS 109  44.239  22.965  -3.408
  698    HB2  HIS 109           HB1      HIS 109  46.386  21.523  -2.236
  699    HB3  HIS 109           HB2      HIS 109  46.343  21.095  -3.949
  700    HD1  HIS 109           HD1      HIS 109  48.137  22.451  -4.994
  701    HD2  HIS 109           HD2      HIS 109  45.800  24.698  -2.395
  702    HE1  HIS 109           HE1      HIS 109  48.950  24.818  -5.235
  703    HE2  HIS 109           HE2      HIS 109  47.522  26.193  -3.648
  704    H    HIS 110           H        HIS 110  42.629  22.472  -4.801
  705    HA   HIS 110           HA       HIS 110  43.037  20.301  -6.624
  706    HB2  HIS 110           HB1      HIS 110  41.043  19.058  -6.237
  707    HB3  HIS 110           HB2      HIS 110  41.858  19.212  -4.678
  708    HD1  HIS 110           HD1      HIS 110  40.923  21.736  -3.506
  709    HD2  HIS 110           HD2      HIS 110  38.393  19.341  -5.770
  710    HE1  HIS 110           HE1      HIS 110  38.592  22.377  -2.813
  711    HE2  HIS 110           HE2      HIS 110  37.045  20.912  -4.195
  712    H    HIS 111           H        HIS 111  41.491  20.340  -8.416
  713    HA   HIS 111           HA       HIS 111  40.389  21.449 -10.069
  714    HB2  HIS 111           HB1      HIS 111  39.084  22.405  -7.565
  715    HB3  HIS 111           HB2      HIS 111  38.714  23.268  -9.060
  716    HD1  HIS 111           HD1      HIS 111  36.631  22.435 -10.071
  717    HD2  HIS 111           HD2      HIS 111  38.765  19.382  -8.231
  718    HE1  HIS 111           HE1      HIS 111  35.276  20.350 -10.442
  719    HE2  HIS 111           HE2      HIS 111  36.580  18.482  -9.318
  720    H    HIS 112           H        HIS 112  42.529  22.363 -10.586
  721    HA   HIS 112           HA       HIS 112  42.357  25.246 -10.737
  722    HB2  HIS 112           HB1      HIS 112  44.647  25.603  -9.851
  723    HB3  HIS 112           HB2      HIS 112  43.515  25.023  -8.624
  724    HD1  HIS 112           HD1      HIS 112  45.979  23.374 -11.024
  725    HD2  HIS 112           HD2      HIS 112  44.597  23.072  -7.117
  726    HE1  HIS 112           HE1      HIS 112  47.296  21.498  -9.987
  727    HE2  HIS 112           HE2      HIS 112  46.452  21.314  -7.600
  Start of MODEL    8
    1    H1   MET  18           H        MET  18 -54.411 -44.592   4.354
    2    HA   MET  18           HA       MET  18 -53.062 -43.914   2.629
    3    HB2  MET  18           HB1      MET  18 -55.751 -43.238   1.544
    4    HB3  MET  18           HB2      MET  18 -54.354 -42.429   0.817
    5    HG2  MET  18           HG1      MET  18 -53.329 -44.611   0.345
    6    HG3  MET  18           HG2      MET  18 -54.744 -45.403   1.045
    7    HE1  MET  18           HE1      MET  18 -54.184 -44.444  -3.221
    8    HE2  MET  18           HE2      MET  18 -53.159 -43.725  -1.979
    9    HE3  MET  18           HE3      MET  18 -53.326 -45.478  -2.077
   10    H    LEU  19           H        LEU  19 -51.647 -42.401   3.171
   11    HA   LEU  19           HA       LEU  19 -52.485 -39.619   3.328
   12    HB2  LEU  19           HB1      LEU  19 -52.465 -40.946   5.642
   13    HB3  LEU  19           HB2      LEU  19 -50.741 -40.551   5.540
   14    HG   LEU  19           HG       LEU  19 -51.678 -38.115   5.124
   15   HD11  LEU  19          HD11      LEU  19 -53.774 -37.654   5.816
   16   HD12  LEU  19          HD12      LEU  19 -53.754 -38.902   7.063
   17   HD13  LEU  19          HD13      LEU  19 -54.055 -39.340   5.381
   18   HD21  LEU  19          HD21      LEU  19 -51.281 -39.603   7.690
   19   HD22  LEU  19          HD22      LEU  19 -51.719 -37.895   7.700
   20   HD23  LEU  19          HD23      LEU  19 -50.232 -38.419   6.910
   21    H    VAL  20           H        VAL  20 -50.946 -38.221   2.643
   22    HA   VAL  20           HA       VAL  20 -48.306 -39.364   2.001
   23    HB   VAL  20           HB       VAL  20 -49.662 -38.765   0.015
   24   HG11  VAL  20          HG11      VAL  20 -50.728 -36.779   1.271
   25   HG12  VAL  20          HG12      VAL  20 -49.305 -35.882   0.742
   26   HG13  VAL  20          HG13      VAL  20 -50.386 -36.605  -0.450
   27   HG21  VAL  20          HG21      VAL  20 -47.885 -37.884  -1.174
   28   HG22  VAL  20          HG22      VAL  20 -47.394 -36.819   0.145
   29   HG23  VAL  20          HG23      VAL  20 -47.081 -38.552   0.248
   30    H    LEU  21           H        LEU  21 -46.465 -38.153   2.404
   31    HA   LEU  21           HA       LEU  21 -46.444 -36.525   4.660
   32    HB2  LEU  21           HB1      LEU  21 -44.548 -37.786   3.277
   33    HB3  LEU  21           HB2      LEU  21 -44.310 -36.153   2.631
   34    HG   LEU  21           HG       LEU  21 -44.114 -35.407   5.073
   35   HD11  LEU  21          HD11      LEU  21 -43.024 -37.628   6.227
   36   HD12  LEU  21          HD12      LEU  21 -44.417 -38.297   5.377
   37   HD13  LEU  21          HD13      LEU  21 -44.639 -37.000   6.550
   38   HD21  LEU  21          HD21      LEU  21 -42.156 -35.294   3.847
   39   HD22  LEU  21          HD22      LEU  21 -42.114 -37.033   3.556
   40   HD23  LEU  21          HD23      LEU  21 -41.718 -36.395   5.154
   41    H    ASP  22           H        ASP  22 -46.186 -34.303   4.969
   42    HA   ASP  22           HA       ASP  22 -46.877 -32.625   2.648
   43    HB2  ASP  22           HB1      ASP  22 -48.036 -32.738   5.390
   44    HB3  ASP  22           HB2      ASP  22 -47.852 -31.140   4.653
   45    HD2  ASP  22           HD       ASP  22 -50.153 -32.015   2.087
   46    H    PHE  23           H        PHE  23 -45.999 -30.519   2.595
   47    HA   PHE  23           HA       PHE  23 -43.744 -30.079   4.438
   48    HB2  PHE  23           HB1      PHE  23 -42.568 -28.985   2.487
   49    HB3  PHE  23           HB2      PHE  23 -42.751 -30.736   2.375
   50    HD1  PHE  23           HD1      PHE  23 -43.578 -31.674   0.442
   51    HD2  PHE  23           HD2      PHE  23 -44.475 -27.607   1.320
   52    HE1  PHE  23           HE1      PHE  23 -44.672 -31.445  -1.750
   53    HE2  PHE  23           HE2      PHE  23 -45.572 -27.373  -0.870
   54    HZ   PHE  23           HZ       PHE  23 -45.671 -29.293  -2.408
   55    H    ASN  24           H        ASN  24 -42.955 -27.710   4.237
   56    HA   ASN  24           HA       ASN  24 -45.339 -25.989   4.341
   57    HB2  ASN  24           HB1      ASN  24 -43.690 -24.487   5.699
   58    HB3  ASN  24           HB2      ASN  24 -44.423 -25.896   6.476
   59   HD21  ASN  24          HD21      ASN  24 -42.932 -26.552   7.876
   60   HD22  ASN  24          HD22      ASN  24 -41.300 -26.954   7.480
   61    H    ASN  25           H        ASN  25 -42.190 -26.406   2.931
   62    HA   ASN  25           HA       ASN  25 -41.039 -25.274   1.325
   63    HB2  ASN  25           HB1      ASN  25 -43.373 -25.764   0.256
   64    HB3  ASN  25           HB2      ASN  25 -43.616 -24.021   0.427
   65   HD21  ASN  25          HD21      ASN  25 -42.962 -22.781  -1.173
   66   HD22  ASN  25          HD22      ASN  25 -41.822 -23.219  -2.396
   67    H    ILE  26           H        ILE  26 -40.326 -24.001   3.315
   68    HA   ILE  26           HA       ILE  26 -41.329 -21.308   3.541
   69    HB   ILE  26           HB       ILE  26 -39.590 -20.980   5.211
   70   HG12  ILE  26          HG11      ILE  26 -38.544 -23.624   5.450
   71   HG13  ILE  26          HG12      ILE  26 -38.301 -23.084   3.781
   72   HG21  ILE  26          HG21      ILE  26 -40.379 -22.514   6.848
   73   HG22  ILE  26          HG22      ILE  26 -41.720 -22.190   5.751
   74   HG23  ILE  26          HG23      ILE  26 -40.817 -23.698   5.618
   75   HD11  ILE  26          HD11      ILE  26 -36.381 -22.558   5.191
   76   HD12  ILE  26          HD12      ILE  26 -37.146 -21.100   4.559
   77   HD13  ILE  26          HD13      ILE  26 -37.416 -21.582   6.233
   78    H    ARG  27           H        ARG  27 -39.326 -19.632   3.780
   79    HA   ARG  27           HA       ARG  27 -37.631 -19.875   1.398
   80    HB2  ARG  27           HB1      ARG  27 -39.441 -17.551   2.079
   81    HB3  ARG  27           HB2      ARG  27 -38.119 -17.445   0.907
   82    HG2  ARG  27           HG1      ARG  27 -39.281 -19.484  -0.217
   83    HG3  ARG  27           HG2      ARG  27 -40.688 -18.950   0.716
   84    HD2  ARG  27           HD1      ARG  27 -41.118 -17.369  -0.794
   85    HD3  ARG  27           HD2      ARG  27 -39.522 -16.663  -0.503
   86    HE   ARG  27           HE       ARG  27 -38.783 -17.602  -2.457
   87   HH11  ARG  27          HH11      ARG  27 -41.778 -19.112  -1.523
   88   HH12  ARG  27          HH12      ARG  27 -41.946 -19.996  -3.004
   89   HH21  ARG  27          HH21      ARG  27 -38.992 -18.761  -4.410
   90   HH22  ARG  27          HH22      ARG  27 -40.359 -19.796  -4.644
   91    H    SER  28           H        SER  28 -36.204 -17.681   1.391
   92    HA   SER  28           HA       SER  28 -35.399 -16.849   4.031
   93    HB2  SER  28           HB1      SER  28 -33.117 -17.696   3.921
   94    HB3  SER  28           HB2      SER  28 -34.261 -19.045   3.797
   95    HG   SER  28           HG       SER  28 -32.337 -18.545   2.151
   96    H    SER  29           H        SER  29 -34.533 -14.862   3.975
   97    HA   SER  29           HA       SER  29 -32.967 -13.853   1.834
   98    HB2  SER  29           HB1      SER  29 -35.790 -13.697   1.471
   99    HB3  SER  29           HB2      SER  29 -35.193 -12.058   1.785
  100    HG   SER  29           HG       SER  29 -33.869 -12.190   0.040
  101    H    ALA  30           H        ALA  30 -31.549 -12.922   3.183
  102    HA   ALA  30           HA       ALA  30 -32.372 -10.573   4.640
  103    HB1  ALA  30           HB1      ALA  30 -31.702 -11.247   6.813
  104    HB2  ALA  30           HB2      ALA  30 -32.794 -12.494   6.210
  105    HB3  ALA  30           HB3      ALA  30 -31.053 -12.773   6.213
  106    H    ASP  31           H        ASP  31 -30.950  -9.360   3.467
  107    HA   ASP  31           HA       ASP  31 -28.106 -10.107   3.604
  108    HB2  ASP  31           HB1      ASP  31 -27.796  -8.571   1.674
  109    HB3  ASP  31           HB2      ASP  31 -28.888  -9.916   1.321
  110    HD2  ASP  31           HD       ASP  31 -31.254  -7.680   0.306
  111    H    LEU  32           H        LEU  32 -26.668  -8.033   3.441
  112    HA   LEU  32           HA       LEU  32 -27.724  -5.809   4.992
  113    HB2  LEU  32           HB1      LEU  32 -26.145  -5.932   6.747
  114    HB3  LEU  32           HB2      LEU  32 -26.874  -7.541   6.598
  115    HG   LEU  32           HG       LEU  32 -24.685  -7.871   5.053
  116   HD11  LEU  32          HD11      LEU  32 -24.054  -5.725   7.045
  117   HD12  LEU  32          HD12      LEU  32 -23.619  -5.825   5.339
  118   HD13  LEU  32          HD13      LEU  32 -22.820  -6.869   6.514
  119   HD21  LEU  32          HD21      LEU  32 -25.423  -9.326   6.868
  120   HD22  LEU  32          HD22      LEU  32 -24.814  -8.171   8.053
  121   HD23  LEU  32          HD23      LEU  32 -23.693  -9.004   6.975
  122    H    HIS  33           H        HIS  33 -26.482  -3.912   4.843
  123    HA   HIS  33           HA       HIS  33 -23.961  -3.802   3.543
  124    HB2  HIS  33           HB1      HIS  33 -26.200  -3.986   1.821
  125    HB3  HIS  33           HB2      HIS  33 -25.647  -2.310   1.754
  126    HD1  HIS  33           HD1      HIS  33 -24.510  -5.799   0.974
  127    HD2  HIS  33           HD2      HIS  33 -23.212  -1.884   0.483
  128    HE1  HIS  33           HE1      HIS  33 -22.557  -5.932  -0.603
  129    HE2  HIS  33           HE2      HIS  33 -21.763  -3.539  -0.904
  130    H    GLY  34           H        GLY  34 -23.106  -1.663   3.435
  131    HA2  GLY  34           HA2      GLY  34 -24.545   0.672   4.031
  132    HA3  GLY  34           HA3      GLY  34 -23.921   0.014   5.537
  133    HA1  GLY  34           HA1      GLY  34 -23.991   0.326   3.434
  134    H    ALA  35           H        ALA  35 -23.299   2.467   3.841
  135    HA   ALA  35           HA       ALA  35 -20.510   2.524   4.388
  136    HB1  ALA  35           HB1      ALA  35 -19.818   1.531   2.499
  137    HB2  ALA  35           HB2      ALA  35 -21.365   1.771   1.686
  138    HB3  ALA  35           HB3      ALA  35 -20.189   3.084   1.749
  139    H    ARG  36           H        ARG  36 -20.383   4.513   5.186
  140    HA   ARG  36           HA       ARG  36 -21.201   6.767   3.544
  141    HB2  ARG  36           HB1      ARG  36 -22.347   7.833   5.538
  142    HB3  ARG  36           HB2      ARG  36 -23.217   6.503   4.760
  143    HG2  ARG  36           HG1      ARG  36 -23.263   5.312   6.634
  144    HG3  ARG  36           HG2      ARG  36 -21.520   5.525   6.876
  145    HD2  ARG  36           HD1      ARG  36 -22.619   6.481   8.770
  146    HD3  ARG  36           HD2      ARG  36 -22.003   7.809   7.776
  147    HE   ARG  36           HE       ARG  36 -24.151   8.516   7.486
  148   HH11  ARG  36          HH11      ARG  36 -24.201   5.166   8.434
  149   HH12  ARG  36          HH12      ARG  36 -25.927   5.093   8.561
  150   HH21  ARG  36          HH21      ARG  36 -26.424   8.432   7.651
  151   HH22  ARG  36          HH22      ARG  36 -27.191   6.951   8.115
  152    H    LYS  37           H        LYS  37 -19.727   8.334   3.643
  153    HA   LYS  37           HA       LYS  37 -18.204   8.794   6.073
  154    HB2  LYS  37           HB1      LYS  37 -17.138   7.110   4.173
  155    HB3  LYS  37           HB2      LYS  37 -16.440   8.678   3.738
  156    HG2  LYS  37           HG1      LYS  37 -14.912   8.408   5.315
  157    HG3  LYS  37           HG2      LYS  37 -16.203   8.458   6.529
  158    HD2  LYS  37           HD1      LYS  37 -16.242   6.201   6.803
  159    HD3  LYS  37           HD2      LYS  37 -15.824   5.890   5.108
  160    HE2  LYS  37           HE1      LYS  37 -13.897   6.907   7.211
  161    HE3  LYS  37           HE2      LYS  37 -14.036   5.224   6.682
  162    HZ1  LYS  37           HZ1      LYS  37 -13.721   6.505   4.346
  163    HZ2  LYS  37           HZ2      LYS  37 -12.458   5.809   5.229
  164    HZ3  LYS  37           HZ3      LYS  37 -12.774   7.464   5.369
  165    H    GLY  38           H        GLY  38 -16.893  10.774   5.950
  166    HA2  GLY  38           HA2      GLY  38 -18.176  12.717   4.148
  167    HA3  GLY  38           HA3      GLY  38 -17.435  13.102   5.694
  168    HA1  GLY  38           HA1      GLY  38 -17.646  12.086   3.839
  169    H    SER  39           H        SER  39 -15.943  11.008   3.317
  170    HA   SER  39           HA       SER  39 -14.385  12.939   1.992
  171    HB2  SER  39           HB1      SER  39 -13.540  12.640   4.599
  172    HB3  SER  39           HB2      SER  39 -12.484  11.522   3.719
  173    HG   SER  39           HG       SER  39 -11.401  13.293   3.331
  174    H    GLN  40           H        GLN  40 -12.669  11.966   0.675
  175    HA   GLN  40           HA       GLN  40 -13.491   9.406  -0.318
  176    HB2  GLN  40           HB1      GLN  40 -12.689  11.282  -1.762
  177    HB3  GLN  40           HB2      GLN  40 -11.066  11.028  -1.102
  178    HG2  GLN  40           HG1      GLN  40 -11.042   9.903  -3.143
  179    HG3  GLN  40           HG2      GLN  40 -11.272   8.634  -1.931
  180   HE21  GLN  40          HE21      GLN  40 -13.457   7.857  -1.583
  181   HE22  GLN  40          HE22      GLN  40 -14.570   7.848  -2.903
  182    H    CYS  41           H        CYS  41 -10.276  10.556   0.723
  183    HA   CYS  41           HA       CYS  41  -9.863   8.011   2.110
  184    HB2  CYS  41           HB1      CYS  41  -7.749   7.592   1.088
  185    HB3  CYS  41           HB2      CYS  41  -8.910   7.858  -0.214
  186    H    LEU  42           H        LEU  42  -8.246   8.072   3.737
  187    HA   LEU  42           HA       LEU  42  -7.636  10.802   4.650
  188    HB2  LEU  42           HB1      LEU  42  -8.597   8.402   5.975
  189    HB3  LEU  42           HB2      LEU  42  -7.148   9.057   6.757
  190    HG   LEU  42           HG       LEU  42  -9.597  10.719   6.200
  191   HD11  LEU  42          HD11      LEU  42  -9.709   8.597   7.823
  192   HD12  LEU  42          HD12      LEU  42 -10.565  10.104   8.147
  193   HD13  LEU  42          HD13      LEU  42  -9.025   9.777   8.941
  194   HD21  LEU  42          HD21      LEU  42  -7.068  11.488   6.842
  195   HD22  LEU  42          HD22      LEU  42  -7.806  11.336   8.438
  196   HD23  LEU  42          HD23      LEU  42  -8.527  12.400   7.229
  197    H    SER  43           H        SER  43  -6.274   7.742   3.767
  198    HA   SER  43           HA       SER  43  -3.647   8.847   3.611
  199    HB2  SER  43           HB1      SER  43  -2.603   7.995   5.433
  200    HB3  SER  43           HB2      SER  43  -4.236   7.966   6.121
  201    HG   SER  43           HG       SER  43  -3.348   5.936   6.371
  202    H    ASP  44           H        ASP  44  -2.022   7.004   3.090
  203    HA   ASP  44           HA       ASP  44  -2.818   5.739   0.760
  204    HB2  ASP  44           HB1      ASP  44  -0.720   4.699   0.719
  205    HB3  ASP  44           HB2      ASP  44  -0.445   6.163   1.674
  206    HD2  ASP  44           HD       ASP  44   0.446   4.358   4.445
  207    H    THR  45           H        THR  45  -3.066   4.668   4.067
  208    HA   THR  45           HA       THR  45  -3.445   1.924   3.663
  209    HB   THR  45           HB       THR  45  -4.446   1.844   5.842
  210    HG1  THR  45           HG1      THR  45  -5.495   3.507   6.710
  211   HG21  THR  45          HG21      THR  45  -1.990   3.092   5.320
  212   HG22  THR  45          HG22      THR  45  -2.495   2.310   6.819
  213   HG23  THR  45          HG23      THR  45  -2.745   4.041   6.599
  214    H    ASP  46           H        ASP  46  -5.539   4.619   3.089
  215    HA   ASP  46           HA       ASP  46  -8.004   3.201   3.101
  216    HB2  ASP  46           HB1      ASP  46  -7.397   5.815   3.104
  217    HB3  ASP  46           HB2      ASP  46  -7.703   5.603   1.376
  218    HD2  ASP  46           HD       ASP  46 -10.760   5.358   3.870
  219    H    CYS  47           H        CYS  47  -5.500   3.711   0.736
  220    HA   CYS  47           HA       CYS  47  -7.038   2.937  -1.540
  221    HB2  CYS  47           HB1      CYS  47  -4.618   4.146  -1.192
  222    HB3  CYS  47           HB2      CYS  47  -4.120   2.515  -1.642
  223    H    ASN  48           H        ASN  48  -7.777   0.968  -1.932
  224    HA   ASN  48           HA       ASN  48  -7.221  -1.320  -0.493
  225    HB2  ASN  48           HB1      ASN  48  -8.905  -0.646  -2.585
  226    HB3  ASN  48           HB2      ASN  48  -7.862  -1.889  -3.289
  227   HD21  ASN  48          HD21      ASN  48 -10.699  -1.988  -2.616
  228   HD22  ASN  48          HD22      ASN  48 -10.885  -3.322  -1.535
  229    H    THR  49           H        THR  49  -6.088  -0.713  -3.823
  230    HA   THR  49           HA       THR  49  -4.220  -2.822  -3.827
  231    HB   THR  49           HB       THR  49  -3.371  -0.737  -5.606
  232    HG1  THR  49           HG1      THR  49  -6.140  -1.370  -5.807
  233   HG21  THR  49          HG21      THR  49  -3.631  -2.382  -7.239
  234   HG22  THR  49          HG22      THR  49  -4.971  -3.150  -6.389
  235   HG23  THR  49          HG23      THR  49  -3.326  -3.318  -5.775
  236    H    ARG  50           H        ARG  50  -1.810  -2.232  -4.434
  237    HA   ARG  50           HA       ARG  50  -0.714  -0.994  -2.073
  238    HB2  ARG  50           HB1      ARG  50   1.475  -1.674  -3.027
  239    HB3  ARG  50           HB2      ARG  50   0.326  -3.013  -2.885
  240    HG2  ARG  50           HG1      ARG  50   0.146  -1.716  -5.476
  241    HG3  ARG  50           HG2      ARG  50   1.778  -2.318  -5.133
  242    HD2  ARG  50           HD1      ARG  50   1.159  -4.463  -5.342
  243    HD3  ARG  50           HD2      ARG  50  -0.298  -4.210  -4.372
  244    HE   ARG  50           HE       ARG  50  -1.496  -4.053  -6.305
  245   HH11  ARG  50          HH11      ARG  50   1.856  -3.449  -7.023
  246   HH12  ARG  50          HH12      ARG  50   1.610  -3.372  -8.735
  247   HH21  ARG  50          HH21      ARG  50  -1.833  -3.955  -8.559
  248   HH22  ARG  50          HH22      ARG  50  -0.488  -3.659  -9.609
  249    H    LYS  51           H        LYS  51  -1.925   1.050  -3.041
  250    HA   LYS  51           HA       LYS  51   0.164   2.661  -4.342
  251    HB2  LYS  51           HB1      LYS  51  -2.789   2.998  -4.889
  252    HB3  LYS  51           HB2      LYS  51  -1.435   3.775  -5.726
  253    HG2  LYS  51           HG1      LYS  51  -0.740   1.619  -6.645
  254    HG3  LYS  51           HG2      LYS  51  -2.090   0.836  -5.804
  255    HD2  LYS  51           HD1      LYS  51  -2.787   3.145  -7.527
  256    HD3  LYS  51           HD2      LYS  51  -2.227   1.680  -8.353
  257    HE2  LYS  51           HE1      LYS  51  -4.074   0.485  -7.798
  258    HE3  LYS  51           HE2      LYS  51  -4.210   1.260  -6.212
  259    HZ1  LYS  51           HZ1      LYS  51  -4.736   3.227  -8.087
  260    HZ2  LYS  51           HZ2      LYS  51  -5.840   2.483  -7.043
  261    HZ3  LYS  51           HZ3      LYS  51  -5.596   1.863  -8.598
  262    H    PHE  52           H        PHE  52  -0.132   5.015  -3.990
  263    HA   PHE  52           HA       PHE  52  -1.099   5.485  -1.260
  264    HB2  PHE  52           HB1      PHE  52   0.299   7.571  -1.400
  265    HB3  PHE  52           HB2      PHE  52   1.208   6.063  -1.513
  266    HD1  PHE  52           HD1      PHE  52   2.730   5.761  -3.217
  267    HD2  PHE  52           HD2      PHE  52  -0.372   8.636  -3.692
  268    HE1  PHE  52           HE1      PHE  52   3.743   6.499  -5.335
  269    HE2  PHE  52           HE2      PHE  52   0.636   9.379  -5.809
  270    HZ   PHE  52           HZ       PHE  52   2.696   8.310  -6.635
  271    H    CYS  53           H        CYS  53  -2.014   7.681  -0.828
  272    HA   CYS  53           HA       CYS  53  -3.908   8.370  -2.964
  273    HB2  CYS  53           HB1      CYS  53  -4.301   7.821  -0.269
  274    HB3  CYS  53           HB2      CYS  53  -4.412   9.579  -0.357
  275    H    LEU  54           H        LEU  54  -2.863   9.865  -4.193
  276    HA   LEU  54           HA       LEU  54  -1.314  11.990  -3.047
  277    HB2  LEU  54           HB1      LEU  54  -0.689  11.137  -5.200
  278    HB3  LEU  54           HB2      LEU  54  -2.306  11.473  -5.844
  279    HG   LEU  54           HG       LEU  54  -1.303  13.939  -4.938
  280   HD11  LEU  54          HD11      LEU  54   0.750  12.324  -6.432
  281   HD12  LEU  54          HD12      LEU  54   0.933  13.140  -4.879
  282   HD13  LEU  54          HD13      LEU  54   0.760  14.086  -6.357
  283   HD21  LEU  54          HD21      LEU  54  -2.692  13.031  -7.037
  284   HD22  LEU  54          HD22      LEU  54  -1.121  13.253  -7.808
  285   HD23  LEU  54          HD23      LEU  54  -1.912  14.613  -7.011
  286    H    GLN  55           H        GLN  55  -2.021  13.885  -2.326
  287    HA   GLN  55           HA       GLN  55  -4.741  14.734  -3.073
  288    HB2  GLN  55           HB1      GLN  55  -4.652  16.050  -0.905
  289    HB3  GLN  55           HB2      GLN  55  -4.741  14.289  -0.749
  290    HG2  GLN  55           HG1      GLN  55  -2.687  14.110   0.166
  291    HG3  GLN  55           HG2      GLN  55  -2.030  15.441  -0.795
  292   HE21  GLN  55          HE21      GLN  55  -2.548  17.615  -0.141
  293   HE22  GLN  55          HE22      GLN  55  -2.847  17.960   1.525
  294    HA   PRO  56           HA       PRO  56  -2.019  17.896  -4.963
  295    HB2  PRO  56           HB1      PRO  56  -3.723  18.427  -7.040
  296    HB3  PRO  56           HB2      PRO  56  -2.569  17.095  -7.044
  297    HG2  PRO  56           HG1      PRO  56  -5.491  17.079  -6.365
  298    HG3  PRO  56           HG2      PRO  56  -4.553  15.934  -7.396
  299    HD2  PRO  56           HD1      PRO  56  -5.260  15.364  -4.837
  300    HD3  PRO  56           HD2      PRO  56  -3.747  14.793  -5.562
  301    H    ARG  57           H        ARG  57  -2.216  20.142  -5.003
  302    HA   ARG  57           HA       ARG  57  -4.310  21.207  -3.319
  303    HB2  ARG  57           HB1      ARG  57  -1.708  21.813  -3.517
  304    HB3  ARG  57           HB2      ARG  57  -2.360  23.012  -4.644
  305    HG2  ARG  57           HG1      ARG  57  -3.448  24.187  -3.015
  306    HG3  ARG  57           HG2      ARG  57  -3.639  22.765  -1.976
  307    HD2  ARG  57           HD1      ARG  57  -1.085  22.838  -1.701
  308    HD3  ARG  57           HD2      ARG  57  -1.197  24.463  -2.390
  309    HE   ARG  57           HE       ARG  57  -2.975  24.037  -0.172
  310   HH11  ARG  57          HH11      ARG  57   0.251  24.938  -1.124
  311   HH12  ARG  57          HH12      ARG  57   0.568  25.834   0.325
  312   HH21  ARG  57          HH21      ARG  57  -2.568  25.213   1.740
  313   HH22  ARG  57          HH22      ARG  57  -1.036  25.989   1.953
  314    H    ASP  58           H        ASP  58  -3.302  21.421  -6.687
  315    HA   ASP  58           HA       ASP  58  -5.306  23.388  -7.345
  316    HB2  ASP  58           HB1      ASP  58  -3.210  21.874  -8.858
  317    HB3  ASP  58           HB2      ASP  58  -4.535  22.629  -9.753
  318    HD2  ASP  58           HD       ASP  58  -3.431  25.850  -8.628
  319    H    GLU  59           H        GLU  59  -5.084  19.951  -7.220
  320    HA   GLU  59           HA       GLU  59  -7.715  19.743  -8.533
  321    HB2  GLU  59           HB1      GLU  59  -5.344  17.888  -8.588
  322    HB3  GLU  59           HB2      GLU  59  -6.978  17.306  -8.941
  323    HG2  GLU  59           HG1      GLU  59  -6.896  18.078 -11.016
  324    HG3  GLU  59           HG2      GLU  59  -6.418  19.684 -10.451
  325    HE2  GLU  59           HE       GLU  59  -3.398  19.103 -11.968
  326    H    LYS  60           H        LYS  60  -8.633  17.394  -7.850
  327    HA   LYS  60           HA       LYS  60  -8.965  17.595  -4.966
  328    HB2  LYS  60           HB1      LYS  60 -10.508  16.498  -7.226
  329    HB3  LYS  60           HB2      LYS  60 -10.591  15.543  -5.737
  330    HG2  LYS  60           HG1      LYS  60 -10.996  18.050  -4.764
  331    HG3  LYS  60           HG2      LYS  60 -11.750  18.162  -6.363
  332    HD2  LYS  60           HD1      LYS  60 -12.737  15.782  -5.578
  333    HD3  LYS  60           HD2      LYS  60 -12.540  16.568  -4.001
  334    HE2  LYS  60           HE1      LYS  60 -13.849  18.076  -6.236
  335    HE3  LYS  60           HE2      LYS  60 -14.765  16.842  -5.357
  336    HZ1  LYS  60           HZ1      LYS  60 -14.776  18.059  -3.457
  337    HZ2  LYS  60           HZ2      LYS  60 -14.699  19.334  -4.567
  338    HZ3  LYS  60           HZ3      LYS  60 -13.296  18.816  -3.778
  339    HA   PRO  61           HA       PRO  61  -6.571  14.097  -3.834
  340    HB2  PRO  61           HB1      PRO  61  -8.108  12.927  -1.891
  341    HB3  PRO  61           HB2      PRO  61  -7.249  14.450  -1.667
  342    HG2  PRO  61           HG1      PRO  61 -10.121  13.977  -2.391
  343    HG3  PRO  61           HG2      PRO  61  -9.422  15.121  -1.184
  344    HD2  PRO  61           HD1      PRO  61 -10.260  15.914  -3.641
  345    HD3  PRO  61           HD2      PRO  61  -8.884  16.662  -2.812
  346    H    PHE  62           H        PHE  62  -6.261  11.946  -4.288
  347    HA   PHE  62           HA       PHE  62  -8.367  10.110  -4.797
  348    HB2  PHE  62           HB1      PHE  62  -7.900   9.774  -7.230
  349    HB3  PHE  62           HB2      PHE  62  -8.669  11.317  -6.854
  350    HD1  PHE  62           HD1      PHE  62  -7.754  13.308  -7.604
  351    HD2  PHE  62           HD2      PHE  62  -5.327   9.814  -7.473
  352    HE1  PHE  62           HE1      PHE  62  -5.954  14.518  -8.768
  353    HE2  PHE  62           HE2      PHE  62  -3.524  11.017  -8.636
  354    HZ   PHE  62           HZ       PHE  62  -3.836  13.373  -9.285
  355    H    CYS  63           H        CYS  63  -7.379   8.115  -6.057
  356    HA   CYS  63           HA       CYS  63  -4.884   7.498  -4.666
  357    HB2  CYS  63           HB1      CYS  63  -7.207   5.959  -5.637
  358    HB3  CYS  63           HB2      CYS  63  -5.647   5.162  -5.862
  359    H    ALA  64           H        ALA  64  -3.010   7.576  -5.695
  360    HA   ALA  64           HA       ALA  64  -3.001   7.302  -8.630
  361    HB1  ALA  64           HB1      ALA  64  -0.709   8.557  -8.276
  362    HB2  ALA  64           HB2      ALA  64  -2.235   9.439  -8.361
  363    HB3  ALA  64           HB3      ALA  64  -1.500   9.097  -6.795
  364    H    THR  65           H        THR  65  -1.536   5.949  -9.592
  365    HA   THR  65           HA       THR  65  -0.708   3.661  -8.293
  366    HB   THR  65           HB       THR  65   1.146   3.847 -10.306
  367    HG1  THR  65           HG1      THR  65   0.581   5.644 -11.323
  368   HG21  THR  65          HG21      THR  65  -0.421   2.012  -9.979
  369   HG22  THR  65          HG22      THR  65  -0.475   2.571 -11.651
  370   HG23  THR  65          HG23      THR  65  -1.753   3.030 -10.525
  371    H    CYS  66           H        CYS  66   1.637   2.897  -8.161
  372    HA   CYS  66           HA       CYS  66   3.014   4.618  -6.328
  373    HB2  CYS  66           HB1      CYS  66   3.108   1.825  -7.135
  374    HB3  CYS  66           HB2      CYS  66   4.727   2.506  -6.963
  375    H    ARG  67           H        ARG  67   5.525   4.720  -6.606
  376    HA   ARG  67           HA       ARG  67   6.032   5.812  -9.291
  377    HB2  ARG  67           HB1      ARG  67   7.588   6.463  -6.787
  378    HB3  ARG  67           HB2      ARG  67   7.559   7.349  -8.319
  379    HG2  ARG  67           HG1      ARG  67   4.976   7.564  -7.712
  380    HG3  ARG  67           HG2      ARG  67   5.630   7.382  -6.075
  381    HD2  ARG  67           HD1      ARG  67   6.433   9.466  -6.062
  382    HD3  ARG  67           HD2      ARG  67   7.215   9.228  -7.632
  383    HE   ARG  67           HE       ARG  67   4.534   9.559  -8.175
  384   HH11  ARG  67          HH11      ARG  67   7.060  11.408  -6.652
  385   HH12  ARG  67          HH12      ARG  67   6.384  12.940  -7.094
  386   HH21  ARG  67          HH21      ARG  67   3.634  11.571  -8.763
  387   HH22  ARG  67          HH22      ARG  67   4.434  13.032  -8.294
  388    H    GLY  68           H        GLY  68   8.695   5.978  -9.410
  389    HA2  GLY  68           HA2      GLY  68   9.533   3.154  -9.267
  390    HA3  GLY  68           HA3      GLY  68  10.123   4.319 -10.443
  391    HA1  GLY  68           HA1      GLY  68   9.427   3.653  -8.549
  392    H    LEU  69           H        LEU  69  12.192   3.324  -9.597
  393    HA   LEU  69           HA       LEU  69  13.066   4.167  -6.988
  394    HB2  LEU  69           HB1      LEU  69  14.287   2.697  -9.289
  395    HB3  LEU  69           HB2      LEU  69  15.337   3.379  -8.036
  396    HG   LEU  69           HG       LEU  69  13.148   1.354  -7.577
  397   HD11  LEU  69          HD11      LEU  69  14.877   0.218  -8.676
  398   HD12  LEU  69          HD12      LEU  69  15.167  -0.072  -6.960
  399   HD13  LEU  69          HD13      LEU  69  16.130   1.124  -7.828
  400   HD21  LEU  69          HD21      LEU  69  14.211   1.195  -5.320
  401   HD22  LEU  69          HD22      LEU  69  13.372   2.716  -5.631
  402   HD23  LEU  69          HD23      LEU  69  15.134   2.646  -5.717
  403    H    ARG  70           H        ARG  70  13.178   5.415 -10.210
  404    HA   ARG  70           HA       ARG  70  15.284   7.319  -9.621
  405    HB2  ARG  70           HB1      ARG  70  13.510   6.982 -12.052
  406    HB3  ARG  70           HB2      ARG  70  14.852   8.130 -11.927
  407    HG2  ARG  70           HG1      ARG  70  15.396   5.242 -11.418
  408    HG3  ARG  70           HG2      ARG  70  15.165   5.798 -13.084
  409    HD2  ARG  70           HD1      ARG  70  16.935   7.541 -11.545
  410    HD3  ARG  70           HD2      ARG  70  17.523   5.877 -11.656
  411    HE   ARG  70           HE       ARG  70  16.747   6.621 -14.212
  412   HH11  ARG  70          HH11      ARG  70  19.094   7.600 -11.834
  413   HH12  ARG  70          HH12      ARG  70  20.243   8.154 -13.006
  414   HH21  ARG  70          HH21      ARG  70  18.253   7.347 -15.764
  415   HH22  ARG  70          HH22      ARG  70  19.764   8.011 -15.241
  416    H    ARG  71           H        ARG  71  11.872   7.141  -9.413
  417    HA   ARG  71           HA       ARG  71  11.234   9.880  -9.722
  418    HB2  ARG  71           HB1      ARG  71   9.882   7.434  -8.890
  419    HB3  ARG  71           HB2      ARG  71   9.345   8.849  -7.972
  420    HG2  ARG  71           HG1      ARG  71   7.946   8.433  -9.948
  421    HG3  ARG  71           HG2      ARG  71   8.760  10.007 -10.009
  422    HD2  ARG  71           HD1      ARG  71  10.410   9.181 -11.551
  423    HD3  ARG  71           HD2      ARG  71   9.806   7.528 -11.367
  424    HE   ARG  71           HE       ARG  71   8.110   8.007 -12.841
  425   HH11  ARG  71          HH11      ARG  71   9.656  10.962 -11.843
  426   HH12  ARG  71          HH12      ARG  71   8.836  11.940 -13.015
  427   HH21  ARG  71          HH21      ARG  71   7.025   9.283 -14.389
  428   HH22  ARG  71          HH22      ARG  71   7.340  10.984 -14.462
  429    H    ARG  72           H        ARG  72  10.911  11.497  -8.198
  430    HA   ARG  72           HA       ARG  72  12.626  11.358  -5.895
  431    HB2  ARG  72           HB1      ARG  72  10.739  13.546  -6.800
  432    HB3  ARG  72           HB2      ARG  72  11.976  13.702  -5.545
  433    HG2  ARG  72           HG1      ARG  72  13.053  12.729  -8.076
  434    HG3  ARG  72           HG2      ARG  72  12.291  14.324  -8.198
  435    HD2  ARG  72           HD1      ARG  72  14.316  13.620  -6.068
  436    HD3  ARG  72           HD2      ARG  72  14.749  14.323  -7.632
  437    HE   ARG  72           HE       ARG  72  12.769  15.918  -6.442
  438   HH11  ARG  72          HH11      ARG  72  16.111  15.040  -6.025
  439   HH12  ARG  72          HH12      ARG  72  16.544  16.534  -5.263
  440   HH21  ARG  72          HH21      ARG  72  13.326  17.889  -5.440
  441   HH22  ARG  72          HH22      ARG  72  14.959  18.154  -4.929
  442    H    CYS  73           H        CYS  73  11.915  11.951  -3.720
  443    HA   CYS  73           HA       CYS  73   9.116  11.594  -3.074
  444    HB2  CYS  73           HB1      CYS  73   9.469   9.713  -1.558
  445    HB3  CYS  73           HB2      CYS  73   9.903   9.274  -3.209
  446    H    GLN  74           H        GLN  74   8.645  12.045  -0.825
  447    HA   GLN  74           HA       GLN  74  10.755  13.657   0.452
  448    HB2  GLN  74           HB1      GLN  74   8.599  14.771  -0.504
  449    HB3  GLN  74           HB2      GLN  74   7.834  14.111   0.951
  450    HG2  GLN  74           HG1      GLN  74   9.053  15.455   2.383
  451    HG3  GLN  74           HG2      GLN  74  10.328  15.731   1.189
  452   HE21  GLN  74          HE21      GLN  74   7.959  17.228   2.776
  453   HE22  GLN  74          HE22      GLN  74   7.527  18.448   1.633
  454    H    ARG  75           H        ARG  75   8.383  11.165   0.836
  455    HA   ARG  75           HA       ARG  75   9.258  10.813   3.627
  456    HB2  ARG  75           HB1      ARG  75   6.484  10.406   2.486
  457    HB3  ARG  75           HB2      ARG  75   6.982   9.906   4.109
  458    HG2  ARG  75           HG1      ARG  75   7.341  12.168   4.792
  459    HG3  ARG  75           HG2      ARG  75   7.105  12.748   3.134
  460    HD2  ARG  75           HD1      ARG  75   4.791  12.212   3.161
  461    HD3  ARG  75           HD2      ARG  75   4.969  11.271   4.651
  462    HE   ARG  75           HE       ARG  75   4.578  14.088   4.447
  463   HH11  ARG  75          HH11      ARG  75   6.074  11.600   6.368
  464   HH12  ARG  75          HH12      ARG  75   6.035  12.525   7.832
  465   HH21  ARG  75          HH21      ARG  75   4.521  15.316   6.368
  466   HH22  ARG  75          HH22      ARG  75   5.151  14.639   7.831
  467    H    ASP  76           H        ASP  76   8.884   8.544   4.415
  468    HA   ASP  76           HA       ASP  76  10.013   6.711   2.501
  469    HB2  ASP  76           HB1      ASP  76   9.082   6.003   5.282
  470    HB3  ASP  76           HB2      ASP  76  10.361   5.243   4.324
  471    HD2  ASP  76           HD       ASP  76  12.504   8.030   5.001
  472    H    ALA  77           H        ALA  77   6.958   7.040   4.252
  473    HA   ALA  77           HA       ALA  77   5.814   4.630   3.270
  474    HB1  ALA  77           HB1      ALA  77   4.685   5.262   5.130
  475    HB2  ALA  77           HB2      ALA  77   4.858   6.983   4.787
  476    HB3  ALA  77           HB3      ALA  77   3.643   6.033   3.934
  477    H    MET  78           H        MET  78   6.136   7.834   1.997
  478    HA   MET  78           HA       MET  78   4.014   7.952   0.207
  479    HB2  MET  78           HB1      MET  78   6.641   9.242   0.493
  480    HB3  MET  78           HB2      MET  78   6.036   9.190  -1.169
  481    HG2  MET  78           HG1      MET  78   4.303  10.172   1.077
  482    HG3  MET  78           HG2      MET  78   5.473  11.228   0.283
  483    HE1  MET  78           HE1      MET  78   5.757  11.440  -2.033
  484    HE2  MET  78           HE2      MET  78   4.757  10.719  -3.294
  485    HE3  MET  78           HE3      MET  78   4.399  12.342  -2.704
  486    H    CYS  79           H        CYS  79   6.908   6.055   0.113
  487    HA   CYS  79           HA       CYS  79   6.446   5.317  -2.684
  488    HB2  CYS  79           HB1      CYS  79   8.764   5.274  -0.849
  489    HB3  CYS  79           HB2      CYS  79   8.645   3.897  -1.946
  490    H    CYS  80           H        CYS  80   6.361   3.084  -3.307
  491    HA   CYS  80           HA       CYS  80   4.527   1.549  -1.931
  492    HB2  CYS  80           HB1      CYS  80   6.362   1.152  -4.184
  493    HB3  CYS  80           HB2      CYS  80   5.990  -0.338  -3.314
  494    HA   PRO  81           HA       PRO  81   6.586  -0.548   1.324
  495    HB2  PRO  81           HB1      PRO  81   5.482  -3.053   1.211
  496    HB3  PRO  81           HB2      PRO  81   4.605  -1.626   1.760
  497    HG2  PRO  81           HG1      PRO  81   4.616  -2.931  -0.942
  498    HG3  PRO  81           HG2      PRO  81   3.220  -2.333   0.030
  499    HD2  PRO  81           HD1      PRO  81   4.263  -0.936  -2.050
  500    HD3  PRO  81           HD2      PRO  81   3.578  -0.150  -0.617
  501    H    GLY  82           H        GLY  82   8.685  -1.055   1.272
  502    HA2  GLY  82           HA2      GLY  82  10.100  -3.135   0.989
  503    HA3  GLY  82           HA3      GLY  82   9.586  -3.069  -0.690
  504    HA1  GLY  82           HA1      GLY  82  10.085  -2.286   1.221
  505    H    THR  83           H        THR  83   9.757   0.012  -0.271
  506    HA   THR  83           HA       THR  83  12.662   0.172  -0.749
  507    HB   THR  83           HB       THR  83  12.018   2.307  -2.046
  508    HG1  THR  83           HG1      THR  83   9.877   2.193  -2.916
  509   HG21  THR  83          HG21      THR  83  12.624   0.976  -3.726
  510   HG22  THR  83          HG22      THR  83  10.968   0.376  -3.820
  511   HG23  THR  83          HG23      THR  83  12.147  -0.449  -2.804
  512    H    LEU  84           H        LEU  84  13.508   2.474  -0.399
  513    HA   LEU  84           HA       LEU  84  12.194   3.760   1.889
  514    HB2  LEU  84           HB1      LEU  84  14.567   2.220   2.003
  515    HB3  LEU  84           HB2      LEU  84  15.031   3.921   2.190
  516    HG   LEU  84           HG       LEU  84  13.344   4.074   4.050
  517   HD11  LEU  84          HD11      LEU  84  12.947   1.289   3.232
  518   HD12  LEU  84          HD12      LEU  84  11.870   2.388   4.091
  519   HD13  LEU  84          HD13      LEU  84  13.132   1.526   4.969
  520   HD21  LEU  84          HD21      LEU  84  14.813   2.587   5.596
  521   HD22  LEU  84          HD22      LEU  84  15.526   3.988   4.798
  522   HD23  LEU  84          HD23      LEU  84  15.797   2.370   4.149
  523    H    CYS  85           H        CYS  85  12.378   5.961   1.978
  524    HA   CYS  85           HA       CYS  85  13.168   7.288  -0.441
  525    HB2  CYS  85           HB1      CYS  85  11.205   7.875   1.128
  526    HB3  CYS  85           HB2      CYS  85  12.423   8.666   2.131
  527    H    VAL  86           H        VAL  86  15.192   7.816  -0.896
  528    HA   VAL  86           HA       VAL  86  16.889   8.901   1.238
  529    HB   VAL  86           HB       VAL  86  17.870   6.888  -0.790
  530   HG11  VAL  86          HG11      VAL  86  19.957   6.974   0.349
  531   HG12  VAL  86          HG12      VAL  86  19.482   8.640   0.014
  532   HG13  VAL  86          HG13      VAL  86  19.285   7.976   1.636
  533   HG21  VAL  86          HG21      VAL  86  16.387   5.866   0.888
  534   HG22  VAL  86          HG22      VAL  86  18.056   5.322   1.055
  535   HG23  VAL  86          HG23      VAL  86  17.404   6.523   2.169
  536    H    ASN  87           H        ASN  87  18.054  10.646   0.656
  537    HA   ASN  87           HA       ASN  87  18.754  12.425  -0.577
  538    HB2  ASN  87           HB1      ASN  87  19.172  10.120  -2.463
  539    HB3  ASN  87           HB2      ASN  87  19.507  11.774  -2.988
  540   HD21  ASN  87          HD21      ASN  87  21.672  11.724  -3.122
  541   HD22  ASN  87          HD22      ASN  87  22.729  11.415  -1.790
  542    H    ASP  88           H        ASP  88  15.938  11.928  -0.467
  543    HA   ASP  88           HA       ASP  88  14.004  12.740  -1.350
  544    HB2  ASP  88           HB1      ASP  88  16.006  14.548  -2.123
  545    HB3  ASP  88           HB2      ASP  88  15.063  14.245  -3.587
  546    HD2  ASP  88           HD       ASP  88  13.312  16.153  -0.593
  547    H    VAL  89           H        VAL  89  15.356  10.317  -2.436
  548    HA   VAL  89           HA       VAL  89  13.691  10.058  -4.824
  549    HB   VAL  89           HB       VAL  89  16.612   9.282  -4.770
  550   HG11  VAL  89          HG11      VAL  89  16.130   8.752  -7.212
  551   HG12  VAL  89          HG12      VAL  89  15.507   7.618  -6.012
  552   HG13  VAL  89          HG13      VAL  89  14.424   8.787  -6.769
  553   HG21  VAL  89          HG21      VAL  89  15.099  11.521  -6.053
  554   HG22  VAL  89          HG22      VAL  89  16.635  11.560  -5.186
  555   HG23  VAL  89          HG23      VAL  89  16.558  10.887  -6.815
  556    H    CYS  90           H        CYS  90  12.846   8.036  -5.132
  557    HA   CYS  90           HA       CYS  90  12.686   6.312  -2.914
  558    HB2  CYS  90           HB1      CYS  90  11.193   6.660  -5.130
  559    HB3  CYS  90           HB2      CYS  90  12.075   5.206  -5.599
  560    H    THR  91           H        THR  91  14.419   5.258  -2.172
  561    HA   THR  91           HA       THR  91  16.092   3.798  -4.110
  562    HB   THR  91           HB       THR  91  16.911   4.699  -1.343
  563    HG1  THR  91           HG1      THR  91  17.246   5.878  -3.901
  564   HG21  THR  91          HG21      THR  91  18.703   3.835  -3.596
  565   HG22  THR  91          HG22      THR  91  18.027   2.675  -2.454
  566   HG23  THR  91          HG23      THR  91  19.078   3.969  -1.879
  567    H    THR  92           H        THR  92  15.948   1.661  -4.053
  568    HA   THR  92           HA       THR  92  14.286   0.201  -2.405
  569    HB   THR  92           HB       THR  92  16.595  -1.379  -3.198
  570    HG1  THR  92           HG1      THR  92  16.702  -0.839  -5.298
  571   HG21  THR  92          HG21      THR  92  14.897  -2.638  -4.417
  572   HG22  THR  92          HG22      THR  92  13.729  -1.342  -4.152
  573   HG23  THR  92          HG23      THR  92  14.342  -2.271  -2.784
  574    H    MET  93           H        MET  93  14.671  -1.258  -0.670
  575    HA   MET  93           HA       MET  93  16.239  -0.217   1.410
  576    HB2  MET  93           HB1      MET  93  14.397  -2.400   1.019
  577    HB3  MET  93           HB2      MET  93  15.787  -2.941   1.972
  578    HG2  MET  93           HG1      MET  93  15.394  -1.360   3.672
  579    HG3  MET  93           HG2      MET  93  14.282  -0.441   2.655
  580    HE1  MET  93           HE1      MET  93  13.465  -0.563   5.111
  581    HE2  MET  93           HE2      MET  93  11.801  -0.734   4.552
  582    HE3  MET  93           HE3      MET  93  12.444  -1.846   5.762
  583    H    GLU  94           H        GLU  94  16.829  -2.838  -0.880
  584    HA   GLU  94           HA       GLU  94  19.234  -3.746   0.327
  585    HB2  GLU  94           HB1      GLU  94  18.352  -4.028  -2.554
  586    HB3  GLU  94           HB2      GLU  94  19.577  -5.002  -1.726
  587    HG2  GLU  94           HG1      GLU  94  17.531  -5.471  -0.084
  588    HG3  GLU  94           HG2      GLU  94  16.628  -5.131  -1.567
  589    HE2  GLU  94           HE       GLU  94  18.002  -8.662  -1.225
  590    H    ASP  95           H        ASP  95  18.460  -1.182  -1.875
  591    HA   ASP  95           HA       ASP  95  21.151  -0.786  -2.804
  592    HB2  ASP  95           HB1      ASP  95  18.524   0.266  -3.396
  593    HB3  ASP  95           HB2      ASP  95  19.691   1.583  -3.205
  594    HD2  ASP  95           HD       ASP  95  20.481   0.968  -6.494
  595    H    ALA  96           H        ALA  96  19.034   0.729  -0.409
  596    HA   ALA  96           HA       ALA  96  20.582   2.900   0.319
  597    HB1  ALA  96           HB1      ALA  96  18.291   1.630   1.296
  598    HB2  ALA  96           HB2      ALA  96  19.409   1.707   2.658
  599    HB3  ALA  96           HB3      ALA  96  18.956   3.182   1.805
  600    H    THR  97           H        THR  97  21.852   3.189   2.337
  601    HA   THR  97           HA       THR  97  23.662   2.734   3.642
  602    HB   THR  97           HB       THR  97  23.183  -0.213   3.472
  603    HG1  THR  97           HG1      THR  97  21.532   0.141   5.133
  604   HG21  THR  97          HG21      THR  97  23.598   1.411   5.953
  605   HG22  THR  97          HG22      THR  97  24.961   1.061   4.891
  606   HG23  THR  97          HG23      THR  97  24.049  -0.260   5.621
  607    H    GLU  98           H        GLU  98  25.283   3.321   2.246
  608    HA   GLU  98           HA       GLU  98  26.931   1.191   1.239
  609    HB2  GLU  98           HB1      GLU  98  25.031   2.174  -0.516
  610    HB3  GLU  98           HB2      GLU  98  26.486   3.093  -0.931
  611    HG2  GLU  98           HG1      GLU  98  26.412   0.086  -0.734
  612    HG3  GLU  98           HG2      GLU  98  26.152   0.989  -2.233
  613    HE2  GLU  98           HE       GLU  98  29.518   1.481  -2.678
  614    H    ASN  99           H        ASN  99  29.012   1.750   1.399
  615    HA   ASN  99           HA       ASN  99  29.743   4.587   1.312
  616    HB2  ASN  99           HB1      ASN  99  30.156   2.676   3.584
  617    HB3  ASN  99           HB2      ASN  99  31.374   3.921   3.274
  618   HD21  ASN  99          HD21      ASN  99  28.749   3.261   5.061
  619   HD22  ASN  99          HD22      ASN  99  28.166   4.860   5.356
  620    H    LEU 100           H        LEU 100  31.408   1.527   2.066
  621    HA   LEU 100           HA       LEU 100  33.275   0.561   1.199
  622    HB2  LEU 100           HB1      LEU 100  31.546   1.126  -0.923
  623    HB3  LEU 100           HB2      LEU 100  33.144   1.671  -1.465
  624    HG   LEU 100           HG       LEU 100  33.689  -0.819  -0.449
  625   HD11  LEU 100          HD11      LEU 100  31.302  -1.339  -2.127
  626   HD12  LEU 100          HD12      LEU 100  31.037  -0.921  -0.435
  627   HD13  LEU 100          HD13      LEU 100  32.030  -2.317  -0.853
  628   HD21  LEU 100          HD21      LEU 100  34.031  -1.459  -2.726
  629   HD22  LEU 100          HD22      LEU 100  34.452   0.247  -2.572
  630   HD23  LEU 100          HD23      LEU 100  32.913  -0.221  -3.298
  631    H    TYR 101           H        TYR 101  33.356   3.376   2.213
  632    HA   TYR 101           HA       TYR 101  36.040   3.972   1.252
  633    HB2  TYR 101           HB1      TYR 101  33.768   5.439   0.374
  634    HB3  TYR 101           HB2      TYR 101  34.663   6.473   1.490
  635    HD1  TYR 101           HD1      TYR 101  34.737   4.822  -1.761
  636    HD2  TYR 101           HD2      TYR 101  36.960   7.172   1.001
  637    HE1  TYR 101           HE1      TYR 101  36.349   5.371  -3.536
  638    HE2  TYR 101           HE2      TYR 101  38.579   7.728  -0.765
  639    HH   TYR 101           HH       TYR 101  38.895   7.725  -3.040
  640    H    PHE 102           H        PHE 102  37.096   5.668   2.606
  641    HA   PHE 102           HA       PHE 102  35.980   5.758   5.326
  642    HB2  PHE 102           HB1      PHE 102  38.125   5.298   6.299
  643    HB3  PHE 102           HB2      PHE 102  37.780   4.030   5.123
  644    HD1  PHE 102           HD1      PHE 102  39.954   6.810   5.959
  645    HD2  PHE 102           HD2      PHE 102  38.955   3.947   2.972
  646    HE1  PHE 102           HE1      PHE 102  42.091   7.256   4.821
  647    HE2  PHE 102           HE2      PHE 102  41.089   4.387   1.831
  648    HZ   PHE 102           HZ       PHE 102  42.660   6.043   2.755
  649    H    GLN 103           H        GLN 103  37.758   7.272   6.620
  650    HA   GLN 103           HA       GLN 103  37.288   9.873   5.530
  651    HB2  GLN 103           HB1      GLN 103  37.682   8.867   8.056
  652    HB3  GLN 103           HB2      GLN 103  39.211   9.702   7.736
  653    HG2  GLN 103           HG1      GLN 103  37.263  11.490   6.878
  654    HG3  GLN 103           HG2      GLN 103  36.612  10.789   8.367
  655   HE21  GLN 103          HE21      GLN 103  38.516  10.503  10.065
  656   HE22  GLN 103          HE22      GLN 103  39.404  11.956  10.354
  657    H    SER 104           H        SER 104  38.447  10.621   3.882
  658    HA   SER 104           HA       SER 104  41.299   9.944   3.717
  659    HB2  SER 104           HB1      SER 104  39.495   9.659   1.783
  660    HB3  SER 104           HB2      SER 104  39.884  11.365   1.504
  661    HG   SER 104           HG       SER 104  41.621   9.137   1.409
  662    H    LEU 105           H        LEU 105  42.342  11.929   2.256
  663    HA   LEU 105           HA       LEU 105  42.604  14.043   4.159
  664    HB2  LEU 105           HB1      LEU 105  44.407  13.110   2.625
  665    HB3  LEU 105           HB2      LEU 105  43.637  14.049   1.335
  666    HG   LEU 105           HG       LEU 105  44.241  15.669   3.675
  667   HD11  LEU 105          HD11      LEU 105  46.483  14.225   2.278
  668   HD12  LEU 105          HD12      LEU 105  46.105  14.215   4.000
  669   HD13  LEU 105          HD13      LEU 105  46.697  15.690   3.237
  670   HD21  LEU 105          HD21      LEU 105  44.805  15.775   0.725
  671   HD22  LEU 105          HD22      LEU 105  45.406  16.993   1.849
  672   HD23  LEU 105          HD23      LEU 105  43.670  16.747   1.662
  673    H    GLU 106           H        GLU 106  41.210  15.654   4.379
  674    HA   GLU 106           HA       GLU 106  39.841  16.666   1.973
  675    HB2  GLU 106           HB1      GLU 106  38.777  15.729   4.443
  676    HB3  GLU 106           HB2      GLU 106  38.475  17.471   4.344
  677    HG2  GLU 106           HG1      GLU 106  37.867  16.283   1.815
  678    HG3  GLU 106           HG2      GLU 106  37.055  15.379   3.101
  679    HE2  GLU 106           HE       GLU 106  35.358  18.421   4.055
  680    H    HIS 107           H        HIS 107  39.561  18.908   1.762
  681    HA   HIS 107           HA       HIS 107  41.436  20.497   3.380
  682    HB2  HIS 107           HB1      HIS 107  41.718  20.235   0.821
  683    HB3  HIS 107           HB2      HIS 107  40.345  21.341   0.704
  684    HD1  HIS 107           HD1      HIS 107  43.620  21.369   2.662
  685    HD2  HIS 107           HD2      HIS 107  41.197  23.875   0.402
  686    HE1  HIS 107           HE1      HIS 107  44.797  23.592   2.628
  687    HE2  HIS 107           HE2      HIS 107  43.316  25.124   1.246
  688    H    HIS 108           H        HIS 108  40.832  22.598   4.056
  689    HA   HIS 108           HA       HIS 108  38.039  23.373   3.775
  690    HB2  HIS 108           HB1      HIS 108  39.234  22.282   6.233
  691    HB3  HIS 108           HB2      HIS 108  38.387  23.816   6.458
  692    HD1  HIS 108           HD1      HIS 108  37.598  20.623   7.141
  693    HD2  HIS 108           HD2      HIS 108  35.786  23.345   4.578
  694    HE1  HIS 108           HE1      HIS 108  35.234  19.811   6.859
  695    HE2  HIS 108           HE2      HIS 108  34.126  21.473   5.295
  696    H    HIS 109           H        HIS 109  37.651  25.545   4.842
  697    HA   HIS 109           HA       HIS 109  40.017  27.196   5.164
  698    HB2  HIS 109           HB1      HIS 109  39.349  27.060   2.668
  699    HB3  HIS 109           HB2      HIS 109  37.975  28.068   3.134
  700    HD1  HIS 109           HD1      HIS 109  41.240  28.415   1.828
  701    HD2  HIS 109           HD2      HIS 109  39.017  30.504   4.648
  702    HE1  HIS 109           HE1      HIS 109  42.329  30.676   2.003
  703    HE2  HIS 109           HE2      HIS 109  40.970  31.953   3.726
  704    H    HIS 110           H        HIS 110  39.495  27.907   7.154
  705    HA   HIS 110           HA       HIS 110  37.038  29.489   7.402
  706    HB2  HIS 110           HB1      HIS 110  37.612  27.013   8.766
  707    HB3  HIS 110           HB2      HIS 110  37.485  28.332   9.935
  708    HD1  HIS 110           HD1      HIS 110  35.443  26.179   7.760
  709    HD2  HIS 110           HD2      HIS 110  34.945  29.680   9.941
  710    HE1  HIS 110           HE1      HIS 110  32.957  26.520   7.926
  711    HE2  HIS 110           HE2      HIS 110  32.651  28.658   9.258
  712    H    HIS 111           H        HIS 111  37.167  31.246   8.804
  713    HA   HIS 111           HA       HIS 111  39.840  31.806   9.908
  714    HB2  HIS 111           HB1      HIS 111  39.465  34.202   9.351
  715    HB3  HIS 111           HB2      HIS 111  39.581  33.161   7.928
  716    HD1  HIS 111           HD1      HIS 111  37.997  33.938   6.209
  717    HD2  HIS 111           HD2      HIS 111  36.394  34.258  10.029
  718    HE1  HIS 111           HE1      HIS 111  35.660  34.807   5.887
  719    HE2  HIS 111           HE2      HIS 111  34.679  35.004   8.220
  720    H    HIS 112           H        HIS 112  39.711  33.705  11.515
  721    HA   HIS 112           HA       HIS 112  37.742  32.987  13.501
  722    HB2  HIS 112           HB1      HIS 112  40.355  34.155  13.486
  723    HB3  HIS 112           HB2      HIS 112  39.256  35.248  14.332
  724    HD1  HIS 112           HD1      HIS 112  41.568  33.054  15.378
  725    HD2  HIS 112           HD2      HIS 112  37.458  33.106  15.987
  726    HE1  HIS 112           HE1      HIS 112  41.178  31.685  17.451
  727    HE2  HIS 112           HE2      HIS 112  38.667  31.715  17.824
  Start of MODEL    9
    1    H1   MET  18           H        MET  18 -72.357   1.070 -40.542
    2    HA   MET  18           HA       MET  18 -70.282   1.940 -41.439
    3    HB2  MET  18           HB1      MET  18 -71.494   2.940 -39.042
    4    HB3  MET  18           HB2      MET  18 -69.745   3.198 -38.956
    5    HG2  MET  18           HG1      MET  18 -69.756   4.784 -40.540
    6    HG3  MET  18           HG2      MET  18 -70.927   3.911 -41.532
    7    HE1  MET  18           HE1      MET  18 -71.503   6.317 -42.126
    8    HE2  MET  18           HE2      MET  18 -73.107   5.584 -42.098
    9    HE3  MET  18           HE3      MET  18 -72.842   7.156 -41.341
   10    H    LEU  19           H        LEU  19 -69.927   0.415 -38.258
   11    HA   LEU  19           HA       LEU  19 -68.154  -0.564 -37.218
   12    HB2  LEU  19           HB1      LEU  19 -67.832  -1.212 -40.098
   13    HB3  LEU  19           HB2      LEU  19 -66.452  -1.531 -39.036
   14    HG   LEU  19           HG       LEU  19 -67.848  -3.521 -39.383
   15   HD11  LEU  19          HD11      LEU  19 -67.789  -4.253 -37.178
   16   HD12  LEU  19          HD12      LEU  19 -68.204  -2.664 -36.535
   17   HD13  LEU  19          HD13      LEU  19 -66.599  -2.952 -37.207
   18   HD21  LEU  19          HD21      LEU  19 -70.013  -2.309 -37.729
   19   HD22  LEU  19          HD22      LEU  19 -70.082  -3.654 -38.869
   20   HD23  LEU  19          HD23      LEU  19 -69.979  -1.996 -39.465
   21    H    VAL  20           H        VAL  20 -67.523   1.601 -36.496
   22    HA   VAL  20           HA       VAL  20 -65.141   2.671 -37.837
   23    HB   VAL  20           HB       VAL  20 -65.446   4.673 -36.475
   24   HG11  VAL  20          HG11      VAL  20 -67.894   3.720 -37.948
   25   HG12  VAL  20          HG12      VAL  20 -67.677   5.379 -37.388
   26   HG13  VAL  20          HG13      VAL  20 -66.566   4.695 -38.575
   27   HG21  VAL  20          HG21      VAL  20 -67.378   2.937 -35.078
   28   HG22  VAL  20          HG22      VAL  20 -66.374   4.247 -34.458
   29   HG23  VAL  20          HG23      VAL  20 -67.874   4.614 -35.310
   30    H    LEU  21           H        LEU  21 -63.169   2.610 -36.923
   31    HA   LEU  21           HA       LEU  21 -62.768   0.954 -34.617
   32    HB2  LEU  21           HB1      LEU  21 -61.128   2.188 -36.711
   33    HB3  LEU  21           HB2      LEU  21 -60.343   2.123 -35.123
   34    HG   LEU  21           HG       LEU  21 -59.761   0.206 -36.552
   35   HD11  LEU  21          HD11      LEU  21 -59.432  -0.708 -34.554
   36   HD12  LEU  21          HD12      LEU  21 -61.023  -1.451 -34.715
   37   HD13  LEU  21          HD13      LEU  21 -60.851   0.091 -33.878
   38   HD21  LEU  21          HD21      LEU  21 -62.001   0.138 -37.700
   39   HD22  LEU  21          HD22      LEU  21 -62.630  -0.658 -36.257
   40   HD23  LEU  21          HD23      LEU  21 -61.354  -1.426 -37.202
   41    H    ASP  22           H        ASP  22 -62.155   1.524 -32.580
   42    HA   ASP  22           HA       ASP  22 -62.064   4.410 -31.986
   43    HB2  ASP  22           HB1      ASP  22 -64.141   3.207 -31.201
   44    HB3  ASP  22           HB2      ASP  22 -63.098   2.266 -30.125
   45    HD2  ASP  22           HD       ASP  22 -62.964   6.103 -29.206
   46    H    PHE  23           H        PHE  23 -60.776   5.030 -30.138
   47    HA   PHE  23           HA       PHE  23 -58.792   3.067 -29.262
   48    HB2  PHE  23           HB1      PHE  23 -58.298   5.318 -31.054
   49    HB3  PHE  23           HB2      PHE  23 -57.287   5.378 -29.607
   50    HD1  PHE  23           HD1      PHE  23 -55.585   3.739 -29.183
   51    HD2  PHE  23           HD2      PHE  23 -58.077   3.457 -32.623
   52    HE1  PHE  23           HE1      PHE  23 -54.055   2.073 -30.151
   53    HE2  PHE  23           HE2      PHE  23 -56.551   1.789 -33.595
   54    HZ   PHE  23           HZ       PHE  23 -54.537   1.094 -32.359
   55    H    ASN  24           H        ASN  24 -58.091   3.344 -27.196
   56    HA   ASN  24           HA       ASN  24 -58.481   5.836 -25.795
   57    HB2  ASN  24           HB1      ASN  24 -60.573   3.961 -25.760
   58    HB3  ASN  24           HB2      ASN  24 -59.754   3.780 -24.205
   59   HD21  ASN  24          HD21      ASN  24 -62.391   4.934 -24.992
   60   HD22  ASN  24          HD22      ASN  24 -62.415   6.505 -24.274
   61    H    ASN  25           H        ASN  25 -58.107   5.231 -23.263
   62    HA   ASN  25           HA       ASN  25 -56.551   4.641 -21.713
   63    HB2  ASN  25           HB1      ASN  25 -57.007   2.241 -23.322
   64    HB3  ASN  25           HB2      ASN  25 -55.403   2.271 -22.578
   65   HD21  ASN  25          HD21      ASN  25 -58.771   2.981 -21.716
   66   HD22  ASN  25          HD22      ASN  25 -58.701   2.255 -20.150
   67    H    ILE  26           H        ILE  26 -55.201   6.399 -22.290
   68    HA   ILE  26           HA       ILE  26 -52.787   5.601 -23.783
   69    HB   ILE  26           HB       ILE  26 -53.870   8.411 -23.573
   70   HG12  ILE  26          HG11      ILE  26 -54.104   7.819 -26.189
   71   HG13  ILE  26          HG12      ILE  26 -54.409   6.216 -25.496
   72   HG21  ILE  26          HG21      ILE  26 -51.696   7.233 -25.298
   73   HG22  ILE  26          HG22      ILE  26 -52.240   8.910 -25.316
   74   HG23  ILE  26          HG23      ILE  26 -51.451   8.255 -23.882
   75   HD11  ILE  26          HD11      ILE  26 -56.527   6.889 -25.360
   76   HD12  ILE  26          HD12      ILE  26 -55.994   7.798 -23.945
   77   HD13  ILE  26          HD13      ILE  26 -56.099   8.592 -25.516
   78    H    ARG  27           H        ARG  27 -51.374   5.106 -22.202
   79    HA   ARG  27           HA       ARG  27 -50.913   7.141 -20.119
   80    HB2  ARG  27           HB1      ARG  27 -51.375   4.282 -19.915
   81    HB3  ARG  27           HB2      ARG  27 -49.832   4.745 -19.180
   82    HG2  ARG  27           HG1      ARG  27 -50.960   5.294 -17.353
   83    HG3  ARG  27           HG2      ARG  27 -51.626   6.656 -18.270
   84    HD2  ARG  27           HD1      ARG  27 -53.430   5.080 -19.095
   85    HD3  ARG  27           HD2      ARG  27 -52.830   3.923 -17.899
   86    HE   ARG  27           HE       ARG  27 -53.838   5.148 -16.248
   87   HH11  ARG  27          HH11      ARG  27 -53.671   7.058 -19.155
   88   HH12  ARG  27          HH12      ARG  27 -54.662   8.333 -18.530
   89   HH21  ARG  27          HH21      ARG  27 -55.144   6.822 -15.414
   90   HH22  ARG  27          HH22      ARG  27 -55.499   8.199 -16.402
   91    H    SER  28           H        SER  28 -48.687   7.250 -19.314
   92    HA   SER  28           HA       SER  28 -46.521   6.023 -20.633
   93    HB2  SER  28           HB1      SER  28 -45.807   7.552 -22.211
   94    HB3  SER  28           HB2      SER  28 -47.565   7.723 -22.369
   95    HG   SER  28           HG       SER  28 -47.242   9.444 -20.673
   96    H    SER  29           H        SER  29 -44.488   6.697 -19.818
   97    HA   SER  29           HA       SER  29 -44.208   8.899 -18.038
   98    HB2  SER  29           HB1      SER  29 -45.392   6.642 -16.889
   99    HB3  SER  29           HB2      SER  29 -43.692   6.557 -16.396
  100    HG   SER  29           HG       SER  29 -45.642   8.417 -15.731
  101    H    ALA  30           H        ALA  30 -42.055   9.090 -17.182
  102    HA   ALA  30           HA       ALA  30 -40.101   7.253 -18.391
  103    HB1  ALA  30           HB1      ALA  30 -38.986   8.872 -19.486
  104    HB2  ALA  30           HB2      ALA  30 -40.533   9.718 -19.408
  105    HB3  ALA  30           HB3      ALA  30 -39.274  10.070 -18.224
  106    H    ASP  31           H        ASP  31 -37.783   8.245 -17.480
  107    HA   ASP  31           HA       ASP  31 -37.935   8.901 -14.676
  108    HB2  ASP  31           HB1      ASP  31 -38.193   6.284 -15.100
  109    HB3  ASP  31           HB2      ASP  31 -36.430   6.384 -15.211
  110    HD2  ASP  31           HD       ASP  31 -36.447   6.086 -11.792
  111    H    LEU  32           H        LEU  32 -36.300  10.222 -14.247
  112    HA   LEU  32           HA       LEU  32 -34.004  10.257 -16.063
  113    HB2  LEU  32           HB1      LEU  32 -35.545  12.258 -14.698
  114    HB3  LEU  32           HB2      LEU  32 -33.845  12.380 -14.216
  115    HG   LEU  32           HG       LEU  32 -34.376  13.872 -16.080
  116   HD11  LEU  32          HD11      LEU  32 -32.193  13.512 -16.388
  117   HD12  LEU  32          HD12      LEU  32 -32.695  12.492 -17.736
  118   HD13  LEU  32          HD13      LEU  32 -32.351  11.769 -16.164
  119   HD21  LEU  32          HD21      LEU  32 -35.028  11.326 -17.561
  120   HD22  LEU  32          HD22      LEU  32 -34.883  12.924 -18.293
  121   HD23  LEU  32          HD23      LEU  32 -36.161  12.605 -17.120
  122    H    HIS  33           H        HIS  33 -32.268   9.163 -15.450
  123    HA   HIS  33           HA       HIS  33 -31.810   8.582 -12.638
  124    HB2  HIS  33           HB1      HIS  33 -30.955   7.457 -15.217
  125    HB3  HIS  33           HB2      HIS  33 -29.685   7.489 -13.990
  126    HD1  HIS  33           HD1      HIS  33 -33.257   6.917 -13.015
  127    HD2  HIS  33           HD2      HIS  33 -29.765   4.735 -13.568
  128    HE1  HIS  33           HE1      HIS  33 -33.728   4.641 -12.057
  129    HE2  HIS  33           HE2      HIS  33 -31.595   3.307 -12.393
  130    H    GLY  34           H        GLY  34 -29.541   8.771 -11.793
  131    HA2  GLY  34           HA2      GLY  34 -27.653  10.527 -12.903
  132    HA3  GLY  34           HA3      GLY  34 -28.711  11.457 -11.852
  133    HA1  GLY  34           HA1      GLY  34 -27.738   9.711 -12.577
  134    H    ALA  35           H        ALA  35 -25.874  10.955 -11.541
  135    HA   ALA  35           HA       ALA  35 -25.954   9.577  -8.938
  136    HB1  ALA  35           HB1      ALA  35 -23.324   9.513 -10.113
  137    HB2  ALA  35           HB2      ALA  35 -24.327   8.184  -9.528
  138    HB3  ALA  35           HB3      ALA  35 -24.509   8.764 -11.183
  139    H    ARG  36           H        ARG  36 -23.575  10.141  -7.897
  140    HA   ARG  36           HA       ARG  36 -23.182  13.040  -8.121
  141    HB2  ARG  36           HB1      ARG  36 -24.463  11.712  -5.953
  142    HB3  ARG  36           HB2      ARG  36 -22.892  12.298  -5.383
  143    HG2  ARG  36           HG1      ARG  36 -23.660  14.367  -5.221
  144    HG3  ARG  36           HG2      ARG  36 -24.157  14.346  -6.922
  145    HD2  ARG  36           HD1      ARG  36 -26.323  13.802  -6.443
  146    HD3  ARG  36           HD2      ARG  36 -25.872  12.879  -5.002
  147    HE   ARG  36           HE       ARG  36 -25.457  15.710  -4.726
  148   HH11  ARG  36          HH11      ARG  36 -27.757  13.112  -4.443
  149   HH12  ARG  36          HH12      ARG  36 -28.757  13.948  -3.302
  150   HH21  ARG  36          HH21      ARG  36 -26.766  16.820  -3.223
  151   HH22  ARG  36          HH22      ARG  36 -28.193  16.057  -2.609
  152    H    LYS  37           H        LYS  37 -21.161  13.777  -7.099
  153    HA   LYS  37           HA       LYS  37 -19.146  11.699  -6.698
  154    HB2  LYS  37           HB1      LYS  37 -19.331  13.459  -9.025
  155    HB3  LYS  37           HB2      LYS  37 -17.768  13.569  -8.201
  156    HG2  LYS  37           HG1      LYS  37 -18.724  10.823  -8.612
  157    HG3  LYS  37           HG2      LYS  37 -18.401  11.732 -10.098
  158    HD2  LYS  37           HD1      LYS  37 -16.154  12.327  -9.187
  159    HD3  LYS  37           HD2      LYS  37 -16.487  11.256  -7.815
  160    HE2  LYS  37           HE1      LYS  37 -16.686  10.262 -10.651
  161    HE3  LYS  37           HE2      LYS  37 -15.137  10.319  -9.797
  162    HZ1  LYS  37           HZ1      LYS  37 -16.332   9.021  -7.983
  163    HZ2  LYS  37           HZ2      LYS  37 -15.946   8.189  -9.404
  164    HZ3  LYS  37           HZ3      LYS  37 -17.531   8.718  -9.138
  165    H    GLY  38           H        GLY  38 -18.469  12.158  -4.700
  166    HA2  GLY  38           HA2      GLY  38 -18.184  14.963  -3.893
  167    HA3  GLY  38           HA3      GLY  38 -18.201  13.577  -2.814
  168    HA1  GLY  38           HA1      GLY  38 -17.727  14.658  -4.581
  169    H    SER  39           H        SER  39 -16.305  12.075  -3.029
  170    HA   SER  39           HA       SER  39 -13.862  13.457  -3.876
  171    HB2  SER  39           HB1      SER  39 -12.885  13.496  -1.825
  172    HB3  SER  39           HB2      SER  39 -14.563  13.462  -1.254
  173    HG   SER  39           HG       SER  39 -13.621  11.806  -0.204
  174    H    GLN  40           H        GLN  40 -11.941  11.934  -3.781
  175    HA   GLN  40           HA       GLN  40 -12.755   9.402  -4.974
  176    HB2  GLN  40           HB1      GLN  40 -10.261  11.054  -4.986
  177    HB3  GLN  40           HB2      GLN  40 -10.142   9.320  -5.328
  178    HG2  GLN  40           HG1      GLN  40 -10.348  10.214  -7.442
  179    HG3  GLN  40           HG2      GLN  40 -12.013   9.767  -7.050
  180   HE21  GLN  40          HE21      GLN  40 -13.453  11.231  -7.573
  181   HE22  GLN  40          HE22      GLN  40 -13.209  12.941  -7.614
  182    H    CYS  41           H        CYS  41 -10.046  10.297  -2.835
  183    HA   CYS  41           HA       CYS  41 -10.776   8.125  -1.023
  184    HB2  CYS  41           HB1      CYS  41  -8.349   7.387  -0.987
  185    HB3  CYS  41           HB2      CYS  41  -9.266   6.961  -2.433
  186    H    LEU  42           H        LEU  42  -9.918   8.332   1.074
  187    HA   LEU  42           HA       LEU  42  -8.920  11.032   1.675
  188    HB2  LEU  42           HB1      LEU  42 -10.977   9.406   2.812
  189    HB3  LEU  42           HB2      LEU  42  -9.723   9.684   4.033
  190    HG   LEU  42           HG       LEU  42  -9.965  12.156   3.534
  191   HD11  LEU  42          HD11      LEU  42 -11.085  12.491   1.597
  192   HD12  LEU  42          HD12      LEU  42 -12.474  12.483   2.683
  193   HD13  LEU  42          HD13      LEU  42 -12.057  11.030   1.774
  194   HD21  LEU  42          HD21      LEU  42 -11.595  12.393   5.153
  195   HD22  LEU  42          HD22      LEU  42 -11.041  10.743   5.435
  196   HD23  LEU  42          HD23      LEU  42 -12.541  11.031   4.551
  197    H    SER  43           H        SER  43  -8.240   7.644   1.959
  198    HA   SER  43           HA       SER  43  -5.605   8.294   3.052
  199    HB2  SER  43           HB1      SER  43  -7.668   7.076   4.578
  200    HB3  SER  43           HB2      SER  43  -6.470   5.820   4.217
  201    HG   SER  43           HG       SER  43  -5.601   6.736   5.950
  202    H    ASP  44           H        ASP  44  -4.190   6.239   3.019
  203    HA   ASP  44           HA       ASP  44  -4.071   5.320   0.348
  204    HB2  ASP  44           HB1      ASP  44  -2.181   3.984   1.056
  205    HB3  ASP  44           HB2      ASP  44  -2.092   5.571   1.832
  206    HD2  ASP  44           HD       ASP  44  -2.783   4.186   4.988
  207    H    THR  45           H        THR  45  -5.433   3.992   3.278
  208    HA   THR  45           HA       THR  45  -5.702   1.316   2.534
  209    HB   THR  45           HB       THR  45  -7.627   1.249   4.126
  210    HG1  THR  45           HG1      THR  45  -8.549   3.060   4.720
  211   HG21  THR  45          HG21      THR  45  -4.962   1.539   4.657
  212   HG22  THR  45          HG22      THR  45  -6.193   1.148   5.857
  213   HG23  THR  45          HG23      THR  45  -5.669   2.818   5.642
  214    H    ASP  46           H        ASP  46  -7.578   4.133   1.655
  215    HA   ASP  46           HA       ASP  46  -9.823   2.756   0.603
  216    HB2  ASP  46           HB1      ASP  46  -8.725   5.525   0.055
  217    HB3  ASP  46           HB2      ASP  46 -10.263   4.929  -0.584
  218    HD2  ASP  46           HD       ASP  46 -10.729   4.775   3.245
  219    H    CYS  47           H        CYS  47  -6.668   3.487  -0.629
  220    HA   CYS  47           HA       CYS  47  -7.356   3.021  -3.390
  221    HB2  CYS  47           HB1      CYS  47  -4.839   3.597  -1.873
  222    HB3  CYS  47           HB2      CYS  47  -4.719   2.922  -3.499
  223    H    ASN  48           H        ASN  48  -6.239   1.329  -4.669
  224    HA   ASN  48           HA       ASN  48  -6.791  -1.234  -3.638
  225    HB2  ASN  48           HB1      ASN  48  -5.046  -0.556  -6.020
  226    HB3  ASN  48           HB2      ASN  48  -5.877  -2.086  -5.715
  227   HD21  ASN  48          HD21      ASN  48  -8.290  -1.889  -5.446
  228   HD22  ASN  48          HD22      ASN  48  -9.108  -0.834  -6.542
  229    H    THR  49           H        THR  49  -4.876  -2.970  -4.155
  230    HA   THR  49           HA       THR  49  -3.096  -2.716  -1.976
  231    HB   THR  49           HB       THR  49  -3.767  -4.917  -2.665
  232    HG1  THR  49           HG1      THR  49  -1.770  -5.119  -1.836
  233   HG21  THR  49          HG21      THR  49  -2.468  -4.236  -5.304
  234   HG22  THR  49          HG22      THR  49  -4.172  -4.585  -5.010
  235   HG23  THR  49          HG23      THR  49  -2.968  -5.862  -4.837
  236    H    ARG  50           H        ARG  50  -0.856  -2.439  -1.922
  237    HA   ARG  50           HA       ARG  50   1.087  -1.376  -2.454
  238    HB2  ARG  50           HB1      ARG  50   0.455  -2.562  -5.168
  239    HB3  ARG  50           HB2      ARG  50   2.027  -1.911  -4.681
  240    HG2  ARG  50           HG1      ARG  50   2.106  -3.618  -2.859
  241    HG3  ARG  50           HG2      ARG  50   0.632  -4.323  -3.546
  242    HD2  ARG  50           HD1      ARG  50   1.847  -5.478  -5.012
  243    HD3  ARG  50           HD2      ARG  50   2.485  -3.963  -5.663
  244    HE   ARG  50           HE       ARG  50   4.454  -4.384  -4.592
  245   HH11  ARG  50          HH11      ARG  50   1.949  -6.302  -3.121
  246   HH12  ARG  50          HH12      ARG  50   3.039  -7.172  -2.092
  247   HH21  ARG  50          HH21      ARG  50   5.898  -5.521  -3.241
  248   HH22  ARG  50          HH22      ARG  50   5.284  -6.726  -2.161
  249    H    LYS  51           H        LYS  51  -1.346   0.170  -2.656
  250    HA   LYS  51           HA       LYS  51  -0.352   2.277  -4.433
  251    HB2  LYS  51           HB1      LYS  51  -2.973   0.896  -4.584
  252    HB3  LYS  51           HB2      LYS  51  -3.002   2.660  -4.746
  253    HG2  LYS  51           HG1      LYS  51  -2.184   2.602  -6.816
  254    HG3  LYS  51           HG2      LYS  51  -0.931   1.427  -6.369
  255    HD2  LYS  51           HD1      LYS  51  -3.100  -0.173  -6.275
  256    HD3  LYS  51           HD2      LYS  51  -3.624   0.989  -7.508
  257    HE2  LYS  51           HE1      LYS  51  -2.303   0.060  -9.047
  258    HE3  LYS  51           HE2      LYS  51  -0.899   0.210  -7.981
  259    HZ1  LYS  51           HZ1      LYS  51  -1.280  -2.088  -8.547
  260    HZ2  LYS  51           HZ2      LYS  51  -2.867  -2.014  -7.967
  261    HZ3  LYS  51           HZ3      LYS  51  -1.567  -1.862  -6.895
  262    H    PHE  52           H        PHE  52  -0.863   4.387  -3.785
  263    HA   PHE  52           HA       PHE  52  -2.055   4.617  -1.101
  264    HB2  PHE  52           HB1      PHE  52  -0.476   6.459  -0.638
  265    HB3  PHE  52           HB2      PHE  52   0.349   4.926  -0.927
  266    HD1  PHE  52           HD1      PHE  52   1.416   4.496  -3.155
  267    HD2  PHE  52           HD2      PHE  52  -0.023   8.332  -1.999
  268    HE1  PHE  52           HE1      PHE  52   2.793   5.536  -4.907
  269    HE2  PHE  52           HE2      PHE  52   1.352   9.378  -3.750
  270    HZ   PHE  52           HZ       PHE  52   2.761   7.981  -5.209
  271    H    CYS  53           H        CYS  53  -2.836   6.851  -0.612
  272    HA   CYS  53           HA       CYS  53  -4.124   7.978  -3.004
  273    HB2  CYS  53           HB1      CYS  53  -5.697   7.122  -1.363
  274    HB3  CYS  53           HB2      CYS  53  -4.942   8.089  -0.094
  275    H    LEU  54           H        LEU  54  -2.779   9.546  -3.718
  276    HA   LEU  54           HA       LEU  54  -1.393  11.313  -1.925
  277    HB2  LEU  54           HB1      LEU  54  -0.348  10.688  -4.006
  278    HB3  LEU  54           HB2      LEU  54  -1.726  11.323  -4.919
  279    HG   LEU  54           HG       LEU  54  -0.830  13.509  -3.467
  280   HD11  LEU  54          HD11      LEU  54   1.636  13.410  -4.415
  281   HD12  LEU  54          HD12      LEU  54   1.413  11.683  -4.136
  282   HD13  LEU  54          HD13      LEU  54   1.236  12.821  -2.801
  283   HD21  LEU  54          HD21      LEU  54   0.001  14.271  -5.687
  284   HD22  LEU  54          HD22      LEU  54  -1.641  13.630  -5.717
  285   HD23  LEU  54          HD23      LEU  54  -0.301  12.648  -6.306
  286    H    GLN  55           H        GLN  55  -1.948  13.317  -1.288
  287    HA   GLN  55           HA       GLN  55  -4.364  14.518  -2.468
  288    HB2  GLN  55           HB1      GLN  55  -4.841  15.427  -0.152
  289    HB3  GLN  55           HB2      GLN  55  -5.086  13.686  -0.370
  290    HG2  GLN  55           HG1      GLN  55  -3.655  13.205   1.246
  291    HG3  GLN  55           HG2      GLN  55  -2.398  14.188   0.481
  292   HE21  GLN  55          HE21      GLN  55  -5.129  14.271   2.679
  293   HE22  GLN  55          HE22      GLN  55  -4.642  15.693   3.532
  294    HA   PRO  56           HA       PRO  56  -0.975  17.575  -2.853
  295    HB2  PRO  56           HB1      PRO  56  -1.933  18.660  -5.177
  296    HB3  PRO  56           HB2      PRO  56  -0.934  17.210  -5.121
  297    HG2  PRO  56           HG1      PRO  56  -3.916  17.457  -5.310
  298    HG3  PRO  56           HG2      PRO  56  -2.800  16.388  -6.238
  299    HD2  PRO  56           HD1      PRO  56  -4.282  15.493  -4.147
  300    HD3  PRO  56           HD2      PRO  56  -2.667  14.865  -4.514
  301    H    ARG  57           H        ARG  57  -0.991  19.828  -2.573
  302    HA   ARG  57           HA       ARG  57  -3.377  20.848  -1.305
  303    HB2  ARG  57           HB1      ARG  57  -0.561  21.838  -1.647
  304    HB3  ARG  57           HB2      ARG  57  -1.834  22.931  -1.080
  305    HG2  ARG  57           HG1      ARG  57  -2.206  21.673   0.880
  306    HG3  ARG  57           HG2      ARG  57  -1.271  20.303   0.257
  307    HD2  ARG  57           HD1      ARG  57   0.661  21.150   1.000
  308    HD3  ARG  57           HD2      ARG  57   0.300  22.736   0.303
  309    HE   ARG  57           HE       ARG  57  -0.376  23.447   2.366
  310   HH11  ARG  57          HH11      ARG  57  -0.320  19.967   2.336
  311   HH12  ARG  57          HH12      ARG  57  -0.638  19.817   4.032
  312   HH21  ARG  57          HH21      ARG  57  -0.795  23.263   4.601
  313   HH22  ARG  57          HH22      ARG  57  -0.909  21.693   5.319
  314    H    ASP  58           H        ASP  58  -1.700  21.221  -4.330
  315    HA   ASP  58           HA       ASP  58  -3.254  23.556  -5.089
  316    HB2  ASP  58           HB1      ASP  58  -0.847  22.194  -6.059
  317    HB3  ASP  58           HB2      ASP  58  -1.927  22.716  -7.359
  318    HD2  ASP  58           HD       ASP  58  -1.280  26.065  -6.770
  319    H    GLU  59           H        GLU  59  -3.349  20.129  -5.441
  320    HA   GLU  59           HA       GLU  59  -5.596  20.398  -7.329
  321    HB2  GLU  59           HB1      GLU  59  -3.210  18.758  -7.454
  322    HB3  GLU  59           HB2      GLU  59  -4.674  17.763  -7.498
  323    HG2  GLU  59           HG1      GLU  59  -5.386  19.632  -9.277
  324    HG3  GLU  59           HG2      GLU  59  -3.629  19.689  -9.477
  325    HE2  GLU  59           HE       GLU  59  -5.579  16.516 -10.777
  326    H    LYS  60           H        LYS  60  -6.828  18.095  -7.247
  327    HA   LYS  60           HA       LYS  60  -7.801  17.927  -4.507
  328    HB2  LYS  60           HB1      LYS  60  -8.866  17.249  -7.200
  329    HB3  LYS  60           HB2      LYS  60  -9.448  16.283  -5.835
  330    HG2  LYS  60           HG1      LYS  60  -9.573  18.976  -5.013
  331    HG3  LYS  60           HG2      LYS  60 -10.236  18.902  -6.654
  332    HD2  LYS  60           HD1      LYS  60 -11.580  16.868  -5.805
  333    HD3  LYS  60           HD2      LYS  60 -11.159  17.460  -4.188
  334    HE2  LYS  60           HE1      LYS  60 -12.072  19.734  -4.986
  335    HE3  LYS  60           HE2      LYS  60 -12.798  18.811  -6.311
  336    HZ1  LYS  60           HZ1      LYS  60 -13.474  18.822  -3.473
  337    HZ2  LYS  60           HZ2      LYS  60 -13.609  17.343  -4.283
  338    HZ3  LYS  60           HZ3      LYS  60 -14.482  18.686  -4.827
  339    HA   PRO  61           HA       PRO  61  -6.058  14.026  -3.510
  340    HB2  PRO  61           HB1      PRO  61  -8.097  12.791  -2.162
  341    HB3  PRO  61           HB2      PRO  61  -7.175  14.143  -1.506
  342    HG2  PRO  61           HG1      PRO  61  -9.839  14.149  -2.885
  343    HG3  PRO  61           HG2      PRO  61  -9.330  15.006  -1.382
  344    HD2  PRO  61           HD1      PRO  61  -9.510  16.248  -3.789
  345    HD3  PRO  61           HD2      PRO  61  -8.298  16.687  -2.573
  346    H    PHE  62           H        PHE  62  -5.668  12.227  -4.637
  347    HA   PHE  62           HA       PHE  62  -7.848  10.714  -5.818
  348    HB2  PHE  62           HB1      PHE  62  -6.680  10.648  -8.049
  349    HB3  PHE  62           HB2      PHE  62  -7.408  12.202  -7.636
  350    HD1  PHE  62           HD1      PHE  62  -6.173  14.135  -7.844
  351    HD2  PHE  62           HD2      PHE  62  -4.147  10.415  -7.414
  352    HE1  PHE  62           HE1      PHE  62  -4.020  15.269  -8.208
  353    HE2  PHE  62           HE2      PHE  62  -1.992  11.545  -7.776
  354    HZ   PHE  62           HZ       PHE  62  -1.926  13.974  -8.173
  355    H    CYS  63           H        CYS  63  -7.009   8.671  -6.853
  356    HA   CYS  63           HA       CYS  63  -5.077   7.480  -5.059
  357    HB2  CYS  63           HB1      CYS  63  -7.289   6.433  -5.903
  358    HB3  CYS  63           HB2      CYS  63  -6.388   6.082  -7.379
  359    H    ALA  64           H        ALA  64  -2.993   7.167  -5.480
  360    HA   ALA  64           HA       ALA  64  -2.058   7.559  -8.244
  361    HB1  ALA  64           HB1      ALA  64  -1.233   8.754  -5.838
  362    HB2  ALA  64           HB2      ALA  64   0.072   7.676  -6.335
  363    HB3  ALA  64           HB3      ALA  64  -0.507   8.924  -7.437
  364    H    THR  65           H        THR  65  -0.693   6.092  -9.189
  365    HA   THR  65           HA       THR  65  -0.787   3.415  -8.182
  366    HB   THR  65           HB       THR  65   1.105   3.517 -10.268
  367    HG1  THR  65           HG1      THR  65   0.356   4.966 -11.669
  368   HG21  THR  65          HG21      THR  65  -0.629   2.380 -11.542
  369   HG22  THR  65          HG22      THR  65  -1.854   2.921 -10.393
  370   HG23  THR  65          HG23      THR  65  -0.607   1.785  -9.882
  371    H    CYS  66           H        CYS  66   1.189   2.043  -8.038
  372    HA   CYS  66           HA       CYS  66   2.915   2.945  -6.052
  373    HB2  CYS  66           HB1      CYS  66   2.431   0.555  -6.625
  374    HB3  CYS  66           HB2      CYS  66   3.486   0.731  -8.030
  375    H    ARG  67           H        ARG  67   5.052   3.632  -6.036
  376    HA   ARG  67           HA       ARG  67   5.919   4.930  -8.509
  377    HB2  ARG  67           HB1      ARG  67   6.054   5.570  -5.706
  378    HB3  ARG  67           HB2      ARG  67   7.682   5.562  -6.398
  379    HG2  ARG  67           HG1      ARG  67   6.973   7.768  -6.649
  380    HG3  ARG  67           HG2      ARG  67   6.718   7.042  -8.244
  381    HD2  ARG  67           HD1      ARG  67   4.331   6.624  -7.601
  382    HD3  ARG  67           HD2      ARG  67   4.638   7.545  -6.122
  383    HE   ARG  67           HE       ARG  67   5.424   9.209  -8.144
  384   HH11  ARG  67          HH11      ARG  67   2.493   7.521  -7.322
  385   HH12  ARG  67          HH12      ARG  67   1.454   8.706  -8.040
  386   HH21  ARG  67          HH21      ARG  67   4.067  10.778  -9.094
  387   HH22  ARG  67          HH22      ARG  67   2.350  10.558  -9.048
  388    H    GLY  68           H        GLY  68   8.131   4.799  -9.210
  389    HA2  GLY  68           HA2      GLY  68   9.280   2.149  -8.654
  390    HA3  GLY  68           HA3      GLY  68   9.579   3.112 -10.093
  391    HA1  GLY  68           HA1      GLY  68   9.241   2.766  -8.024
  392    H    LEU  69           H        LEU  69  11.796   2.226  -9.202
  393    HA   LEU  69           HA       LEU  69  12.980   3.634  -7.034
  394    HB2  LEU  69           HB1      LEU  69  13.968   1.867  -9.234
  395    HB3  LEU  69           HB2      LEU  69  15.134   2.821  -8.299
  396    HG   LEU  69           HG       LEU  69  13.208   0.818  -7.124
  397   HD11  LEU  69          HD11      LEU  69  14.657  -0.776  -7.639
  398   HD12  LEU  69          HD12      LEU  69  15.947   0.105  -6.825
  399   HD13  LEU  69          HD13      LEU  69  15.622   0.398  -8.533
  400   HD21  LEU  69          HD21      LEU  69  13.677   2.354  -5.433
  401   HD22  LEU  69          HD22      LEU  69  15.343   2.581  -5.969
  402   HD23  LEU  69          HD23      LEU  69  14.867   1.075  -5.180
  403    H    ARG  70           H        ARG  70  12.555   4.307 -10.407
  404    HA   ARG  70           HA       ARG  70  14.476   6.503 -10.343
  405    HB2  ARG  70           HB1      ARG  70  12.842   5.226 -12.533
  406    HB3  ARG  70           HB2      ARG  70  13.712   6.748 -12.778
  407    HG2  ARG  70           HG1      ARG  70  15.523   4.894 -11.606
  408    HG3  ARG  70           HG2      ARG  70  14.703   4.102 -12.962
  409    HD2  ARG  70           HD1      ARG  70  15.619   6.877 -13.445
  410    HD3  ARG  70           HD2      ARG  70  16.884   5.656 -13.239
  411    HE   ARG  70           HE       ARG  70  14.869   4.805 -15.072
  412   HH11  ARG  70          HH11      ARG  70  17.717   6.782 -14.746
  413   HH12  ARG  70          HH12      ARG  70  18.136   6.684 -16.424
  414   HH21  ARG  70          HH21      ARG  70  15.410   4.670 -17.284
  415   HH22  ARG  70          HH22      ARG  70  16.822   5.484 -17.867
  416    H    ARG  71           H        ARG  71  11.632   6.254  -9.059
  417    HA   ARG  71           HA       ARG  71  10.450   8.681 -10.202
  418    HB2  ARG  71           HB1      ARG  71   9.415   6.321  -8.770
  419    HB3  ARG  71           HB2      ARG  71   8.684   7.861  -8.295
  420    HG2  ARG  71           HG1      ARG  71   8.924   7.184 -11.199
  421    HG3  ARG  71           HG2      ARG  71   7.640   6.454 -10.219
  422    HD2  ARG  71           HD1      ARG  71   6.897   8.708  -9.530
  423    HD3  ARG  71           HD2      ARG  71   8.155   9.406 -10.560
  424    HE   ARG  71           HE       ARG  71   5.627   8.364 -11.403
  425   HH11  ARG  71          HH11      ARG  71   8.923   8.926 -12.374
  426   HH12  ARG  71          HH12      ARG  71   8.551   8.994 -14.065
  427   HH21  ARG  71          HH21      ARG  71   5.124   8.452 -13.627
  428   HH22  ARG  71          HH22      ARG  71   6.389   8.726 -14.777
  429    H    ARG  72           H        ARG  72  10.298  10.560  -9.094
  430    HA   ARG  72           HA       ARG  72  11.933  10.881  -6.759
  431    HB2  ARG  72           HB1      ARG  72  10.150  12.802  -8.272
  432    HB3  ARG  72           HB2      ARG  72  11.168  13.267  -6.902
  433    HG2  ARG  72           HG1      ARG  72  12.819  11.875  -8.739
  434    HG3  ARG  72           HG2      ARG  72  11.868  13.062  -9.647
  435    HD2  ARG  72           HD1      ARG  72  13.480  13.678  -7.160
  436    HD3  ARG  72           HD2      ARG  72  14.019  13.965  -8.821
  437    HE   ARG  72           HE       ARG  72  12.135  15.536  -7.316
  438   HH11  ARG  72          HH11      ARG  72  13.257  14.659 -10.493
  439   HH12  ARG  72          HH12      ARG  72  12.667  16.106 -11.243
  440   HH21  ARG  72          HH21      ARG  72  11.354  17.444  -8.291
  441   HH22  ARG  72          HH22      ARG  72  11.585  17.689  -9.989
  442    H    CYS  73           H        CYS  73  11.297  11.455  -4.687
  443    HA   CYS  73           HA       CYS  73   8.433  11.410  -4.077
  444    HB2  CYS  73           HB1      CYS  73   8.904   9.915  -2.112
  445    HB3  CYS  73           HB2      CYS  73   9.049   9.134  -3.687
  446    H    GLN  74           H        GLN  74   7.976  12.147  -1.842
  447    HA   GLN  74           HA       GLN  74   9.949  14.170  -1.020
  448    HB2  GLN  74           HB1      GLN  74   6.940  14.106  -0.896
  449    HB3  GLN  74           HB2      GLN  74   7.885  15.221   0.104
  450    HG2  GLN  74           HG1      GLN  74   8.984  15.968  -2.094
  451    HG3  GLN  74           HG2      GLN  74   7.630  15.141  -2.877
  452   HE21  GLN  74          HE21      GLN  74   6.467  16.786  -3.653
  453   HE22  GLN  74          HE22      GLN  74   5.806  18.068  -2.702
  454    H    ARG  75           H        ARG  75   7.957  11.516   0.045
  455    HA   ARG  75           HA       ARG  75   9.317  11.609   2.647
  456    HB2  ARG  75           HB1      ARG  75   6.370  11.136   2.154
  457    HB3  ARG  75           HB2      ARG  75   7.182  10.780   3.687
  458    HG2  ARG  75           HG1      ARG  75   7.689  13.082   4.059
  459    HG3  ARG  75           HG2      ARG  75   7.146  13.510   2.429
  460    HD2  ARG  75           HD1      ARG  75   4.871  12.488   3.181
  461    HD3  ARG  75           HD2      ARG  75   5.520  12.717   4.812
  462    HE   ARG  75           HE       ARG  75   5.188  14.970   4.594
  463   HH11  ARG  75          HH11      ARG  75   5.043  13.487   1.447
  464   HH12  ARG  75          HH12      ARG  75   4.511  14.928   0.648
  465   HH21  ARG  75          HH21      ARG  75   4.487  16.874   3.553
  466   HH22  ARG  75          HH22      ARG  75   4.196  16.856   1.847
  467    H    ASP  76           H        ASP  76   9.102   9.472   3.819
  468    HA   ASP  76           HA       ASP  76   9.921   7.379   2.036
  469    HB2  ASP  76           HB1      ASP  76   9.349   7.037   4.978
  470    HB3  ASP  76           HB2      ASP  76  10.506   6.156   3.969
  471    HD2  ASP  76           HD       ASP  76  12.784   8.860   4.097
  472    H    ALA  77           H        ALA  77   7.046   8.141   3.893
  473    HA   ALA  77           HA       ALA  77   5.790   5.598   3.470
  474    HB1  ALA  77           HB1      ALA  77   4.880   6.514   5.331
  475    HB2  ALA  77           HB2      ALA  77   5.046   8.166   4.735
  476    HB3  ALA  77           HB3      ALA  77   3.727   7.148   4.156
  477    H    MET  78           H        MET  78   6.011   8.582   1.727
  478    HA   MET  78           HA       MET  78   3.690   8.414   0.160
  479    HB2  MET  78           HB1      MET  78   6.255   9.865   0.058
  480    HB3  MET  78           HB2      MET  78   5.477   9.620  -1.513
  481    HG2  MET  78           HG1      MET  78   3.792  10.634   0.718
  482    HG3  MET  78           HG2      MET  78   4.973  11.730  -0.001
  483    HE1  MET  78           HE1      MET  78   4.758  10.702  -3.326
  484    HE2  MET  78           HE2      MET  78   3.918  12.233  -3.567
  485    HE3  MET  78           HE3      MET  78   5.248  12.130  -2.414
  486    H    CYS  79           H        CYS  79   6.859   6.930  -0.182
  487    HA   CYS  79           HA       CYS  79   6.205   5.811  -2.777
  488    HB2  CYS  79           HB1      CYS  79   8.581   6.432  -1.414
  489    HB3  CYS  79           HB2      CYS  79   8.558   4.672  -1.536
  490    H    CYS  80           H        CYS  80   6.425   3.467  -3.162
  491    HA   CYS  80           HA       CYS  80   4.682   1.989  -1.537
  492    HB2  CYS  80           HB1      CYS  80   6.481   1.391  -3.835
  493    HB3  CYS  80           HB2      CYS  80   5.903   0.022  -2.883
  494    HA   PRO  81           HA       PRO  81   7.146   0.239   1.642
  495    HB2  PRO  81           HB1      PRO  81   6.174  -2.316   1.809
  496    HB3  PRO  81           HB2      PRO  81   5.273  -0.897   2.339
  497    HG2  PRO  81           HG1      PRO  81   5.104  -2.395  -0.253
  498    HG3  PRO  81           HG2      PRO  81   3.774  -1.794   0.805
  499    HD2  PRO  81           HD1      PRO  81   4.542  -0.507  -1.457
  500    HD3  PRO  81           HD2      PRO  81   3.954   0.350  -0.023
  501    H    GLY  82           H        GLY  82   8.977  -0.991   2.047
  502    HA2  GLY  82           HA2      GLY  82  10.489  -2.783   1.553
  503    HA3  GLY  82           HA3      GLY  82   9.906  -2.770  -0.105
  504    HA1  GLY  82           HA1      GLY  82  10.486  -1.924   1.757
  505    H    THR  83           H        THR  83  10.072   0.265  -0.010
  506    HA   THR  83           HA       THR  83  12.990   0.453  -0.387
  507    HB   THR  83           HB       THR  83  12.149   2.450  -1.959
  508    HG1  THR  83           HG1      THR  83  10.172   0.508  -2.500
  509   HG21  THR  83          HG21      THR  83  12.933  -0.319  -2.362
  510   HG22  THR  83          HG22      THR  83  13.412   1.128  -3.249
  511   HG23  THR  83          HG23      THR  83  11.924   0.284  -3.677
  512    H    LEU  84           H        LEU  84  13.732   2.823  -0.358
  513    HA   LEU  84           HA       LEU  84  12.283   4.326   1.714
  514    HB2  LEU  84           HB1      LEU  84  14.334   3.015   2.521
  515    HB3  LEU  84           HB2      LEU  84  15.279   4.194   1.594
  516    HG   LEU  84           HG       LEU  84  13.822   5.883   3.083
  517   HD11  LEU  84          HD11      LEU  84  14.248   3.514   4.894
  518   HD12  LEU  84          HD12      LEU  84  12.687   3.976   4.216
  519   HD13  LEU  84          HD13      LEU  84  13.532   5.071   5.312
  520   HD21  LEU  84          HD21      LEU  84  16.389   4.481   3.803
  521   HD22  LEU  84          HD22      LEU  84  15.778   5.900   4.656
  522   HD23  LEU  84          HD23      LEU  84  16.194   6.010   2.945
  523    H    CYS  85           H        CYS  85  12.263   6.528   1.501
  524    HA   CYS  85           HA       CYS  85  12.876   7.572  -1.100
  525    HB2  CYS  85           HB1      CYS  85  10.888   8.198   0.381
  526    HB3  CYS  85           HB2      CYS  85  12.027   9.179   1.307
  527    H    VAL  86           H        VAL  86  15.022   7.737  -1.499
  528    HA   VAL  86           HA       VAL  86  16.631   9.314   0.403
  529    HB   VAL  86           HB       VAL  86  17.677   7.355  -1.642
  530   HG11  VAL  86          HG11      VAL  86  19.676   7.559   0.042
  531   HG12  VAL  86          HG12      VAL  86  19.445   8.762  -1.228
  532   HG13  VAL  86          HG13      VAL  86  18.924   9.109   0.420
  533   HG21  VAL  86          HG21      VAL  86  17.066   7.013   1.282
  534   HG22  VAL  86          HG22      VAL  86  16.501   6.037  -0.075
  535   HG23  VAL  86          HG23      VAL  86  18.193   5.967   0.419
  536    H    ASN  87           H        ASN  87  17.616  11.129  -0.293
  537    HA   ASN  87           HA       ASN  87  18.044  12.940  -1.603
  538    HB2  ASN  87           HB1      ASN  87  19.489  10.971  -2.605
  539    HB3  ASN  87           HB2      ASN  87  18.395  11.157  -3.980
  540   HD21  ASN  87          HD21      ASN  87  18.672  12.803  -5.364
  541   HD22  ASN  87          HD22      ASN  87  19.885  14.024  -5.206
  542    H    ASP  88           H        ASP  88  15.313  12.212  -1.368
  543    HA   ASP  88           HA       ASP  88  13.281  12.784  -2.217
  544    HB2  ASP  88           HB1      ASP  88  14.844  14.830  -2.903
  545    HB3  ASP  88           HB2      ASP  88  14.488  14.229  -4.528
  546    HD2  ASP  88           HD       ASP  88  11.570  15.926  -2.469
  547    H    VAL  89           H        VAL  89  14.757  10.407  -3.174
  548    HA   VAL  89           HA       VAL  89  13.039   9.831  -5.455
  549    HB   VAL  89           HB       VAL  89  16.017   9.336  -5.562
  550   HG11  VAL  89          HG11      VAL  89  13.835   8.764  -7.564
  551   HG12  VAL  89          HG12      VAL  89  15.566   8.573  -7.858
  552   HG13  VAL  89          HG13      VAL  89  14.758   7.572  -6.650
  553   HG21  VAL  89          HG21      VAL  89  15.995  10.944  -7.429
  554   HG22  VAL  89          HG22      VAL  89  14.294  11.278  -7.102
  555   HG23  VAL  89          HG23      VAL  89  15.520  11.686  -5.902
  556    H    CYS  90           H        CYS  90  12.359   7.740  -5.535
  557    HA   CYS  90           HA       CYS  90  12.552   6.146  -3.238
  558    HB2  CYS  90           HB1      CYS  90  10.998   6.167  -5.522
  559    HB3  CYS  90           HB2      CYS  90  11.916   4.669  -5.684
  560    H    THR  91           H        THR  91  14.357   5.220  -2.532
  561    HA   THR  91           HA       THR  91  16.071   3.835  -4.492
  562    HB   THR  91           HB       THR  91  16.947   5.175  -1.924
  563    HG1  THR  91           HG1      THR  91  18.215   6.338  -3.733
  564   HG21  THR  91          HG21      THR  91  19.233   4.650  -2.748
  565   HG22  THR  91          HG22      THR  91  18.510   3.681  -4.032
  566   HG23  THR  91          HG23      THR  91  18.291   3.215  -2.345
  567    H    THR  92           H        THR  92  16.720   1.779  -4.033
  568    HA   THR  92           HA       THR  92  15.168   0.171  -2.379
  569    HB   THR  92           HB       THR  92  17.381  -1.351  -2.566
  570    HG1  THR  92           HG1      THR  92  18.704  -0.691  -4.131
  571   HG21  THR  92          HG21      THR  92  15.861  -0.924  -5.098
  572   HG22  THR  92          HG22      THR  92  14.988  -1.459  -3.661
  573   HG23  THR  92          HG23      THR  92  16.317  -2.427  -4.297
  574    H    MET  93           H        MET  93  15.333  -0.566  -0.318
  575    HA   MET  93           HA       MET  93  16.734   0.952   1.584
  576    HB2  MET  93           HB1      MET  93  15.054  -1.476   1.582
  577    HB3  MET  93           HB2      MET  93  16.192  -1.346   2.933
  578    HG2  MET  93           HG1      MET  93  15.277   0.945   3.387
  579    HG3  MET  93           HG2      MET  93  14.041   0.610   2.175
  580    HE1  MET  93           HE1      MET  93  15.701  -0.212   5.341
  581    HE2  MET  93           HE2      MET  93  14.291   0.479   6.145
  582    HE3  MET  93           HE3      MET  93  14.615  -1.251   6.265
  583    H    GLU  94           H        GLU  94  17.466  -2.136   0.044
  584    HA   GLU  94           HA       GLU  94  19.647  -2.878   1.640
  585    HB2  GLU  94           HB1      GLU  94  19.114  -3.451  -1.286
  586    HB3  GLU  94           HB2      GLU  94  20.329  -4.274  -0.296
  587    HG2  GLU  94           HG1      GLU  94  18.740  -5.386   0.988
  588    HG3  GLU  94           HG2      GLU  94  17.454  -4.264   0.521
  589    HE2  GLU  94           HE       GLU  94  16.731  -7.066  -1.489
  590    H    ASP  95           H        ASP  95  19.426  -0.778  -1.176
  591    HA   ASP  95           HA       ASP  95  22.242  -0.456  -1.501
  592    HB2  ASP  95           HB1      ASP  95  19.783   0.663  -2.694
  593    HB3  ASP  95           HB2      ASP  95  21.172   1.760  -2.683
  594    HD2  ASP  95           HD       ASP  95  21.099  -0.912  -5.426
  595    H    ALA  96           H        ALA  96  19.704   1.418   0.101
  596    HA   ALA  96           HA       ALA  96  21.341   3.604   0.837
  597    HB1  ALA  96           HB1      ALA  96  18.625   2.835   1.161
  598    HB2  ALA  96           HB2      ALA  96  19.263   3.295   2.741
  599    HB3  ALA  96           HB3      ALA  96  19.357   4.424   1.389
  600    H    THR  97           H        THR  97  23.250   2.856   1.746
  601    HA   THR  97           HA       THR  97  23.163   2.346   4.558
  602    HB   THR  97           HB       THR  97  24.743   0.199   3.976
  603    HG1  THR  97           HG1      THR  97  24.048  -0.802   2.224
  604   HG21  THR  97          HG21      THR  97  22.111   0.678   5.077
  605   HG22  THR  97          HG22      THR  97  23.339  -0.488   5.571
  606   HG23  THR  97          HG23      THR  97  22.198  -0.897   4.289
  607    H    GLU  98           H        GLU  98  25.309   1.784   1.760
  608    HA   GLU  98           HA       GLU  98  27.228   3.658   2.942
  609    HB2  GLU  98           HB1      GLU  98  27.640   0.772   2.384
  610    HB3  GLU  98           HB2      GLU  98  28.955   1.865   1.925
  611    HG2  GLU  98           HG1      GLU  98  29.239   2.630   4.151
  612    HG3  GLU  98           HG2      GLU  98  27.742   1.842   4.671
  613    HE2  GLU  98           HE       GLU  98  29.911  -0.636   5.739
  614    H    ASN  99           H        ASN  99  28.342   4.887   1.489
  615    HA   ASN  99           HA       ASN  99  27.347   4.901  -1.217
  616    HB2  ASN  99           HB1      ASN  99  28.807   6.912  -1.470
  617    HB3  ASN  99           HB2      ASN  99  27.656   7.032  -0.133
  618   HD21  ASN  99          HD21      ASN  99  30.900   7.196  -1.038
  619   HD22  ASN  99          HD22      ASN  99  31.591   7.325   0.540
  620    H    LEU 100           H        LEU 100  28.240   3.886  -2.881
  621    HA   LEU 100           HA       LEU 100  30.611   2.355  -2.626
  622    HB2  LEU 100           HB1      LEU 100  28.541   2.816  -4.627
  623    HB3  LEU 100           HB2      LEU 100  30.150   2.610  -5.341
  624    HG   LEU 100           HG       LEU 100  29.853   0.542  -3.452
  625   HD11  LEU 100          HD11      LEU 100  27.544   0.400  -5.335
  626   HD12  LEU 100          HD12      LEU 100  27.364   1.235  -3.793
  627   HD13  LEU 100          HD13      LEU 100  27.819  -0.468  -3.824
  628   HD21  LEU 100          HD21      LEU 100  29.609  -0.750  -5.741
  629   HD22  LEU 100          HD22      LEU 100  31.130   0.010  -5.268
  630   HD23  LEU 100          HD23      LEU 100  30.052   0.823  -6.404
  631    H    TYR 101           H        TYR 101  32.452   2.531  -4.200
  632    HA   TYR 101           HA       TYR 101  33.086   5.090  -5.305
  633    HB2  TYR 101           HB1      TYR 101  33.885   4.487  -2.564
  634    HB3  TYR 101           HB2      TYR 101  35.270   4.841  -3.600
  635    HD1  TYR 101           HD1      TYR 101  32.772   6.279  -1.581
  636    HD2  TYR 101           HD2      TYR 101  35.035   6.981  -5.115
  637    HE1  TYR 101           HE1      TYR 101  32.330   8.689  -1.378
  638    HE2  TYR 101           HE2      TYR 101  34.601   9.394  -4.921
  639    HH   TYR 101           HH       TYR 101  33.808  11.021  -3.583
  640    H    PHE 102           H        PHE 102  35.588   5.087  -5.846
  641    HA   PHE 102           HA       PHE 102  36.116   2.472  -7.070
  642    HB2  PHE 102           HB1      PHE 102  36.533   5.265  -7.888
  643    HB3  PHE 102           HB2      PHE 102  37.915   4.215  -8.203
  644    HD1  PHE 102           HD1      PHE 102  37.959   3.763 -10.461
  645    HD2  PHE 102           HD2      PHE 102  34.257   3.533  -8.372
  646    HE1  PHE 102           HE1      PHE 102  36.870   2.898 -12.491
  647    HE2  PHE 102           HE2      PHE 102  33.163   2.668 -10.399
  648    HZ   PHE 102           HZ       PHE 102  34.470   2.348 -12.462
  649    H    GLN 103           H        GLN 103  38.367   1.753  -7.205
  650    HA   GLN 103           HA       GLN 103  40.331   2.872  -5.451
  651    HB2  GLN 103           HB1      GLN 103  38.483   1.197  -4.233
  652    HB3  GLN 103           HB2      GLN 103  39.867   0.138  -4.555
  653    HG2  GLN 103           HG1      GLN 103  40.773   2.647  -3.479
  654    HG3  GLN 103           HG2      GLN 103  39.541   1.928  -2.432
  655   HE21  GLN 103          HE21      GLN 103  39.864  -0.476  -2.043
  656   HE22  GLN 103          HE22      GLN 103  41.479  -0.984  -1.699
  657    H    SER 104           H        SER 104  42.137   1.017  -5.135
  658    HA   SER 104           HA       SER 104  43.780  -0.162  -6.177
  659    HB2  SER 104           HB1      SER 104  41.896  -1.835  -6.319
  660    HB3  SER 104           HB2      SER 104  41.582  -1.235  -7.957
  661    HG   SER 104           HG       SER 104  43.146  -2.447  -8.627
  662    H    LEU 105           H        LEU 105  44.870   1.586  -7.060
  663    HA   LEU 105           HA       LEU 105  44.173   2.375  -9.796
  664    HB2  LEU 105           HB1      LEU 105  46.286   3.640  -8.068
  665    HB3  LEU 105           HB2      LEU 105  45.444   4.326  -9.468
  666    HG   LEU 105           HG       LEU 105  43.399   3.865  -7.677
  667   HD11  LEU 105          HD11      LEU 105  44.445   5.222  -5.681
  668   HD12  LEU 105          HD12      LEU 105  45.930   4.442  -6.224
  669   HD13  LEU 105          HD13      LEU 105  44.547   3.461  -5.741
  670   HD21  LEU 105          HD21      LEU 105  43.386   5.821  -8.935
  671   HD22  LEU 105          HD22      LEU 105  45.011   6.278  -8.425
  672   HD23  LEU 105          HD23      LEU 105  43.665   6.398  -7.292
  673    H    GLU 106           H        GLU 106  46.286   3.028 -11.077
  674    HA   GLU 106           HA       GLU 106  48.142   0.745 -10.900
  675    HB2  GLU 106           HB1      GLU 106  46.412   1.364 -12.985
  676    HB3  GLU 106           HB2      GLU 106  47.980   1.979 -13.531
  677    HG2  GLU 106           HG1      GLU 106  48.217  -0.119 -14.309
  678    HG3  GLU 106           HG2      GLU 106  48.747  -0.426 -12.649
  679    HE2  GLU 106           HE       GLU 106  45.937  -2.635 -13.781
  680    H    HIS 107           H        HIS 107  50.147   1.345 -12.445
  681    HA   HIS 107           HA       HIS 107  50.995   4.073 -12.333
  682    HB2  HIS 107           HB1      HIS 107  51.244   3.184  -9.940
  683    HB3  HIS 107           HB2      HIS 107  52.555   2.187 -10.575
  684    HD1  HIS 107           HD1      HIS 107  52.152   5.225  -8.879
  685    HD2  HIS 107           HD2      HIS 107  54.454   4.058 -12.135
  686    HE1  HIS 107           HE1      HIS 107  54.001   6.923  -9.039
  687    HE2  HIS 107           HE2      HIS 107  55.408   6.211 -11.028
  688    H    HIS 108           H        HIS 108  52.354   4.396 -13.970
  689    HA   HIS 108           HA       HIS 108  54.390   2.509 -14.683
  690    HB2  HIS 108           HB1      HIS 108  51.857   2.195 -15.894
  691    HB3  HIS 108           HB2      HIS 108  52.906   2.921 -17.115
  692    HD1  HIS 108           HD1      HIS 108  52.973  -0.056 -14.750
  693    HD2  HIS 108           HD2      HIS 108  54.473   1.147 -18.433
  694    HE1  HIS 108           HE1      HIS 108  54.160  -2.067 -15.682
  695    HE2  HIS 108           HE2      HIS 108  55.076  -1.334 -17.934
  696    H    HIS 109           H        HIS 109  55.482   3.264 -16.813
  697    HA   HIS 109           HA       HIS 109  55.176   5.921 -17.693
  698    HB2  HIS 109           HB1      HIS 109  57.333   6.816 -16.698
  699    HB3  HIS 109           HB2      HIS 109  55.963   6.683 -15.590
  700    HD1  HIS 109           HD1      HIS 109  59.405   5.476 -16.110
  701    HD2  HIS 109           HD2      HIS 109  56.151   4.525 -13.708
  702    HE1  HIS 109           HE1      HIS 109  60.323   4.012 -14.284
  703    HE2  HIS 109           HE2      HIS 109  58.335   3.431 -12.815
  704    H    HIS 110           H        HIS 110  55.504   5.053 -19.709
  705    HA   HIS 110           HA       HIS 110  58.277   4.527 -20.411
  706    HB2  HIS 110           HB1      HIS 110  56.548   2.390 -19.975
  707    HB3  HIS 110           HB2      HIS 110  56.543   2.593 -21.730
  708    HD1  HIS 110           HD1      HIS 110  58.514   1.718 -23.000
  709    HD2  HIS 110           HD2      HIS 110  59.221   1.915 -18.911
  710    HE1  HIS 110           HE1      HIS 110  60.725   0.574 -22.644
  711    HE2  HIS 110           HE2      HIS 110  61.158   0.694 -20.145
  712    H    HIS 111           H        HIS 111  58.669   4.629 -22.717
  713    HA   HIS 111           HA       HIS 111  58.463   5.615 -24.757
  714    HB2  HIS 111           HB1      HIS 111  56.401   3.977 -24.638
  715    HB3  HIS 111           HB2      HIS 111  55.478   5.481 -24.586
  716    HD1  HIS 111           HD1      HIS 111  58.032   3.775 -26.815
  717    HD2  HIS 111           HD2      HIS 111  55.015   6.624 -27.010
  718    HE1  HIS 111           HE1      HIS 111  57.791   4.333 -29.255
  719    HE2  HIS 111           HE2      HIS 111  55.947   6.075 -29.375
  720    H    HIS 112           H        HIS 112  59.170   7.663 -24.327
  721    HA   HIS 112           HA       HIS 112  57.825   9.654 -22.928
  722    HB2  HIS 112           HB1      HIS 112  60.269   9.483 -24.012
  723    HB3  HIS 112           HB2      HIS 112  59.495  10.479 -25.248
  724    HD1  HIS 112           HD1      HIS 112  59.945  10.535 -21.470
  725    HD2  HIS 112           HD2      HIS 112  59.508  13.128 -24.687
  726    HE1  HIS 112           HE1      HIS 112  60.215  12.844 -20.513
  727    HE2  HIS 112           HE2      HIS 112  59.948  14.429 -22.479
  Start of MODEL   10
    1    H1   MET  18           H        MET  18 -21.220 -17.703 -23.691
    2    HA   MET  18           HA       MET  18 -19.179 -15.846 -23.556
    3    HB2  MET  18           HB1      MET  18 -21.887 -14.505 -23.750
    4    HB3  MET  18           HB2      MET  18 -20.346 -13.707 -23.401
    5    HG2  MET  18           HG1      MET  18 -20.433 -13.238 -25.609
    6    HG3  MET  18           HG2      MET  18 -19.690 -14.837 -25.718
    7    HE1  MET  18           HE1      MET  18 -21.791 -16.047 -28.501
    8    HE2  MET  18           HE2      MET  18 -20.582 -14.770 -28.370
    9    HE3  MET  18           HE3      MET  18 -20.361 -16.287 -27.496
   10    H    LEU  19           H        LEU  19 -19.883 -17.872 -21.946
   11    HA   LEU  19           HA       LEU  19 -20.879 -16.526 -19.521
   12    HB2  LEU  19           HB1      LEU  19 -21.155 -19.450 -20.240
   13    HB3  LEU  19           HB2      LEU  19 -21.741 -18.672 -18.759
   14    HG   LEU  19           HG       LEU  19 -22.884 -17.302 -20.970
   15   HD11  LEU  19          HD11      LEU  19 -24.218 -19.230 -21.881
   16   HD12  LEU  19          HD12      LEU  19 -23.028 -20.302 -21.142
   17   HD13  LEU  19          HD13      LEU  19 -22.531 -19.162 -22.392
   18   HD21  LEU  19          HD21      LEU  19 -24.919 -17.827 -19.892
   19   HD22  LEU  19          HD22      LEU  19 -23.725 -17.644 -18.608
   20   HD23  LEU  19          HD23      LEU  19 -24.231 -19.255 -19.120
   21    H    VAL  20           H        VAL  20 -18.692 -15.931 -19.053
   22    HA   VAL  20           HA       VAL  20 -16.879 -18.136 -18.389
   23    HB   VAL  20           HB       VAL  20 -16.292 -15.174 -18.413
   24   HG11  VAL  20          HG11      VAL  20 -14.652 -16.097 -17.078
   25   HG12  VAL  20          HG12      VAL  20 -14.648 -17.626 -17.957
   26   HG13  VAL  20          HG13      VAL  20 -13.909 -16.193 -18.673
   27   HG21  VAL  20          HG21      VAL  20 -16.409 -15.369 -20.638
   28   HG22  VAL  20          HG22      VAL  20 -14.915 -16.297 -20.507
   29   HG23  VAL  20          HG23      VAL  20 -16.467 -17.131 -20.569
   30    H    LEU  21           H        LEU  21 -16.185 -18.546 -16.342
   31    HA   LEU  21           HA       LEU  21 -17.800 -17.817 -14.172
   32    HB2  LEU  21           HB1      LEU  21 -15.646 -19.571 -14.665
   33    HB3  LEU  21           HB2      LEU  21 -15.175 -18.559 -13.290
   34    HG   LEU  21           HG       LEU  21 -16.173 -20.595 -12.485
   35   HD11  LEU  21          HD11      LEU  21 -16.639 -18.393 -11.350
   36   HD12  LEU  21          HD12      LEU  21 -17.776 -19.694 -11.001
   37   HD13  LEU  21          HD13      LEU  21 -18.218 -18.418 -12.135
   38   HD21  LEU  21          HD21      LEU  21 -18.671 -20.923 -12.980
   39   HD22  LEU  21          HD22      LEU  21 -17.510 -21.387 -14.225
   40   HD23  LEU  21          HD23      LEU  21 -18.393 -19.866 -14.364
   41    H    ASP  22           H        ASP  22 -17.611 -16.320 -12.564
   42    HA   ASP  22           HA       ASP  22 -15.272 -14.611 -12.415
   43    HB2  ASP  22           HB1      ASP  22 -18.009 -13.558 -13.168
   44    HB3  ASP  22           HB2      ASP  22 -16.696 -12.535 -12.571
   45    HD2  ASP  22           HD       ASP  22 -14.856 -13.060 -15.560
   46    H    PHE  23           H        PHE  23 -15.078 -15.524 -10.338
   47    HA   PHE  23           HA       PHE  23 -17.026 -15.696  -8.384
   48    HB2  PHE  23           HB1      PHE  23 -14.048 -15.402  -8.331
   49    HB3  PHE  23           HB2      PHE  23 -14.937 -15.254  -6.815
   50    HD1  PHE  23           HD1      PHE  23 -14.238 -17.536  -9.631
   51    HD2  PHE  23           HD2      PHE  23 -15.807 -17.134  -5.694
   52    HE1  PHE  23           HE1      PHE  23 -14.324 -19.986  -9.419
   53    HE2  PHE  23           HE2      PHE  23 -15.894 -19.583  -5.477
   54    HZ   PHE  23           HZ       PHE  23 -15.152 -21.012  -7.339
   55    H    ASN  24           H        ASN  24 -17.892 -14.337  -6.886
   56    HA   ASN  24           HA       ASN  24 -16.870 -11.667  -6.504
   57    HB2  ASN  24           HB1      ASN  24 -19.122 -12.213  -8.308
   58    HB3  ASN  24           HB2      ASN  24 -19.492 -11.024  -7.054
   59   HD21  ASN  24          HD21      ASN  24 -18.547 -11.242 -10.108
   60   HD22  ASN  24          HD22      ASN  24 -17.565  -9.826 -10.248
   61    H    ASN  25           H        ASN  25 -16.697 -12.559  -4.368
   62    HA   ASN  25           HA       ASN  25 -19.270 -12.565  -2.935
   63    HB2  ASN  25           HB1      ASN  25 -18.170 -14.836  -3.131
   64    HB3  ASN  25           HB2      ASN  25 -16.853 -14.194  -2.141
   65   HD21  ASN  25          HD21      ASN  25 -17.166 -15.505  -0.401
   66   HD22  ASN  25          HD22      ASN  25 -18.555 -15.419   0.621
   67    H    ILE  26           H        ILE  26 -19.428 -11.230  -1.233
   68    HA   ILE  26           HA       ILE  26 -16.964  -9.905  -0.303
   69    HB   ILE  26           HB       ILE  26 -18.421  -7.950   0.265
   70   HG12  ILE  26          HG11      ILE  26 -20.440  -9.149  -1.619
   71   HG13  ILE  26          HG12      ILE  26 -20.537  -9.437   0.127
   72   HG21  ILE  26          HG21      ILE  26 -17.849  -8.878  -2.497
   73   HG22  ILE  26          HG22      ILE  26 -18.823  -7.422  -2.296
   74   HG23  ILE  26          HG23      ILE  26 -17.200  -7.500  -1.609
   75   HD11  ILE  26          HD11      ILE  26 -21.567  -7.265  -1.293
   76   HD12  ILE  26          HD12      ILE  26 -21.504  -7.479   0.457
   77   HD13  ILE  26          HD13      ILE  26 -20.198  -6.638  -0.376
   78    H    ARG  27           H        ARG  27 -17.206  -8.947   1.929
   79    HA   ARG  27           HA       ARG  27 -19.050 -10.396   3.662
   80    HB2  ARG  27           HB1      ARG  27 -17.196 -11.038   5.201
   81    HB3  ARG  27           HB2      ARG  27 -17.159 -11.879   3.646
   82    HG2  ARG  27           HG1      ARG  27 -15.469 -10.185   2.869
   83    HG3  ARG  27           HG2      ARG  27 -15.399  -9.617   4.546
   84    HD2  ARG  27           HD1      ARG  27 -13.595 -11.166   4.212
   85    HD3  ARG  27           HD2      ARG  27 -14.808 -11.929   5.248
   86    HE   ARG  27           HE       ARG  27 -15.178 -12.547   2.476
   87   HH11  ARG  27          HH11      ARG  27 -13.419 -13.391   5.360
   88   HH12  ARG  27          HH12      ARG  27 -13.121 -15.022   4.857
   89   HH21  ARG  27          HH21      ARG  27 -14.791 -14.692   1.803
   90   HH22  ARG  27          HH22      ARG  27 -13.901 -15.760   2.833
   91    H    SER  28           H        SER  28 -18.859  -7.647   2.871
   92    HA   SER  28           HA       SER  28 -18.829  -6.444   5.490
   93    HB2  SER  28           HB1      SER  28 -17.315  -4.537   4.277
   94    HB3  SER  28           HB2      SER  28 -16.654  -5.810   5.320
   95    HG   SER  28           HG       SER  28 -15.490  -6.092   3.542
   96    H    SER  29           H        SER  29 -20.061  -4.590   5.606
   97    HA   SER  29           HA       SER  29 -21.110  -3.464   3.118
   98    HB2  SER  29           HB1      SER  29 -22.776  -4.670   5.338
   99    HB3  SER  29           HB2      SER  29 -23.434  -3.510   4.171
  100    HG   SER  29           HG       SER  29 -23.357  -6.035   3.817
  101    H    ALA  30           H        ALA  30 -20.112  -1.520   3.462
  102    HA   ALA  30           HA       ALA  30 -20.166  -0.168   5.981
  103    HB1  ALA  30           HB1      ALA  30 -18.759   1.337   5.037
  104    HB2  ALA  30           HB2      ALA  30 -18.548   0.033   3.868
  105    HB3  ALA  30           HB3      ALA  30 -19.639   1.371   3.509
  106    H    ASP  31           H        ASP  31 -21.657   1.170   6.778
  107    HA   ASP  31           HA       ASP  31 -23.550   2.481   4.979
  108    HB2  ASP  31           HB1      ASP  31 -24.462   0.234   5.869
  109    HB3  ASP  31           HB2      ASP  31 -24.575   1.062   7.428
  110    HD2  ASP  31           HD       ASP  31 -27.480   2.608   6.516
  111    H    LEU  32           H        LEU  32 -22.583   4.442   5.493
  112    HA   LEU  32           HA       LEU  32 -22.871   5.312   8.294
  113    HB2  LEU  32           HB1      LEU  32 -20.612   5.325   6.708
  114    HB3  LEU  32           HB2      LEU  32 -21.211   6.988   6.581
  115    HG   LEU  32           HG       LEU  32 -21.056   5.914   9.321
  116   HD11  LEU  32          HD11      LEU  32 -19.049   4.911   8.567
  117   HD12  LEU  32          HD12      LEU  32 -18.588   6.403   9.385
  118   HD13  LEU  32          HD13      LEU  32 -18.608   6.334   7.624
  119   HD21  LEU  32          HD21      LEU  32 -19.952   8.461   8.166
  120   HD22  LEU  32          HD22      LEU  32 -20.398   8.121   9.838
  121   HD23  LEU  32          HD23      LEU  32 -21.651   8.267   8.603
  122    H    HIS  33           H        HIS  33 -23.981   7.158   8.748
  123    HA   HIS  33           HA       HIS  33 -25.611   8.245   6.594
  124    HB2  HIS  33           HB1      HIS  33 -25.715   8.423   9.601
  125    HB3  HIS  33           HB2      HIS  33 -26.691   9.490   8.587
  126    HD1  HIS  33           HD1      HIS  33 -27.728   7.142  10.535
  127    HD2  HIS  33           HD2      HIS  33 -27.514   7.058   6.387
  128    HE1  HIS  33           HE1      HIS  33 -29.407   5.416   9.809
  129    HE2  HIS  33           HE2      HIS  33 -29.277   5.364   7.273
  130    H    GLY  34           H        GLY  34 -23.196   9.066   6.017
  131    HA2  GLY  34           HA2      GLY  34 -22.828  11.726   7.221
  132    HA3  GLY  34           HA3      GLY  34 -21.608  10.840   6.319
  133    HA1  GLY  34           HA1      GLY  34 -23.568  11.521   6.788
  134    H    ALA  35           H        ALA  35 -22.629  10.223   3.990
  135    HA   ALA  35           HA       ALA  35 -23.069  11.037   1.911
  136    HB1  ALA  35           HB1      ALA  35 -25.169  12.133   3.641
  137    HB2  ALA  35           HB2      ALA  35 -24.937  12.997   2.120
  138    HB3  ALA  35           HB3      ALA  35 -25.294  11.269   2.108
  139    H    ARG  36           H        ARG  36 -20.918  11.935   1.823
  140    HA   ARG  36           HA       ARG  36 -20.981  14.853   1.586
  141    HB2  ARG  36           HB1      ARG  36 -18.932  13.242   3.112
  142    HB3  ARG  36           HB2      ARG  36 -18.645  14.902   2.569
  143    HG2  ARG  36           HG1      ARG  36 -21.112  14.979   3.892
  144    HG3  ARG  36           HG2      ARG  36 -20.056  13.962   4.887
  145    HD2  ARG  36           HD1      ARG  36 -19.473  16.769   3.920
  146    HD3  ARG  36           HD2      ARG  36 -19.845  16.269   5.575
  147    HE   ARG  36           HE       ARG  36 -17.630  14.807   4.834
  148   HH11  ARG  36          HH11      ARG  36 -18.459  18.173   5.152
  149   HH12  ARG  36          HH12      ARG  36 -16.846  18.668   5.546
  150   HH21  ARG  36          HH21      ARG  36 -15.503  15.445   5.351
  151   HH22  ARG  36          HH22      ARG  36 -15.165  17.115   5.657
  152    H    LYS  37           H        LYS  37 -20.170  15.522  -0.291
  153    HA   LYS  37           HA       LYS  37 -18.710  13.590  -1.941
  154    HB2  LYS  37           HB1      LYS  37 -20.216  16.127  -2.591
  155    HB3  LYS  37           HB2      LYS  37 -19.199  15.290  -3.774
  156    HG2  LYS  37           HG1      LYS  37 -21.369  13.813  -2.327
  157    HG3  LYS  37           HG2      LYS  37 -21.737  14.822  -3.737
  158    HD2  LYS  37           HD1      LYS  37 -20.668  13.435  -5.201
  159    HD3  LYS  37           HD2      LYS  37 -19.482  12.911  -3.992
  160    HE2  LYS  37           HE1      LYS  37 -20.871  11.029  -4.468
  161    HE3  LYS  37           HE2      LYS  37 -21.321  11.632  -2.866
  162    HZ1  LYS  37           HZ1      LYS  37 -23.199  11.062  -4.431
  163    HZ2  LYS  37           HZ2      LYS  37 -22.776  12.442  -5.312
  164    HZ3  LYS  37           HZ3      LYS  37 -23.275  12.587  -3.703
  165    H    GLY  38           H        GLY  38 -16.613  13.752  -1.215
  166    HA2  GLY  38           HA2      GLY  38 -15.118  16.007  -2.177
  167    HA3  GLY  38           HA3      GLY  38 -15.189  15.948  -0.421
  168    HA1  GLY  38           HA1      GLY  38 -15.254  15.163  -2.397
  169    H    SER  39           H        SER  39 -14.358  14.028   0.644
  170    HA   SER  39           HA       SER  39 -11.830  13.279  -0.336
  171    HB2  SER  39           HB1      SER  39 -12.929  11.388   1.601
  172    HB3  SER  39           HB2      SER  39 -11.541  12.482   1.748
  173    HG   SER  39           HG       SER  39 -12.905  14.120   2.379
  174    H    GLN  40           H        GLN  40 -11.332  11.889  -1.882
  175    HA   GLN  40           HA       GLN  40 -13.278  10.094  -2.978
  176    HB2  GLN  40           HB1      GLN  40 -10.610  11.074  -3.682
  177    HB3  GLN  40           HB2      GLN  40 -10.862   9.370  -4.092
  178    HG2  GLN  40           HG1      GLN  40 -13.014  11.264  -4.848
  179    HG3  GLN  40           HG2      GLN  40 -11.489  11.365  -5.738
  180   HE21  GLN  40          HE21      GLN  40 -14.032   9.134  -4.752
  181   HE22  GLN  40          HE22      GLN  40 -13.872   8.068  -6.102
  182    H    CYS  41           H        CYS  41 -10.569   9.837  -0.789
  183    HA   CYS  41           HA       CYS  41 -11.376   7.128  -0.121
  184    HB2  CYS  41           HB1      CYS  41  -9.128   6.199  -0.337
  185    HB3  CYS  41           HB2      CYS  41  -9.715   6.784  -1.894
  186    H    LEU  42           H        LEU  42 -10.963   6.589   1.981
  187    HA   LEU  42           HA       LEU  42  -9.989   8.752   3.679
  188    HB2  LEU  42           HB1      LEU  42 -11.808   6.464   3.978
  189    HB3  LEU  42           HB2      LEU  42 -10.755   6.752   5.374
  190    HG   LEU  42           HG       LEU  42 -12.936   7.832   5.634
  191   HD11  LEU  42          HD11      LEU  42 -12.073   9.645   6.665
  192   HD12  LEU  42          HD12      LEU  42 -11.158  10.156   5.247
  193   HD13  LEU  42          HD13      LEU  42 -10.544   8.859   6.271
  194   HD21  LEU  42          HD21      LEU  42 -12.138   9.260   3.107
  195   HD22  LEU  42          HD22      LEU  42 -13.395   9.850   4.197
  196   HD23  LEU  42          HD23      LEU  42 -13.581   8.288   3.399
  197    H    SER  43           H        SER  43  -9.197   5.472   2.739
  198    HA   SER  43           HA       SER  43  -6.637   5.751   4.156
  199    HB2  SER  43           HB1      SER  43  -8.288   3.209   4.012
  200    HB3  SER  43           HB2      SER  43  -6.701   3.384   4.783
  201    HG   SER  43           HG       SER  43  -9.054   4.781   5.543
  202    H    ASP  44           H        ASP  44  -4.858   4.728   3.184
  203    HA   ASP  44           HA       ASP  44  -4.729   4.807   0.417
  204    HB2  ASP  44           HB1      ASP  44  -2.974   3.099   2.197
  205    HB3  ASP  44           HB2      ASP  44  -2.563   3.759   0.609
  206    HD2  ASP  44           HD       ASP  44  -2.662   7.041   2.315
  207    H    THR  45           H        THR  45  -5.569   2.157   2.546
  208    HA   THR  45           HA       THR  45  -5.395   0.077   0.633
  209    HB   THR  45           HB       THR  45  -6.760  -1.243   2.185
  210    HG1  THR  45           HG1      THR  45  -7.541  -0.214   4.093
  211   HG21  THR  45          HG21      THR  45  -5.144  -1.441   3.804
  212   HG22  THR  45          HG22      THR  45  -4.960   0.304   3.988
  213   HG23  THR  45          HG23      THR  45  -4.258  -0.516   2.594
  214    H    ASP  46           H        ASP  46  -7.819   2.461   1.347
  215    HA   ASP  46           HA       ASP  46 -10.012   1.159   0.096
  216    HB2  ASP  46           HB1      ASP  46  -9.544   3.603   1.482
  217    HB3  ASP  46           HB2      ASP  46 -10.290   3.999  -0.072
  218    HD2  ASP  46           HD       ASP  46 -12.737   2.980   2.584
  219    H    CYS  47           H        CYS  47  -7.349   3.057  -1.070
  220    HA   CYS  47           HA       CYS  47  -8.295   4.007  -3.484
  221    HB2  CYS  47           HB1      CYS  47  -6.037   4.442  -2.485
  222    HB3  CYS  47           HB2      CYS  47  -5.544   2.838  -3.033
  223    H    ASN  48           H        ASN  48  -6.334   1.041  -3.215
  224    HA   ASN  48           HA       ASN  48  -8.150  -0.336  -5.028
  225    HB2  ASN  48           HB1      ASN  48  -6.243   0.929  -6.291
  226    HB3  ASN  48           HB2      ASN  48  -5.224  -0.384  -5.693
  227   HD21  ASN  48          HD21      ASN  48  -8.101   0.325  -7.583
  228   HD22  ASN  48          HD22      ASN  48  -8.037  -1.102  -8.556
  229    H    THR  49           H        THR  49  -4.837  -0.805  -3.791
  230    HA   THR  49           HA       THR  49  -5.478  -2.684  -1.825
  231    HB   THR  49           HB       THR  49  -6.213  -4.206  -3.501
  232    HG1  THR  49           HG1      THR  49  -3.530  -5.005  -3.038
  233   HG21  THR  49          HG21      THR  49  -5.190  -3.101  -5.442
  234   HG22  THR  49          HG22      THR  49  -4.862  -4.835  -5.436
  235   HG23  THR  49          HG23      THR  49  -3.608  -3.697  -4.941
  236    H    ARG  50           H        ARG  50  -3.140  -1.730  -4.290
  237    HA   ARG  50           HA       ARG  50  -1.037  -1.873  -2.239
  238    HB2  ARG  50           HB1      ARG  50  -0.734  -2.677  -5.144
  239    HB3  ARG  50           HB2      ARG  50   0.559  -2.644  -3.936
  240    HG2  ARG  50           HG1      ARG  50  -1.381  -4.233  -2.763
  241    HG3  ARG  50           HG2      ARG  50  -1.418  -4.689  -4.476
  242    HD2  ARG  50           HD1      ARG  50   0.176  -6.118  -3.462
  243    HD3  ARG  50           HD2      ARG  50   1.095  -4.899  -4.353
  244    HE   ARG  50           HE       ARG  50   0.729  -4.052  -1.686
  245   HH11  ARG  50          HH11      ARG  50   2.502  -6.369  -3.586
  246   HH12  ARG  50          HH12      ARG  50   3.829  -6.458  -2.476
  247   HH21  ARG  50          HH21      ARG  50   2.471  -4.161  -0.218
  248   HH22  ARG  50          HH22      ARG  50   3.810  -5.202  -0.561
  249    H    LYS  51           H        LYS  51  -2.687   0.340  -3.246
  250    HA   LYS  51           HA       LYS  51  -0.548   2.023  -4.379
  251    HB2  LYS  51           HB1      LYS  51  -3.481   1.884  -4.946
  252    HB3  LYS  51           HB2      LYS  51  -2.666   3.452  -5.068
  253    HG2  LYS  51           HG1      LYS  51  -2.506   2.701  -7.230
  254    HG3  LYS  51           HG2      LYS  51  -0.968   2.144  -6.550
  255    HD2  LYS  51           HD1      LYS  51  -1.613  -0.069  -6.509
  256    HD3  LYS  51           HD2      LYS  51  -3.335   0.336  -6.410
  257    HE2  LYS  51           HE1      LYS  51  -3.568   0.571  -8.668
  258    HE3  LYS  51           HE2      LYS  51  -1.911   1.160  -8.871
  259    HZ1  LYS  51           HZ1      LYS  51  -1.751  -0.900  -9.802
  260    HZ2  LYS  51           HZ2      LYS  51  -2.898  -1.598  -8.772
  261    HZ3  LYS  51           HZ3      LYS  51  -1.333  -1.286  -8.209
  262    H    PHE  52           H        PHE  52  -0.697   4.335  -3.784
  263    HA   PHE  52           HA       PHE  52  -1.624   4.615  -1.003
  264    HB2  PHE  52           HB1      PHE  52   0.092   6.410  -0.806
  265    HB3  PHE  52           HB2      PHE  52   0.775   4.819  -1.153
  266    HD1  PHE  52           HD1      PHE  52   2.008   4.392  -3.121
  267    HD2  PHE  52           HD2      PHE  52  -0.044   8.090  -2.645
  268    HE1  PHE  52           HE1      PHE  52   3.193   5.297  -5.078
  269    HE2  PHE  52           HE2      PHE  52   1.136   9.001  -4.602
  270    HZ   PHE  52           HZ       PHE  52   2.756   7.604  -5.823
  271    H    CYS  53           H        CYS  53  -2.820   6.381  -0.394
  272    HA   CYS  53           HA       CYS  53  -4.249   7.729  -2.506
  273    HB2  CYS  53           HB1      CYS  53  -4.471   7.586   0.480
  274    HB3  CYS  53           HB2      CYS  53  -5.294   8.887  -0.383
  275    H    LEU  54           H        LEU  54  -3.257   9.361  -3.508
  276    HA   LEU  54           HA       LEU  54  -1.501  11.149  -2.021
  277    HB2  LEU  54           HB1      LEU  54  -1.248  10.106  -4.476
  278    HB3  LEU  54           HB2      LEU  54  -2.089  11.610  -4.887
  279    HG   LEU  54           HG       LEU  54   0.324  11.847  -5.126
  280   HD11  LEU  54          HD11      LEU  54   0.619  13.845  -3.724
  281   HD12  LEU  54          HD12      LEU  54  -0.823  13.401  -2.813
  282   HD13  LEU  54          HD13      LEU  54  -0.951  13.812  -4.523
  283   HD21  LEU  54          HD21      LEU  54   0.805  11.731  -2.215
  284   HD22  LEU  54          HD22      LEU  54   1.855  11.286  -3.560
  285   HD23  LEU  54          HD23      LEU  54   0.580  10.186  -3.035
  286    H    GLN  55           H        GLN  55  -2.443  12.772  -0.972
  287    HA   GLN  55           HA       GLN  55  -4.603  14.241  -2.333
  288    HB2  GLN  55           HB1      GLN  55  -5.389  14.834   0.008
  289    HB3  GLN  55           HB2      GLN  55  -5.643  13.158  -0.505
  290    HG2  GLN  55           HG1      GLN  55  -4.179  12.310   0.997
  291    HG3  GLN  55           HG2      GLN  55  -3.128  13.731   0.931
  292   HE21  GLN  55          HE21      GLN  55  -2.945  14.158   3.059
  293   HE22  GLN  55          HE22      GLN  55  -4.266  14.589   4.084
  294    HA   PRO  56           HA       PRO  56  -1.162  17.213  -1.789
  295    HB2  PRO  56           HB1      PRO  56  -1.759  18.643  -4.046
  296    HB3  PRO  56           HB2      PRO  56  -0.794  17.168  -4.056
  297    HG2  PRO  56           HG1      PRO  56  -3.715  17.533  -4.630
  298    HG3  PRO  56           HG2      PRO  56  -2.488  16.571  -5.533
  299    HD2  PRO  56           HD1      PRO  56  -4.267  15.439  -3.825
  300    HD3  PRO  56           HD2      PRO  56  -2.623  14.817  -4.045
  301    H    ARG  57           H        ARG  57  -1.195  19.382  -1.155
  302    HA   ARG  57           HA       ARG  57  -3.740  20.299  -0.140
  303    HB2  ARG  57           HB1      ARG  57  -0.965  20.706   0.477
  304    HB3  ARG  57           HB2      ARG  57  -1.752  22.275   0.252
  305    HG2  ARG  57           HG1      ARG  57  -3.142  22.015   2.057
  306    HG3  ARG  57           HG2      ARG  57  -3.095  20.247   1.962
  307    HD2  ARG  57           HD1      ARG  57  -0.823  20.210   2.819
  308    HD3  ARG  57           HD2      ARG  57  -0.777  21.978   2.811
  309    HE   ARG  57           HE       ARG  57  -2.904  21.395   4.400
  310   HH11  ARG  57          HH11      ARG  57   0.445  20.446   4.373
  311   HH12  ARG  57          HH12      ARG  57   0.539  20.248   6.091
  312   HH21  ARG  57          HH21      ARG  57  -2.793  21.137   6.665
  313   HH22  ARG  57          HH22      ARG  57  -1.304  20.640   7.394
  314    H    ASP  58           H        ASP  58  -1.608  21.026  -2.784
  315    HA   ASP  58           HA       ASP  58  -2.965  23.523  -3.401
  316    HB2  ASP  58           HB1      ASP  58  -0.517  23.339  -3.698
  317    HB3  ASP  58           HB2      ASP  58  -0.777  22.077  -4.910
  318    HD2  ASP  58           HD       ASP  58  -1.327  24.385  -7.371
  319    H    GLU  59           H        GLU  59  -3.076  20.193  -4.283
  320    HA   GLU  59           HA       GLU  59  -4.988  20.838  -6.430
  321    HB2  GLU  59           HB1      GLU  59  -2.616  19.260  -6.528
  322    HB3  GLU  59           HB2      GLU  59  -4.005  18.182  -6.737
  323    HG2  GLU  59           HG1      GLU  59  -4.061  18.758  -8.872
  324    HG3  GLU  59           HG2      GLU  59  -4.551  20.378  -8.359
  325    HE2  GLU  59           HE       GLU  59  -0.682  19.902  -9.160
  326    H    LYS  60           H        LYS  60  -6.282  18.625  -6.893
  327    HA   LYS  60           HA       LYS  60  -7.703  18.115  -4.410
  328    HB2  LYS  60           HB1      LYS  60  -8.286  17.917  -7.297
  329    HB3  LYS  60           HB2      LYS  60  -9.023  16.655  -6.295
  330    HG2  LYS  60           HG1      LYS  60 -10.437  18.088  -5.255
  331    HG3  LYS  60           HG2      LYS  60  -9.292  19.438  -5.336
  332    HD2  LYS  60           HD1      LYS  60 -10.148  18.605  -7.986
  333    HD3  LYS  60           HD2      LYS  60 -11.519  19.049  -6.954
  334    HE2  LYS  60           HE1      LYS  60 -10.642  21.224  -6.547
  335    HE3  LYS  60           HE2      LYS  60  -9.076  20.782  -7.244
  336    HZ1  LYS  60           HZ1      LYS  60 -11.235  20.406  -9.085
  337    HZ2  LYS  60           HZ2      LYS  60  -9.787  21.256  -9.284
  338    HZ3  LYS  60           HZ3      LYS  60 -11.117  22.009  -8.560
  339    HA   PRO  61           HA       PRO  61  -6.183  14.076  -3.617
  340    HB2  PRO  61           HB1      PRO  61  -8.436  12.740  -2.819
  341    HB3  PRO  61           HB2      PRO  61  -7.642  13.976  -1.844
  342    HG2  PRO  61           HG1      PRO  61 -10.015  14.222  -3.663
  343    HG3  PRO  61           HG2      PRO  61  -9.780  14.874  -1.998
  344    HD2  PRO  61           HD1      PRO  61  -9.520  16.407  -4.225
  345    HD3  PRO  61           HD2      PRO  61  -8.544  16.661  -2.768
  346    H    PHE  62           H        PHE  62  -5.607  12.414  -4.867
  347    HA   PHE  62           HA       PHE  62  -7.544  11.113  -6.596
  348    HB2  PHE  62           HB1      PHE  62  -6.357  11.422  -8.638
  349    HB3  PHE  62           HB2      PHE  62  -6.553  13.021  -7.918
  350    HD1  PHE  62           HD1      PHE  62  -4.280  10.937  -9.503
  351    HD2  PHE  62           HD2      PHE  62  -4.550  13.707  -6.283
  352    HE1  PHE  62           HE1      PHE  62  -1.851  11.313  -9.626
  353    HE2  PHE  62           HE2      PHE  62  -2.123  14.088  -6.402
  354    HZ   PHE  62           HZ       PHE  62  -0.770  12.891  -8.076
  355    H    CYS  63           H        CYS  63  -6.977   9.018  -7.171
  356    HA   CYS  63           HA       CYS  63  -5.124   7.725  -5.431
  357    HB2  CYS  63           HB1      CYS  63  -7.137   6.933  -7.427
  358    HB3  CYS  63           HB2      CYS  63  -5.756   5.838  -7.321
  359    H    ALA  64           H        ALA  64  -3.074   7.107  -5.770
  360    HA   ALA  64           HA       ALA  64  -1.946   7.539  -8.460
  361    HB1  ALA  64           HB1      ALA  64  -0.822   8.119  -5.746
  362    HB2  ALA  64           HB2      ALA  64   0.242   7.859  -7.128
  363    HB3  ALA  64           HB3      ALA  64  -0.934   9.173  -7.156
  364    H    THR  65           H        THR  65  -0.062   6.193  -8.986
  365    HA   THR  65           HA       THR  65  -0.491   3.458  -8.058
  366    HB   THR  65           HB       THR  65   1.056   2.862  -9.959
  367    HG1  THR  65           HG1      THR  65   0.634   5.514 -10.861
  368   HG21  THR  65          HG21      THR  65  -1.655   3.796 -10.033
  369   HG22  THR  65          HG22      THR  65  -0.896   2.511 -10.972
  370   HG23  THR  65          HG23      THR  65  -0.856   4.174 -11.558
  371    H    CYS  66           H        CYS  66   1.339   2.069  -7.581
  372    HA   CYS  66           HA       CYS  66   3.017   3.050  -5.611
  373    HB2  CYS  66           HB1      CYS  66   2.506   0.668  -5.896
  374    HB3  CYS  66           HB2      CYS  66   3.453   0.638  -7.384
  375    H    ARG  67           H        ARG  67   5.056   3.864  -5.533
  376    HA   ARG  67           HA       ARG  67   6.146   4.868  -8.031
  377    HB2  ARG  67           HB1      ARG  67   7.015   5.291  -5.161
  378    HB3  ARG  67           HB2      ARG  67   7.710   6.109  -6.568
  379    HG2  ARG  67           HG1      ARG  67   4.847   6.332  -5.633
  380    HG3  ARG  67           HG2      ARG  67   6.122   7.541  -5.407
  381    HD2  ARG  67           HD1      ARG  67   6.361   7.496  -7.972
  382    HD3  ARG  67           HD2      ARG  67   4.797   6.670  -7.954
  383    HE   ARG  67           HE       ARG  67   4.671   9.037  -6.409
  384   HH11  ARG  67          HH11      ARG  67   4.796   7.916  -9.703
  385   HH12  ARG  67          HH12      ARG  67   3.958   9.293 -10.340
  386   HH21  ARG  67          HH21      ARG  67   3.567  10.853  -7.235
  387   HH22  ARG  67          HH22      ARG  67   3.260  10.963  -8.935
  388    H    GLY  68           H        GLY  68   8.044   4.258  -8.960
  389    HA2  GLY  68           HA2      GLY  68   9.188   1.748  -8.016
  390    HA3  GLY  68           HA3      GLY  68   9.493   2.515  -9.568
  391    HA1  GLY  68           HA1      GLY  68   9.193   2.439  -7.465
  392    H    LEU  69           H        LEU  69  11.687   1.628  -8.597
  393    HA   LEU  69           HA       LEU  69  12.984   3.258  -6.657
  394    HB2  LEU  69           HB1      LEU  69  14.106   1.375  -8.739
  395    HB3  LEU  69           HB2      LEU  69  15.045   2.123  -7.436
  396    HG   LEU  69           HG       LEU  69  12.825   0.104  -7.135
  397   HD11  LEU  69          HD11      LEU  69  15.167  -0.603  -7.884
  398   HD12  LEU  69          HD12      LEU  69  14.470  -1.419  -6.486
  399   HD13  LEU  69          HD13      LEU  69  15.680  -0.158  -6.256
  400   HD21  LEU  69          HD21      LEU  69  14.106   0.419  -4.697
  401   HD22  LEU  69          HD22      LEU  69  12.487   0.981  -5.117
  402   HD23  LEU  69          HD23      LEU  69  13.868   2.067  -5.280
  403    H    ARG  70           H        ARG  70  12.530   3.467 -10.087
  404    HA   ARG  70           HA       ARG  70  14.566   5.543 -10.355
  405    HB2  ARG  70           HB1      ARG  70  12.767   4.213 -12.395
  406    HB3  ARG  70           HB2      ARG  70  13.965   5.460 -12.773
  407    HG2  ARG  70           HG1      ARG  70  15.420   3.575 -11.360
  408    HG3  ARG  70           HG2      ARG  70  14.319   2.615 -12.363
  409    HD2  ARG  70           HD1      ARG  70  15.045   4.133 -14.305
  410    HD3  ARG  70           HD2      ARG  70  16.363   4.635 -13.235
  411    HE   ARG  70           HE       ARG  70  16.138   2.148 -14.636
  412   HH11  ARG  70          HH11      ARG  70  17.465   3.701 -11.817
  413   HH12  ARG  70          HH12      ARG  70  18.755   2.560 -11.635
  414   HH21  ARG  70          HH21      ARG  70  17.832   0.639 -14.408
  415   HH22  ARG  70          HH22      ARG  70  18.964   0.818 -13.110
  416    H    ARG  71           H        ARG  71  11.731   5.631  -9.028
  417    HA   ARG  71           HA       ARG  71  10.707   7.969 -10.481
  418    HB2  ARG  71           HB1      ARG  71   9.477   5.892  -8.739
  419    HB3  ARG  71           HB2      ARG  71   8.780   7.519  -8.685
  420    HG2  ARG  71           HG1      ARG  71   9.187   5.962 -11.237
  421    HG3  ARG  71           HG2      ARG  71   7.685   5.955 -10.296
  422    HD2  ARG  71           HD1      ARG  71   8.138   8.632 -10.521
  423    HD3  ARG  71           HD2      ARG  71   8.811   8.033 -12.043
  424    HE   ARG  71           HE       ARG  71   6.349   6.822 -11.785
  425   HH11  ARG  71          HH11      ARG  71   7.569  10.077 -11.968
  426   HH12  ARG  71          HH12      ARG  71   6.141  10.710 -12.716
  427   HH21  ARG  71          HH21      ARG  71   4.462   7.643 -12.770
  428   HH22  ARG  71          HH22      ARG  71   4.373   9.326 -13.171
  429    H    ARG  72           H        ARG  72  10.543   9.949  -9.532
  430    HA   ARG  72           HA       ARG  72  12.199  10.462  -7.259
  431    HB2  ARG  72           HB1      ARG  72  10.285  12.334  -8.673
  432    HB3  ARG  72           HB2      ARG  72  11.609  12.795  -7.595
  433    HG2  ARG  72           HG1      ARG  72  12.533  11.135  -9.792
  434    HG3  ARG  72           HG2      ARG  72  11.720  12.607 -10.348
  435    HD2  ARG  72           HD1      ARG  72  13.217  14.018  -9.193
  436    HD3  ARG  72           HD2      ARG  72  13.824  12.681  -8.207
  437    HE   ARG  72           HE       ARG  72  14.386  12.083 -10.869
  438   HH11  ARG  72          HH11      ARG  72  15.272  14.441  -8.466
  439   HH12  ARG  72          HH12      ARG  72  16.850  14.714  -9.127
  440   HH21  ARG  72          HH21      ARG  72  16.461  12.432 -11.748
  441   HH22  ARG  72          HH22      ARG  72  17.525  13.570 -10.994
  442    H    CYS  73           H        CYS  73  11.588  11.305  -5.242
  443    HA   CYS  73           HA       CYS  73   8.772  11.358  -4.532
  444    HB2  CYS  73           HB1      CYS  73   8.918   9.748  -2.762
  445    HB3  CYS  73           HB2      CYS  73   9.494   8.980  -4.243
  446    H    GLN  74           H        GLN  74   8.341  12.469  -2.596
  447    HA   GLN  74           HA       GLN  74  10.613  14.065  -1.621
  448    HB2  GLN  74           HB1      GLN  74   7.763  14.663  -2.166
  449    HB3  GLN  74           HB2      GLN  74   8.461  15.429  -0.729
  450    HG2  GLN  74           HG1      GLN  74  10.392  16.075  -2.389
  451    HG3  GLN  74           HG2      GLN  74   9.126  15.831  -3.599
  452   HE21  GLN  74          HE21      GLN  74   9.433  17.350  -0.402
  453   HE22  GLN  74          HE22      GLN  74   8.612  18.809  -0.829
  454    H    ARG  75           H        ARG  75   7.623  12.480  -0.532
  455    HA   ARG  75           HA       ARG  75   8.698  12.454   2.202
  456    HB2  ARG  75           HB1      ARG  75   6.354  13.399   1.573
  457    HB3  ARG  75           HB2      ARG  75   5.884  11.695   1.496
  458    HG2  ARG  75           HG1      ARG  75   6.995  11.588   3.873
  459    HG3  ARG  75           HG2      ARG  75   6.676  13.331   3.850
  460    HD2  ARG  75           HD1      ARG  75   4.403  11.722   2.937
  461    HD3  ARG  75           HD2      ARG  75   4.892  11.386   4.605
  462    HE   ARG  75           HE       ARG  75   4.798  14.119   4.436
  463   HH11  ARG  75          HH11      ARG  75   2.563  11.509   3.877
  464   HH12  ARG  75          HH12      ARG  75   1.166  12.440   4.311
  465   HH21  ARG  75          HH21      ARG  75   2.968  15.354   5.009
  466   HH22  ARG  75          HH22      ARG  75   1.398  14.626   4.954
  467    H    ASP  76           H        ASP  76   8.754  10.541   3.405
  468    HA   ASP  76           HA       ASP  76   9.471   8.217   1.996
  469    HB2  ASP  76           HB1      ASP  76   9.909   9.057   4.501
  470    HB3  ASP  76           HB2      ASP  76   8.558   7.958   4.814
  471    HD2  ASP  76           HD       ASP  76  11.585   6.002   4.984
  472    H    ALA  77           H        ALA  77   6.424   9.359   3.202
  473    HA   ALA  77           HA       ALA  77   5.095   6.814   3.057
  474    HB1  ALA  77           HB1      ALA  77   3.264   7.865   3.922
  475    HB2  ALA  77           HB2      ALA  77   4.523   8.979   4.457
  476    HB3  ALA  77           HB3      ALA  77   3.559   9.358   3.028
  477    H    MET  78           H        MET  78   5.606   9.540   0.932
  478    HA   MET  78           HA       MET  78   3.593   9.078  -0.947
  479    HB2  MET  78           HB1      MET  78   6.145  10.542  -0.856
  480    HB3  MET  78           HB2      MET  78   5.654  10.027  -2.476
  481    HG2  MET  78           HG1      MET  78   3.371  11.071  -1.908
  482    HG3  MET  78           HG2      MET  78   4.235  11.863  -0.587
  483    HE1  MET  78           HE1      MET  78   4.314  10.889  -4.118
  484    HE2  MET  78           HE2      MET  78   3.974  12.445  -4.874
  485    HE3  MET  78           HE3      MET  78   5.630  11.840  -4.806
  486    H    CYS  79           H        CYS  79   6.728   7.568  -0.516
  487    HA   CYS  79           HA       CYS  79   6.517   6.077  -2.993
  488    HB2  CYS  79           HB1      CYS  79   8.600   6.715  -1.081
  489    HB3  CYS  79           HB2      CYS  79   8.588   4.989  -1.446
  490    H    CYS  80           H        CYS  80   7.073   3.633  -2.769
  491    HA   CYS  80           HA       CYS  80   4.938   2.461  -1.223
  492    HB2  CYS  80           HB1      CYS  80   6.732   1.621  -3.416
  493    HB3  CYS  80           HB2      CYS  80   6.258   0.335  -2.303
  494    HA   PRO  81           HA       PRO  81   7.177   0.978   2.245
  495    HB2  PRO  81           HB1      PRO  81   6.092  -1.507   2.635
  496    HB3  PRO  81           HB2      PRO  81   5.230  -0.004   2.965
  497    HG2  PRO  81           HG1      PRO  81   5.116  -1.769   0.543
  498    HG3  PRO  81           HG2      PRO  81   3.765  -1.008   1.462
  499    HD2  PRO  81           HD1      PRO  81   4.690  -0.005  -0.884
  500    HD3  PRO  81           HD2      PRO  81   4.073   1.026   0.420
  501    H    GLY  82           H        GLY  82   9.005  -0.147   2.795
  502    HA2  GLY  82           HA2      GLY  82  10.467  -2.047   2.607
  503    HA3  GLY  82           HA3      GLY  82   9.920  -2.252   0.950
  504    HA1  GLY  82           HA1      GLY  82  10.481  -1.171   2.692
  505    H    THR  83           H        THR  83  10.170   0.792   0.691
  506    HA   THR  83           HA       THR  83  13.093   0.834   0.308
  507    HB   THR  83           HB       THR  83  12.582   2.511  -1.548
  508    HG1  THR  83           HG1      THR  83  10.009   1.294  -1.404
  509   HG21  THR  83          HG21      THR  83  11.483   0.298  -2.846
  510   HG22  THR  83          HG22      THR  83  12.448  -0.377  -1.534
  511   HG23  THR  83          HG23      THR  83  13.192   0.706  -2.710
  512    H    LEU  84           H        LEU  84  13.908   3.175   0.065
  513    HA   LEU  84           HA       LEU  84  12.528   4.929   1.983
  514    HB2  LEU  84           HB1      LEU  84  14.634   3.628   2.803
  515    HB3  LEU  84           HB2      LEU  84  15.513   4.825   1.836
  516    HG   LEU  84           HG       LEU  84  14.223   6.574   3.230
  517   HD11  LEU  84          HD11      LEU  84  13.573   5.846   5.449
  518   HD12  LEU  84          HD12      LEU  84  13.981   4.179   5.046
  519   HD13  LEU  84          HD13      LEU  84  12.641   4.982   4.226
  520   HD21  LEU  84          HD21      LEU  84  16.207   4.985   4.812
  521   HD22  LEU  84          HD22      LEU  84  16.018   6.734   4.693
  522   HD23  LEU  84          HD23      LEU  84  16.694   5.826   3.340
  523    H    CYS  85           H        CYS  85  12.701   7.141   1.621
  524    HA   CYS  85           HA       CYS  85  13.189   7.884  -1.117
  525    HB2  CYS  85           HB1      CYS  85  12.057   9.208   1.307
  526    HB3  CYS  85           HB2      CYS  85  12.666  10.241   0.013
  527    H    VAL  86           H        VAL  86  15.318   7.891  -1.632
  528    HA   VAL  86           HA       VAL  86  17.095   9.574   0.011
  529    HB   VAL  86           HB       VAL  86  17.884   7.282  -1.793
  530   HG11  VAL  86          HG11      VAL  86  20.037   7.709  -0.268
  531   HG12  VAL  86          HG12      VAL  86  19.791   8.510  -1.821
  532   HG13  VAL  86          HG13      VAL  86  19.401   9.352  -0.321
  533   HG21  VAL  86          HG21      VAL  86  18.463   6.118   0.294
  534   HG22  VAL  86          HG22      VAL  86  17.784   7.458   1.217
  535   HG23  VAL  86          HG23      VAL  86  16.739   6.476   0.191
  536    H    ASN  87           H        ASN  87  18.150  11.231  -0.936
  537    HA   ASN  87           HA       ASN  87  18.614  12.849  -2.468
  538    HB2  ASN  87           HB1      ASN  87  18.795  10.486  -4.357
  539    HB3  ASN  87           HB2      ASN  87  19.496  12.087  -4.622
  540   HD21  ASN  87          HD21      ASN  87  20.742   9.419  -4.420
  541   HD22  ASN  87          HD22      ASN  87  21.946   9.569  -3.191
  542    H    ASP  88           H        ASP  88  15.860  12.319  -2.018
  543    HA   ASP  88           HA       ASP  88  13.819  12.911  -2.828
  544    HB2  ASP  88           HB1      ASP  88  15.654  14.631  -4.057
  545    HB3  ASP  88           HB2      ASP  88  14.618  14.056  -5.371
  546    HD2  ASP  88           HD       ASP  88  12.902  16.218  -2.514
  547    H    VAL  89           H        VAL  89  15.128  10.372  -3.611
  548    HA   VAL  89           HA       VAL  89  13.266   9.672  -5.743
  549    HB   VAL  89           HB       VAL  89  16.215   9.032  -5.909
  550   HG11  VAL  89          HG11      VAL  89  15.042   7.154  -6.735
  551   HG12  VAL  89          HG12      VAL  89  13.863   8.163  -7.574
  552   HG13  VAL  89          HG13      VAL  89  15.528   8.084  -8.152
  553   HG21  VAL  89          HG21      VAL  89  15.761  11.324  -6.550
  554   HG22  VAL  89          HG22      VAL  89  16.138  10.367  -7.983
  555   HG23  VAL  89          HG23      VAL  89  14.466  10.795  -7.624
  556    H    CYS  90           H        CYS  90  12.550   7.569  -5.666
  557    HA   CYS  90           HA       CYS  90  12.679   6.228  -3.201
  558    HB2  CYS  90           HB1      CYS  90  11.124   6.064  -5.488
  559    HB3  CYS  90           HB2      CYS  90  11.970   4.516  -5.460
  560    H    THR  91           H        THR  91  14.398   5.237  -2.391
  561    HA   THR  91           HA       THR  91  16.045   3.588  -4.196
  562    HB   THR  91           HB       THR  91  17.089   5.090  -1.790
  563    HG1  THR  91           HG1      THR  91  16.550   6.553  -3.450
  564   HG21  THR  91          HG21      THR  91  18.190   2.913  -2.711
  565   HG22  THR  91          HG22      THR  91  19.200   4.313  -2.351
  566   HG23  THR  91          HG23      THR  91  18.741   3.962  -4.017
  567    H    THR  92           H        THR  92  16.317   1.528  -3.606
  568    HA   THR  92           HA       THR  92  14.848   0.352  -1.550
  569    HB   THR  92           HB       THR  92  17.265  -1.146  -2.255
  570    HG1  THR  92           HG1      THR  92  16.608  -1.363  -4.474
  571   HG21  THR  92          HG21      THR  92  14.313  -1.536  -2.191
  572   HG22  THR  92          HG22      THR  92  15.595  -2.504  -1.464
  573   HG23  THR  92          HG23      THR  92  15.277  -2.619  -3.195
  574    H    MET  93           H        MET  93  15.336  -0.357   0.501
  575    HA   MET  93           HA       MET  93  17.068   1.150   2.066
  576    HB2  MET  93           HB1      MET  93  15.225  -0.991   2.447
  577    HB3  MET  93           HB2      MET  93  16.725  -1.401   3.295
  578    HG2  MET  93           HG1      MET  93  16.466   0.211   4.851
  579    HG3  MET  93           HG2      MET  93  15.769   1.348   3.693
  580    HE1  MET  93           HE1      MET  93  15.445  -0.407   6.604
  581    HE2  MET  93           HE2      MET  93  14.266   0.877   6.876
  582    HE3  MET  93           HE3      MET  93  13.753  -0.812   6.902
  583    H    GLU  94           H        GLU  94  17.504  -2.183   0.883
  584    HA   GLU  94           HA       GLU  94  20.075  -2.558   1.944
  585    HB2  GLU  94           HB1      GLU  94  18.481  -3.848  -0.237
  586    HB3  GLU  94           HB2      GLU  94  20.200  -4.244  -0.077
  587    HG2  GLU  94           HG1      GLU  94  19.513  -5.836   1.326
  588    HG3  GLU  94           HG2      GLU  94  19.347  -4.513   2.489
  589    HE2  GLU  94           HE       GLU  94  16.185  -6.457   1.898
  590    H    ASP  95           H        ASP  95  18.961  -0.921  -0.908
  591    HA   ASP  95           HA       ASP  95  21.535  -0.834  -2.191
  592    HB2  ASP  95           HB1      ASP  95  18.827   0.320  -2.728
  593    HB3  ASP  95           HB2      ASP  95  20.230   1.044  -3.525
  594    HD2  ASP  95           HD       ASP  95  20.816  -1.939  -5.344
  595    H    ALA  96           H        ALA  96  19.794   1.089   0.105
  596    HA   ALA  96           HA       ALA  96  20.940   3.586  -0.194
  597    HB1  ALA  96           HB1      ALA  96  19.920   4.082   1.743
  598    HB2  ALA  96           HB2      ALA  96  19.230   2.465   1.596
  599    HB3  ALA  96           HB3      ALA  96  20.659   2.727   2.595
  600    H    THR  97           H        THR  97  22.584   4.617   1.240
  601    HA   THR  97           HA       THR  97  25.095   3.452   0.891
  602    HB   THR  97           HB       THR  97  24.696   5.890   1.221
  603    HG1  THR  97           HG1      THR  97  26.803   4.976   1.489
  604   HG21  THR  97          HG21      THR  97  23.284   5.208   3.416
  605   HG22  THR  97          HG22      THR  97  23.989   6.805   3.169
  606   HG23  THR  97          HG23      THR  97  24.832   5.612   4.158
  607    H    GLU  98           H        GLU  98  22.781   3.097   3.441
  608    HA   GLU  98           HA       GLU  98  24.378   1.025   4.654
  609    HB2  GLU  98           HB1      GLU  98  24.396   1.968   6.898
  610    HB3  GLU  98           HB2      GLU  98  25.252   3.032   5.771
  611    HG2  GLU  98           HG1      GLU  98  23.618   4.661   5.832
  612    HG3  GLU  98           HG2      GLU  98  22.372   3.524   6.362
  613    HE2  GLU  98           HE       GLU  98  24.725   4.053   9.420
  614    H    ASN  99           H        ASN  99  23.145   0.183   6.693
  615    HA   ASN  99           HA       ASN  99  20.248   0.439   6.343
  616    HB2  ASN  99           HB1      ASN  99  21.439  -1.615   5.135
  617    HB3  ASN  99           HB2      ASN  99  21.332  -2.307   6.759
  618   HD21  ASN  99          HD21      ASN  99  19.986  -3.208   4.399
  619   HD22  ASN  99          HD22      ASN  99  18.290  -3.094   4.708
  620    H    LEU 100           H        LEU 100  19.011  -0.342   8.166
  621    HA   LEU 100           HA       LEU 100  20.547  -0.174  10.666
  622    HB2  LEU 100           HB1      LEU 100  18.436   1.326   9.867
  623    HB3  LEU 100           HB2      LEU 100  17.610   0.034  10.756
  624    HG   LEU 100           HG       LEU 100  19.526   0.725  12.544
  625   HD11  LEU 100          HD11      LEU 100  20.488   2.563  11.532
  626   HD12  LEU 100          HD12      LEU 100  19.260   3.307  12.557
  627   HD13  LEU 100          HD13      LEU 100  18.964   3.106  10.829
  628   HD21  LEU 100          HD21      LEU 100  17.789   1.642  13.810
  629   HD22  LEU 100          HD22      LEU 100  16.982   0.507  12.727
  630   HD23  LEU 100          HD23      LEU 100  16.939   2.236  12.383
  631    H    TYR 101           H        TYR 101  19.706  -1.450  12.509
  632    HA   TYR 101           HA       TYR 101  18.076  -3.748  11.980
  633    HB2  TYR 101           HB1      TYR 101  20.828  -3.976  11.414
  634    HB3  TYR 101           HB2      TYR 101  20.579  -4.811  12.950
  635    HD1  TYR 101           HD1      TYR 101  18.950  -6.695  13.100
  636    HD2  TYR 101           HD2      TYR 101  20.030  -4.939   9.379
  637    HE1  TYR 101           HE1      TYR 101  18.071  -8.667  11.921
  638    HE2  TYR 101           HE2      TYR 101  19.153  -6.905   8.189
  639    HH   TYR 101           HH       TYR 101  17.993  -8.810   8.384
  640    H    PHE 102           H        PHE 102  17.578  -4.945  13.876
  641    HA   PHE 102           HA       PHE 102  18.337  -3.571  16.370
  642    HB2  PHE 102           HB1      PHE 102  15.715  -4.740  15.463
  643    HB3  PHE 102           HB2      PHE 102  16.072  -4.555  17.181
  644    HD1  PHE 102           HD1      PHE 102  15.689  -2.688  14.017
  645    HD2  PHE 102           HD2      PHE 102  15.923  -2.470  18.262
  646    HE1  PHE 102           HE1      PHE 102  14.973  -0.336  13.932
  647    HE2  PHE 102           HE2      PHE 102  15.205  -0.118  18.184
  648    HZ   PHE 102           HZ       PHE 102  14.729   0.952  16.017
  649    H    GLN 103           H        GLN 103  20.142  -5.284  15.972
  650    HA   GLN 103           HA       GLN 103  19.508  -7.536  17.707
  651    HB2  GLN 103           HB1      GLN 103  20.647  -7.816  14.921
  652    HB3  GLN 103           HB2      GLN 103  20.753  -9.088  16.147
  653    HG2  GLN 103           HG1      GLN 103  18.122  -8.656  16.252
  654    HG3  GLN 103           HG2      GLN 103  18.426  -8.153  14.584
  655   HE21  GLN 103          HE21      GLN 103  17.245  -9.896  13.781
  656   HE22  GLN 103          HE22      GLN 103  17.873 -11.506  13.788
  657    H    SER 104           H        SER 104  21.568  -8.771  18.257
  658    HA   SER 104           HA       SER 104  23.496  -6.886  19.194
  659    HB2  SER 104           HB1      SER 104  24.272  -9.726  19.290
  660    HB3  SER 104           HB2      SER 104  24.135  -8.539  20.599
  661    HG   SER 104           HG       SER 104  22.562 -10.109  20.885
  662    H    LEU 105           H        LEU 105  25.745  -6.844  18.726
  663    HA   LEU 105           HA       LEU 105  26.310  -7.293  15.920
  664    HB2  LEU 105           HB1      LEU 105  27.471  -5.721  18.131
  665    HB3  LEU 105           HB2      LEU 105  28.632  -6.354  16.950
  666    HG   LEU 105           HG       LEU 105  26.240  -4.681  16.199
  667   HD11  LEU 105          HD11      LEU 105  27.593  -2.768  16.178
  668   HD12  LEU 105          HD12      LEU 105  29.073  -3.706  16.372
  669   HD13  LEU 105          HD13      LEU 105  27.946  -3.553  17.719
  670   HD21  LEU 105          HD21      LEU 105  28.473  -5.965  14.747
  671   HD22  LEU 105          HD22      LEU 105  28.034  -4.333  14.244
  672   HD23  LEU 105          HD23      LEU 105  26.825  -5.617  14.222
  673    H    GLU 106           H        GLU 106  28.440  -8.235  15.284
  674    HA   GLU 106           HA       GLU 106  29.466 -10.264  17.112
  675    HB2  GLU 106           HB1      GLU 106  29.349 -11.959  15.202
  676    HB3  GLU 106           HB2      GLU 106  27.837 -11.582  16.041
  677    HG2  GLU 106           HG1      GLU 106  27.034 -10.270  14.260
  678    HG3  GLU 106           HG2      GLU 106  28.631 -10.197  13.502
  679    HE2  GLU 106           HE       GLU 106  28.186 -13.687  12.577
  680    H    HIS 107           H        HIS 107  31.358 -11.457  16.024
  681    HA   HIS 107           HA       HIS 107  32.754  -9.930  13.997
  682    HB2  HIS 107           HB1      HIS 107  34.711  -9.449  15.323
  683    HB3  HIS 107           HB2      HIS 107  33.298  -8.751  16.119
  684    HD1  HIS 107           HD1      HIS 107  36.206 -10.069  17.223
  685    HD2  HIS 107           HD2      HIS 107  32.277 -11.235  17.907
  686    HE1  HIS 107           HE1      HIS 107  36.258 -11.387  19.365
  687    HE2  HIS 107           HE2      HIS 107  33.857 -12.100  19.783
  688    H    HIS 108           H        HIS 108  35.194 -10.945  14.013
  689    HA   HIS 108           HA       HIS 108  36.439 -12.761  13.443
  690    HB2  HIS 108           HB1      HIS 108  34.946 -13.542  15.822
  691    HB3  HIS 108           HB2      HIS 108  35.337 -14.927  14.800
  692    HD1  HIS 108           HD1      HIS 108  37.647 -11.979  15.151
  693    HD2  HIS 108           HD2      HIS 108  37.348 -15.926  16.415
  694    HE1  HIS 108           HE1      HIS 108  39.870 -12.521  16.194
  695    HE2  HIS 108           HE2      HIS 108  39.689 -14.933  16.967
  696    H    HIS 109           H        HIS 109  35.666 -12.747  11.296
  697    HA   HIS 109           HA       HIS 109  33.322 -14.145  10.498
  698    HB2  HIS 109           HB1      HIS 109  35.702 -13.021   9.040
  699    HB3  HIS 109           HB2      HIS 109  34.496 -13.989   8.186
  700    HD1  HIS 109           HD1      HIS 109  32.095 -12.988   7.954
  701    HD2  HIS 109           HD2      HIS 109  34.880 -10.433   9.678
  702    HE1  HIS 109           HE1      HIS 109  31.035 -10.708   7.905
  703    HE2  HIS 109           HE2      HIS 109  32.736  -9.145   8.957
  704    H    HIS 110           H        HIS 110  33.276 -16.048   9.106
  705    HA   HIS 110           HA       HIS 110  35.468 -17.928   9.690
  706    HB2  HIS 110           HB1      HIS 110  32.493 -18.288   9.881
  707    HB3  HIS 110           HB2      HIS 110  33.525 -19.677   9.526
  708    HD1  HIS 110           HD1      HIS 110  35.741 -19.667  11.372
  709    HD2  HIS 110           HD2      HIS 110  32.034 -18.203  12.545
  710    HE1  HIS 110           HE1      HIS 110  35.745 -19.763  13.884
  711    HE2  HIS 110           HE2      HIS 110  33.479 -18.869  14.604
  712    H    HIS 111           H        HIS 111  36.414 -18.741   7.945
  713    HA   HIS 111           HA       HIS 111  34.860 -18.940   5.454
  714    HB2  HIS 111           HB1      HIS 111  37.447 -17.566   5.960
  715    HB3  HIS 111           HB2      HIS 111  37.316 -18.483   4.455
  716    HD1  HIS 111           HD1      HIS 111  35.186 -15.888   6.265
  717    HD2  HIS 111           HD2      HIS 111  36.352 -16.986   2.432
  718    HE1  HIS 111           HE1      HIS 111  34.150 -14.184   4.734
  719    HE2  HIS 111           HE2      HIS 111  34.861 -14.855   2.390
  720    H    HIS 112           H        HIS 112  38.102 -19.816   6.667
  721    HA   HIS 112           HA       HIS 112  38.084 -22.290   5.217
  722    HB2  HIS 112           HB1      HIS 112  40.115 -20.827   5.830
  723    HB3  HIS 112           HB2      HIS 112  40.011 -21.586   7.422
  724    HD1  HIS 112           HD1      HIS 112  39.097 -24.391   5.882
  725    HD2  HIS 112           HD2      HIS 112  42.613 -22.207   5.529
  726    HE1  HIS 112           HE1      HIS 112  40.816 -26.019   5.038
  727    HE2  HIS 112           HE2      HIS 112  42.965 -24.686   4.820
  Start of MODEL   11
    1    H1   MET  18           H        MET  18 -53.434 -20.982  20.805
    2    HA   MET  18           HA       MET  18 -52.511 -18.670  21.875
    3    HB2  MET  18           HB1      MET  18 -52.576 -19.832  19.186
    4    HB3  MET  18           HB2      MET  18 -52.439 -18.067  19.185
    5    HG2  MET  18           HG1      MET  18 -50.511 -18.315  20.794
    6    HG3  MET  18           HG2      MET  18 -50.585 -20.048  20.471
    7    HE1  MET  18           HE1      MET  18 -48.618 -20.927  18.543
    8    HE2  MET  18           HE2      MET  18 -47.503 -19.561  18.491
    9    HE3  MET  18           HE3      MET  18 -48.269 -20.016  20.014
   10    H    LEU  19           H        LEU  19 -55.081 -18.802  19.401
   11    HA   LEU  19           HA       LEU  19 -56.730 -17.337  18.843
   12    HB2  LEU  19           HB1      LEU  19 -56.533 -16.552  21.755
   13    HB3  LEU  19           HB2      LEU  19 -57.901 -16.249  20.671
   14    HG   LEU  19           HG       LEU  19 -57.832 -18.909  20.488
   15   HD11  LEU  19          HD11      LEU  19 -56.478 -19.872  21.954
   16   HD12  LEU  19          HD12      LEU  19 -57.462 -19.194  23.250
   17   HD13  LEU  19          HD13      LEU  19 -56.054 -18.312  22.658
   18   HD21  LEU  19          HD21      LEU  19 -59.868 -18.153  21.116
   19   HD22  LEU  19          HD22      LEU  19 -59.206 -17.010  22.287
   20   HD23  LEU  19          HD23      LEU  19 -59.336 -18.722  22.700
   21    H    VAL  20           H        VAL  20 -54.455 -16.385  17.949
   22    HA   VAL  20           HA       VAL  20 -54.173 -13.618  18.882
   23    HB   VAL  20           HB       VAL  20 -52.441 -15.078  16.887
   24   HG11  VAL  20          HG11      VAL  20 -52.108 -12.787  16.580
   25   HG12  VAL  20          HG12      VAL  20 -52.241 -12.442  18.306
   26   HG13  VAL  20          HG13      VAL  20 -50.811 -13.261  17.677
   27   HG21  VAL  20          HG21      VAL  20 -51.557 -16.214  18.579
   28   HG22  VAL  20          HG22      VAL  20 -51.056 -14.686  19.304
   29   HG23  VAL  20          HG23      VAL  20 -52.614 -15.394  19.728
   30    H    LEU  21           H        LEU  21 -55.238 -12.077  17.846
   31    HA   LEU  21           HA       LEU  21 -56.276 -12.586  15.167
   32    HB2  LEU  21           HB1      LEU  21 -57.000 -10.872  17.439
   33    HB3  LEU  21           HB2      LEU  21 -57.148 -10.089  15.857
   34    HG   LEU  21           HG       LEU  21 -58.402 -12.532  15.497
   35   HD11  LEU  21          HD11      LEU  21 -58.629 -13.204  17.683
   36   HD12  LEU  21          HD12      LEU  21 -60.117 -12.288  17.448
   37   HD13  LEU  21          HD13      LEU  21 -58.754 -11.554  18.292
   38   HD21  LEU  21          HD21      LEU  21 -59.617  -9.868  16.223
   39   HD22  LEU  21          HD22      LEU  21 -60.437 -11.194  15.400
   40   HD23  LEU  21          HD23      LEU  21 -59.099 -10.359  14.610
   41    H    ASP  22           H        ASP  22 -55.983 -11.120  13.433
   42    HA   ASP  22           HA       ASP  22 -53.533  -9.499  13.663
   43    HB2  ASP  22           HB1      ASP  22 -53.986 -11.633  11.982
   44    HB3  ASP  22           HB2      ASP  22 -54.364 -10.247  10.952
   45    HD2  ASP  22           HD       ASP  22 -50.686 -11.079  11.259
   46    H    PHE  23           H        PHE  23 -53.514  -7.432  12.871
   47    HA   PHE  23           HA       PHE  23 -56.136  -6.342  12.104
   48    HB2  PHE  23           HB1      PHE  23 -53.930  -5.364  13.804
   49    HB3  PHE  23           HB2      PHE  23 -54.625  -4.154  12.725
   50    HD1  PHE  23           HD1      PHE  23 -55.908  -6.879  14.934
   51    HD2  PHE  23           HD2      PHE  23 -56.267  -2.845  13.625
   52    HE1  PHE  23           HE1      PHE  23 -57.787  -6.546  16.488
   53    HE2  PHE  23           HE2      PHE  23 -58.146  -2.505  15.178
   54    HZ   PHE  23           HZ       PHE  23 -58.907  -4.357  16.612
   55    H    ASN  24           H        ASN  24 -52.659  -5.953  11.450
   56    HA   ASN  24           HA       ASN  24 -52.931  -5.943   8.663
   57    HB2  ASN  24           HB1      ASN  24 -53.892  -3.591   9.650
   58    HB3  ASN  24           HB2      ASN  24 -52.194  -3.175   9.378
   59   HD21  ASN  24          HD21      ASN  24 -52.059  -2.086   7.557
   60   HD22  ASN  24          HD22      ASN  24 -52.805  -2.516   6.059
   61    H    ASN  25           H        ASN  25 -50.873  -4.811   7.640
   62    HA   ASN  25           HA       ASN  25 -48.562  -4.838   9.380
   63    HB2  ASN  25           HB1      ASN  25 -49.034  -6.961   7.284
   64    HB3  ASN  25           HB2      ASN  25 -47.415  -6.553   7.866
   65   HD21  ASN  25          HD21      ASN  25 -50.286  -8.260   8.496
   66   HD22  ASN  25          HD22      ASN  25 -49.843  -8.903  10.038
   67    H    ILE  26           H        ILE  26 -47.596  -3.017   8.776
   68    HA   ILE  26           HA       ILE  26 -47.920  -1.704   6.339
   69    HB   ILE  26           HB       ILE  26 -47.063  -0.644   8.419
   70   HG12  ILE  26          HG11      ILE  26 -44.884   0.080   6.643
   71   HG13  ILE  26          HG12      ILE  26 -46.407  -0.100   5.754
   72   HG21  ILE  26          HG21      ILE  26 -45.032  -1.084   9.333
   73   HG22  ILE  26          HG22      ILE  26 -45.328  -2.657   8.596
   74   HG23  ILE  26          HG23      ILE  26 -44.295  -1.482   7.782
   75   HD11  ILE  26          HD11      ILE  26 -45.577   1.972   7.632
   76   HD12  ILE  26          HD12      ILE  26 -46.773   2.018   6.336
   77   HD13  ILE  26          HD13      ILE  26 -47.205   1.354   7.911
   78    H    ARG  27           H        ARG  27 -46.847  -1.709   4.426
   79    HA   ARG  27           HA       ARG  27 -45.042  -3.948   3.950
   80    HB2  ARG  27           HB1      ARG  27 -45.446  -3.620   1.624
   81    HB3  ARG  27           HB2      ARG  27 -47.004  -3.477   2.451
   82    HG2  ARG  27           HG1      ARG  27 -46.501  -0.929   2.447
   83    HG3  ARG  27           HG2      ARG  27 -45.355  -1.348   1.163
   84    HD2  ARG  27           HD1      ARG  27 -47.151  -2.394  -0.130
   85    HD3  ARG  27           HD2      ARG  27 -48.298  -2.011   1.162
   86    HE   ARG  27           HE       ARG  27 -47.205   0.400   0.472
   87   HH11  ARG  27          HH11      ARG  27 -48.889  -2.136  -1.218
   88   HH12  ARG  27          HH12      ARG  27 -49.596  -1.067  -2.383
   89   HH21  ARG  27          HH21      ARG  27 -48.130   1.816  -1.057
   90   HH22  ARG  27          HH22      ARG  27 -49.163   1.181  -2.292
   91    H    SER  28           H        SER  28 -43.052  -3.679   2.782
   92    HA   SER  28           HA       SER  28 -40.996  -2.758   2.463
   93    HB2  SER  28           HB1      SER  28 -41.981   0.040   2.419
   94    HB3  SER  28           HB2      SER  28 -40.968  -0.829   1.252
   95    HG   SER  28           HG       SER  28 -43.154  -0.277   0.532
   96    H    SER  29           H        SER  29 -39.550  -0.796   3.301
   97    HA   SER  29           HA       SER  29 -40.137   0.285   5.849
   98    HB2  SER  29           HB1      SER  29 -39.616  -2.356   6.094
   99    HB3  SER  29           HB2      SER  29 -37.968  -1.709   6.187
  100    HG   SER  29           HG       SER  29 -39.034  -0.166   7.778
  101    H    ALA  30           H        ALA  30 -38.373   1.522   6.727
  102    HA   ALA  30           HA       ALA  30 -36.616   2.958   6.552
  103    HB1  ALA  30           HB1      ALA  30 -35.532   0.569   6.239
  104    HB2  ALA  30           HB2      ALA  30 -35.199   1.197   4.624
  105    HB3  ALA  30           HB3      ALA  30 -34.588   2.046   6.044
  106    H    ASP  31           H        ASP  31 -34.989   3.839   4.640
  107    HA   ASP  31           HA       ASP  31 -36.211   4.098   2.076
  108    HB2  ASP  31           HB1      ASP  31 -36.461   6.671   2.373
  109    HB3  ASP  31           HB2      ASP  31 -37.751   5.609   2.953
  110    HD2  ASP  31           HD       ASP  31 -35.741   7.734   5.580
  111    H    LEU  32           H        LEU  32 -34.097   5.787   4.390
  112    HA   LEU  32           HA       LEU  32 -32.089   6.009   2.244
  113    HB2  LEU  32           HB1      LEU  32 -33.238   8.014   3.905
  114    HB3  LEU  32           HB2      LEU  32 -31.537   7.828   4.359
  115    HG   LEU  32           HG       LEU  32 -31.731   7.957   1.508
  116   HD11  LEU  32          HD11      LEU  32 -33.816   9.112   1.761
  117   HD12  LEU  32          HD12      LEU  32 -32.570  10.286   1.341
  118   HD13  LEU  32          HD13      LEU  32 -33.137  10.161   3.006
  119   HD21  LEU  32          HD21      LEU  32 -30.614   9.903   3.523
  120   HD22  LEU  32          HD22      LEU  32 -30.209   9.820   1.808
  121   HD23  LEU  32          HD23      LEU  32 -29.766   8.495   2.886
  122    H    HIS  33           H        HIS  33 -29.829   6.492   3.405
  123    HA   HIS  33           HA       HIS  33 -29.336   5.140   5.856
  124    HB2  HIS  33           HB1      HIS  33 -29.788   3.199   4.353
  125    HB3  HIS  33           HB2      HIS  33 -28.419   3.701   3.359
  126    HD1  HIS  33           HD1      HIS  33 -26.237   2.686   3.936
  127    HD2  HIS  33           HD2      HIS  33 -28.880   2.605   7.141
  128    HE1  HIS  33           HE1      HIS  33 -25.053   1.410   5.751
  129    HE2  HIS  33           HE2      HIS  33 -26.668   1.360   7.710
  130    H    GLY  34           H        GLY  34 -27.519   5.373   2.792
  131    HA2  GLY  34           HA2      GLY  34 -26.065   7.615   3.107
  132    HA3  GLY  34           HA3      GLY  34 -25.258   6.507   4.207
  133    HA1  GLY  34           HA1      GLY  34 -26.443   7.065   2.531
  134    H    ALA  35           H        ALA  35 -24.266   7.792   1.759
  135    HA   ALA  35           HA       ALA  35 -23.723   5.389   0.140
  136    HB1  ALA  35           HB1      ALA  35 -24.211   6.597  -1.653
  137    HB2  ALA  35           HB2      ALA  35 -24.559   7.990  -0.628
  138    HB3  ALA  35           HB3      ALA  35 -22.926   7.734  -1.245
  139    H    ARG  36           H        ARG  36 -22.316   8.150   1.790
  140    HA   ARG  36           HA       ARG  36 -19.739   6.788   1.808
  141    HB2  ARG  36           HB1      ARG  36 -20.323   9.313   0.379
  142    HB3  ARG  36           HB2      ARG  36 -18.860   9.315   1.377
  143    HG2  ARG  36           HG1      ARG  36 -19.131   6.931  -0.302
  144    HG3  ARG  36           HG2      ARG  36 -19.009   8.450  -1.206
  145    HD2  ARG  36           HD1      ARG  36 -16.792   7.530  -0.862
  146    HD3  ARG  36           HD2      ARG  36 -16.980   9.023   0.069
  147    HE   ARG  36           HE       ARG  36 -16.693   7.819   1.990
  148   HH11  ARG  36          HH11      ARG  36 -17.480   5.637  -0.606
  149   HH12  ARG  36          HH12      ARG  36 -17.198   4.209   0.333
  150   HH21  ARG  36          HH21      ARG  36 -16.319   5.947   3.238
  151   HH22  ARG  36          HH22      ARG  36 -16.540   4.386   2.520
  152    H    LYS  37           H        LYS  37 -18.311   7.536   3.461
  153    HA   LYS  37           HA       LYS  37 -19.393   9.435   5.394
  154    HB2  LYS  37           HB1      LYS  37 -19.572   6.619   5.735
  155    HB3  LYS  37           HB2      LYS  37 -18.353   7.221   6.872
  156    HG2  LYS  37           HG1      LYS  37 -19.871   8.206   8.182
  157    HG3  LYS  37           HG2      LYS  37 -20.779   8.842   6.798
  158    HD2  LYS  37           HD1      LYS  37 -21.516   6.357   6.472
  159    HD3  LYS  37           HD2      LYS  37 -21.028   6.193   8.168
  160    HE2  LYS  37           HE1      LYS  37 -23.109   6.880   8.661
  161    HE3  LYS  37           HE2      LYS  37 -22.520   8.488   8.218
  162    HZ1  LYS  37           HZ1      LYS  37 -24.477   8.158   6.994
  163    HZ2  LYS  37           HZ2      LYS  37 -24.042   6.589   6.534
  164    HZ3  LYS  37           HZ3      LYS  37 -23.225   7.918   5.881
  165    H    GLY  38           H        GLY  38 -17.725  10.852   5.130
  166    HA2  GLY  38           HA2      GLY  38 -15.520  10.962   6.559
  167    HA3  GLY  38           HA3      GLY  38 -14.980   9.855   5.306
  168    HA1  GLY  38           HA1      GLY  38 -16.154  11.415   6.147
  169    H    SER  39           H        SER  39 -13.421  11.222   4.477
  170    HA   SER  39           HA       SER  39 -14.446  13.656   3.166
  171    HB2  SER  39           HB1      SER  39 -12.404  13.463   5.067
  172    HB3  SER  39           HB2      SER  39 -11.560  13.625   3.517
  173    HG   SER  39           HG       SER  39 -12.341  15.592   3.264
  174    H    GLN  40           H        GLN  40 -11.792  11.282   2.939
  175    HA   GLN  40           HA       GLN  40 -12.311  11.042   0.075
  176    HB2  GLN  40           HB1      GLN  40  -9.603  11.698   1.257
  177    HB3  GLN  40           HB2      GLN  40  -9.884  11.229  -0.426
  178    HG2  GLN  40           HG1      GLN  40 -11.033  13.674   0.920
  179    HG3  GLN  40           HG2      GLN  40  -9.630  13.649  -0.159
  180   HE21  GLN  40          HE21      GLN  40 -11.882  15.205  -0.638
  181   HE22  GLN  40          HE22      GLN  40 -12.670  14.622  -2.060
  182    H    CYS  41           H        CYS  41  -9.809   9.977   2.386
  183    HA   CYS  41           HA       CYS  41 -10.693   7.215   2.052
  184    HB2  CYS  41           HB1      CYS  41  -8.527   6.380   1.448
  185    HB3  CYS  41           HB2      CYS  41  -8.958   7.653   0.305
  186    H    LEU  42           H        LEU  42 -10.298   5.926   3.807
  187    HA   LEU  42           HA       LEU  42  -9.630   7.264   6.257
  188    HB2  LEU  42           HB1      LEU  42 -11.148   5.044   5.533
  189    HB3  LEU  42           HB2      LEU  42  -9.775   4.375   6.432
  190    HG   LEU  42           HG       LEU  42 -10.627   6.471   8.024
  191   HD11  LEU  42          HD11      LEU  42 -12.672   6.358   6.394
  192   HD12  LEU  42          HD12      LEU  42 -12.915   6.543   8.130
  193   HD13  LEU  42          HD13      LEU  42 -13.112   4.961   7.377
  194   HD21  LEU  42          HD21      LEU  42 -11.857   4.265   9.084
  195   HD22  LEU  42          HD22      LEU  42 -10.166   4.706   9.317
  196   HD23  LEU  42          HD23      LEU  42 -10.610   3.552   8.059
  197    H    SER  43           H        SER  43  -7.994   5.210   3.992
  198    HA   SER  43           HA       SER  43  -5.468   5.703   5.233
  199    HB2  SER  43           HB1      SER  43  -6.594   3.726   6.524
  200    HB3  SER  43           HB2      SER  43  -6.158   2.784   5.089
  201    HG   SER  43           HG       SER  43  -4.458   2.641   6.507
  202    H    ASP  44           H        ASP  44  -3.681   4.547   4.037
  203    HA   ASP  44           HA       ASP  44  -3.910   5.010   1.289
  204    HB2  ASP  44           HB1      ASP  44  -1.700   4.209   1.084
  205    HB3  ASP  44           HB2      ASP  44  -1.788   4.903   2.709
  206    HD2  ASP  44           HD       ASP  44  -1.913   1.537   4.030
  207    H    THR  45           H        THR  45  -4.611   2.203   3.192
  208    HA   THR  45           HA       THR  45  -4.576   0.335   1.016
  209    HB   THR  45           HB       THR  45  -6.250  -0.625   3.106
  210    HG1  THR  45           HG1      THR  45  -5.189  -0.088   4.915
  211   HG21  THR  45          HG21      THR  45  -4.812  -2.039   1.782
  212   HG22  THR  45          HG22      THR  45  -4.331  -2.168   3.474
  213   HG23  THR  45          HG23      THR  45  -3.380  -1.189   2.359
  214    H    ASP  46           H        ASP  46  -6.881   2.543   2.353
  215    HA   ASP  46           HA       ASP  46  -9.243   1.306   1.384
  216    HB2  ASP  46           HB1      ASP  46  -8.635   4.182   2.111
  217    HB3  ASP  46           HB2      ASP  46 -10.250   3.586   1.703
  218    HD2  ASP  46           HD       ASP  46 -10.732   2.391   4.866
  219    H    CYS  47           H        CYS  47  -6.825   3.328  -0.067
  220    HA   CYS  47           HA       CYS  47  -8.169   4.449  -2.201
  221    HB2  CYS  47           HB1      CYS  47  -5.455   3.985  -1.456
  222    HB3  CYS  47           HB2      CYS  47  -5.640   3.517  -3.146
  223    H    ASN  48           H        ASN  48  -6.699   1.221  -1.998
  224    HA   ASN  48           HA       ASN  48  -8.646   0.020  -3.642
  225    HB2  ASN  48           HB1      ASN  48  -6.382   1.251  -5.009
  226    HB3  ASN  48           HB2      ASN  48  -6.498  -0.482  -5.342
  227   HD21  ASN  48          HD21      ASN  48  -7.155   2.177  -6.786
  228   HD22  ASN  48          HD22      ASN  48  -8.690   1.849  -7.508
  229    H    THR  49           H        THR  49  -5.124  -0.476  -3.559
  230    HA   THR  49           HA       THR  49  -5.209  -2.509  -1.578
  231    HB   THR  49           HB       THR  49  -4.270  -4.062  -3.728
  232    HG1  THR  49           HG1      THR  49  -5.418  -3.280  -5.338
  233   HG21  THR  49          HG21      THR  49  -6.199  -5.498  -3.156
  234   HG22  THR  49          HG22      THR  49  -6.859  -4.186  -2.177
  235   HG23  THR  49          HG23      THR  49  -5.328  -4.939  -1.727
  236    H    ARG  50           H        ARG  50  -3.385  -2.076  -4.616
  237    HA   ARG  50           HA       ARG  50  -0.916  -1.998  -3.033
  238    HB2  ARG  50           HB1      ARG  50  -1.198  -2.316  -6.027
  239    HB3  ARG  50           HB2      ARG  50   0.254  -2.585  -5.052
  240    HG2  ARG  50           HG1      ARG  50  -0.287  -4.721  -4.845
  241    HG3  ARG  50           HG2      ARG  50  -1.763  -4.245  -3.992
  242    HD2  ARG  50           HD1      ARG  50  -3.091  -4.476  -5.840
  243    HD3  ARG  50           HD2      ARG  50  -1.784  -4.039  -6.948
  244    HE   ARG  50           HE       ARG  50  -2.448  -6.679  -6.005
  245   HH11  ARG  50          HH11      ARG  50   0.015  -4.646  -7.390
  246   HH12  ARG  50          HH12      ARG  50   0.900  -5.965  -8.082
  247   HH21  ARG  50          HH21      ARG  50  -1.293  -8.424  -6.911
  248   HH22  ARG  50          HH22      ARG  50   0.154  -8.116  -7.810
  249    H    LYS  51           H        LYS  51  -2.806   0.264  -3.393
  250    HA   LYS  51           HA       LYS  51  -0.890   2.176  -4.551
  251    HB2  LYS  51           HB1      LYS  51  -3.833   1.901  -5.001
  252    HB3  LYS  51           HB2      LYS  51  -3.129   3.526  -4.984
  253    HG2  LYS  51           HG1      LYS  51  -2.946   3.093  -7.203
  254    HG3  LYS  51           HG2      LYS  51  -1.411   2.396  -6.656
  255    HD2  LYS  51           HD1      LYS  51  -2.056   0.274  -7.093
  256    HD3  LYS  51           HD2      LYS  51  -3.720   0.570  -6.560
  257    HE2  LYS  51           HE1      LYS  51  -4.351   1.494  -8.635
  258    HE3  LYS  51           HE2      LYS  51  -2.666   1.707  -9.133
  259    HZ1  LYS  51           HZ1      LYS  51  -4.361  -0.546  -9.476
  260    HZ2  LYS  51           HZ2      LYS  51  -2.950  -0.989  -8.656
  261    HZ3  LYS  51           HZ3      LYS  51  -2.848  -0.231 -10.165
  262    H    PHE  52           H        PHE  52  -1.101   4.381  -3.691
  263    HA   PHE  52           HA       PHE  52  -2.010   4.343  -0.888
  264    HB2  PHE  52           HB1      PHE  52  -0.269   6.056  -0.454
  265    HB3  PHE  52           HB2      PHE  52   0.402   4.519  -1.004
  266    HD1  PHE  52           HD1      PHE  52   1.276   4.274  -3.293
  267    HD2  PHE  52           HD2      PHE  52  -0.006   8.035  -1.769
  268    HE1  PHE  52           HE1      PHE  52   2.483   5.416  -5.108
  269    HE2  PHE  52           HE2      PHE  52   1.198   9.184  -3.581
  270    HZ   PHE  52           HZ       PHE  52   2.444   7.875  -5.254
  271    H    CYS  53           H        CYS  53  -2.426   6.626  -0.035
  272    HA   CYS  53           HA       CYS  53  -4.282   7.910  -1.878
  273    HB2  CYS  53           HB1      CYS  53  -4.411   7.322   0.813
  274    HB3  CYS  53           HB2      CYS  53  -4.049   9.048   0.812
  275    H    LEU  54           H        LEU  54  -3.414   9.395  -3.177
  276    HA   LEU  54           HA       LEU  54  -1.285  11.130  -2.158
  277    HB2  LEU  54           HB1      LEU  54  -0.887   9.938  -4.271
  278    HB3  LEU  54           HB2      LEU  54  -2.303  10.744  -4.969
  279    HG   LEU  54           HG       LEU  54  -1.032  12.936  -4.451
  280   HD11  LEU  54          HD11      LEU  54   1.290  11.017  -4.515
  281   HD12  LEU  54          HD12      LEU  54   0.697  11.823  -3.063
  282   HD13  LEU  54          HD13      LEU  54   1.360  12.776  -4.391
  283   HD21  LEU  54          HD21      LEU  54  -1.347  11.453  -6.686
  284   HD22  LEU  54          HD22      LEU  54   0.413  11.503  -6.580
  285   HD23  LEU  54          HD23      LEU  54  -0.511  13.005  -6.641
  286    H    GLN  55           H        GLN  55  -1.580  13.244  -1.784
  287    HA   GLN  55           HA       GLN  55  -3.963  14.568  -2.854
  288    HB2  GLN  55           HB1      GLN  55  -3.151  14.842   0.043
  289    HB3  GLN  55           HB2      GLN  55  -4.616  15.456  -0.737
  290    HG2  GLN  55           HG1      GLN  55  -5.210  13.019  -1.199
  291    HG3  GLN  55           HG2      GLN  55  -3.930  12.622  -0.044
  292   HE21  GLN  55          HE21      GLN  55  -5.759  11.624   1.095
  293   HE22  GLN  55          HE22      GLN  55  -6.693  12.604   2.166
  294    HA   PRO  56           HA       PRO  56  -0.267  17.204  -3.465
  295    HB2  PRO  56           HB1      PRO  56  -1.147  18.256  -5.836
  296    HB3  PRO  56           HB2      PRO  56  -0.312  16.708  -5.708
  297    HG2  PRO  56           HG1      PRO  56  -3.254  17.273  -5.869
  298    HG3  PRO  56           HG2      PRO  56  -2.279  16.037  -6.749
  299    HD2  PRO  56           HD1      PRO  56  -3.808  15.432  -4.587
  300    HD3  PRO  56           HD2      PRO  56  -2.279  14.607  -4.941
  301    H    ARG  57           H        ARG  57  -0.029  19.453  -3.304
  302    HA   ARG  57           HA       ARG  57  -2.275  20.803  -2.084
  303    HB2  ARG  57           HB1      ARG  57   0.251  20.884  -1.413
  304    HB3  ARG  57           HB2      ARG  57   0.347  22.129  -2.668
  305    HG2  ARG  57           HG1      ARG  57  -1.847  22.924  -1.215
  306    HG3  ARG  57           HG2      ARG  57  -0.757  22.272   0.021
  307    HD2  ARG  57           HD1      ARG  57   0.970  23.779  -0.531
  308    HD3  ARG  57           HD2      ARG  57   0.210  24.194  -2.072
  309    HE   ARG  57           HE       ARG  57  -1.612  24.985  -0.211
  310   HH11  ARG  57          HH11      ARG  57   1.764  25.634  -0.759
  311   HH12  ARG  57          HH12      ARG  57   1.703  27.227  -0.080
  312   HH21  ARG  57          HH21      ARG  57  -1.706  27.081   0.685
  313   HH22  ARG  57          HH22      ARG  57  -0.272  28.048   0.743
  314    H    ASP  58           H        ASP  58  -0.597  20.809  -5.127
  315    HA   ASP  58           HA       ASP  58  -1.866  23.273  -6.005
  316    HB2  ASP  58           HB1      ASP  58   0.040  21.349  -7.353
  317    HB3  ASP  58           HB2      ASP  58  -0.653  22.759  -8.165
  318    HD2  ASP  58           HD       ASP  58   2.339  23.299  -5.695
  319    H    GLU  59           H        GLU  59  -2.363  19.867  -6.177
  320    HA   GLU  59           HA       GLU  59  -4.580  20.300  -8.071
  321    HB2  GLU  59           HB1      GLU  59  -2.409  18.356  -8.088
  322    HB3  GLU  59           HB2      GLU  59  -4.001  17.584  -8.155
  323    HG2  GLU  59           HG1      GLU  59  -3.266  19.845  -9.994
  324    HG3  GLU  59           HG2      GLU  59  -2.863  18.162 -10.362
  325    HE2  GLU  59           HE       GLU  59  -6.665  17.966 -10.061
  326    H    LYS  60           H        LYS  60  -6.114  18.231  -7.877
  327    HA   LYS  60           HA       LYS  60  -7.092  18.309  -5.148
  328    HB2  LYS  60           HB1      LYS  60  -8.187  17.699  -7.802
  329    HB3  LYS  60           HB2      LYS  60  -8.780  16.628  -6.521
  330    HG2  LYS  60           HG1      LYS  60 -10.052  18.219  -5.599
  331    HG3  LYS  60           HG2      LYS  60  -8.796  19.456  -5.789
  332    HD2  LYS  60           HD1      LYS  60  -9.393  19.384  -8.304
  333    HD3  LYS  60           HD2      LYS  60 -10.869  18.564  -7.767
  334    HE2  LYS  60           HE1      LYS  60 -10.206  21.003  -6.253
  335    HE3  LYS  60           HE2      LYS  60 -10.575  21.263  -7.964
  336    HZ1  LYS  60           HZ1      LYS  60 -12.653  20.014  -7.635
  337    HZ2  LYS  60           HZ2      LYS  60 -12.580  21.411  -6.683
  338    HZ3  LYS  60           HZ3      LYS  60 -12.312  19.895  -5.981
  339    HA   PRO  61           HA       PRO  61  -5.720  14.364  -3.806
  340    HB2  PRO  61           HB1      PRO  61  -7.881  13.427  -2.407
  341    HB3  PRO  61           HB2      PRO  61  -6.852  14.742  -1.841
  342    HG2  PRO  61           HG1      PRO  61  -9.484  14.869  -3.274
  343    HG3  PRO  61           HG2      PRO  61  -8.922  15.799  -1.834
  344    HD2  PRO  61           HD1      PRO  61  -8.955  16.852  -4.337
  345    HD3  PRO  61           HD2      PRO  61  -7.727  17.279  -3.133
  346    H    PHE  62           H        PHE  62  -5.535  12.367  -4.639
  347    HA   PHE  62           HA       PHE  62  -7.753  10.884  -5.660
  348    HB2  PHE  62           HB1      PHE  62  -7.203  10.819  -7.978
  349    HB3  PHE  62           HB2      PHE  62  -7.278  12.521  -7.518
  350    HD1  PHE  62           HD1      PHE  62  -4.959  13.532  -6.704
  351    HD2  PHE  62           HD2      PHE  62  -5.408  10.161  -9.264
  352    HE1  PHE  62           HE1      PHE  62  -2.686  13.894  -7.574
  353    HE2  PHE  62           HE2      PHE  62  -3.135  10.518 -10.137
  354    HZ   PHE  62           HZ       PHE  62  -1.771  12.386  -9.291
  355    H    CYS  63           H        CYS  63  -7.136   8.742  -6.399
  356    HA   CYS  63           HA       CYS  63  -4.939   7.706  -4.873
  357    HB2  CYS  63           HB1      CYS  63  -6.975   6.459  -6.719
  358    HB3  CYS  63           HB2      CYS  63  -5.667   5.517  -5.998
  359    H    ALA  64           H        ALA  64  -2.908   7.543  -5.528
  360    HA   ALA  64           HA       ALA  64  -2.340   7.634  -8.412
  361    HB1  ALA  64           HB1      ALA  64  -0.556   8.295  -6.071
  362    HB2  ALA  64           HB2      ALA  64  -0.090   8.382  -7.771
  363    HB3  ALA  64           HB3      ALA  64  -1.347   9.450  -7.146
  364    H    THR  65           H        THR  65  -0.643   6.292  -9.258
  365    HA   THR  65           HA       THR  65  -0.773   3.613  -8.263
  366    HB   THR  65           HB       THR  65   1.057   3.292 -10.113
  367    HG1  THR  65           HG1      THR  65  -0.081   5.674 -11.114
  368   HG21  THR  65          HG21      THR  65  -1.856   3.850 -10.389
  369   HG22  THR  65          HG22      THR  65  -0.962   2.356 -10.666
  370   HG23  THR  65          HG23      THR  65  -0.900   3.654 -11.857
  371    H    CYS  66           H        CYS  66   1.293   2.296  -8.062
  372    HA   CYS  66           HA       CYS  66   2.813   3.302  -5.905
  373    HB2  CYS  66           HB1      CYS  66   2.415   0.925  -6.144
  374    HB3  CYS  66           HB2      CYS  66   3.262   0.905  -7.692
  375    H    ARG  67           H        ARG  67   4.779   4.246  -5.796
  376    HA   ARG  67           HA       ARG  67   5.888   5.295  -8.253
  377    HB2  ARG  67           HB1      ARG  67   6.772   5.663  -5.379
  378    HB3  ARG  67           HB2      ARG  67   7.382   6.569  -6.772
  379    HG2  ARG  67           HG1      ARG  67   4.560   6.616  -5.701
  380    HG3  ARG  67           HG2      ARG  67   5.774   7.899  -5.563
  381    HD2  ARG  67           HD1      ARG  67   5.842   7.843  -8.141
  382    HD3  ARG  67           HD2      ARG  67   4.325   6.944  -8.010
  383    HE   ARG  67           HE       ARG  67   4.290   9.373  -6.498
  384   HH11  ARG  67          HH11      ARG  67   3.882   8.015  -9.678
  385   HH12  ARG  67          HH12      ARG  67   2.851   9.293 -10.233
  386   HH21  ARG  67          HH21      ARG  67   2.934  11.060  -7.217
  387   HH22  ARG  67          HH22      ARG  67   2.313  11.025  -8.833
  388    H    GLY  68           H        GLY  68   7.946   4.908  -9.059
  389    HA2  GLY  68           HA2      GLY  68   9.125   2.370  -8.174
  390    HA3  GLY  68           HA3      GLY  68   9.378   3.131  -9.737
  391    HA1  GLY  68           HA1      GLY  68   9.109   3.063  -7.629
  392    H    LEU  69           H        LEU  69  11.625   2.366  -8.831
  393    HA   LEU  69           HA       LEU  69  12.911   3.945  -6.877
  394    HB2  LEU  69           HB1      LEU  69  14.048   2.360  -9.186
  395    HB3  LEU  69           HB2      LEU  69  15.005   3.063  -7.871
  396    HG   LEU  69           HG       LEU  69  12.970   0.849  -7.642
  397   HD11  LEU  69          HD11      LEU  69  14.719  -0.440  -8.107
  398   HD12  LEU  69          HD12      LEU  69  15.419   0.081  -6.575
  399   HD13  LEU  69          HD13      LEU  69  15.825   0.933  -8.065
  400   HD21  LEU  69          HD21      LEU  69  14.509   2.341  -5.527
  401   HD22  LEU  69          HD22      LEU  69  13.753   0.770  -5.259
  402   HD23  LEU  69          HD23      LEU  69  12.760   2.169  -5.675
  403    H    ARG  70           H        ARG  70  12.261   4.433 -10.249
  404    HA   ARG  70           HA       ARG  70  14.120   6.673 -10.422
  405    HB2  ARG  70           HB1      ARG  70  12.203   5.638 -12.523
  406    HB3  ARG  70           HB2      ARG  70  13.564   6.743 -12.771
  407    HG2  ARG  70           HG1      ARG  70  14.815   4.596 -11.642
  408    HG3  ARG  70           HG2      ARG  70  13.527   3.826 -12.584
  409    HD2  ARG  70           HD1      ARG  70  15.198   5.980 -13.835
  410    HD3  ARG  70           HD2      ARG  70  15.831   4.334 -13.696
  411    HE   ARG  70           HE       ARG  70  13.313   4.099 -14.811
  412   HH11  ARG  70          HH11      ARG  70  16.342   5.613 -15.619
  413   HH12  ARG  70          HH12      ARG  70  16.105   5.473 -17.329
  414   HH21  ARG  70          HH21      ARG  70  12.989   3.908 -17.061
  415   HH22  ARG  70          HH22      ARG  70  14.197   4.504 -18.149
  416    H    ARG  71           H        ARG  71  11.390   6.434  -8.910
  417    HA   ARG  71           HA       ARG  71  10.170   8.875 -10.012
  418    HB2  ARG  71           HB1      ARG  71   9.086   6.531  -8.500
  419    HB3  ARG  71           HB2      ARG  71   8.279   8.098  -8.347
  420    HG2  ARG  71           HG1      ARG  71   8.808   6.695 -10.967
  421    HG3  ARG  71           HG2      ARG  71   7.280   6.644 -10.073
  422    HD2  ARG  71           HD1      ARG  71   7.517   9.276 -10.164
  423    HD3  ARG  71           HD2      ARG  71   8.535   8.897 -11.561
  424    HE   ARG  71           HE       ARG  71   6.171   7.464 -11.856
  425   HH11  ARG  71          HH11      ARG  71   7.207  10.785 -11.734
  426   HH12  ARG  71          HH12      ARG  71   5.931  11.358 -12.757
  427   HH21  ARG  71          HH21      ARG  71   4.486   8.205 -13.204
  428   HH22  ARG  71          HH22      ARG  71   4.383   9.888 -13.592
  429    H    ARG  72           H        ARG  72   9.777  10.641  -8.708
  430    HA   ARG  72           HA       ARG  72  11.511  10.923  -6.435
  431    HB2  ARG  72           HB1      ARG  72   9.456  12.828  -7.585
  432    HB3  ARG  72           HB2      ARG  72  10.674  13.237  -6.367
  433    HG2  ARG  72           HG1      ARG  72  12.108  12.108  -8.492
  434    HG3  ARG  72           HG2      ARG  72  10.907  13.183  -9.228
  435    HD2  ARG  72           HD1      ARG  72  12.880  13.930  -7.056
  436    HD3  ARG  72           HD2      ARG  72  12.973  14.386  -8.763
  437    HE   ARG  72           HE       ARG  72  10.524  15.289  -7.868
  438   HH11  ARG  72          HH11      ARG  72  13.875  15.820  -7.090
  439   HH12  ARG  72          HH12      ARG  72  13.629  17.451  -6.560
  440   HH21  ARG  72          HH21      ARG  72  10.187  17.436  -7.173
  441   HH22  ARG  72          HH22      ARG  72  11.531  18.369  -6.607
  442    H    CYS  73           H        CYS  73  10.795  11.688  -4.332
  443    HA   CYS  73           HA       CYS  73   8.030  11.088  -3.617
  444    HB2  CYS  73           HB1      CYS  73   8.583   9.565  -1.863
  445    HB3  CYS  73           HB2      CYS  73   9.372   8.982  -3.330
  446    H    GLN  74           H        GLN  74   7.404  11.935  -1.550
  447    HA   GLN  74           HA       GLN  74   9.206  14.056  -0.582
  448    HB2  GLN  74           HB1      GLN  74   6.679  14.338  -1.722
  449    HB3  GLN  74           HB2      GLN  74   6.398  14.497   0.020
  450    HG2  GLN  74           HG1      GLN  74   7.807  16.358   0.210
  451    HG3  GLN  74           HG2      GLN  74   8.551  16.051  -1.367
  452   HE21  GLN  74          HE21      GLN  74   6.132  17.704   0.305
  453   HE22  GLN  74          HE22      GLN  74   5.299  18.370  -1.055
  454    H    ARG  75           H        ARG  75   6.945  11.525   0.258
  455    HA   ARG  75           HA       ARG  75   7.718  11.844   3.084
  456    HB2  ARG  75           HB1      ARG  75   5.171  12.024   2.063
  457    HB3  ARG  75           HB2      ARG  75   5.257  10.333   2.578
  458    HG2  ARG  75           HG1      ARG  75   5.862  10.999   4.830
  459    HG3  ARG  75           HG2      ARG  75   5.876  12.699   4.334
  460    HD2  ARG  75           HD1      ARG  75   3.373  11.640   3.539
  461    HD3  ARG  75           HD2      ARG  75   3.672  11.092   5.195
  462    HE   ARG  75           HE       ARG  75   4.281  13.791   5.142
  463   HH11  ARG  75          HH11      ARG  75   1.497  11.771   4.605
  464   HH12  ARG  75          HH12      ARG  75   0.362  12.974   5.123
  465   HH21  ARG  75          HH21      ARG  75   2.797  15.383   5.825
  466   HH22  ARG  75          HH22      ARG  75   1.102  15.029   5.815
  467    H    ASP  76           H        ASP  76   7.963   9.907   4.317
  468    HA   ASP  76           HA       ASP  76   9.345   7.858   2.955
  469    HB2  ASP  76           HB1      ASP  76   9.172   6.658   5.207
  470    HB3  ASP  76           HB2      ASP  76   9.979   8.232   5.197
  471    HD2  ASP  76           HD       ASP  76   7.445   9.711   7.069
  472    H    ALA  77           H        ALA  77   6.094   8.004   4.356
  473    HA   ALA  77           HA       ALA  77   5.445   5.305   3.658
  474    HB1  ALA  77           HB1      ALA  77   3.296   7.292   4.149
  475    HB2  ALA  77           HB2      ALA  77   3.475   5.642   4.749
  476    HB3  ALA  77           HB3      ALA  77   4.418   6.949   5.465
  477    H    MET  78           H        MET  78   5.255   8.384   2.073
  478    HA   MET  78           HA       MET  78   3.253   7.977   0.210
  479    HB2  MET  78           HB1      MET  78   5.646   9.668   0.423
  480    HB3  MET  78           HB2      MET  78   5.143   9.339  -1.242
  481    HG2  MET  78           HG1      MET  78   2.952  10.102   0.563
  482    HG3  MET  78           HG2      MET  78   4.178  11.347   0.306
  483    HE1  MET  78           HE1      MET  78   4.097  11.978  -3.494
  484    HE2  MET  78           HE2      MET  78   4.924  12.235  -1.958
  485    HE3  MET  78           HE3      MET  78   5.101  10.700  -2.808
  486    H    CYS  79           H        CYS  79   6.620   6.905   0.130
  487    HA   CYS  79           HA       CYS  79   6.324   5.702  -2.481
  488    HB2  CYS  79           HB1      CYS  79   8.493   6.404  -0.715
  489    HB3  CYS  79           HB2      CYS  79   8.663   4.727  -1.237
  490    H    CYS  80           H        CYS  80   6.399   3.484  -2.938
  491    HA   CYS  80           HA       CYS  80   4.858   1.824  -1.325
  492    HB2  CYS  80           HB1      CYS  80   6.649   1.409  -3.676
  493    HB3  CYS  80           HB2      CYS  80   6.125  -0.018  -2.778
  494    HA   PRO  81           HA       PRO  81   7.499   0.089   1.718
  495    HB2  PRO  81           HB1      PRO  81   6.679  -2.522   1.797
  496    HB3  PRO  81           HB2      PRO  81   5.713  -1.180   2.410
  497    HG2  PRO  81           HG1      PRO  81   5.563  -2.578  -0.241
  498    HG3  PRO  81           HG2      PRO  81   4.228  -2.099   0.874
  499    HD2  PRO  81           HD1      PRO  81   4.864  -0.675  -1.350
  500    HD3  PRO  81           HD2      PRO  81   4.263   0.084   0.134
  501    H    GLY  82           H        GLY  82   9.295  -1.305   2.108
  502    HA2  GLY  82           HA2      GLY  82  10.938  -2.878   1.486
  503    HA3  GLY  82           HA3      GLY  82  10.297  -2.866  -0.151
  504    HA1  GLY  82           HA1      GLY  82  10.896  -2.024   1.707
  505    H    THR  83           H        THR  83  10.313   0.193   0.075
  506    HA   THR  83           HA       THR  83  13.198   0.535  -0.440
  507    HB   THR  83           HB       THR  83  12.270   2.509  -1.929
  508    HG1  THR  83           HG1      THR  83  10.162   0.605  -2.131
  509   HG21  THR  83          HG21      THR  83  13.445   1.139  -3.267
  510   HG22  THR  83          HG22      THR  83  11.877   0.464  -3.709
  511   HG23  THR  83          HG23      THR  83  12.850  -0.310  -2.459
  512    H    LEU  84           H        LEU  84  13.853   2.910  -0.328
  513    HA   LEU  84           HA       LEU  84  12.433   4.260   1.871
  514    HB2  LEU  84           HB1      LEU  84  14.758   3.031   2.278
  515    HB3  LEU  84           HB2      LEU  84  15.379   4.557   1.627
  516    HG   LEU  84           HG       LEU  84  13.915   5.669   3.445
  517   HD11  LEU  84          HD11      LEU  84  13.710   4.222   5.473
  518   HD12  LEU  84          HD12      LEU  84  14.067   2.833   4.445
  519   HD13  LEU  84          HD13      LEU  84  12.621   3.799   4.153
  520   HD21  LEU  84          HD21      LEU  84  15.936   6.074   4.260
  521   HD22  LEU  84          HD22      LEU  84  16.577   4.677   3.394
  522   HD23  LEU  84          HD23      LEU  84  15.946   4.488   5.031
  523    H    CYS  85           H        CYS  85  12.903   6.594   2.017
  524    HA   CYS  85           HA       CYS  85  12.947   7.757  -0.652
  525    HB2  CYS  85           HB1      CYS  85  11.937   8.551   2.015
  526    HB3  CYS  85           HB2      CYS  85  12.553   9.868   1.014
  527    H    VAL  86           H        VAL  86  15.018   7.904  -1.353
  528    HA   VAL  86           HA       VAL  86  16.945   9.304   0.384
  529    HB   VAL  86           HB       VAL  86  17.525   7.498  -1.969
  530   HG11  VAL  86          HG11      VAL  86  19.791   7.802  -0.361
  531   HG12  VAL  86          HG12      VAL  86  19.527   8.466  -1.975
  532   HG13  VAL  86          HG13      VAL  86  19.126   9.424  -0.549
  533   HG21  VAL  86          HG21      VAL  86  18.336   5.902  -0.315
  534   HG22  VAL  86          HG22      VAL  86  17.868   6.996   0.987
  535   HG23  VAL  86          HG23      VAL  86  16.632   6.272  -0.043
  536    H    ASN  87           H        ASN  87  17.595  11.270  -0.196
  537    HA   ASN  87           HA       ASN  87  17.775  13.218  -1.361
  538    HB2  ASN  87           HB1      ASN  87  18.449  11.134  -3.429
  539    HB3  ASN  87           HB2      ASN  87  18.446  12.854  -3.842
  540   HD21  ASN  87          HD21      ASN  87  20.062  14.163  -3.135
  541   HD22  ASN  87          HD22      ASN  87  21.457  13.591  -2.292
  542    H    ASP  88           H        ASP  88  15.158  12.442  -0.972
  543    HA   ASP  88           HA       ASP  88  13.032  12.870  -1.660
  544    HB2  ASP  88           HB1      ASP  88  14.672  14.731  -3.341
  545    HB3  ASP  88           HB2      ASP  88  12.944  14.564  -3.681
  546    HD2  ASP  88           HD       ASP  88  12.143  16.606  -1.067
  547    H    VAL  89           H        VAL  89  14.600  10.659  -2.871
  548    HA   VAL  89           HA       VAL  89  12.779  10.136  -5.100
  549    HB   VAL  89           HB       VAL  89  15.768   9.739  -5.283
  550   HG11  VAL  89          HG11      VAL  89  15.002   9.212  -7.736
  551   HG12  VAL  89          HG12      VAL  89  14.969   7.959  -6.494
  552   HG13  VAL  89          HG13      VAL  89  13.482   8.795  -6.945
  553   HG21  VAL  89          HG21      VAL  89  15.599  11.943  -5.812
  554   HG22  VAL  89          HG22      VAL  89  15.186  11.267  -7.389
  555   HG23  VAL  89          HG23      VAL  89  13.909  11.811  -6.300
  556    H    CYS  90           H        CYS  90  12.200   8.007  -5.337
  557    HA   CYS  90           HA       CYS  90  12.458   6.320  -3.088
  558    HB2  CYS  90           HB1      CYS  90  10.856   6.427  -5.372
  559    HB3  CYS  90           HB2      CYS  90  11.734   4.904  -5.521
  560    H    THR  91           H        THR  91  14.128   5.119  -2.506
  561    HA   THR  91           HA       THR  91  15.738   3.800  -4.571
  562    HB   THR  91           HB       THR  91  16.941   5.320  -2.249
  563    HG1  THR  91           HG1      THR  91  17.100   5.846  -5.047
  564   HG21  THR  91          HG21      THR  91  18.189   3.291  -2.844
  565   HG22  THR  91          HG22      THR  91  19.088   4.749  -3.265
  566   HG23  THR  91          HG23      THR  91  18.260   3.830  -4.522
  567    H    THR  92           H        THR  92  16.424   1.781  -4.046
  568    HA   THR  92           HA       THR  92  15.138   0.359  -2.014
  569    HB   THR  92           HB       THR  92  17.617  -0.932  -2.703
  570    HG1  THR  92           HG1      THR  92  17.752  -0.571  -4.798
  571   HG21  THR  92          HG21      THR  92  15.969  -2.446  -2.321
  572   HG22  THR  92          HG22      THR  92  15.734  -2.283  -4.061
  573   HG23  THR  92          HG23      THR  92  14.705  -1.387  -2.946
  574    H    MET  93           H        MET  93  15.588  -0.047   0.068
  575    HA   MET  93           HA       MET  93  17.480   1.493   1.466
  576    HB2  MET  93           HB1      MET  93  15.287   0.032   2.161
  577    HB3  MET  93           HB2      MET  93  16.593  -0.995   2.772
  578    HG2  MET  93           HG1      MET  93  16.607   1.927   3.408
  579    HG3  MET  93           HG2      MET  93  15.534   0.837   4.289
  580    HE1  MET  93           HE1      MET  93  15.886  -0.368   5.946
  581    HE2  MET  93           HE2      MET  93  17.340  -1.218   6.467
  582    HE3  MET  93           HE3      MET  93  17.024   0.422   7.036
  583    H    GLU  94           H        GLU  94  17.656  -1.655  -0.001
  584    HA   GLU  94           HA       GLU  94  20.016  -2.497   1.385
  585    HB2  GLU  94           HB1      GLU  94  18.746  -3.501  -1.174
  586    HB3  GLU  94           HB2      GLU  94  20.085  -4.294  -0.327
  587    HG2  GLU  94           HG1      GLU  94  17.710  -3.743   1.325
  588    HG3  GLU  94           HG2      GLU  94  17.479  -4.911   0.017
  589    HE2  GLU  94           HE       GLU  94  19.082  -6.262   3.191
  590    H    ASP  95           H        ASP  95  19.324  -0.747  -1.555
  591    HA   ASP  95           HA       ASP  95  22.036  -0.905  -2.534
  592    HB2  ASP  95           HB1      ASP  95  19.515   0.452  -3.446
  593    HB3  ASP  95           HB2      ASP  95  21.074   0.929  -4.135
  594    HD2  ASP  95           HD       ASP  95  19.898  -2.794  -4.892
  595    H    ALA  96           H        ALA  96  20.052   1.359  -0.742
  596    HA   ALA  96           HA       ALA  96  21.673   3.637  -0.958
  597    HB1  ALA  96           HB1      ALA  96  19.371   2.831   0.543
  598    HB2  ALA  96           HB2      ALA  96  20.505   3.676   1.598
  599    HB3  ALA  96           HB3      ALA  96  19.920   4.455   0.128
  600    H    THR  97           H        THR  97  23.568   4.180  -0.086
  601    HA   THR  97           HA       THR  97  24.473   3.122   2.426
  602    HB   THR  97           HB       THR  97  26.653   2.517   0.713
  603    HG1  THR  97           HG1      THR  97  25.806   1.317  -0.845
  604   HG21  THR  97          HG21      THR  97  26.021   1.559   2.966
  605   HG22  THR  97          HG22      THR  97  26.560   0.387   1.764
  606   HG23  THR  97          HG23      THR  97  24.841   0.561   2.118
  607    H    GLU  98           H        GLU  98  25.459   4.765   3.386
  608    HA   GLU  98           HA       GLU  98  26.080   7.189   2.213
  609    HB2  GLU  98           HB1      GLU  98  27.416   7.667   4.232
  610    HB3  GLU  98           HB2      GLU  98  25.845   6.947   4.617
  611    HG2  GLU  98           HG1      GLU  98  27.067   4.712   4.727
  612    HG3  GLU  98           HG2      GLU  98  28.554   5.670   4.737
  613    HE2  GLU  98           HE       GLU  98  27.208   5.090   8.154
  614    H    ASN  99           H        ASN  99  28.137   8.223   1.817
  615    HA   ASN  99           HA       ASN  99  30.249   6.340   0.995
  616    HB2  ASN  99           HB1      ASN  99  30.725   7.768  -0.938
  617    HB3  ASN  99           HB2      ASN  99  29.055   7.189  -0.978
  618   HD21  ASN  99          HD21      ASN  99  31.075   9.896  -1.009
  619   HD22  ASN  99          HD22      ASN  99  29.852  11.115  -0.930
  620    H    LEU 100           H        LEU 100  32.312   7.790   0.422
  621    HA   LEU 100           HA       LEU 100  33.202   8.838   2.893
  622    HB2  LEU 100           HB1      LEU 100  34.361   8.000   0.493
  623    HB3  LEU 100           HB2      LEU 100  34.788   9.713   0.642
  624    HG   LEU 100           HG       LEU 100  35.692   9.189   2.931
  625   HD11  LEU 100          HD11      LEU 100  34.347   6.960   2.932
  626   HD12  LEU 100          HD12      LEU 100  35.934   7.031   3.697
  627   HD13  LEU 100          HD13      LEU 100  35.761   6.325   2.091
  628   HD21  LEU 100          HD21      LEU 100  36.955   7.751   0.598
  629   HD22  LEU 100          HD22      LEU 100  37.772   8.249   2.080
  630   HD23  LEU 100          HD23      LEU 100  37.135   9.465   0.973
  631    H    TYR 101           H        TYR 101  34.584  11.074   2.553
  632    HA   TYR 101           HA       TYR 101  32.919  13.104   1.302
  633    HB2  TYR 101           HB1      TYR 101  32.856  12.541   4.140
  634    HB3  TYR 101           HB2      TYR 101  33.450  14.177   3.845
  635    HD1  TYR 101           HD1      TYR 101  30.548  12.076   3.961
  636    HD2  TYR 101           HD2      TYR 101  32.051  15.742   2.411
  637    HE1  TYR 101           HE1      TYR 101  28.245  12.868   3.615
  638    HE2  TYR 101           HE2      TYR 101  29.753  16.544   2.062
  639    HH   TYR 101           HH       TYR 101  27.446  15.413   1.694
  640    H    PHE 102           H        PHE 102  34.082  14.795   0.575
  641    HA   PHE 102           HA       PHE 102  36.959  14.693   0.925
  642    HB2  PHE 102           HB1      PHE 102  35.068  15.948  -0.980
  643    HB3  PHE 102           HB2      PHE 102  36.558  16.843  -0.676
  644    HD1  PHE 102           HD1      PHE 102  38.672  16.077  -1.463
  645    HD2  PHE 102           HD2      PHE 102  35.186  13.688  -1.963
  646    HE1  PHE 102           HE1      PHE 102  39.894  14.629  -3.033
  647    HE2  PHE 102           HE2      PHE 102  36.402  12.235  -3.533
  648    HZ   PHE 102           HZ       PHE 102  38.759  12.704  -4.069
  649    H    GLN 103           H        GLN 103  38.233  16.508   1.558
  650    HA   GLN 103           HA       GLN 103  37.027  18.002   3.717
  651    HB2  GLN 103           HB1      GLN 103  39.248  18.672   4.299
  652    HB3  GLN 103           HB2      GLN 103  39.298  16.955   3.871
  653    HG2  GLN 103           HG1      GLN 103  41.097  17.582   2.676
  654    HG3  GLN 103           HG2      GLN 103  39.867  18.020   1.481
  655   HE21  GLN 103          HE21      GLN 103  40.027  19.974   0.666
  656   HE22  GLN 103          HE22      GLN 103  40.783  21.336   1.414
  657    H    SER 104           H        SER 104  37.279  20.325   3.945
  658    HA   SER 104           HA       SER 104  37.441  21.755   1.379
  659    HB2  SER 104           HB1      SER 104  35.296  21.971   3.500
  660    HB3  SER 104           HB2      SER 104  35.583  23.252   2.310
  661    HG   SER 104           HG       SER 104  34.493  20.722   1.966
  662    H    LEU 105           H        LEU 105  38.063  23.967   1.522
  663    HA   LEU 105           HA       LEU 105  39.914  24.461   3.683
  664    HB2  LEU 105           HB1      LEU 105  39.281  25.728   1.058
  665    HB3  LEU 105           HB2      LEU 105  40.111  26.696   2.289
  666    HG   LEU 105           HG       LEU 105  41.195  24.024   1.472
  667   HD11  LEU 105          HD11      LEU 105  42.515  25.058  -0.247
  668   HD12  LEU 105          HD12      LEU 105  41.817  26.638   0.108
  669   HD13  LEU 105          HD13      LEU 105  40.810  25.363  -0.578
  670   HD21  LEU 105          HD21      LEU 105  41.935  25.628   3.458
  671   HD22  LEU 105          HD22      LEU 105  42.848  26.390   2.155
  672   HD23  LEU 105          HD23      LEU 105  43.097  24.682   2.528
  673    H    GLU 106           H        GLU 106  39.742  25.954   5.284
  674    HA   GLU 106           HA       GLU 106  37.098  27.008   5.807
  675    HB2  GLU 106           HB1      GLU 106  39.647  27.243   7.422
  676    HB3  GLU 106           HB2      GLU 106  38.022  27.679   7.974
  677    HG2  GLU 106           HG1      GLU 106  38.129  25.626   8.907
  678    HG3  GLU 106           HG2      GLU 106  37.543  25.152   7.306
  679    HE2  GLU 106           HE       GLU 106  41.381  24.429   8.068
  680    H    HIS 107           H        HIS 107  36.968  29.297   6.712
  681    HA   HIS 107           HA       HIS 107  37.969  31.091   4.691
  682    HB2  HIS 107           HB1      HIS 107  36.593  32.780   5.763
  683    HB3  HIS 107           HB2      HIS 107  35.667  31.289   5.571
  684    HD1  HIS 107           HD1      HIS 107  34.646  33.196   7.633
  685    HD2  HIS 107           HD2      HIS 107  37.477  30.281   8.504
  686    HE1  HIS 107           HE1      HIS 107  34.482  32.818  10.114
  687    HE2  HIS 107           HE2      HIS 107  36.213  31.038  10.648
  688    H    HIS 108           H        HIS 108  38.514  33.424   5.802
  689    HA   HIS 108           HA       HIS 108  40.699  32.923   7.714
  690    HB2  HIS 108           HB1      HIS 108  40.989  33.705   5.052
  691    HB3  HIS 108           HB2      HIS 108  41.184  35.200   5.971
  692    HD1  HIS 108           HD1      HIS 108  42.616  33.899   8.461
  693    HD2  HIS 108           HD2      HIS 108  43.672  33.335   4.483
  694    HE1  HIS 108           HE1      HIS 108  45.037  33.221   8.498
  695    HE2  HIS 108           HE2      HIS 108  45.683  32.876   6.066
  696    H    HIS 109           H        HIS 109  37.933  33.853   8.121
  697    HA   HIS 109           HA       HIS 109  36.784  35.427   9.297
  698    HB2  HIS 109           HB1      HIS 109  39.490  36.345  10.283
  699    HB3  HIS 109           HB2      HIS 109  37.935  36.501  11.106
  700    HD1  HIS 109           HD1      HIS 109  36.803  33.773  11.176
  701    HD2  HIS 109           HD2      HIS 109  40.872  34.460  11.652
  702    HE1  HIS 109           HE1      HIS 109  37.689  31.752  12.383
  703    HE2  HIS 109           HE2      HIS 109  40.177  32.172  12.674
  704    H    HIS 110           H        HIS 110  37.025  37.978   9.949
  705    HA   HIS 110           HA       HIS 110  37.909  39.404   7.536
  706    HB2  HIS 110           HB1      HIS 110  35.200  39.438   8.834
  707    HB3  HIS 110           HB2      HIS 110  35.782  40.858   7.961
  708    HD1  HIS 110           HD1      HIS 110  33.394  38.802   7.152
  709    HD2  HIS 110           HD2      HIS 110  37.158  39.150   5.427
  710    HE1  HIS 110           HE1      HIS 110  33.157  37.874   4.826
  711    HE2  HIS 110           HE2      HIS 110  35.457  38.087   3.771
  712    H    HIS 111           H        HIS 111  37.533  41.918   8.038
  713    HA   HIS 111           HA       HIS 111  39.179  42.433  10.372
  714    HB2  HIS 111           HB1      HIS 111  39.485  43.460   8.023
  715    HB3  HIS 111           HB2      HIS 111  38.146  44.521   8.467
  716    HD1  HIS 111           HD1      HIS 111  41.026  43.464  10.697
  717    HD2  HIS 111           HD2      HIS 111  39.440  46.873   8.929
  718    HE1  HIS 111           HE1      HIS 111  42.357  45.386  11.626
  719    HE2  HIS 111           HE2      HIS 111  41.388  47.468  10.547
  720    H    HIS 112           H        HIS 112  36.135  43.747   9.054
  721    HA   HIS 112           HA       HIS 112  35.326  44.367  11.820
  722    HB2  HIS 112           HB1      HIS 112  35.762  46.241   9.958
  723    HB3  HIS 112           HB2      HIS 112  34.090  45.845   9.551
  724    HD1  HIS 112           HD1      HIS 112  35.477  48.448  11.115
  725    HD2  HIS 112           HD2      HIS 112  32.842  45.578  12.557
  726    HE1  HIS 112           HE1      HIS 112  34.343  49.508  13.094
  727    HE2  HIS 112           HE2      HIS 112  32.733  47.754  13.976
  Start of MODEL   12
    1    H1   MET  18           H        MET  18 -62.813  41.252  33.890
    2    HA   MET  18           HA       MET  18 -61.394  40.473  35.508
    3    HB2  MET  18           HB1      MET  18 -63.184  38.174  35.091
    4    HB3  MET  18           HB2      MET  18 -61.569  37.749  35.679
    5    HG2  MET  18           HG1      MET  18 -61.933  38.594  37.725
    6    HG3  MET  18           HG2      MET  18 -62.807  39.992  37.090
    7    HE1  MET  18           HE1      MET  18 -62.980  38.089  39.521
    8    HE2  MET  18           HE2      MET  18 -64.569  38.799  39.803
    9    HE3  MET  18           HE3      MET  18 -64.404  37.052  39.623
   10    H    LEU  19           H        LEU  19 -59.261  40.141  35.295
   11    HA   LEU  19           HA       LEU  19 -58.219  38.211  33.410
   12    HB2  LEU  19           HB1      LEU  19 -58.500  40.974  32.705
   13    HB3  LEU  19           HB2      LEU  19 -56.779  40.572  32.837
   14    HG   LEU  19           HG       LEU  19 -57.757  38.494  31.333
   15   HD11  LEU  19          HD11      LEU  19 -58.944  39.890  29.484
   16   HD12  LEU  19          HD12      LEU  19 -59.372  40.953  30.825
   17   HD13  LEU  19          HD13      LEU  19 -59.874  39.263  30.846
   18   HD21  LEU  19          HD21      LEU  19 -56.832  40.016  29.406
   19   HD22  LEU  19          HD22      LEU  19 -55.757  39.382  30.651
   20   HD23  LEU  19          HD23      LEU  19 -56.334  41.045  30.749
   21    H    VAL  20           H        VAL  20 -57.153  37.203  35.066
   22    HA   VAL  20           HA       VAL  20 -55.545  38.654  36.954
   23    HB   VAL  20           HB       VAL  20 -54.873  36.463  37.799
   24   HG11  VAL  20          HG11      VAL  20 -57.127  37.514  38.324
   25   HG12  VAL  20          HG12      VAL  20 -57.816  36.339  37.201
   26   HG13  VAL  20          HG13      VAL  20 -56.963  35.787  38.643
   27   HG21  VAL  20          HG21      VAL  20 -56.297  34.546  36.544
   28   HG22  VAL  20          HG22      VAL  20 -55.898  35.588  35.178
   29   HG23  VAL  20          HG23      VAL  20 -54.611  34.914  36.178
   30    H    LEU  21           H        LEU  21 -53.351  38.879  37.018
   31    HA   LEU  21           HA       LEU  21 -51.945  38.694  34.534
   32    HB2  LEU  21           HB1      LEU  21 -51.623  40.008  37.056
   33    HB3  LEU  21           HB2      LEU  21 -50.130  39.138  36.658
   34    HG   LEU  21           HG       LEU  21 -50.176  40.331  34.425
   35   HD11  LEU  21          HD11      LEU  21 -52.104  42.174  35.815
   36   HD12  LEU  21          HD12      LEU  21 -52.604  40.959  34.640
   37   HD13  LEU  21          HD13      LEU  21 -51.519  42.262  34.153
   38   HD21  LEU  21          HD21      LEU  21 -49.917  42.567  36.216
   39   HD22  LEU  21          HD22      LEU  21 -48.667  41.665  35.358
   40   HD23  LEU  21          HD23      LEU  21 -49.226  41.113  36.937
   41    H    ASP  22           H        ASP  22 -50.691  37.105  33.799
   42    HA   ASP  22           HA       ASP  22 -49.117  35.410  35.414
   43    HB2  ASP  22           HB1      ASP  22 -51.865  34.604  35.070
   44    HB3  ASP  22           HB2      ASP  22 -50.792  33.441  34.279
   45    HD2  ASP  22           HD       ASP  22 -49.437  32.404  37.315
   46    H    PHE  23           H        PHE  23 -47.477  35.696  33.993
   47    HA   PHE  23           HA       PHE  23 -47.688  34.298  31.451
   48    HB2  PHE  23           HB1      PHE  23 -47.585  37.207  31.709
   49    HB3  PHE  23           HB2      PHE  23 -46.271  36.569  30.719
   50    HD1  PHE  23           HD1      PHE  23 -46.742  35.286  28.673
   51    HD2  PHE  23           HD2      PHE  23 -49.839  37.162  30.910
   52    HE1  PHE  23           HE1      PHE  23 -48.256  35.078  26.744
   53    HE2  PHE  23           HE2      PHE  23 -51.359  36.955  28.987
   54    HZ   PHE  23           HZ       PHE  23 -50.569  35.912  26.901
   55    H    ASN  24           H        ASN  24 -45.418  36.543  33.042
   56    HA   ASN  24           HA       ASN  24 -43.219  36.347  33.593
   57    HB2  ASN  24           HB1      ASN  24 -43.593  33.356  33.668
   58    HB3  ASN  24           HB2      ASN  24 -42.517  34.357  34.651
   59   HD21  ASN  24          HD21      ASN  24 -45.632  33.001  34.355
   60   HD22  ASN  24          HD22      ASN  24 -46.295  33.626  35.823
   61    H    ASN  25           H        ASN  25 -41.200  34.690  33.018
   62    HA   ASN  25           HA       ASN  25 -41.227  33.711  30.337
   63    HB2  ASN  25           HB1      ASN  25 -41.141  36.300  30.168
   64    HB3  ASN  25           HB2      ASN  25 -39.470  36.122  30.717
   65   HD21  ASN  25          HD21      ASN  25 -41.600  35.917  28.084
   66   HD22  ASN  25          HD22      ASN  25 -40.467  35.356  26.905
   67    H    ILE  26           H        ILE  26 -39.415  32.494  29.859
   68    HA   ILE  26           HA       ILE  26 -37.503  32.183  32.076
   69    HB   ILE  26           HB       ILE  26 -38.287  30.167  29.967
   70   HG12  ILE  26          HG11      ILE  26 -38.855  30.161  32.940
   71   HG13  ILE  26          HG12      ILE  26 -40.022  30.676  31.711
   72   HG21  ILE  26          HG21      ILE  26 -36.245  29.355  30.447
   73   HG22  ILE  26          HG22      ILE  26 -36.121  30.271  31.948
   74   HG23  ILE  26          HG23      ILE  26 -37.032  28.762  31.910
   75   HD11  ILE  26          HD11      ILE  26 -39.060  28.126  30.953
   76   HD12  ILE  26          HD12      ILE  26 -39.511  28.059  32.657
   77   HD13  ILE  26          HD13      ILE  26 -40.686  28.590  31.453
   78    H    ARG  27           H        ARG  27 -35.319  32.138  31.681
   79    HA   ARG  27           HA       ARG  27 -34.501  32.987  28.984
   80    HB2  ARG  27           HB1      ARG  27 -33.624  33.723  31.721
   81    HB3  ARG  27           HB2      ARG  27 -32.355  33.598  30.494
   82    HG2  ARG  27           HG1      ARG  27 -33.172  35.363  29.253
   83    HG3  ARG  27           HG2      ARG  27 -34.809  35.187  29.905
   84    HD2  ARG  27           HD1      ARG  27 -34.294  36.917  31.236
   85    HD3  ARG  27           HD2      ARG  27 -33.348  35.737  32.155
   86    HE   ARG  27           HE       ARG  27 -31.420  36.700  31.364
   87   HH11  ARG  27          HH11      ARG  27 -34.137  37.853  29.518
   88   HH12  ARG  27          HH12      ARG  27 -33.225  39.070  28.690
   89   HH21  ARG  27          HH21      ARG  27 -30.208  38.300  30.281
   90   HH22  ARG  27          HH22      ARG  27 -30.990  39.324  29.124
   91    H    SER  28           H        SER  28 -33.140  31.761  27.836
   92    HA   SER  28           HA       SER  28 -31.177  30.054  28.938
   93    HB2  SER  28           HB1      SER  28 -33.790  28.949  28.893
   94    HB3  SER  28           HB2      SER  28 -32.872  28.161  27.596
   95    HG   SER  28           HG       SER  28 -32.772  27.404  29.981
   96    H    SER  29           H        SER  29 -29.658  29.708  27.439
   97    HA   SER  29           HA       SER  29 -30.230  29.271  24.681
   98    HB2  SER  29           HB1      SER  29 -29.239  31.293  23.752
   99    HB3  SER  29           HB2      SER  29 -30.596  31.725  24.806
  100    HG   SER  29           HG       SER  29 -28.235  32.710  24.969
  101    H    ALA  30           H        ALA  30 -28.601  28.164  23.781
  102    HA   ALA  30           HA       ALA  30 -25.860  28.585  24.334
  103    HB1  ALA  30           HB1      ALA  30 -25.645  27.455  26.242
  104    HB2  ALA  30           HB2      ALA  30 -27.273  26.787  26.119
  105    HB3  ALA  30           HB3      ALA  30 -25.930  25.994  25.296
  106    H    ASP  31           H        ASP  31 -24.563  27.539  22.874
  107    HA   ASP  31           HA       ASP  31 -25.216  25.186  21.488
  108    HB2  ASP  31           HB1      ASP  31 -26.937  26.284  20.323
  109    HB3  ASP  31           HB2      ASP  31 -25.991  27.768  20.156
  110    HD2  ASP  31           HD       ASP  31 -24.910  24.815  17.726
  111    H    LEU  32           H        LEU  32 -23.489  24.439  20.335
  112    HA   LEU  32           HA       LEU  32 -21.471  26.058  19.207
  113    HB2  LEU  32           HB1      LEU  32 -21.261  25.956  21.936
  114    HB3  LEU  32           HB2      LEU  32 -20.212  24.620  21.427
  115    HG   LEU  32           HG       LEU  32 -18.997  26.257  19.956
  116   HD11  LEU  32          HD11      LEU  32 -20.637  27.980  19.732
  117   HD12  LEU  32          HD12      LEU  32 -19.252  28.653  20.591
  118   HD13  LEU  32          HD13      LEU  32 -20.710  28.211  21.479
  119   HD21  LEU  32          HD21      LEU  32 -18.785  25.750  22.703
  120   HD22  LEU  32          HD22      LEU  32 -18.536  27.486  22.512
  121   HD23  LEU  32          HD23      LEU  32 -17.529  26.346  21.618
  122    H    HIS  33           H        HIS  33 -20.870  24.847  17.549
  123    HA   HIS  33           HA       HIS  33 -19.878  22.176  17.934
  124    HB2  HIS  33           HB1      HIS  33 -22.615  22.498  17.281
  125    HB3  HIS  33           HB2      HIS  33 -21.806  21.941  15.815
  126    HD1  HIS  33           HD1      HIS  33 -23.298  20.674  18.823
  127    HD2  HIS  33           HD2      HIS  33 -20.168  19.500  16.356
  128    HE1  HIS  33           HE1      HIS  33 -22.900  18.248  19.351
  129    HE2  HIS  33           HE2      HIS  33 -20.988  17.529  17.843
  130    H    GLY  34           H        GLY  34 -19.430  21.193  15.613
  131    HA2  GLY  34           HA2      GLY  34 -18.879  21.742  13.314
  132    HA3  GLY  34           HA3      GLY  34 -18.515  23.375  13.851
  133    HA1  GLY  34           HA1      GLY  34 -18.618  21.257  14.003
  134    H    ALA  35           H        ALA  35 -17.130  20.628  12.794
  135    HA   ALA  35           HA       ALA  35 -14.509  21.439  13.476
  136    HB1  ALA  35           HB1      ALA  35 -15.059  18.807  14.738
  137    HB2  ALA  35           HB2      ALA  35 -13.856  20.030  15.147
  138    HB3  ALA  35           HB3      ALA  35 -15.541  20.263  15.607
  139    H    ARG  36           H        ARG  36 -13.043  19.201  13.176
  140    HA   ARG  36           HA       ARG  36 -12.184  17.827  11.577
  141    HB2  ARG  36           HB1      ARG  36 -14.685  16.865  12.234
  142    HB3  ARG  36           HB2      ARG  36 -14.745  16.952  10.468
  143    HG2  ARG  36           HG1      ARG  36 -12.361  15.772  10.732
  144    HG3  ARG  36           HG2      ARG  36 -13.131  15.208  12.224
  145    HD2  ARG  36           HD1      ARG  36 -15.109  14.500  10.799
  146    HD3  ARG  36           HD2      ARG  36 -14.080  14.813   9.396
  147    HE   ARG  36           HE       ARG  36 -12.569  13.149  10.903
  148   HH11  ARG  36          HH11      ARG  36 -15.836  13.005   9.710
  149   HH12  ARG  36          HH12      ARG  36 -15.858  11.276   9.599
  150   HH21  ARG  36          HH21      ARG  36 -12.585  10.872  10.761
  151   HH22  ARG  36          HH22      ARG  36 -14.008  10.065  10.198
  152    H    LYS  37           H        LYS  37 -12.709  17.118   9.087
  153    HA   LYS  37           HA       LYS  37 -13.596  19.437   7.562
  154    HB2  LYS  37           HB1      LYS  37 -10.919  19.160   8.151
  155    HB3  LYS  37           HB2      LYS  37 -11.048  18.390   6.562
  156    HG2  LYS  37           HG1      LYS  37 -10.605  20.548   5.945
  157    HG3  LYS  37           HG2      LYS  37 -12.378  20.560   5.949
  158    HD2  LYS  37           HD1      LYS  37 -11.872  21.204   8.538
  159    HD3  LYS  37           HD2      LYS  37 -10.473  21.931   7.729
  160    HE2  LYS  37           HE1      LYS  37 -12.490  22.702   6.065
  161    HE3  LYS  37           HE2      LYS  37 -13.312  22.684   7.631
  162    HZ1  LYS  37           HZ1      LYS  37 -11.953  24.769   6.754
  163    HZ2  LYS  37           HZ2      LYS  37 -10.698  23.965   7.554
  164    HZ3  LYS  37           HZ3      LYS  37 -12.095  24.407   8.400
  165    H    GLY  38           H        GLY  38 -13.536  18.950   5.160
  166    HA2  GLY  38           HA2      GLY  38 -14.710  16.329   4.765
  167    HA3  GLY  38           HA3      GLY  38 -14.640  17.632   3.588
  168    HA1  GLY  38           HA1      GLY  38 -13.898  16.350   5.113
  169    H    SER  39           H        SER  39 -12.922  14.927   4.987
  170    HA   SER  39           HA       SER  39 -10.810  15.178   2.971
  171    HB2  SER  39           HB1      SER  39 -10.798  14.390   5.674
  172    HB3  SER  39           HB2      SER  39 -10.492  12.914   4.740
  173    HG   SER  39           HG       SER  39  -8.963  14.518   3.562
  174    H    GLN  40           H        GLN  40 -10.813  13.967   1.198
  175    HA   GLN  40           HA       GLN  40 -12.917  12.253   0.520
  176    HB2  GLN  40           HB1      GLN  40 -11.189  13.490  -0.978
  177    HB3  GLN  40           HB2      GLN  40 -10.208  12.033  -0.755
  178    HG2  GLN  40           HG1      GLN  40 -11.607  10.712  -1.990
  179    HG3  GLN  40           HG2      GLN  40 -13.025  11.707  -1.635
  180   HE21  GLN  40          HE21      GLN  40 -10.976  10.818  -4.010
  181   HE22  GLN  40          HE22      GLN  40 -11.140  12.171  -5.072
  182    H    CYS  41           H        CYS  41  -9.637  11.541   1.660
  183    HA   CYS  41           HA       CYS  41 -10.555   8.832   2.346
  184    HB2  CYS  41           HB1      CYS  41  -8.477   7.861   1.630
  185    HB3  CYS  41           HB2      CYS  41  -9.146   8.789   0.286
  186    H    LEU  42           H        LEU  42  -9.744   7.970   4.241
  187    HA   LEU  42           HA       LEU  42  -8.806   9.882   6.170
  188    HB2  LEU  42           HB1      LEU  42 -10.400   7.773   6.404
  189    HB3  LEU  42           HB2      LEU  42  -8.860   6.967   6.754
  190    HG   LEU  42           HG       LEU  42  -8.698   9.081   8.434
  191   HD11  LEU  42          HD11      LEU  42 -10.831  10.005   8.020
  192   HD12  LEU  42          HD12      LEU  42 -10.954   9.160   9.562
  193   HD13  LEU  42          HD13      LEU  42 -11.613   8.426   8.100
  194   HD21  LEU  42          HD21      LEU  42  -8.920   7.531  10.125
  195   HD22  LEU  42          HD22      LEU  42  -8.567   6.494   8.742
  196   HD23  LEU  42          HD23      LEU  42 -10.227   6.670   9.312
  197    H    SER  43           H        SER  43  -7.424   7.274   4.295
  198    HA   SER  43           HA       SER  43  -4.773   8.197   4.740
  199    HB2  SER  43           HB1      SER  43  -5.449   6.845   6.879
  200    HB3  SER  43           HB2      SER  43  -5.194   5.435   5.836
  201    HG   SER  43           HG       SER  43  -3.133   5.700   6.070
  202    H    ASP  44           H        ASP  44  -3.256   6.080   4.076
  203    HA   ASP  44           HA       ASP  44  -3.804   5.746   1.317
  204    HB2  ASP  44           HB1      ASP  44  -1.765   4.584   1.181
  205    HB3  ASP  44           HB2      ASP  44  -1.525   5.739   2.499
  206    HD2  ASP  44           HD       ASP  44  -1.562   1.883   3.357
  207    H    THR  45           H        THR  45  -4.496   3.842   4.143
  208    HA   THR  45           HA       THR  45  -4.897   1.328   3.017
  209    HB   THR  45           HB       THR  45  -6.795   1.279   4.907
  210    HG1  THR  45           HG1      THR  45  -6.802   3.041   6.065
  211   HG21  THR  45          HG21      THR  45  -3.969   1.467   5.864
  212   HG22  THR  45          HG22      THR  45  -4.419   0.199   4.724
  213   HG23  THR  45          HG23      THR  45  -5.222   0.304   6.291
  214    H    ASP  46           H        ASP  46  -6.871   4.194   2.900
  215    HA   ASP  46           HA       ASP  46  -9.297   2.955   2.111
  216    HB2  ASP  46           HB1      ASP  46  -8.677   5.442   2.914
  217    HB3  ASP  46           HB2      ASP  46  -8.700   5.708   1.165
  218    HD2  ASP  46           HD       ASP  46 -12.180   4.393   1.441
  219    H    CYS  47           H        CYS  47  -6.404   3.836   0.422
  220    HA   CYS  47           HA       CYS  47  -7.592   3.734  -2.201
  221    HB2  CYS  47           HB1      CYS  47  -5.003   4.421  -1.043
  222    HB3  CYS  47           HB2      CYS  47  -4.843   3.469  -2.520
  223    H    ASN  48           H        ASN  48  -4.827   1.869  -0.967
  224    HA   ASN  48           HA       ASN  48  -5.988  -0.672  -1.267
  225    HB2  ASN  48           HB1      ASN  48  -5.186   0.550  -3.726
  226    HB3  ASN  48           HB2      ASN  48  -4.092  -0.798  -3.388
  227   HD21  ASN  48          HD21      ASN  48  -6.968   0.042  -4.768
  228   HD22  ASN  48          HD22      ASN  48  -7.719  -1.513  -4.823
  229    H    THR  49           H        THR  49  -4.148  -2.403  -1.512
  230    HA   THR  49           HA       THR  49  -2.296  -1.892   0.596
  231    HB   THR  49           HB       THR  49  -1.839  -4.244  -1.149
  232    HG1  THR  49           HG1      THR  49  -4.181  -4.028   0.465
  233   HG21  THR  49          HG21      THR  49  -2.094  -3.753   1.815
  234   HG22  THR  49          HG22      THR  49  -0.635  -4.137   0.901
  235   HG23  THR  49          HG23      THR  49  -1.889  -5.358   1.114
  236    H    ARG  50           H        ARG  50  -2.169  -1.694  -2.859
  237    HA   ARG  50           HA       ARG  50   0.719  -1.127  -2.698
  238    HB2  ARG  50           HB1      ARG  50  -0.730  -2.126  -5.154
  239    HB3  ARG  50           HB2      ARG  50   1.018  -2.005  -4.898
  240    HG2  ARG  50           HG1      ARG  50   0.827  -4.218  -4.513
  241    HG3  ARG  50           HG2      ARG  50   0.409  -3.657  -2.886
  242    HD2  ARG  50           HD1      ARG  50  -1.902  -3.951  -3.242
  243    HD3  ARG  50           HD2      ARG  50  -1.689  -4.050  -4.995
  244    HE   ARG  50           HE       ARG  50  -0.275  -6.173  -3.955
  245   HH11  ARG  50          HH11      ARG  50  -3.575  -5.063  -3.912
  246   HH12  ARG  50          HH12      ARG  50  -4.246  -6.654  -3.784
  247   HH21  ARG  50          HH21      ARG  50  -1.148  -8.274  -3.786
  248   HH22  ARG  50          HH22      ARG  50  -2.864  -8.481  -3.711
  249    H    LYS  51           H        LYS  51  -1.498   0.722  -2.326
  250    HA   LYS  51           HA       LYS  51  -0.700   2.686  -4.319
  251    HB2  LYS  51           HB1      LYS  51  -3.455   1.564  -4.048
  252    HB3  LYS  51           HB2      LYS  51  -3.285   3.293  -4.385
  253    HG2  LYS  51           HG1      LYS  51  -2.835   2.923  -6.527
  254    HG3  LYS  51           HG2      LYS  51  -1.581   1.740  -6.115
  255    HD2  LYS  51           HD1      LYS  51  -2.969  -0.039  -6.362
  256    HD3  LYS  51           HD2      LYS  51  -4.378   0.852  -5.760
  257    HE2  LYS  51           HE1      LYS  51  -4.211   2.176  -7.985
  258    HE3  LYS  51           HE2      LYS  51  -3.203   0.822  -8.517
  259    HZ1  LYS  51           HZ1      LYS  51  -4.953  -0.634  -8.446
  260    HZ2  LYS  51           HZ2      LYS  51  -5.753   0.782  -8.912
  261    HZ3  LYS  51           HZ3      LYS  51  -5.820   0.263  -7.303
  262    H    PHE  52           H        PHE  52  -0.898   4.814  -3.627
  263    HA   PHE  52           HA       PHE  52  -1.629   5.131  -0.791
  264    HB2  PHE  52           HB1      PHE  52  -0.047   7.118  -0.864
  265    HB3  PHE  52           HB2      PHE  52   0.701   5.523  -0.970
  266    HD1  PHE  52           HD1      PHE  52   1.763   4.753  -2.990
  267    HD2  PHE  52           HD2      PHE  52  -0.090   8.581  -2.813
  268    HE1  PHE  52           HE1      PHE  52   2.895   5.395  -5.078
  269    HE2  PHE  52           HE2      PHE  52   1.039   9.228  -4.901
  270    HZ   PHE  52           HZ       PHE  52   2.533   7.634  -6.037
  271    H    CYS  53           H        CYS  53  -2.253   7.429  -0.226
  272    HA   CYS  53           HA       CYS  53  -4.223   8.339  -2.186
  273    HB2  CYS  53           HB1      CYS  53  -4.373   7.932   0.542
  274    HB3  CYS  53           HB2      CYS  53  -4.200   9.683   0.416
  275    H    LEU  54           H        LEU  54  -3.245   9.678  -3.609
  276    HA   LEU  54           HA       LEU  54  -1.352  11.679  -2.698
  277    HB2  LEU  54           HB1      LEU  54  -1.393  10.261  -4.935
  278    HB3  LEU  54           HB2      LEU  54  -2.397  11.613  -5.483
  279    HG   LEU  54           HG       LEU  54  -0.059  11.897  -6.137
  280   HD11  LEU  54          HD11      LEU  54  -1.355  13.890  -5.798
  281   HD12  LEU  54          HD12      LEU  54   0.275  14.159  -5.181
  282   HD13  LEU  54          HD13      LEU  54  -1.050  13.845  -4.061
  283   HD21  LEU  54          HD21      LEU  54   0.551  10.787  -3.722
  284   HD22  LEU  54          HD22      LEU  54   0.894  12.493  -3.433
  285   HD23  LEU  54          HD23      LEU  54   1.690  11.645  -4.759
  286    H    GLN  55           H        GLN  55  -2.142  13.457  -1.782
  287    HA   GLN  55           HA       GLN  55  -4.535  14.696  -2.976
  288    HB2  GLN  55           HB1      GLN  55  -4.782  15.788  -0.676
  289    HB3  GLN  55           HB2      GLN  55  -5.165  14.065  -0.801
  290    HG2  GLN  55           HG1      GLN  55  -2.980  13.486   0.117
  291    HG3  GLN  55           HG2      GLN  55  -2.577  15.205   0.226
  292   HE21  GLN  55          HE21      GLN  55  -2.259  14.186   2.499
  293   HE22  GLN  55          HE22      GLN  55  -3.590  14.395   3.581
  294    HA   PRO  56           HA       PRO  56  -1.129  17.646  -3.799
  295    HB2  PRO  56           HB1      PRO  56  -2.228  18.593  -6.121
  296    HB3  PRO  56           HB2      PRO  56  -1.252  17.128  -6.035
  297    HG2  PRO  56           HG1      PRO  56  -4.235  17.428  -6.037
  298    HG3  PRO  56           HG2      PRO  56  -3.205  16.274  -6.963
  299    HD2  PRO  56           HD1      PRO  56  -4.554  15.555  -4.718
  300    HD3  PRO  56           HD2      PRO  56  -2.978  14.867  -5.152
  301    H    ARG  57           H        ARG  57  -1.075  19.886  -3.588
  302    HA   ARG  57           HA       ARG  57  -3.390  21.047  -2.305
  303    HB2  ARG  57           HB1      ARG  57  -0.544  21.511  -2.342
  304    HB3  ARG  57           HB2      ARG  57  -1.415  23.021  -2.644
  305    HG2  ARG  57           HG1      ARG  57  -1.640  23.216  -0.444
  306    HG3  ARG  57           HG2      ARG  57  -2.794  21.874  -0.539
  307    HD2  ARG  57           HD1      ARG  57  -1.154  20.267   0.016
  308    HD3  ARG  57           HD2      ARG  57   0.164  21.406  -0.295
  309    HE   ARG  57           HE       ARG  57  -1.293  21.098   2.138
  310   HH11  ARG  57          HH11      ARG  57   0.396  23.408   0.154
  311   HH12  ARG  57          HH12      ARG  57   0.797  24.449   1.481
  312   HH21  ARG  57          HH21      ARG  57  -0.771  22.460   3.892
  313   HH22  ARG  57          HH22      ARG  57   0.133  23.908   3.606
  314    H    ASP  58           H        ASP  58  -1.784  21.212  -5.383
  315    HA   ASP  58           HA       ASP  58  -3.257  23.579  -6.207
  316    HB2  ASP  58           HB1      ASP  58  -0.834  22.331  -6.997
  317    HB3  ASP  58           HB2      ASP  58  -1.922  22.285  -8.390
  318    HD2  ASP  58           HD       ASP  58  -0.344  25.711  -7.361
  319    H    GLU  59           H        GLU  59  -3.503  20.147  -6.401
  320    HA   GLU  59           HA       GLU  59  -5.806  20.432  -8.220
  321    HB2  GLU  59           HB1      GLU  59  -3.464  18.825  -8.512
  322    HB3  GLU  59           HB2      GLU  59  -4.851  17.750  -8.264
  323    HG2  GLU  59           HG1      GLU  59  -5.919  19.416 -10.074
  324    HG3  GLU  59           HG2      GLU  59  -4.211  19.530 -10.528
  325    HE2  GLU  59           HE       GLU  59  -4.362  16.511 -12.118
  326    H    LYS  60           H        LYS  60  -7.096  18.165  -8.029
  327    HA   LYS  60           HA       LYS  60  -8.019  18.131  -5.277
  328    HB2  LYS  60           HB1      LYS  60  -9.079  17.270  -7.914
  329    HB3  LYS  60           HB2      LYS  60  -9.630  16.357  -6.499
  330    HG2  LYS  60           HG1      LYS  60 -10.716  18.171  -5.565
  331    HG3  LYS  60           HG2      LYS  60  -9.748  19.341  -6.481
  332    HD2  LYS  60           HD1      LYS  60 -10.893  18.807  -8.526
  333    HD3  LYS  60           HD2      LYS  60 -11.741  17.460  -7.742
  334    HE2  LYS  60           HE1      LYS  60 -12.508  19.438  -6.101
  335    HE3  LYS  60           HE2      LYS  60 -12.246  20.375  -7.580
  336    HZ1  LYS  60           HZ1      LYS  60 -14.527  19.149  -7.025
  337    HZ2  LYS  60           HZ2      LYS  60 -13.760  17.911  -7.884
  338    HZ3  LYS  60           HZ3      LYS  60 -13.992  19.422  -8.607
  339    HA   PRO  61           HA       PRO  61  -6.210  14.339  -4.010
  340    HB2  PRO  61           HB1      PRO  61  -8.225  13.170  -2.571
  341    HB3  PRO  61           HB2      PRO  61  -7.325  14.580  -2.015
  342    HG2  PRO  61           HG1      PRO  61  -9.991  14.445  -3.382
  343    HG3  PRO  61           HG2      PRO  61  -9.493  15.415  -1.947
  344    HD2  PRO  61           HD1      PRO  61  -9.700  16.480  -4.436
  345    HD3  PRO  61           HD2      PRO  61  -8.491  17.024  -3.259
  346    H    PHE  62           H        PHE  62  -5.960  12.222  -4.617
  347    HA   PHE  62           HA       PHE  62  -8.057  10.675  -5.783
  348    HB2  PHE  62           HB1      PHE  62  -7.311  10.546  -8.040
  349    HB3  PHE  62           HB2      PHE  62  -7.427  12.262  -7.645
  350    HD1  PHE  62           HD1      PHE  62  -5.371   9.776  -9.035
  351    HD2  PHE  62           HD2      PHE  62  -5.228  13.382  -6.777
  352    HE1  PHE  62           HE1      PHE  62  -3.032  10.110  -9.722
  353    HE2  PHE  62           HE2      PHE  62  -2.889  13.721  -7.460
  354    HZ   PHE  62           HZ       PHE  62  -1.788  12.085  -8.936
  355    H    CYS  63           H        CYS  63  -7.182   8.568  -6.668
  356    HA   CYS  63           HA       CYS  63  -5.148   7.605  -4.835
  357    HB2  CYS  63           HB1      CYS  63  -7.414   6.465  -5.499
  358    HB3  CYS  63           HB2      CYS  63  -6.493   5.885  -6.890
  359    H    ALA  64           H        ALA  64  -3.121   7.020  -5.356
  360    HA   ALA  64           HA       ALA  64  -2.350   7.185  -8.198
  361    HB1  ALA  64           HB1      ALA  64  -0.013   7.612  -6.908
  362    HB2  ALA  64           HB2      ALA  64  -1.097   8.897  -7.447
  363    HB3  ALA  64           HB3      ALA  64  -1.151   8.342  -5.774
  364    H    THR  65           H        THR  65  -0.531   5.839  -8.845
  365    HA   THR  65           HA       THR  65  -0.648   3.236  -7.525
  366    HB   THR  65           HB       THR  65   0.959   3.493  -9.984
  367    HG1  THR  65           HG1      THR  65  -1.874   3.723 -10.146
  368   HG21  THR  65          HG21      THR  65  -0.593   1.528  -8.572
  369   HG22  THR  65          HG22      THR  65   0.563   1.301  -9.886
  370   HG23  THR  65          HG23      THR  65  -1.131   1.630 -10.247
  371    H    CYS  66           H        CYS  66   1.481   1.954  -7.633
  372    HA   CYS  66           HA       CYS  66   3.314   3.029  -5.873
  373    HB2  CYS  66           HB1      CYS  66   2.956   0.593  -7.136
  374    HB3  CYS  66           HB2      CYS  66   4.527   1.127  -7.733
  375    H    ARG  67           H        ARG  67   5.507   3.724  -6.137
  376    HA   ARG  67           HA       ARG  67   5.865   5.323  -8.563
  377    HB2  ARG  67           HB1      ARG  67   7.099   5.444  -5.812
  378    HB3  ARG  67           HB2      ARG  67   7.725   6.385  -7.175
  379    HG2  ARG  67           HG1      ARG  67   4.862   6.549  -6.251
  380    HG3  ARG  67           HG2      ARG  67   6.150   7.596  -5.634
  381    HD2  ARG  67           HD1      ARG  67   6.596   8.428  -7.886
  382    HD3  ARG  67           HD2      ARG  67   5.364   7.336  -8.535
  383    HE   ARG  67           HE       ARG  67   4.304   9.068  -6.530
  384   HH11  ARG  67          HH11      ARG  67   5.224   8.887  -9.883
  385   HH12  ARG  67          HH12      ARG  67   4.138  10.140 -10.384
  386   HH21  ARG  67          HH21      ARG  67   2.869  10.718  -7.178
  387   HH22  ARG  67          HH22      ARG  67   2.799  11.181  -8.843
  388    H    GLY  68           H        GLY  68   8.412   5.671  -8.943
  389    HA2  GLY  68           HA2      GLY  68   9.525   2.950  -9.246
  390    HA3  GLY  68           HA3      GLY  68   9.746   4.233 -10.426
  391    HA1  GLY  68           HA1      GLY  68   9.500   3.398  -8.487
  392    H    LEU  69           H        LEU  69  11.862   2.770  -9.292
  393    HA   LEU  69           HA       LEU  69  13.091   3.992  -7.095
  394    HB2  LEU  69           HB1      LEU  69  14.304   2.585  -9.479
  395    HB3  LEU  69           HB2      LEU  69  15.197   3.038  -8.016
  396    HG   LEU  69           HG       LEU  69  12.968   1.017  -8.230
  397   HD11  LEU  69          HD11      LEU  69  15.630   0.375  -7.122
  398   HD12  LEU  69          HD12      LEU  69  15.538   0.648  -8.863
  399   HD13  LEU  69          HD13      LEU  69  14.543  -0.600  -8.112
  400   HD21  LEU  69          HD21      LEU  69  14.340   2.215  -5.843
  401   HD22  LEU  69          HD22      LEU  69  13.607   0.611  -5.790
  402   HD23  LEU  69          HD23      LEU  69  12.613   2.025  -6.145
  403    H    ARG  70           H        ARG  70  12.817   4.984 -10.400
  404    HA   ARG  70           HA       ARG  70  14.859   7.052 -10.056
  405    HB2  ARG  70           HB1      ARG  70  13.256   6.261 -12.501
  406    HB3  ARG  70           HB2      ARG  70  14.555   7.463 -12.464
  407    HG2  ARG  70           HG1      ARG  70  15.423   4.919 -11.373
  408    HG3  ARG  70           HG2      ARG  70  14.813   4.768 -13.029
  409    HD2  ARG  70           HD1      ARG  70  17.095   5.235 -13.304
  410    HD3  ARG  70           HD2      ARG  70  16.287   6.785 -13.570
  411    HE   ARG  70           HE       ARG  70  16.922   6.711 -10.885
  412   HH11  ARG  70          HH11      ARG  70  18.633   6.589 -13.915
  413   HH12  ARG  70          HH12      ARG  70  20.066   7.330 -13.285
  414   HH21  ARG  70          HH21      ARG  70  18.804   7.687 -10.044
  415   HH22  ARG  70          HH22      ARG  70  20.163   7.953 -11.083
  416    H    ARG  71           H        ARG  71  11.917   6.849  -9.003
  417    HA   ARG  71           HA       ARG  71  10.978   9.443 -10.012
  418    HB2  ARG  71           HB1      ARG  71   9.545   7.228  -8.529
  419    HB3  ARG  71           HB2      ARG  71   8.816   8.798  -8.905
  420    HG2  ARG  71           HG1      ARG  71   9.886   6.878 -10.975
  421    HG3  ARG  71           HG2      ARG  71   8.187   7.003 -10.488
  422    HD2  ARG  71           HD1      ARG  71   7.868   8.695 -11.901
  423    HD3  ARG  71           HD2      ARG  71   9.144   9.616 -11.091
  424    HE   ARG  71           HE       ARG  71  10.151   7.659 -12.937
  425   HH11  ARG  71          HH11      ARG  71   8.936  10.903 -12.591
  426   HH12  ARG  71          HH12      ARG  71   9.734  11.493 -14.011
  427   HH21  ARG  71          HH21      ARG  71  11.206   8.424 -14.809
  428   HH22  ARG  71          HH22      ARG  71  11.024  10.081 -15.273
  429    H    ARG  72           H        ARG  72  10.437  11.114  -8.603
  430    HA   ARG  72           HA       ARG  72  11.974  11.197  -6.181
  431    HB2  ARG  72           HB1      ARG  72  10.049  13.187  -7.405
  432    HB3  ARG  72           HB2      ARG  72  11.056  13.504  -5.985
  433    HG2  ARG  72           HG1      ARG  72  12.855  12.590  -7.898
  434    HG3  ARG  72           HG2      ARG  72  11.734  13.635  -8.788
  435    HD2  ARG  72           HD1      ARG  72  12.753  14.620  -6.167
  436    HD3  ARG  72           HD2      ARG  72  13.875  14.592  -7.534
  437    HE   ARG  72           HE       ARG  72  11.487  15.797  -8.368
  438   HH11  ARG  72          HH11      ARG  72  14.172  16.395  -6.235
  439   HH12  ARG  72          HH12      ARG  72  14.067  18.118  -6.375
  440   HH21  ARG  72          HH21      ARG  72  11.338  18.064  -8.560
  441   HH22  ARG  72          HH22      ARG  72  12.454  19.067  -7.696
  442    H    CYS  73           H        CYS  73  11.119  11.723  -4.079
  443    HA   CYS  73           HA       CYS  73   8.293  11.182  -3.626
  444    HB2  CYS  73           HB1      CYS  73   8.682   9.448  -1.988
  445    HB3  CYS  73           HB2      CYS  73   9.406   8.968  -3.523
  446    H    GLN  74           H        GLN  74   7.764  11.450  -1.235
  447    HA   GLN  74           HA       GLN  74   9.511  13.487  -0.023
  448    HB2  GLN  74           HB1      GLN  74   6.573  13.567  -0.581
  449    HB3  GLN  74           HB2      GLN  74   7.190  14.381   0.866
  450    HG2  GLN  74           HG1      GLN  74   8.918  15.278  -1.047
  451    HG3  GLN  74           HG2      GLN  74   7.403  15.133  -1.950
  452   HE21  GLN  74          HE21      GLN  74   9.108  16.830   0.512
  453   HE22  GLN  74          HE22      GLN  74   7.928  18.062   0.785
  454    H    ARG  75           H        ARG  75   7.068  10.995   0.474
  455    HA   ARG  75           HA       ARG  75   7.909  10.821   3.293
  456    HB2  ARG  75           HB1      ARG  75   5.343  11.136   2.230
  457    HB3  ARG  75           HB2      ARG  75   5.436   9.431   2.695
  458    HG2  ARG  75           HG1      ARG  75   6.128  10.085   4.962
  459    HG3  ARG  75           HG2      ARG  75   5.976  11.786   4.491
  460    HD2  ARG  75           HD1      ARG  75   3.605  10.126   3.926
  461    HD3  ARG  75           HD2      ARG  75   3.999  10.321   5.639
  462    HE   ARG  75           HE       ARG  75   4.075  12.826   4.327
  463   HH11  ARG  75          HH11      ARG  75   1.855  10.411   5.495
  464   HH12  ARG  75          HH12      ARG  75   0.564  11.537   5.755
  465   HH21  ARG  75          HH21      ARG  75   2.382  14.317   4.666
  466   HH22  ARG  75          HH22      ARG  75   0.865  13.758   5.282
  467    H    ASP  76           H        ASP  76   8.427   8.831   4.152
  468    HA   ASP  76           HA       ASP  76   9.558   6.924   2.430
  469    HB2  ASP  76           HB1      ASP  76  10.332   7.214   4.725
  470    HB3  ASP  76           HB2      ASP  76   8.767   6.665   5.338
  471    HD2  ASP  76           HD       ASP  76  10.401   3.616   5.514
  472    H    ALA  77           H        ALA  77   6.362   7.240   3.754
  473    HA   ALA  77           HA       ALA  77   5.574   4.533   3.162
  474    HB1  ALA  77           HB1      ALA  77   4.135   5.120   4.762
  475    HB2  ALA  77           HB2      ALA  77   4.405   6.842   4.489
  476    HB3  ALA  77           HB3      ALA  77   3.247   5.962   3.493
  477    H    MET  78           H        MET  78   5.188   7.713   1.678
  478    HA   MET  78           HA       MET  78   3.335   7.129  -0.290
  479    HB2  MET  78           HB1      MET  78   5.523   9.104   0.034
  480    HB3  MET  78           HB2      MET  78   4.931   8.855  -1.615
  481    HG2  MET  78           HG1      MET  78   2.767   9.155   0.315
  482    HG3  MET  78           HG2      MET  78   3.851  10.548   0.262
  483    HE1  MET  78           HE1      MET  78   3.650  11.895  -3.246
  484    HE2  MET  78           HE2      MET  78   4.674  11.584  -1.843
  485    HE3  MET  78           HE3      MET  78   4.628  10.429  -3.176
  486    H    CYS  79           H        CYS  79   6.792   6.472  -0.216
  487    HA   CYS  79           HA       CYS  79   7.089   5.692  -2.905
  488    HB2  CYS  79           HB1      CYS  79   8.667   5.631  -0.466
  489    HB3  CYS  79           HB2      CYS  79   8.918   4.175  -1.431
  490    H    CYS  80           H        CYS  80   8.023   3.259  -3.192
  491    HA   CYS  80           HA       CYS  80   5.694   1.603  -2.985
  492    HB2  CYS  80           HB1      CYS  80   8.423   1.335  -4.181
  493    HB3  CYS  80           HB2      CYS  80   7.474  -0.128  -3.911
  494    HA   PRO  81           HA       PRO  81   6.512  -0.681   0.669
  495    HB2  PRO  81           HB1      PRO  81   5.747  -3.215  -0.034
  496    HB3  PRO  81           HB2      PRO  81   4.611  -1.892   0.224
  497    HG2  PRO  81           HG1      PRO  81   5.764  -2.935  -2.341
  498    HG3  PRO  81           HG2      PRO  81   4.058  -2.501  -1.951
  499    HD2  PRO  81           HD1      PRO  81   5.699  -0.862  -3.362
  500    HD3  PRO  81           HD2      PRO  81   4.457  -0.252  -2.258
  501    H    GLY  82           H        GLY  82   8.504  -1.076   1.403
  502    HA2  GLY  82           HA2      GLY  82  10.290  -2.608   1.768
  503    HA3  GLY  82           HA3      GLY  82  10.056  -3.222   0.138
  504    HA1  GLY  82           HA1      GLY  82  10.152  -1.744   1.662
  505    H    THR  83           H        THR  83  10.034   0.188   0.509
  506    HA   THR  83           HA       THR  83  12.861   0.370  -0.268
  507    HB   THR  83           HB       THR  83  11.659   2.412  -1.705
  508    HG1  THR  83           HG1      THR  83   9.982   1.413  -2.842
  509   HG21  THR  83          HG21      THR  83  12.051   0.616  -3.635
  510   HG22  THR  83          HG22      THR  83  12.894  -0.216  -2.328
  511   HG23  THR  83          HG23      THR  83  13.389   1.408  -2.804
  512    H    LEU  84           H        LEU  84  13.649   2.675  -0.182
  513    HA   LEU  84           HA       LEU  84  12.293   4.160   1.971
  514    HB2  LEU  84           HB1      LEU  84  14.998   3.092   1.827
  515    HB3  LEU  84           HB2      LEU  84  14.972   4.835   2.148
  516    HG   LEU  84           HG       LEU  84  15.092   3.478   4.202
  517   HD11  LEU  84          HD11      LEU  84  14.218   5.572   4.620
  518   HD12  LEU  84          HD12      LEU  84  12.956   4.514   5.251
  519   HD13  LEU  84          HD13      LEU  84  12.762   5.271   3.671
  520   HD21  LEU  84          HD21      LEU  84  13.686   1.605   3.238
  521   HD22  LEU  84          HD22      LEU  84  12.277   2.605   3.595
  522   HD23  LEU  84          HD23      LEU  84  13.333   2.068   4.903
  523    H    CYS  85           H        CYS  85  12.884   6.479   2.050
  524    HA   CYS  85           HA       CYS  85  13.033   7.547  -0.670
  525    HB2  CYS  85           HB1      CYS  85  11.906   8.508   1.921
  526    HB3  CYS  85           HB2      CYS  85  12.442   9.718   0.756
  527    H    VAL  86           H        VAL  86  15.169   7.653  -1.188
  528    HA   VAL  86           HA       VAL  86  16.951   9.096   0.656
  529    HB   VAL  86           HB       VAL  86  17.717   7.360  -1.694
  530   HG11  VAL  86          HG11      VAL  86  19.267   8.900   0.347
  531   HG12  VAL  86          HG12      VAL  86  19.948   7.437  -0.367
  532   HG13  VAL  86          HG13      VAL  86  19.505   8.798  -1.397
  533   HG21  VAL  86          HG21      VAL  86  18.432   5.729   0.017
  534   HG22  VAL  86          HG22      VAL  86  17.708   6.749   1.260
  535   HG23  VAL  86          HG23      VAL  86  16.689   6.005   0.027
  536    H    ASN  87           H        ASN  87  17.705  11.047   0.128
  537    HA   ASN  87           HA       ASN  87  17.945  13.016  -0.992
  538    HB2  ASN  87           HB1      ASN  87  19.482  11.239  -2.234
  539    HB3  ASN  87           HB2      ASN  87  18.359  11.555  -3.563
  540   HD21  ASN  87          HD21      ASN  87  21.040  12.689  -1.820
  541   HD22  ASN  87          HD22      ASN  87  21.229  14.202  -2.632
  542    H    ASP  88           H        ASP  88  15.285  12.090  -0.775
  543    HA   ASP  88           HA       ASP  88  13.196  12.595  -1.522
  544    HB2  ASP  88           HB1      ASP  88  14.434  14.336  -3.649
  545    HB3  ASP  88           HB2      ASP  88  12.888  14.541  -2.816
  546    HD2  ASP  88           HD       ASP  88  15.532  16.708  -1.387
  547    H    VAL  89           H        VAL  89  14.696  10.372  -2.662
  548    HA   VAL  89           HA       VAL  89  13.030   9.955  -5.021
  549    HB   VAL  89           HB       VAL  89  16.016   9.489  -5.057
  550   HG11  VAL  89          HG11      VAL  89  13.944   9.009  -7.195
  551   HG12  VAL  89          HG12      VAL  89  15.686   8.782  -7.365
  552   HG13  VAL  89          HG13      VAL  89  14.766   7.762  -6.259
  553   HG21  VAL  89          HG21      VAL  89  15.710  11.123  -7.077
  554   HG22  VAL  89          HG22      VAL  89  14.260  11.615  -6.201
  555   HG23  VAL  89          HG23      VAL  89  15.843  11.755  -5.435
  556    H    CYS  90           H        CYS  90  12.431   7.844  -5.346
  557    HA   CYS  90           HA       CYS  90  12.518   6.099  -3.135
  558    HB2  CYS  90           HB1      CYS  90  11.109   6.270  -5.555
  559    HB3  CYS  90           HB2      CYS  90  11.953   4.722  -5.621
  560    H    THR  91           H        THR  91  14.235   5.022  -2.446
  561    HA   THR  91           HA       THR  91  16.029   3.808  -4.445
  562    HB   THR  91           HB       THR  91  16.853   4.946  -1.767
  563    HG1  THR  91           HG1      THR  91  18.122   6.305  -3.388
  564   HG21  THR  91          HG21      THR  91  19.154   4.513  -2.621
  565   HG22  THR  91          HG22      THR  91  18.441   3.635  -3.974
  566   HG23  THR  91          HG23      THR  91  18.222   3.046  -2.326
  567    H    THR  92           H        THR  92  16.651   1.722  -4.110
  568    HA   THR  92           HA       THR  92  15.050   0.064  -2.504
  569    HB   THR  92           HB       THR  92  17.206  -1.519  -2.965
  570    HG1  THR  92           HG1      THR  92  18.402  -0.766  -4.565
  571   HG21  THR  92          HG21      THR  92  16.014  -2.371  -4.841
  572   HG22  THR  92          HG22      THR  92  15.218  -0.823  -5.122
  573   HG23  THR  92          HG23      THR  92  14.807  -1.781  -3.700
  574    H    MET  93           H        MET  93  15.537  -1.149  -0.644
  575    HA   MET  93           HA       MET  93  16.899   0.229   1.387
  576    HB2  MET  93           HB1      MET  93  15.206  -2.005   1.197
  577    HB3  MET  93           HB2      MET  93  16.689  -2.592   1.964
  578    HG2  MET  93           HG1      MET  93  16.438  -0.509   3.496
  579    HG3  MET  93           HG2      MET  93  14.767  -0.519   2.923
  580    HE1  MET  93           HE1      MET  93  12.968  -1.656   4.353
  581    HE2  MET  93           HE2      MET  93  13.484  -2.282   5.920
  582    HE3  MET  93           HE3      MET  93  14.003  -0.679   5.397
  583    H    GLU  94           H        GLU  94  17.887  -2.402  -0.731
  584    HA   GLU  94           HA       GLU  94  20.251  -3.141   0.572
  585    HB2  GLU  94           HB1      GLU  94  19.351  -3.269  -2.298
  586    HB3  GLU  94           HB2      GLU  94  20.970  -3.807  -1.822
  587    HG2  GLU  94           HG1      GLU  94  20.200  -5.631  -0.683
  588    HG3  GLU  94           HG2      GLU  94  18.642  -4.878  -0.322
  589    HE2  GLU  94           HE       GLU  94  17.185  -6.291  -3.080
  590    H    ASP  95           H        ASP  95  19.601  -0.593  -1.779
  591    HA   ASP  95           HA       ASP  95  22.344   0.179  -2.051
  592    HB2  ASP  95           HB1      ASP  95  20.255   0.583  -3.629
  593    HB3  ASP  95           HB2      ASP  95  20.109   2.064  -2.672
  594    HD2  ASP  95           HD       ASP  95  22.954   1.837  -5.357
  595    H    ALA  96           H        ALA  96  19.534   1.665  -0.438
  596    HA   ALA  96           HA       ALA  96  20.885   3.813   0.724
  597    HB1  ALA  96           HB1      ALA  96  18.444   2.345   1.714
  598    HB2  ALA  96           HB2      ALA  96  18.993   3.915   2.301
  599    HB3  ALA  96           HB3      ALA  96  18.471   3.734   0.626
  600    H    THR  97           H        THR  97  20.716   3.928   3.338
  601    HA   THR  97           HA       THR  97  21.700   3.359   5.312
  602    HB   THR  97           HB       THR  97  21.739   0.492   4.379
  603    HG1  THR  97           HG1      THR  97  19.629   1.569   4.117
  604   HG21  THR  97          HG21      THR  97  21.221   1.566   7.140
  605   HG22  THR  97          HG22      THR  97  22.853   1.259   6.549
  606   HG23  THR  97          HG23      THR  97  21.694  -0.065   6.666
  607    H    GLU  98           H        GLU  98  23.628   4.445   4.778
  608    HA   GLU  98           HA       GLU  98  25.755   3.093   3.402
  609    HB2  GLU  98           HB1      GLU  98  25.525   5.723   4.852
  610    HB3  GLU  98           HB2      GLU  98  27.083   5.128   4.256
  611    HG2  GLU  98           HG1      GLU  98  26.465   6.413   2.485
  612    HG3  GLU  98           HG2      GLU  98  25.756   4.865   2.005
  613    HE2  GLU  98           HE       GLU  98  23.052   7.323   3.530
  614    H    ASN  99           H        ASN  99  27.514   2.082   4.234
  615    HA   ASN  99           HA       ASN  99  27.357   1.060   6.878
  616    HB2  ASN  99           HB1      ASN  99  28.473   0.080   4.704
  617    HB3  ASN  99           HB2      ASN  99  29.894   0.956   5.290
  618   HD21  ASN  99          HD21      ASN  99  30.123  -1.684   5.077
  619   HD22  ASN  99          HD22      ASN  99  30.119  -2.441   6.630
  620    H    LEU 100           H        LEU 100  27.404   2.761   8.336
  621    HA   LEU 100           HA       LEU 100  30.006   4.120   8.579
  622    HB2  LEU 100           HB1      LEU 100  27.479   5.290   8.161
  623    HB3  LEU 100           HB2      LEU 100  27.896   5.588   9.857
  624    HG   LEU 100           HG       LEU 100  28.549   7.440   8.374
  625   HD11  LEU 100          HD11      LEU 100  30.723   5.904   9.772
  626   HD12  LEU 100          HD12      LEU 100  29.782   7.266  10.378
  627   HD13  LEU 100          HD13      LEU 100  30.970   7.515   9.098
  628   HD21  LEU 100          HD21      LEU 100  30.248   7.208   6.728
  629   HD22  LEU 100          HD22      LEU 100  29.044   5.960   6.406
  630   HD23  LEU 100          HD23      LEU 100  30.563   5.537   7.196
  631    H    TYR 101           H        TYR 101  28.910   1.628   9.790
  632    HA   TYR 101           HA       TYR 101  28.927   0.553  11.793
  633    HB2  TYR 101           HB1      TYR 101  30.963   2.535  11.904
  634    HB3  TYR 101           HB2      TYR 101  30.175   2.496  13.483
  635    HD1  TYR 101           HD1      TYR 101  31.141  -0.125  10.990
  636    HD2  TYR 101           HD2      TYR 101  31.332   1.232  15.019
  637    HE1  TYR 101           HE1      TYR 101  32.419  -2.136  11.600
  638    HE2  TYR 101           HE2      TYR 101  32.612  -0.775  15.638
  639    HH   TYR 101           HH       TYR 101  33.474  -2.695  14.947
  640    H    PHE 102           H        PHE 102  28.427   0.943  14.267
  641    HA   PHE 102           HA       PHE 102  26.672   3.099  14.897
  642    HB2  PHE 102           HB1      PHE 102  25.553   0.603  13.797
  643    HB3  PHE 102           HB2      PHE 102  24.813   1.135  15.309
  644    HD1  PHE 102           HD1      PHE 102  24.593   1.381  11.856
  645    HD2  PHE 102           HD2      PHE 102  24.282   3.754  15.376
  646    HE1  PHE 102           HE1      PHE 102  23.216   3.012  10.631
  647    HE2  PHE 102           HE2      PHE 102  22.904   5.387  14.158
  648    HZ   PHE 102           HZ       PHE 102  22.368   5.018  11.782
  649    H    GLN 103           H        GLN 103  25.504   2.629  17.039
  650    HA   GLN 103           HA       GLN 103  25.646   2.130  19.253
  651    HB2  GLN 103           HB1      GLN 103  25.547  -0.230  18.122
  652    HB3  GLN 103           HB2      GLN 103  27.239  -0.329  18.636
  653    HG2  GLN 103           HG1      GLN 103  26.558  -1.015  20.624
  654    HG3  GLN 103           HG2      GLN 103  25.832   0.578  20.873
  655   HE21  GLN 103          HE21      GLN 103  25.143  -2.461  21.299
  656   HE22  GLN 103          HE22      GLN 103  23.462  -2.506  20.902
  657    H    SER 104           H        SER 104  27.086   3.964  19.439
  658    HA   SER 104           HA       SER 104  29.913   3.253  19.811
  659    HB2  SER 104           HB1      SER 104  28.663   6.009  19.595
  660    HB3  SER 104           HB2      SER 104  30.395   5.632  19.626
  661    HG   SER 104           HG       SER 104  28.852   5.781  17.514
  662    H    LEU 105           H        LEU 105  28.550   2.260  21.819
  663    HA   LEU 105           HA       LEU 105  28.655   4.231  23.999
  664    HB2  LEU 105           HB1      LEU 105  26.757   2.253  23.309
  665    HB3  LEU 105           HB2      LEU 105  27.541   1.720  24.805
  666    HG   LEU 105           HG       LEU 105  25.476   2.976  25.229
  667   HD11  LEU 105          HD11      LEU 105  27.402   4.906  26.257
  668   HD12  LEU 105          HD12      LEU 105  27.890   3.230  26.504
  669   HD13  LEU 105          HD13      LEU 105  26.337   3.794  27.118
  670   HD21  LEU 105          HD21      LEU 105  26.919   5.357  24.078
  671   HD22  LEU 105          HD22      LEU 105  25.274   5.300  24.713
  672   HD23  LEU 105          HD23      LEU 105  25.675   4.447  23.222
  673    H    GLU 106           H        GLU 106  30.145   4.055  25.555
  674    HA   GLU 106           HA       GLU 106  31.268   1.622  26.446
  675    HB2  GLU 106           HB1      GLU 106  32.350   2.243  24.073
  676    HB3  GLU 106           HB2      GLU 106  33.399   3.208  25.122
  677    HG2  GLU 106           HG1      GLU 106  34.224   1.336  26.246
  678    HG3  GLU 106           HG2      GLU 106  32.898   0.311  25.678
  679    HE2  GLU 106           HE       GLU 106  35.260   1.132  22.648
  680    H    HIS 107           H        HIS 107  31.071   2.309  28.509
  681    HA   HIS 107           HA       HIS 107  33.025   4.088  29.557
  682    HB2  HIS 107           HB1      HIS 107  30.552   5.255  28.719
  683    HB3  HIS 107           HB2      HIS 107  30.623   5.307  30.483
  684    HD1  HIS 107           HD1      HIS 107  32.037   6.890  27.474
  685    HD2  HIS 107           HD2      HIS 107  32.839   6.789  31.549
  686    HE1  HIS 107           HE1      HIS 107  33.605   8.810  27.898
  687    HE2  HIS 107           HE2      HIS 107  34.095   8.749  30.387
  688    H    HIS 108           H        HIS 108  33.585   2.813  31.204
  689    HA   HIS 108           HA       HIS 108  31.504   2.074  33.138
  690    HB2  HIS 108           HB1      HIS 108  32.680  -0.126  33.467
  691    HB3  HIS 108           HB2      HIS 108  31.841   0.044  31.922
  692    HD1  HIS 108           HD1      HIS 108  35.247  -0.321  33.379
  693    HD2  HIS 108           HD2      HIS 108  33.499   0.203  29.646
  694    HE1  HIS 108           HE1      HIS 108  37.066  -0.803  31.711
  695    HE2  HIS 108           HE2      HIS 108  35.999  -0.482  29.428
  696    H    HIS 109           H        HIS 109  32.007   2.824  35.079
  697    HA   HIS 109           HA       HIS 109  34.758   2.729  36.022
  698    HB2  HIS 109           HB1      HIS 109  33.181   5.269  35.648
  699    HB3  HIS 109           HB2      HIS 109  34.459   5.155  36.863
  700    HD1  HIS 109           HD1      HIS 109  34.022   6.254  33.541
  701    HD2  HIS 109           HD2      HIS 109  36.994   4.112  35.501
  702    HE1  HIS 109           HE1      HIS 109  36.075   6.487  32.108
  703    HE2  HIS 109           HE2      HIS 109  37.892   5.178  33.304
  704    H    HIS 110           H        HIS 110  34.908   2.385  38.180
  705    HA   HIS 110           HA       HIS 110  32.549   2.805  39.858
  706    HB2  HIS 110           HB1      HIS 110  33.893   0.174  39.311
  707    HB3  HIS 110           HB2      HIS 110  33.123   0.464  40.874
  708    HD1  HIS 110           HD1      HIS 110  32.349  -0.296  37.341
  709    HD2  HIS 110           HD2      HIS 110  30.291   0.797  40.781
  710    HE1  HIS 110           HE1      HIS 110  29.926  -0.752  36.847
  711    HE2  HIS 110           HE2      HIS 110  28.666  -0.083  38.948
  712    H    HIS 111           H        HIS 111  33.000   2.904  42.110
  713    HA   HIS 111           HA       HIS 111  35.523   4.080  42.711
  714    HB2  HIS 111           HB1      HIS 111  33.022   4.218  43.811
  715    HB3  HIS 111           HB2      HIS 111  33.871   3.213  44.989
  716    HD1  HIS 111           HD1      HIS 111  34.638   6.477  43.169
  717    HD2  HIS 111           HD2      HIS 111  35.044   4.700  46.903
  718    HE1  HIS 111           HE1      HIS 111  35.698   8.225  44.633
  719    HE2  HIS 111           HE2      HIS 111  35.945   7.141  46.916
  720    H    HIS 112           H        HIS 112  33.934   1.194  44.086
  721    HA   HIS 112           HA       HIS 112  36.241  -0.432  43.876
  722    HB2  HIS 112           HB1      HIS 112  36.670  -0.666  46.342
  723    HB3  HIS 112           HB2      HIS 112  37.176   0.874  45.644
  724    HD1  HIS 112           HD1      HIS 112  33.935  -0.358  47.237
  725    HD2  HIS 112           HD2      HIS 112  36.520   2.895  47.297
  726    HE1  HIS 112           HE1      HIS 112  32.945   1.257  48.892
  727    HE2  HIS 112           HE2      HIS 112  34.523   3.246  48.928
  Start of MODEL   13
    1    H1   MET  18           H        MET  18 -31.090  -0.128  61.496
    2    HA   MET  18           HA       MET  18 -31.002  -2.390  60.066
    3    HB2  MET  18           HB1      MET  18 -33.880  -1.653  60.578
    4    HB3  MET  18           HB2      MET  18 -33.393  -2.583  59.153
    5    HG2  MET  18           HG1      MET  18 -32.712  -4.425  60.415
    6    HG3  MET  18           HG2      MET  18 -32.615  -3.472  61.900
    7    HE1  MET  18           HE1      MET  18 -34.699  -6.388  62.127
    8    HE2  MET  18           HE2      MET  18 -33.503  -5.370  62.931
    9    HE3  MET  18           HE3      MET  18 -35.189  -5.327  63.448
   10    H    LEU  19           H        LEU  19 -29.894  -1.357  58.519
   11    HA   LEU  19           HA       LEU  19 -31.343   0.588  56.877
   12    HB2  LEU  19           HB1      LEU  19 -28.589   0.966  58.055
   13    HB3  LEU  19           HB2      LEU  19 -29.214   1.920  56.701
   14    HG   LEU  19           HG       LEU  19 -30.586   1.828  59.378
   15   HD11  LEU  19          HD11      LEU  19 -29.020   3.118  60.266
   16   HD12  LEU  19          HD12      LEU  19 -29.226   4.286  58.961
   17   HD13  LEU  19          HD13      LEU  19 -28.060   2.973  58.793
   18   HD21  LEU  19          HD21      LEU  19 -30.718   3.707  57.024
   19   HD22  LEU  19          HD22      LEU  19 -31.519   3.976  58.572
   20   HD23  LEU  19          HD23      LEU  19 -31.976   2.598  57.569
   21    H    VAL  20           H        VAL  20 -31.059  -2.029  56.199
   22    HA   VAL  20           HA       VAL  20 -28.720  -2.541  54.647
   23    HB   VAL  20           HB       VAL  20 -31.412  -3.902  54.475
   24   HG11  VAL  20          HG11      VAL  20 -29.846  -5.828  53.753
   25   HG12  VAL  20          HG12      VAL  20 -30.246  -4.571  52.581
   26   HG13  VAL  20          HG13      VAL  20 -28.688  -4.544  53.408
   27   HG21  VAL  20          HG21      VAL  20 -29.520  -5.482  55.853
   28   HG22  VAL  20          HG22      VAL  20 -29.484  -3.876  56.581
   29   HG23  VAL  20          HG23      VAL  20 -31.004  -4.765  56.481
   30    H    LEU  21           H        LEU  21 -28.260  -1.390  52.888
   31    HA   LEU  21           HA       LEU  21 -30.186  -0.005  51.339
   32    HB2  LEU  21           HB1      LEU  21 -27.587   0.326  51.648
   33    HB3  LEU  21           HB2      LEU  21 -27.518  -0.724  50.223
   34    HG   LEU  21           HG       LEU  21 -29.029   0.942  49.069
   35   HD11  LEU  21          HD11      LEU  21 -28.169   3.102  50.826
   36   HD12  LEU  21          HD12      LEU  21 -29.314   1.995  51.584
   37   HD13  LEU  21          HD13      LEU  21 -29.737   2.804  50.075
   38   HD21  LEU  21          HD21      LEU  21 -26.881   2.683  49.329
   39   HD22  LEU  21          HD22      LEU  21 -27.051   1.380  48.153
   40   HD23  LEU  21          HD23      LEU  21 -26.206   1.090  49.674
   41    H    ASP  22           H        ASP  22 -30.939  -0.406  49.247
   42    HA   ASP  22           HA       ASP  22 -31.094  -3.237  48.569
   43    HB2  ASP  22           HB1      ASP  22 -32.724  -0.819  48.015
   44    HB3  ASP  22           HB2      ASP  22 -32.687  -2.048  46.743
   45    HD2  ASP  22           HD       ASP  22 -35.100  -2.685  49.619
   46    H    PHE  23           H        PHE  23 -30.929  -0.338  46.511
   47    HA   PHE  23           HA       PHE  23 -28.503  -1.214  45.241
   48    HB2  PHE  23           HB1      PHE  23 -30.763  -2.381  44.253
   49    HB3  PHE  23           HB2      PHE  23 -30.651  -0.943  43.236
   50    HD1  PHE  23           HD1      PHE  23 -29.675  -1.321  41.206
   51    HD2  PHE  23           HD2      PHE  23 -28.202  -3.408  44.610
   52    HE1  PHE  23           HE1      PHE  23 -27.981  -2.415  39.797
   53    HE2  PHE  23           HE2      PHE  23 -26.506  -4.505  43.207
   54    HZ   PHE  23           HZ       PHE  23 -26.393  -4.009  40.797
   55    H    ASN  24           H        ASN  24 -27.569   0.374  43.929
   56    HA   ASN  24           HA       ASN  24 -29.023   2.882  43.574
   57    HB2  ASN  24           HB1      ASN  24 -27.674   2.822  45.788
   58    HB3  ASN  24           HB2      ASN  24 -26.253   2.958  44.743
   59   HD21  ASN  24          HD21      ASN  24 -25.639   4.974  45.360
   60   HD22  ASN  24          HD22      ASN  24 -26.561   6.398  45.033
   61    H    ASN  25           H        ASN  25 -28.818   1.745  41.398
   62    HA   ASN  25           HA       ASN  25 -26.390   2.743  40.078
   63    HB2  ASN  25           HB1      ASN  25 -26.233   0.275  40.398
   64    HB3  ASN  25           HB2      ASN  25 -27.710   0.095  39.446
   65   HD21  ASN  25          HD21      ASN  25 -26.206  -1.275  38.176
   66   HD22  ASN  25          HD22      ASN  25 -25.297  -0.514  36.919
   67    H    ILE  26           H        ILE  26 -27.462   4.526  39.262
   68    HA   ILE  26           HA       ILE  26 -29.471   3.928  37.195
   69    HB   ILE  26           HB       ILE  26 -29.498   6.413  38.906
   70   HG12  ILE  26          HG11      ILE  26 -31.803   5.027  39.480
   71   HG13  ILE  26          HG12      ILE  26 -30.598   3.732  39.374
   72   HG21  ILE  26          HG21      ILE  26 -30.602   7.028  37.003
   73   HG22  ILE  26          HG22      ILE  26 -31.133   5.385  36.647
   74   HG23  ILE  26          HG23      ILE  26 -31.938   6.317  37.908
   75   HD11  ILE  26          HD11      ILE  26 -31.100   5.420  41.549
   76   HD12  ILE  26          HD12      ILE  26 -29.813   4.226  41.379
   77   HD13  ILE  26          HD13      ILE  26 -29.532   5.900  40.903
   78    H    ARG  27           H        ARG  27 -28.083   4.063  35.474
   79    HA   ARG  27           HA       ARG  27 -26.994   6.736  34.933
   80    HB2  ARG  27           HB1      ARG  27 -24.976   5.750  33.953
   81    HB3  ARG  27           HB2      ARG  27 -25.131   5.335  35.668
   82    HG2  ARG  27           HG1      ARG  27 -25.013   3.174  35.205
   83    HG3  ARG  27           HG2      ARG  27 -26.401   3.310  34.113
   84    HD2  ARG  27           HD1      ARG  27 -25.061   3.698  32.235
   85    HD3  ARG  27           HD2      ARG  27 -23.669   4.160  33.225
   86    HE   ARG  27           HE       ARG  27 -24.353   1.534  32.378
   87   HH11  ARG  27          HH11      ARG  27 -22.930   3.324  35.002
   88   HH12  ARG  27          HH12      ARG  27 -21.952   2.002  35.546
   89   HH21  ARG  27          HH21      ARG  27 -23.071  -0.216  33.085
   90   HH22  ARG  27          HH22      ARG  27 -22.033  -0.011  34.456
   91    H    SER  28           H        SER  28 -26.951   7.349  32.761
   92    HA   SER  28           HA       SER  28 -28.086   5.492  30.805
   93    HB2  SER  28           HB1      SER  28 -29.349   8.000  31.802
   94    HB3  SER  28           HB2      SER  28 -29.441   7.684  30.062
   95    HG   SER  28           HG       SER  28 -31.214   6.750  31.089
   96    H    SER  29           H        SER  29 -27.083   5.605  28.900
   97    HA   SER  29           HA       SER  29 -26.002   8.049  27.861
   98    HB2  SER  29           HB1      SER  29 -24.318   6.485  29.521
   99    HB3  SER  29           HB2      SER  29 -23.768   6.242  27.854
  100    HG   SER  29           HG       SER  29 -24.020   8.678  29.272
  101    H    ALA  30           H        ALA  30 -25.515   7.922  25.673
  102    HA   ALA  30           HA       ALA  30 -25.347   5.422  24.288
  103    HB1  ALA  30           HB1      ALA  30 -27.591   6.660  23.049
  104    HB2  ALA  30           HB2      ALA  30 -27.474   5.058  23.778
  105    HB3  ALA  30           HB3      ALA  30 -27.941   6.444  24.764
  106    H    ASP  31           H        ASP  31 -26.654   8.635  23.458
  107    HA   ASP  31           HA       ASP  31 -25.976  10.217  21.970
  108    HB2  ASP  31           HB1      ASP  31 -23.533   9.136  23.113
  109    HB3  ASP  31           HB2      ASP  31 -23.281   9.689  21.451
  110    HD2  ASP  31           HD       ASP  31 -23.253  12.394  24.117
  111    H    LEU  32           H        LEU  32 -25.167  10.534  19.733
  112    HA   LEU  32           HA       LEU  32 -24.504   8.343  18.075
  113    HB2  LEU  32           HB1      LEU  32 -27.194   8.422  18.744
  114    HB3  LEU  32           HB2      LEU  32 -27.122   9.204  17.154
  115    HG   LEU  32           HG       LEU  32 -25.575   6.846  16.975
  116   HD11  LEU  32          HD11      LEU  32 -28.096   6.534  18.547
  117   HD12  LEU  32          HD12      LEU  32 -26.531   5.750  18.766
  118   HD13  LEU  32          HD13      LEU  32 -27.582   5.264  17.436
  119   HD21  LEU  32          HD21      LEU  32 -27.247   8.207  15.405
  120   HD22  LEU  32          HD22      LEU  32 -28.339   6.920  15.915
  121   HD23  LEU  32          HD23      LEU  32 -26.822   6.521  15.109
  122    H    HIS  33           H        HIS  33 -23.895   8.999  16.038
  123    HA   HIS  33           HA       HIS  33 -24.665  11.540  14.957
  124    HB2  HIS  33           HB1      HIS  33 -22.458  12.577  14.961
  125    HB3  HIS  33           HB2      HIS  33 -23.004  12.277  16.614
  126    HD1  HIS  33           HD1      HIS  33 -20.354  11.330  14.196
  127    HD2  HIS  33           HD2      HIS  33 -21.599  10.248  18.009
  128    HE1  HIS  33           HE1      HIS  33 -18.469   9.974  15.159
  129    HE2  HIS  33           HE2      HIS  33 -19.229   9.311  17.490
  130    H    GLY  34           H        GLY  34 -22.759  12.011  13.118
  131    HA2  GLY  34           HA2      GLY  34 -22.265   9.449  11.757
  132    HA3  GLY  34           HA3      GLY  34 -23.141  10.718  10.915
  133    HA1  GLY  34           HA1      GLY  34 -21.764   9.909  12.317
  134    H    ALA  35           H        ALA  35 -20.647   9.495  10.138
  135    HA   ALA  35           HA       ALA  35 -18.887  11.857  10.275
  136    HB1  ALA  35           HB1      ALA  35 -18.314   9.267  11.133
  137    HB2  ALA  35           HB2      ALA  35 -17.471   9.440   9.593
  138    HB3  ALA  35           HB3      ALA  35 -17.171  10.590  10.896
  139    H    ARG  36           H        ARG  36 -18.866  12.883   8.392
  140    HA   ARG  36           HA       ARG  36 -18.588  11.331   5.930
  141    HB2  ARG  36           HB1      ARG  36 -20.253  12.742   4.774
  142    HB3  ARG  36           HB2      ARG  36 -20.968  11.775   6.073
  143    HG2  ARG  36           HG1      ARG  36 -21.372  13.598   7.419
  144    HG3  ARG  36           HG2      ARG  36 -20.105  14.568   6.649
  145    HD2  ARG  36           HD1      ARG  36 -22.376  13.719   4.930
  146    HD3  ARG  36           HD2      ARG  36 -22.710  14.936   6.171
  147    HE   ARG  36           HE       ARG  36 -20.432  15.796   4.885
  148   HH11  ARG  36          HH11      ARG  36 -23.715  15.060   3.991
  149   HH12  ARG  36          HH12      ARG  36 -23.754  16.202   2.689
  150   HH21  ARG  36          HH21      ARG  36 -20.472  17.303   3.174
  151   HH22  ARG  36          HH22      ARG  36 -21.909  17.477   2.224
  152    H    LYS  37           H        LYS  37 -18.017  12.777   4.056
  153    HA   LYS  37           HA       LYS  37 -17.058  15.396   4.451
  154    HB2  LYS  37           HB1      LYS  37 -15.392  13.583   5.637
  155    HB3  LYS  37           HB2      LYS  37 -14.674  13.724   4.024
  156    HG2  LYS  37           HG1      LYS  37 -13.552  15.444   4.925
  157    HG3  LYS  37           HG2      LYS  37 -15.057  16.331   4.619
  158    HD2  LYS  37           HD1      LYS  37 -15.334  14.957   7.102
  159    HD3  LYS  37           HD2      LYS  37 -13.784  15.819   7.106
  160    HE2  LYS  37           HE1      LYS  37 -16.262  17.222   6.158
  161    HE3  LYS  37           HE2      LYS  37 -15.956  17.034   7.892
  162    HZ1  LYS  37           HZ1      LYS  37 -14.428  18.625   7.844
  163    HZ2  LYS  37           HZ2      LYS  37 -14.955  19.000   6.282
  164    HZ3  LYS  37           HZ3      LYS  37 -13.641  17.959   6.502
  165    H    GLY  38           H        GLY  38 -16.529  16.360   2.527
  166    HA2  GLY  38           HA2      GLY  38 -17.138  14.853   0.143
  167    HA3  GLY  38           HA3      GLY  38 -16.768  16.569   0.229
  168    HA1  GLY  38           HA1      GLY  38 -16.523  14.504   0.668
  169    H    SER  39           H        SER  39 -15.286  13.353   0.368
  170    HA   SER  39           HA       SER  39 -12.997  14.413  -1.107
  171    HB2  SER  39           HB1      SER  39 -12.902  13.807   1.669
  172    HB3  SER  39           HB2      SER  39 -12.007  12.534   0.821
  173    HG   SER  39           HG       SER  39 -11.586  15.265   0.239
  174    H    GLN  40           H        GLN  40 -11.618  12.668  -1.996
  175    HA   GLN  40           HA       GLN  40 -13.276  10.596  -3.106
  176    HB2  GLN  40           HB1      GLN  40 -10.674  11.801  -3.669
  177    HB3  GLN  40           HB2      GLN  40 -10.687  10.047  -3.902
  178    HG2  GLN  40           HG1      GLN  40 -13.039  10.930  -5.105
  179    HG3  GLN  40           HG2      GLN  40 -11.814  12.129  -5.546
  180   HE21  GLN  40          HE21      GLN  40 -11.828   8.604  -5.111
  181   HE22  GLN  40          HE22      GLN  40 -11.105   8.243  -6.638
  182    H    CYS  41           H        CYS  41 -10.561  10.776  -0.856
  183    HA   CYS  41           HA       CYS  41 -11.273   8.149   0.174
  184    HB2  CYS  41           HB1      CYS  41  -9.039   7.249   0.030
  185    HB3  CYS  41           HB2      CYS  41  -9.570   7.725  -1.585
  186    H    LEU  42           H        LEU  42 -10.768   7.863   2.321
  187    HA   LEU  42           HA       LEU  42 -10.206  10.255   3.812
  188    HB2  LEU  42           HB1      LEU  42 -10.855   7.411   4.535
  189    HB3  LEU  42           HB2      LEU  42 -10.328   8.574   5.765
  190    HG   LEU  42           HG       LEU  42 -12.415   9.829   4.363
  191   HD11  LEU  42          HD11      LEU  42 -13.051   7.651   3.464
  192   HD12  LEU  42          HD12      LEU  42 -14.253   8.245   4.610
  193   HD13  LEU  42          HD13      LEU  42 -13.116   6.989   5.098
  194   HD21  LEU  42          HD21      LEU  42 -11.716   9.902   6.806
  195   HD22  LEU  42          HD22      LEU  42 -12.660   8.427   7.010
  196   HD23  LEU  42          HD23      LEU  42 -13.449   9.911   6.473
  197    H    SER  43           H        SER  43  -8.488   7.327   2.943
  198    HA   SER  43           HA       SER  43  -5.964   8.517   3.527
  199    HB2  SER  43           HB1      SER  43  -5.650   6.244   5.097
  200    HB3  SER  43           HB2      SER  43  -5.794   7.908   5.687
  201    HG   SER  43           HG       SER  43  -7.325   6.454   6.642
  202    H    ASP  44           H        ASP  44  -4.183   6.718   3.362
  203    HA   ASP  44           HA       ASP  44  -4.315   5.614   0.816
  204    HB2  ASP  44           HB1      ASP  44  -2.241   4.570   1.271
  205    HB3  ASP  44           HB2      ASP  44  -2.246   6.054   2.234
  206    HD2  ASP  44           HD       ASP  44  -2.866   4.029   5.168
  207    H    THR  45           H        THR  45  -5.433   4.367   3.846
  208    HA   THR  45           HA       THR  45  -5.505   1.633   3.335
  209    HB   THR  45           HB       THR  45  -7.445   1.566   4.925
  210    HG1  THR  45           HG1      THR  45  -8.030   3.577   5.885
  211   HG21  THR  45          HG21      THR  45  -5.967   3.055   6.686
  212   HG22  THR  45          HG22      THR  45  -4.782   2.670   5.438
  213   HG23  THR  45          HG23      THR  45  -5.649   1.374   6.260
  214    H    ASP  46           H        ASP  46  -7.508   4.203   2.122
  215    HA   ASP  46           HA       ASP  46  -9.680   2.590   1.242
  216    HB2  ASP  46           HB1      ASP  46  -9.581   5.156   1.596
  217    HB3  ASP  46           HB2      ASP  46  -8.903   5.198  -0.036
  218    HD2  ASP  46           HD       ASP  46 -12.509   5.473  -0.306
  219    H    CYS  47           H        CYS  47  -6.574   3.416  -0.084
  220    HA   CYS  47           HA       CYS  47  -7.284   2.277  -2.684
  221    HB2  CYS  47           HB1      CYS  47  -4.874   3.807  -1.694
  222    HB3  CYS  47           HB2      CYS  47  -4.922   3.033  -3.280
  223    H    ASN  48           H        ASN  48  -5.585   0.837  -3.696
  224    HA   ASN  48           HA       ASN  48  -5.344  -1.530  -2.268
  225    HB2  ASN  48           HB1      ASN  48  -4.699  -0.609  -4.860
  226    HB3  ASN  48           HB2      ASN  48  -3.223  -1.334  -4.208
  227   HD21  ASN  48          HD21      ASN  48  -3.011  -3.460  -4.292
  228   HD22  ASN  48          HD22      ASN  48  -4.276  -4.585  -4.638
  229    H    THR  49           H        THR  49  -3.368  -2.662  -1.596
  230    HA   THR  49           HA       THR  49  -1.914  -1.183   0.304
  231    HB   THR  49           HB       THR  49  -1.276  -3.897  -0.865
  232    HG1  THR  49           HG1      THR  49  -2.995  -2.985   1.151
  233   HG21  THR  49          HG21      THR  49   0.668  -2.909   0.238
  234   HG22  THR  49          HG22      THR  49   0.022  -4.246   1.189
  235   HG23  THR  49          HG23      THR  49  -0.302  -2.583   1.674
  236    H    ARG  50           H        ARG  50  -1.341  -1.853  -3.047
  237    HA   ARG  50           HA       ARG  50   1.421  -0.897  -2.854
  238    HB2  ARG  50           HB1      ARG  50  -0.139  -2.266  -5.046
  239    HB3  ARG  50           HB2      ARG  50   1.454  -1.543  -5.324
  240    HG2  ARG  50           HG1      ARG  50   0.857  -3.729  -3.327
  241    HG3  ARG  50           HG2      ARG  50   1.588  -3.956  -4.926
  242    HD2  ARG  50           HD1      ARG  50   3.369  -2.265  -4.142
  243    HD3  ARG  50           HD2      ARG  50   2.733  -2.577  -2.519
  244    HE   ARG  50           HE       ARG  50   4.368  -4.328  -4.099
  245   HH11  ARG  50          HH11      ARG  50   1.999  -4.166  -1.553
  246   HH12  ARG  50          HH12      ARG  50   2.477  -5.668  -0.834
  247   HH21  ARG  50          HH21      ARG  50   5.006  -6.307  -3.162
  248   HH22  ARG  50          HH22      ARG  50   4.189  -6.885  -1.749
  249    H    LYS  51           H        LYS  51  -0.958   0.829  -2.538
  250    HA   LYS  51           HA       LYS  51  -0.142   2.887  -4.416
  251    HB2  LYS  51           HB1      LYS  51  -2.833   1.587  -4.420
  252    HB3  LYS  51           HB2      LYS  51  -2.736   3.328  -4.725
  253    HG2  LYS  51           HG1      LYS  51  -2.216   2.945  -6.841
  254    HG3  LYS  51           HG2      LYS  51  -0.770   2.061  -6.325
  255    HD2  LYS  51           HD1      LYS  51  -1.727   0.025  -6.622
  256    HD3  LYS  51           HD2      LYS  51  -3.325   0.595  -6.110
  257    HE2  LYS  51           HE1      LYS  51  -3.054   1.976  -8.423
  258    HE3  LYS  51           HE2      LYS  51  -2.105   0.528  -8.796
  259    HZ1  LYS  51           HZ1      LYS  51  -4.704   0.090  -7.559
  260    HZ2  LYS  51           HZ2      LYS  51  -3.922  -0.788  -8.775
  261    HZ3  LYS  51           HZ3      LYS  51  -4.717   0.658  -9.153
  262    H    PHE  52           H        PHE  52  -0.697   5.000  -3.752
  263    HA   PHE  52           HA       PHE  52  -1.652   5.174  -0.970
  264    HB2  PHE  52           HB1      PHE  52  -0.231   7.263  -0.832
  265    HB3  PHE  52           HB2      PHE  52   0.657   5.742  -0.947
  266    HD1  PHE  52           HD1      PHE  52   2.137   5.302  -2.720
  267    HD2  PHE  52           HD2      PHE  52  -0.448   8.679  -2.897
  268    HE1  PHE  52           HE1      PHE  52   3.370   6.140  -4.678
  269    HE2  PHE  52           HE2      PHE  52   0.780   9.521  -4.855
  270    HZ   PHE  52           HZ       PHE  52   2.692   8.251  -5.748
  271    H    CYS  53           H        CYS  53  -2.340   7.551  -0.476
  272    HA   CYS  53           HA       CYS  53  -4.229   8.324  -2.590
  273    HB2  CYS  53           HB1      CYS  53  -4.313   8.301   0.368
  274    HB3  CYS  53           HB2      CYS  53  -5.064   9.700  -0.401
  275    H    LEU  54           H        LEU  54  -3.100   9.737  -3.846
  276    HA   LEU  54           HA       LEU  54  -1.450  11.801  -2.708
  277    HB2  LEU  54           HB1      LEU  54  -0.945  10.724  -4.876
  278    HB3  LEU  54           HB2      LEU  54  -2.419  11.449  -5.541
  279    HG   LEU  54           HG       LEU  54  -1.120  13.657  -4.638
  280   HD11  LEU  54          HD11      LEU  54   1.137  13.522  -4.749
  281   HD12  LEU  54          HD12      LEU  54   1.115  12.229  -5.947
  282   HD13  LEU  54          HD13      LEU  54   0.812  11.863  -4.249
  283   HD21  LEU  54          HD21      LEU  54  -2.105  12.860  -6.959
  284   HD22  LEU  54          HD22      LEU  54  -0.394  12.656  -7.341
  285   HD23  LEU  54          HD23      LEU  54  -1.005  14.234  -6.843
  286    H    GLN  55           H        GLN  55  -2.023  13.809  -2.171
  287    HA   GLN  55           HA       GLN  55  -4.612  14.831  -3.128
  288    HB2  GLN  55           HB1      GLN  55  -3.472  15.190  -0.347
  289    HB3  GLN  55           HB2      GLN  55  -5.007  15.841  -0.940
  290    HG2  GLN  55           HG1      GLN  55  -5.737  13.460  -1.352
  291    HG3  GLN  55           HG2      GLN  55  -4.296  12.965  -0.453
  292   HE21  GLN  55          HE21      GLN  55  -7.413  13.132  -0.076
  293   HE22  GLN  55          HE22      GLN  55  -7.549  13.621   1.575
  294    HA   PRO  56           HA       PRO  56  -1.396  17.881  -4.282
  295    HB2  PRO  56           HB1      PRO  56  -2.682  18.694  -6.561
  296    HB3  PRO  56           HB2      PRO  56  -1.641  17.274  -6.484
  297    HG2  PRO  56           HG1      PRO  56  -4.628  17.453  -6.298
  298    HG3  PRO  56           HG2      PRO  56  -3.612  16.308  -7.249
  299    HD2  PRO  56           HD1      PRO  56  -4.780  15.622  -4.896
  300    HD3  PRO  56           HD2      PRO  56  -3.209  14.981  -5.408
  301    H    ARG  57           H        ARG  57  -1.437  20.144  -4.215
  302    HA   ARG  57           HA       ARG  57  -3.684  21.259  -2.780
  303    HB2  ARG  57           HB1      ARG  57  -1.086  21.685  -2.490
  304    HB3  ARG  57           HB2      ARG  57  -1.394  22.934  -3.704
  305    HG2  ARG  57           HG1      ARG  57  -2.513  24.262  -2.270
  306    HG3  ARG  57           HG2      ARG  57  -3.270  22.893  -1.441
  307    HD2  ARG  57           HD1      ARG  57  -1.699  22.844   0.157
  308    HD3  ARG  57           HD2      ARG  57  -0.394  22.989  -1.028
  309    HE   ARG  57           HE       ARG  57  -1.705  25.474  -0.719
  310   HH11  ARG  57          HH11      ARG  57   0.489  23.318   0.911
  311   HH12  ARG  57          HH12      ARG  57   1.273  24.579   1.803
  312   HH21  ARG  57          HH21      ARG  57  -0.680  27.144   0.449
  313   HH22  ARG  57          HH22      ARG  57   0.607  26.756   1.539
  314    H    ASP  58           H        ASP  58  -2.321  21.403  -5.990
  315    HA   ASP  58           HA       ASP  58  -4.021  23.617  -6.786
  316    HB2  ASP  58           HB1      ASP  58  -2.894  23.565  -8.876
  317    HB3  ASP  58           HB2      ASP  58  -1.662  23.265  -7.645
  318    HD2  ASP  58           HD       ASP  58  -2.221  20.562 -10.381
  319    H    GLU  59           H        GLU  59  -4.065  20.171  -6.813
  320    HA   GLU  59           HA       GLU  59  -6.503  20.226  -8.469
  321    HB2  GLU  59           HB1      GLU  59  -4.107  18.710  -8.801
  322    HB3  GLU  59           HB2      GLU  59  -5.421  17.596  -8.393
  323    HG2  GLU  59           HG1      GLU  59  -6.327  19.499 -10.344
  324    HG3  GLU  59           HG2      GLU  59  -4.836  18.717 -10.890
  325    HE2  GLU  59           HE       GLU  59  -6.526  15.850 -11.663
  326    H    LYS  60           H        LYS  60  -7.717  17.982  -8.040
  327    HA   LYS  60           HA       LYS  60  -8.372  18.048  -5.206
  328    HB2  LYS  60           HB1      LYS  60  -9.708  17.073  -7.690
  329    HB3  LYS  60           HB2      LYS  60 -10.152  16.313  -6.154
  330    HG2  LYS  60           HG1      LYS  60 -11.370  18.063  -5.502
  331    HG3  LYS  60           HG2      LYS  60 -10.118  19.216  -5.999
  332    HD2  LYS  60           HD1      LYS  60 -10.861  18.841  -8.386
  333    HD3  LYS  60           HD2      LYS  60 -12.240  17.950  -7.721
  334    HE2  LYS  60           HE1      LYS  60 -12.138  20.362  -6.280
  335    HE3  LYS  60           HE2      LYS  60 -11.850  20.792  -7.971
  336    HZ1  LYS  60           HZ1      LYS  60 -14.105  19.073  -7.107
  337    HZ2  LYS  60           HZ2      LYS  60 -13.879  19.794  -8.620
  338    HZ3  LYS  60           HZ3      LYS  60 -14.232  20.752  -7.270
  339    HA   PRO  61           HA       PRO  61  -6.486  14.257  -4.057
  340    HB2  PRO  61           HB1      PRO  61  -8.350  13.146  -2.389
  341    HB3  PRO  61           HB2      PRO  61  -7.380  14.554  -1.961
  342    HG2  PRO  61           HG1      PRO  61 -10.177  14.428  -3.036
  343    HG3  PRO  61           HG2      PRO  61  -9.520  15.421  -1.683
  344    HD2  PRO  61           HD1      PRO  61  -9.974  16.438  -4.158
  345    HD3  PRO  61           HD2      PRO  61  -8.641  16.988  -3.127
  346    H    PHE  62           H        PHE  62  -6.252  12.233  -4.835
  347    HA   PHE  62           HA       PHE  62  -8.483  10.622  -5.649
  348    HB2  PHE  62           HB1      PHE  62  -8.054  10.497  -7.989
  349    HB3  PHE  62           HB2      PHE  62  -8.158  12.210  -7.581
  350    HD1  PHE  62           HD1      PHE  62  -5.976  13.481  -7.175
  351    HD2  PHE  62           HD2      PHE  62  -6.164   9.688  -9.095
  352    HE1  PHE  62           HE1      PHE  62  -3.764  13.883  -8.178
  353    HE2  PHE  62           HE2      PHE  62  -3.952  10.083 -10.100
  354    HZ   PHE  62           HZ       PHE  62  -2.749  12.182  -9.640
  355    H    CYS  63           H        CYS  63  -7.758   8.505  -6.537
  356    HA   CYS  63           HA       CYS  63  -5.509   7.554  -5.014
  357    HB2  CYS  63           HB1      CYS  63  -7.754   6.351  -5.447
  358    HB3  CYS  63           HB2      CYS  63  -7.062   5.927  -7.013
  359    H    ALA  64           H        ALA  64  -3.484   7.521  -5.704
  360    HA   ALA  64           HA       ALA  64  -2.987   7.442  -8.609
  361    HB1  ALA  64           HB1      ALA  64  -1.876   9.343  -8.274
  362    HB2  ALA  64           HB2      ALA  64  -1.943   9.161  -6.520
  363    HB3  ALA  64           HB3      ALA  64  -0.660   8.375  -7.441
  364    H    THR  65           H        THR  65  -1.053   6.324  -9.307
  365    HA   THR  65           HA       THR  65  -0.751   3.803  -7.988
  366    HB   THR  65           HB       THR  65   0.976   3.380  -9.788
  367    HG1  THR  65           HG1      THR  65   1.115   4.936 -11.434
  368   HG21  THR  65          HG21      THR  65  -1.711   4.337 -10.780
  369   HG22  THR  65          HG22      THR  65  -1.426   2.778 -10.006
  370   HG23  THR  65          HG23      THR  65  -0.659   3.150 -11.550
  371    H    CYS  66           H        CYS  66   1.487   2.878  -7.624
  372    HA   CYS  66           HA       CYS  66   2.825   4.459  -5.678
  373    HB2  CYS  66           HB1      CYS  66   2.588   1.853  -5.919
  374    HB3  CYS  66           HB2      CYS  66   4.062   2.007  -6.878
  375    H    ARG  67           H        ARG  67   5.145   4.946  -5.692
  376    HA   ARG  67           HA       ARG  67   5.929   6.036  -8.288
  377    HB2  ARG  67           HB1      ARG  67   7.033   6.505  -5.508
  378    HB3  ARG  67           HB2      ARG  67   7.614   7.305  -6.976
  379    HG2  ARG  67           HG1      ARG  67   4.761   7.494  -6.023
  380    HG3  ARG  67           HG2      ARG  67   6.028   8.643  -5.561
  381    HD2  ARG  67           HD1      ARG  67   5.835   8.120  -8.455
  382    HD3  ARG  67           HD2      ARG  67   4.423   8.907  -7.738
  383    HE   ARG  67           HE       ARG  67   6.652  10.266  -6.805
  384   HH11  ARG  67          HH11      ARG  67   5.111   9.617  -9.858
  385   HH12  ARG  67          HH12      ARG  67   5.648  11.092 -10.591
  386   HH21  ARG  67          HH21      ARG  67   7.364  12.213  -7.758
  387   HH22  ARG  67          HH22      ARG  67   6.930  12.568  -9.396
  388    H    GLY  68           H        GLY  68   7.769   5.470  -9.366
  389    HA2  GLY  68           HA2      GLY  68   8.918   2.915  -8.713
  390    HA3  GLY  68           HA3      GLY  68   9.322   3.918 -10.097
  391    HA1  GLY  68           HA1      GLY  68   8.908   3.500  -8.055
  392    H    LEU  69           H        LEU  69  11.396   2.718  -9.037
  393    HA   LEU  69           HA       LEU  69  12.633   3.981  -6.840
  394    HB2  LEU  69           HB1      LEU  69  13.644   2.303  -9.119
  395    HB3  LEU  69           HB2      LEU  69  14.754   3.014  -7.934
  396    HG   LEU  69           HG       LEU  69  12.524   1.080  -7.300
  397   HD11  LEU  69          HD11      LEU  69  14.620  -0.322  -6.667
  398   HD12  LEU  69          HD12      LEU  69  15.450   0.745  -7.800
  399   HD13  LEU  69          HD13      LEU  69  14.096  -0.243  -8.349
  400   HD21  LEU  69          HD21      LEU  69  13.965   0.994  -5.124
  401   HD22  LEU  69          HD22      LEU  69  12.769   2.271  -5.347
  402   HD23  LEU  69          HD23      LEU  69  14.479   2.603  -5.635
  403    H    ARG  70           H        ARG  70  12.374   4.818 -10.190
  404    HA   ARG  70           HA       ARG  70  14.480   6.826  -9.993
  405    HB2  ARG  70           HB1      ARG  70  12.821   5.721 -12.241
  406    HB3  ARG  70           HB2      ARG  70  13.690   7.250 -12.436
  407    HG2  ARG  70           HG1      ARG  70  15.624   5.590 -11.401
  408    HG3  ARG  70           HG2      ARG  70  14.692   4.520 -12.461
  409    HD2  ARG  70           HD1      ARG  70  15.323   5.599 -14.357
  410    HD3  ARG  70           HD2      ARG  70  15.345   7.180 -13.561
  411    HE   ARG  70           HE       ARG  70  17.470   5.787 -12.500
  412   HH11  ARG  70          HH11      ARG  70  16.450   6.826 -15.663
  413   HH12  ARG  70          HH12      ARG  70  18.064   6.980 -16.275
  414   HH21  ARG  70          HH21      ARG  70  19.599   5.985 -13.296
  415   HH22  ARG  70          HH22      ARG  70  19.854   6.500 -14.929
  416    H    ARG  71           H        ARG  71  11.603   6.790  -8.761
  417    HA   ARG  71           HA       ARG  71  10.739   9.412  -9.766
  418    HB2  ARG  71           HB1      ARG  71   9.290   7.233  -8.260
  419    HB3  ARG  71           HB2      ARG  71   8.623   8.860  -8.456
  420    HG2  ARG  71           HG1      ARG  71   9.375   7.009 -10.721
  421    HG3  ARG  71           HG2      ARG  71   7.735   7.277 -10.106
  422    HD2  ARG  71           HD1      ARG  71   8.275   9.802 -10.560
  423    HD3  ARG  71           HD2      ARG  71   9.507   9.129 -11.638
  424    HE   ARG  71           HE       ARG  71   7.185   7.819 -12.296
  425   HH11  ARG  71          HH11      ARG  71   8.255  11.130 -12.182
  426   HH12  ARG  71          HH12      ARG  71   7.217  11.646 -13.470
  427   HH21  ARG  71          HH21      ARG  71   5.814   8.486 -13.991
  428   HH22  ARG  71          HH22      ARG  71   5.828  10.142 -14.497
  429    H    ARG  72           H        ARG  72  10.465  11.147  -8.399
  430    HA   ARG  72           HA       ARG  72  12.112  11.210  -6.078
  431    HB2  ARG  72           HB1      ARG  72  10.067  13.235  -7.020
  432    HB3  ARG  72           HB2      ARG  72  11.359  13.522  -5.847
  433    HG2  ARG  72           HG1      ARG  72  12.272  12.492  -8.446
  434    HG3  ARG  72           HG2      ARG  72  11.525  14.098  -8.486
  435    HD2  ARG  72           HD1      ARG  72  13.085  14.976  -6.916
  436    HD3  ARG  72           HD2      ARG  72  13.684  13.358  -6.527
  437    HE   ARG  72           HE       ARG  72  15.083  13.488  -8.325
  438   HH11  ARG  72          HH11      ARG  72  12.548  15.845  -8.703
  439   HH12  ARG  72          HH12      ARG  72  13.250  16.565 -10.113
  440   HH21  ARG  72          HH21      ARG  72  16.017  14.430 -10.181
  441   HH22  ARG  72          HH22      ARG  72  15.223  15.760 -10.954
  442    H    CYS  73           H        CYS  73  11.417  11.809  -3.919
  443    HA   CYS  73           HA       CYS  73   8.648  11.353  -3.206
  444    HB2  CYS  73           HB1      CYS  73   9.157   9.556  -1.600
  445    HB3  CYS  73           HB2      CYS  73   9.489   9.068  -3.262
  446    H    GLN  74           H        GLN  74   8.150  11.989  -1.054
  447    HA   GLN  74           HA       GLN  74  10.184  13.768   0.106
  448    HB2  GLN  74           HB1      GLN  74   7.472  14.178  -0.557
  449    HB3  GLN  74           HB2      GLN  74   7.558  14.160   1.212
  450    HG2  GLN  74           HG1      GLN  74   8.882  16.034   1.323
  451    HG3  GLN  74           HG2      GLN  74   9.528  15.792  -0.307
  452   HE21  GLN  74          HE21      GLN  74   8.991  18.163  -0.289
  453   HE22  GLN  74          HE22      GLN  74   7.417  18.612  -0.841
  454    H    ARG  75           H        ARG  75   8.165  11.023   0.725
  455    HA   ARG  75           HA       ARG  75   9.372  10.783   3.390
  456    HB2  ARG  75           HB1      ARG  75   6.793  11.526   3.138
  457    HB3  ARG  75           HB2      ARG  75   6.606   9.766   3.087
  458    HG2  ARG  75           HG1      ARG  75   8.049   9.740   5.216
  459    HG3  ARG  75           HG2      ARG  75   7.677  11.470   5.302
  460    HD2  ARG  75           HD1      ARG  75   5.226  10.188   4.784
  461    HD3  ARG  75           HD2      ARG  75   6.041   9.216   6.017
  462    HE   ARG  75           HE       ARG  75   5.707  10.904   7.522
  463   HH11  ARG  75          HH11      ARG  75   5.265  12.151   4.301
  464   HH12  ARG  75          HH12      ARG  75   4.685  13.693   4.838
  465   HH21  ARG  75          HH21      ARG  75   4.944  12.931   8.239
  466   HH22  ARG  75          HH22      ARG  75   4.503  14.136   7.077
  467    H    ASP  76           H        ASP  76   9.344   8.565   4.230
  468    HA   ASP  76           HA       ASP  76  10.032   6.696   2.149
  469    HB2  ASP  76           HB1      ASP  76  11.465   6.576   4.000
  470    HB3  ASP  76           HB2      ASP  76  10.124   6.634   5.151
  471    HD2  ASP  76           HD       ASP  76  10.548   3.132   3.326
  472    H    ALA  77           H        ALA  77   7.303   7.338   4.173
  473    HA   ALA  77           HA       ALA  77   6.081   4.771   3.985
  474    HB1  ALA  77           HB1      ALA  77   4.852   7.458   4.591
  475    HB2  ALA  77           HB2      ALA  77   4.075   5.893   4.832
  476    HB3  ALA  77           HB3      ALA  77   5.505   6.320   5.771
  477    H    MET  78           H        MET  78   5.677   7.819   2.209
  478    HA   MET  78           HA       MET  78   3.563   7.021   0.561
  479    HB2  MET  78           HB1      MET  78   4.148   8.870  -0.867
  480    HB3  MET  78           HB2      MET  78   4.378   9.358   0.818
  481    HG2  MET  78           HG1      MET  78   6.465   9.946   0.386
  482    HG3  MET  78           HG2      MET  78   6.829   8.286  -0.094
  483    HE1  MET  78           HE1      MET  78   4.201  10.514  -2.321
  484    HE2  MET  78           HE2      MET  78   5.106  11.483  -1.157
  485    HE3  MET  78           HE3      MET  78   5.431  11.646  -2.883
  486    H    CYS  79           H        CYS  79   6.883   6.140   0.533
  487    HA   CYS  79           HA       CYS  79   6.875   5.267  -2.231
  488    HB2  CYS  79           HB1      CYS  79   8.891   6.226  -0.985
  489    HB3  CYS  79           HB2      CYS  79   8.984   4.670  -0.160
  490    H    CYS  80           H        CYS  80   6.953   3.137  -2.934
  491    HA   CYS  80           HA       CYS  80   5.338   1.284  -1.674
  492    HB2  CYS  80           HB1      CYS  80   7.283   1.228  -3.901
  493    HB3  CYS  80           HB2      CYS  80   6.932  -0.337  -3.167
  494    HA   PRO  81           HA       PRO  81   7.674  -0.736   1.441
  495    HB2  PRO  81           HB1      PRO  81   6.911  -3.351   1.154
  496    HB3  PRO  81           HB2      PRO  81   5.853  -2.093   1.795
  497    HG2  PRO  81           HG1      PRO  81   6.022  -3.200  -0.989
  498    HG3  PRO  81           HG2      PRO  81   4.564  -2.858   0.017
  499    HD2  PRO  81           HD1      PRO  81   5.404  -1.199  -1.960
  500    HD3  PRO  81           HD2      PRO  81   4.630  -0.608  -0.479
  501    H    GLY  82           H        GLY  82   9.530  -1.960   1.853
  502    HA2  GLY  82           HA2      GLY  82  11.303  -3.412   1.310
  503    HA3  GLY  82           HA3      GLY  82  10.757  -3.418  -0.360
  504    HA1  GLY  82           HA1      GLY  82  11.196  -2.565   1.536
  505    H    THR  83           H        THR  83  10.576  -0.363  -0.095
  506    HA   THR  83           HA       THR  83  13.452   0.139  -0.508
  507    HB   THR  83           HB       THR  83  12.818   1.921  -2.082
  508    HG1  THR  83           HG1      THR  83  10.456   1.657  -2.778
  509   HG21  THR  83          HG21      THR  83  12.233  -0.923  -2.489
  510   HG22  THR  83          HG22      THR  83  13.200   0.187  -3.462
  511   HG23  THR  83          HG23      THR  83  11.446   0.149  -3.648
  512    H    LEU  84           H        LEU  84  13.929   2.594  -0.336
  513    HA   LEU  84           HA       LEU  84  12.391   3.838   1.824
  514    HB2  LEU  84           HB1      LEU  84  14.790   2.520   2.277
  515    HB3  LEU  84           HB2      LEU  84  15.252   4.226   2.151
  516    HG   LEU  84           HG       LEU  84  13.120   4.354   3.856
  517   HD11  LEU  84          HD11      LEU  84  12.728   2.145   4.324
  518   HD12  LEU  84          HD12      LEU  84  13.905   2.539   5.575
  519   HD13  LEU  84          HD13      LEU  84  14.418   1.685   4.120
  520   HD21  LEU  84          HD21      LEU  84  16.017   4.542   3.992
  521   HD22  LEU  84          HD22      LEU  84  15.296   4.061   5.529
  522   HD23  LEU  84          HD23      LEU  84  14.779   5.551   4.740
  523    H    CYS  85           H        CYS  85  12.438   6.073   1.850
  524    HA   CYS  85           HA       CYS  85  13.058   7.334  -0.638
  525    HB2  CYS  85           HB1      CYS  85  11.152   7.888   1.005
  526    HB3  CYS  85           HB2      CYS  85  12.373   8.784   1.912
  527    H    VAL  86           H        VAL  86  15.120   7.680  -1.173
  528    HA   VAL  86           HA       VAL  86  16.854   8.995   0.814
  529    HB   VAL  86           HB       VAL  86  17.722   6.978  -1.261
  530   HG11  VAL  86          HG11      VAL  86  19.936   7.187  -0.258
  531   HG12  VAL  86          HG12      VAL  86  19.384   8.737  -0.896
  532   HG13  VAL  86          HG13      VAL  86  19.330   8.427   0.839
  533   HG21  VAL  86          HG21      VAL  86  16.647   6.584   1.304
  534   HG22  VAL  86          HG22      VAL  86  17.431   5.392   0.268
  535   HG23  VAL  86          HG23      VAL  86  18.382   6.298   1.444
  536    H    ASN  87           H        ASN  87  17.937  10.773   0.151
  537    HA   ASN  87           HA       ASN  87  18.437  12.599  -1.112
  538    HB2  ASN  87           HB1      ASN  87  18.733  10.434  -3.211
  539    HB3  ASN  87           HB2      ASN  87  19.244  12.109  -3.442
  540   HD21  ASN  87          HD21      ASN  87  21.366  11.275  -3.781
  541   HD22  ASN  87          HD22      ASN  87  22.366  10.864  -2.434
  542    H    ASP  88           H        ASP  88  15.669  11.983  -0.819
  543    HA   ASP  88           HA       ASP  88  13.645  12.697  -1.577
  544    HB2  ASP  88           HB1      ASP  88  15.372  14.663  -2.289
  545    HB3  ASP  88           HB2      ASP  88  14.738  14.203  -3.875
  546    HD2  ASP  88           HD       ASP  88  11.991  15.510  -1.320
  547    H    VAL  89           H        VAL  89  15.001  10.314  -2.712
  548    HA   VAL  89           HA       VAL  89  13.188   9.941  -4.968
  549    HB   VAL  89           HB       VAL  89  16.132   9.291  -5.176
  550   HG11  VAL  89          HG11      VAL  89  15.630   8.618  -7.450
  551   HG12  VAL  89          HG12      VAL  89  14.651   7.688  -6.314
  552   HG13  VAL  89          HG13      VAL  89  13.928   9.019  -7.218
  553   HG21  VAL  89          HG21      VAL  89  14.472  11.538  -6.250
  554   HG22  VAL  89          HG22      VAL  89  16.063  11.589  -5.490
  555   HG23  VAL  89          HG23      VAL  89  15.890  10.974  -7.134
  556    H    CYS  90           H        CYS  90  12.392   7.900  -5.128
  557    HA   CYS  90           HA       CYS  90  12.549   6.181  -2.924
  558    HB2  CYS  90           HB1      CYS  90  11.414   6.009  -5.678
  559    HB3  CYS  90           HB2      CYS  90  11.586   4.508  -4.765
  560    H    THR  91           H        THR  91  14.388   5.230  -2.318
  561    HA   THR  91           HA       THR  91  15.917   3.758  -4.365
  562    HB   THR  91           HB       THR  91  17.071   5.004  -1.864
  563    HG1  THR  91           HG1      THR  91  16.432   6.583  -3.427
  564   HG21  THR  91          HG21      THR  91  18.214   2.973  -2.787
  565   HG22  THR  91          HG22      THR  91  19.212   4.428  -2.778
  566   HG23  THR  91          HG23      THR  91  18.478   3.872  -4.282
  567    H    THR  92           H        THR  92  16.012   1.635  -4.065
  568    HA   THR  92           HA       THR  92  14.703   0.253  -2.065
  569    HB   THR  92           HB       THR  92  16.999  -1.259  -2.980
  570    HG1  THR  92           HG1      THR  92  17.134  -0.058  -4.793
  571   HG21  THR  92          HG21      THR  92  14.643  -1.999  -2.245
  572   HG22  THR  92          HG22      THR  92  15.376  -2.820  -3.622
  573   HG23  THR  92          HG23      THR  92  14.154  -1.577  -3.885
  574    H    MET  93           H        MET  93  15.347  -0.823  -0.189
  575    HA   MET  93           HA       MET  93  17.163   0.518   1.467
  576    HB2  MET  93           HB1      MET  93  15.305  -1.638   1.692
  577    HB3  MET  93           HB2      MET  93  16.836  -2.146   2.417
  578    HG2  MET  93           HG1      MET  93  16.163   0.542   3.233
  579    HG3  MET  93           HG2      MET  93  14.853  -0.585   3.588
  580    HE1  MET  93           HE1      MET  93  14.812  -0.358   5.896
  581    HE2  MET  93           HE2      MET  93  14.956  -2.115   5.937
  582    HE3  MET  93           HE3      MET  93  15.911  -1.125   7.043
  583    H    GLU  94           H        GLU  94  17.506  -2.417  -0.466
  584    HA   GLU  94           HA       GLU  94  20.015  -3.224   0.503
  585    HB2  GLU  94           HB1      GLU  94  18.632  -3.656  -2.147
  586    HB3  GLU  94           HB2      GLU  94  20.198  -4.384  -1.754
  587    HG2  GLU  94           HG1      GLU  94  19.094  -5.406   0.274
  588    HG3  GLU  94           HG2      GLU  94  17.554  -4.872  -0.415
  589    HE2  GLU  94           HE       GLU  94  19.471  -7.641  -2.532
  590    H    ASP  95           H        ASP  95  19.084  -0.870  -1.914
  591    HA   ASP  95           HA       ASP  95  21.768  -0.489  -2.888
  592    HB2  ASP  95           HB1      ASP  95  19.122   0.860  -3.380
  593    HB3  ASP  95           HB2      ASP  95  20.627   1.580  -3.972
  594    HD2  ASP  95           HD       ASP  95  20.852  -1.742  -5.744
  595    H    ALA  96           H        ALA  96  19.618   1.064  -0.588
  596    HA   ALA  96           HA       ALA  96  20.894   3.476  -0.175
  597    HB1  ALA  96           HB1      ALA  96  19.517   1.694   1.829
  598    HB2  ALA  96           HB2      ALA  96  19.987   3.366   2.140
  599    HB3  ALA  96           HB3      ALA  96  18.798   3.002   0.888
  600    H    THR  97           H        THR  97  21.541   0.390   1.484
  601    HA   THR  97           HA       THR  97  24.257   1.369   2.053
  602    HB   THR  97           HB       THR  97  23.175   1.568   4.158
  603    HG1  THR  97           HG1      THR  97  24.764   0.534   5.084
  604   HG21  THR  97          HG21      THR  97  21.684  -0.751   3.240
  605   HG22  THR  97          HG22      THR  97  21.254   0.461   4.448
  606   HG23  THR  97          HG23      THR  97  22.239  -0.928   4.904
  607    H    GLU  98           H        GLU  98  25.493   0.136   0.775
  608    HA   GLU  98           HA       GLU  98  24.829  -2.661   0.333
  609    HB2  GLU  98           HB1      GLU  98  26.764  -0.718  -0.878
  610    HB3  GLU  98           HB2      GLU  98  27.019  -2.457  -1.093
  611    HG2  GLU  98           HG1      GLU  98  25.188  -2.721  -2.431
  612    HG3  GLU  98           HG2      GLU  98  24.330  -1.358  -1.698
  613    HE2  GLU  98           HE       GLU  98  25.262  -0.048  -4.841
  614    H    ASN  99           H        ASN  99  26.708  -4.244   0.371
  615    HA   ASN  99           HA       ASN  99  27.647  -4.524   2.986
  616    HB2  ASN  99           HB1      ASN  99  28.794  -5.779   0.476
  617    HB3  ASN  99           HB2      ASN  99  29.007  -6.366   2.130
  618   HD21  ASN  99          HD21      ASN  99  27.564  -7.731   2.955
  619   HD22  ASN  99          HD22      ASN  99  26.072  -8.176   2.204
  620    H    LEU 100           H        LEU 100  29.731  -4.350   3.888
  621    HA   LEU 100           HA       LEU 100  31.416  -2.335   2.568
  622    HB2  LEU 100           HB1      LEU 100  30.572  -2.806   5.330
  623    HB3  LEU 100           HB2      LEU 100  32.313  -2.522   5.157
  624    HG   LEU 100           HG       LEU 100  30.211  -0.649   4.083
  625   HD11  LEU 100          HD11      LEU 100  31.644  -0.644   6.730
  626   HD12  LEU 100          HD12      LEU 100  29.905  -0.689   6.444
  627   HD13  LEU 100          HD13      LEU 100  30.826   0.764   6.052
  628   HD21  LEU 100          HD21      LEU 100  32.819   0.414   4.780
  629   HD22  LEU 100          HD22      LEU 100  31.899   0.565   3.282
  630   HD23  LEU 100          HD23      LEU 100  32.918  -0.849   3.553
  631    H    TYR 101           H        TYR 101  33.752  -2.517   2.868
  632    HA   TYR 101           HA       TYR 101  34.939  -4.954   3.732
  633    HB2  TYR 101           HB1      TYR 101  35.623  -5.906   1.663
  634    HB3  TYR 101           HB2      TYR 101  33.884  -5.629   1.538
  635    HD1  TYR 101           HD1      TYR 101  36.966  -5.186  -0.093
  636    HD2  TYR 101           HD2      TYR 101  33.185  -3.319   0.475
  637    HE1  TYR 101           HE1      TYR 101  37.303  -3.889  -2.156
  638    HE2  TYR 101           HE2      TYR 101  33.513  -2.016  -1.586
  639    HH   TYR 101           HH       TYR 101  34.798  -1.693  -3.375
  640    H    PHE 102           H        PHE 102  37.227  -4.901   3.662
  641    HA   PHE 102           HA       PHE 102  38.356  -2.279   2.931
  642    HB2  PHE 102           HB1      PHE 102  39.828  -2.387   4.847
  643    HB3  PHE 102           HB2      PHE 102  38.159  -2.571   5.388
  644    HD1  PHE 102           HD1      PHE 102  41.416  -3.978   5.467
  645    HD2  PHE 102           HD2      PHE 102  37.284  -4.952   5.767
  646    HE1  PHE 102           HE1      PHE 102  41.997  -6.074   6.617
  647    HE2  PHE 102           HE2      PHE 102  37.858  -7.050   6.917
  648    HZ   PHE 102           HZ       PHE 102  40.217  -7.613   7.345
  649    H    GLN 103           H        GLN 103  38.233  -4.771   1.386
  650    HA   GLN 103           HA       GLN 103  39.558  -6.020   0.024
  651    HB2  GLN 103           HB1      GLN 103  40.738  -3.516   0.192
  652    HB3  GLN 103           HB2      GLN 103  42.073  -4.634   0.521
  653    HG2  GLN 103           HG1      GLN 103  41.837  -5.713  -1.560
  654    HG3  GLN 103           HG2      GLN 103  40.261  -4.962  -1.846
  655   HE21  GLN 103          HE21      GLN 103  42.558  -4.925  -3.566
  656   HE22  GLN 103          HE22      GLN 103  43.001  -3.269  -3.782
  657    H    SER 104           H        SER 104  42.037  -6.979   0.041
  658    HA   SER 104           HA       SER 104  42.269  -8.283   2.673
  659    HB2  SER 104           HB1      SER 104  43.418  -9.511   0.191
  660    HB3  SER 104           HB2      SER 104  42.779 -10.294   1.647
  661    HG   SER 104           HG       SER 104  41.411  -9.299  -0.581
  662    H    LEU 105           H        LEU 105  43.903  -7.428   3.778
  663    HA   LEU 105           HA       LEU 105  46.469  -7.048   2.388
  664    HB2  LEU 105           HB1      LEU 105  46.873  -5.138   4.001
  665    HB3  LEU 105           HB2      LEU 105  45.700  -4.855   2.704
  666    HG   LEU 105           HG       LEU 105  44.258  -5.796   4.954
  667   HD11  LEU 105          HD11      LEU 105  44.927  -4.578   6.758
  668   HD12  LEU 105          HD12      LEU 105  45.686  -3.327   5.775
  669   HD13  LEU 105          HD13      LEU 105  46.499  -4.873   6.014
  670   HD21  LEU 105          HD21      LEU 105  43.382  -3.402   4.842
  671   HD22  LEU 105          HD22      LEU 105  43.211  -4.394   3.394
  672   HD23  LEU 105          HD23      LEU 105  44.492  -3.186   3.488
  673    H    GLU 106           H        GLU 106  48.355  -7.129   3.822
  674    HA   GLU 106           HA       GLU 106  48.015  -8.281   6.446
  675    HB2  GLU 106           HB1      GLU 106  48.584  -9.931   4.090
  676    HB3  GLU 106           HB2      GLU 106  49.757 -10.136   5.400
  677    HG2  GLU 106           HG1      GLU 106  47.871 -10.570   6.961
  678    HG3  GLU 106           HG2      GLU 106  46.779 -10.516   5.571
  679    HE2  GLU 106           HE       GLU 106  48.787 -13.801   6.243
  680    H    HIS 107           H        HIS 107  49.949  -8.323   7.669
  681    HA   HIS 107           HA       HIS 107  52.150  -6.772   6.468
  682    HB2  HIS 107           HB1      HIS 107  50.761  -6.572   9.088
  683    HB3  HIS 107           HB2      HIS 107  52.510  -6.323   9.098
  684    HD1  HIS 107           HD1      HIS 107  50.587  -5.176   6.123
  685    HD2  HIS 107           HD2      HIS 107  52.161  -3.576   9.619
  686    HE1  HIS 107           HE1      HIS 107  50.488  -2.681   5.825
  687    HE2  HIS 107           HE2      HIS 107  51.448  -1.702   7.961
  688    H    HIS 108           H        HIS 108  54.294  -7.248   7.192
  689    HA   HIS 108           HA       HIS 108  54.696  -9.711   8.689
  690    HB2  HIS 108           HB1      HIS 108  54.466 -10.092   6.092
  691    HB3  HIS 108           HB2      HIS 108  56.126  -9.489   6.068
  692    HD1  HIS 108           HD1      HIS 108  54.254 -12.539   6.498
  693    HD2  HIS 108           HD2      HIS 108  57.898 -11.070   7.848
  694    HE1  HIS 108           HE1      HIS 108  55.550 -14.555   7.263
  695    HE2  HIS 108           HE2      HIS 108  57.777 -13.658   8.088
  696    H    HIS 109           H        HIS 109  56.747  -9.900   9.603
  697    HA   HIS 109           HA       HIS 109  58.895  -8.143   8.977
  698    HB2  HIS 109           HB1      HIS 109  58.924  -6.768  10.949
  699    HB3  HIS 109           HB2      HIS 109  57.356  -6.571  10.158
  700    HD1  HIS 109           HD1      HIS 109  55.273  -7.591  11.342
  701    HD2  HIS 109           HD2      HIS 109  58.810  -7.906  13.498
  702    HE1  HIS 109           HE1      HIS 109  54.583  -8.215  13.679
  703    HE2  HIS 109           HE2      HIS 109  56.744  -8.407  14.998
  704    H    HIS 110           H        HIS 110  60.797  -8.839   9.857
  705    HA   HIS 110           HA       HIS 110  60.752 -10.731  12.070
  706    HB2  HIS 110           HB1      HIS 110  61.326 -11.436   9.253
  707    HB3  HIS 110           HB2      HIS 110  62.467 -12.065  10.447
  708    HD1  HIS 110           HD1      HIS 110  58.977 -12.471   9.239
  709    HD2  HIS 110           HD2      HIS 110  61.406 -13.953  12.266
  710    HE1  HIS 110           HE1      HIS 110  57.759 -14.468  10.161
  711    HE2  HIS 110           HE2      HIS 110  59.243 -15.375  12.011
  712    H    HIS 111           H        HIS 111  63.138  -9.874   9.570
  713    HA   HIS 111           HA       HIS 111  65.241  -9.013   9.709
  714    HB2  HIS 111           HB1      HIS 111  63.877  -7.567  11.980
  715    HB3  HIS 111           HB2      HIS 111  65.558  -7.246  11.539
  716    HD1  HIS 111           HD1      HIS 111  62.784  -7.809   9.039
  717    HD2  HIS 111           HD2      HIS 111  65.222  -4.751  10.444
  718    HE1  HIS 111           HE1      HIS 111  62.369  -5.859   7.505
  719    HE2  HIS 111           HE2      HIS 111  63.860  -3.991   8.362
  720    H    HIS 112           H        HIS 112  67.068  -8.524  11.525
  721    HA   HIS 112           HA       HIS 112  67.140 -10.910  13.255
  722    HB2  HIS 112           HB1      HIS 112  68.922 -10.102  11.136
  723    HB3  HIS 112           HB2      HIS 112  69.794 -10.143  12.671
  724    HD1  HIS 112           HD1      HIS 112  69.102 -12.269   9.961
  725    HD2  HIS 112           HD2      HIS 112  69.076 -12.780  14.085
  726    HE1  HIS 112           HE1      HIS 112  69.296 -14.749  10.333
  727    HE2  HIS 112           HE2      HIS 112  69.279 -15.063  12.852
  Start of MODEL   14
    1    H1   MET  18           H        MET  18 -47.941  -7.263  56.679
    2    HA   MET  18           HA       MET  18 -45.850  -9.105  56.029
    3    HB2  MET  18           HB1      MET  18 -48.164  -8.773  54.106
    4    HB3  MET  18           HB2      MET  18 -46.609  -9.504  53.686
    5    HG2  MET  18           HG1      MET  18 -48.100 -10.612  56.015
    6    HG3  MET  18           HG2      MET  18 -48.685 -10.964  54.387
    7    HE1  MET  18           HE1      MET  18 -48.335 -13.095  55.958
    8    HE2  MET  18           HE2      MET  18 -47.108 -14.231  55.397
    9    HE3  MET  18           HE3      MET  18 -46.799 -13.230  56.815
   10    H    LEU  19           H        LEU  19 -47.838  -6.507  54.612
   11    HA   LEU  19           HA       LEU  19 -47.288  -4.521  53.653
   12    HB2  LEU  19           HB1      LEU  19 -45.837  -4.667  55.945
   13    HB3  LEU  19           HB2      LEU  19 -44.556  -4.450  54.740
   14    HG   LEU  19           HG       LEU  19 -46.016  -2.438  53.949
   15   HD11  LEU  19          HD11      LEU  19 -47.876  -3.141  55.539
   16   HD12  LEU  19          HD12      LEU  19 -47.414  -1.440  55.546
   17   HD13  LEU  19          HD13      LEU  19 -46.855  -2.510  56.831
   18   HD21  LEU  19          HD21      LEU  19 -44.578  -2.188  56.579
   19   HD22  LEU  19          HD22      LEU  19 -44.725  -0.986  55.297
   20   HD23  LEU  19          HD23      LEU  19 -43.740  -2.429  55.047
   21    H    VAL  20           H        VAL  20 -47.153  -5.006  51.516
   22    HA   VAL  20           HA       VAL  20 -45.079  -6.464  50.293
   23    HB   VAL  20           HB       VAL  20 -45.910  -5.426  48.159
   24   HG11  VAL  20          HG11      VAL  20 -48.350  -6.357  49.535
   25   HG12  VAL  20          HG12      VAL  20 -47.587  -6.938  48.053
   26   HG13  VAL  20          HG13      VAL  20 -46.950  -7.425  49.624
   27   HG21  VAL  20          HG21      VAL  20 -47.995  -4.157  49.926
   28   HG22  VAL  20          HG22      VAL  20 -46.620  -3.283  49.249
   29   HG23  VAL  20          HG23      VAL  20 -47.823  -3.999  48.177
   30    H    LEU  21           H        LEU  21 -43.246  -5.841  49.197
   31    HA   LEU  21           HA       LEU  21 -42.054  -3.361  50.047
   32    HB2  LEU  21           HB1      LEU  21 -41.061  -5.601  48.283
   33    HB3  LEU  21           HB2      LEU  21 -40.096  -4.181  48.726
   34    HG   LEU  21           HG       LEU  21 -41.221  -6.110  50.748
   35   HD11  LEU  21          HD11      LEU  21 -38.340  -6.119  50.094
   36   HD12  LEU  21          HD12      LEU  21 -39.422  -6.886  48.933
   37   HD13  LEU  21          HD13      LEU  21 -39.395  -7.437  50.607
   38   HD21  LEU  21          HD21      LEU  21 -40.505  -3.682  51.310
   39   HD22  LEU  21          HD22      LEU  21 -38.866  -4.300  51.103
   40   HD23  LEU  21          HD23      LEU  21 -39.928  -5.008  52.319
   41    H    ASP  22           H        ASP  22 -41.697  -1.557  48.868
   42    HA   ASP  22           HA       ASP  22 -43.225  -1.151  46.497
   43    HB2  ASP  22           HB1      ASP  22 -42.267   0.497  48.433
   44    HB3  ASP  22           HB2      ASP  22 -41.104   0.804  47.137
   45    HD2  ASP  22           HD       ASP  22 -44.038   2.970  46.746
   46    H    PHE  23           H        PHE  23 -41.903   0.222  44.704
   47    HA   PHE  23           HA       PHE  23 -39.439  -1.176  44.003
   48    HB2  PHE  23           HB1      PHE  23 -42.032  -1.600  42.722
   49    HB3  PHE  23           HB2      PHE  23 -40.784  -1.100  41.579
   50    HD1  PHE  23           HD1      PHE  23 -39.091  -2.571  40.873
   51    HD2  PHE  23           HD2      PHE  23 -41.619  -3.644  44.125
   52    HE1  PHE  23           HE1      PHE  23 -38.199  -4.863  40.805
   53    HE2  PHE  23           HE2      PHE  23 -40.730  -5.937  44.063
   54    HZ   PHE  23           HZ       PHE  23 -39.017  -6.549  42.403
   55    H    ASN  24           H        ASN  24 -38.638  -0.234  41.786
   56    HA   ASN  24           HA       ASN  24 -39.387   2.442  41.161
   57    HB2  ASN  24           HB1      ASN  24 -37.582   3.677  42.026
   58    HB3  ASN  24           HB2      ASN  24 -38.090   2.642  43.366
   59   HD21  ASN  24          HD21      ASN  24 -35.501   3.901  42.804
   60   HD22  ASN  24          HD22      ASN  24 -34.349   2.614  42.791
   61    H    ASN  25           H        ASN  25 -37.757   3.446  39.613
   62    HA   ASN  25           HA       ASN  25 -35.871   1.740  38.321
   63    HB2  ASN  25           HB1      ASN  25 -37.040   1.591  36.139
   64    HB3  ASN  25           HB2      ASN  25 -37.873   0.700  37.418
   65   HD21  ASN  25          HD21      ASN  25 -39.954   0.792  36.942
   66   HD22  ASN  25          HD22      ASN  25 -40.845   2.231  36.595
   67    H    ILE  26           H        ILE  26 -34.764   2.796  36.567
   68    HA   ILE  26           HA       ILE  26 -35.186   5.714  36.536
   69    HB   ILE  26           HB       ILE  26 -32.555   4.247  36.305
   70   HG12  ILE  26          HG11      ILE  26 -33.509   6.086  38.508
   71   HG13  ILE  26          HG12      ILE  26 -33.630   4.320  38.593
   72   HG21  ILE  26          HG21      ILE  26 -33.372   7.051  35.849
   73   HG22  ILE  26          HG22      ILE  26 -31.862   6.795  36.720
   74   HG23  ILE  26          HG23      ILE  26 -32.077   6.110  35.109
   75   HD11  ILE  26          HD11      ILE  26 -31.152   4.215  38.284
   76   HD12  ILE  26          HD12      ILE  26 -31.124   5.969  38.470
   77   HD13  ILE  26          HD13      ILE  26 -31.689   4.951  39.794
   78    H    ARG  27           H        ARG  27 -34.154   2.886  34.690
   79    HA   ARG  27           HA       ARG  27 -34.141   2.439  32.461
   80    HB2  ARG  27           HB1      ARG  27 -36.365   4.219  32.897
   81    HB3  ARG  27           HB2      ARG  27 -35.645   4.524  31.310
   82    HG2  ARG  27           HG1      ARG  27 -36.411   2.609  30.444
   83    HG3  ARG  27           HG2      ARG  27 -36.004   1.689  31.902
   84    HD2  ARG  27           HD1      ARG  27 -38.288   1.540  31.997
   85    HD3  ARG  27           HD2      ARG  27 -38.040   3.037  32.907
   86    HE   ARG  27           HE       ARG  27 -38.334   3.872  30.330
   87   HH11  ARG  27          HH11      ARG  27 -40.222   1.912  32.501
   88   HH12  ARG  27          HH12      ARG  27 -41.740   2.365  31.798
   89   HH21  ARG  27          HH21      ARG  27 -40.325   4.476  29.396
   90   HH22  ARG  27          HH22      ARG  27 -41.797   3.822  30.031
   91    H    SER  28           H        SER  28 -33.712   3.540  30.224
   92    HA   SER  28           HA       SER  28 -32.255   6.004  30.275
   93    HB2  SER  28           HB1      SER  28 -30.774   3.374  30.185
   94    HB3  SER  28           HB2      SER  28 -30.097   4.846  29.465
   95    HG   SER  28           HG       SER  28 -29.440   5.276  31.407
   96    H    SER  29           H        SER  29 -31.882   6.817  28.232
   97    HA   SER  29           HA       SER  29 -32.995   5.213  26.027
   98    HB2  SER  29           HB1      SER  29 -32.702   8.131  25.636
   99    HB3  SER  29           HB2      SER  29 -34.055   7.058  25.232
  100    HG   SER  29           HG       SER  29 -34.912   8.091  26.883
  101    H    ALA  30           H        ALA  30 -32.142   6.286  23.821
  102    HA   ALA  30           HA       ALA  30 -29.338   6.968  23.895
  103    HB1  ALA  30           HB1      ALA  30 -29.115   4.593  24.114
  104    HB2  ALA  30           HB2      ALA  30 -30.233   4.315  22.779
  105    HB3  ALA  30           HB3      ALA  30 -28.656   5.043  22.471
  106    H    ASP  31           H        ASP  31 -28.544   6.681  21.391
  107    HA   ASP  31           HA       ASP  31 -30.667   7.657  19.625
  108    HB2  ASP  31           HB1      ASP  31 -29.175   9.501  20.823
  109    HB3  ASP  31           HB2      ASP  31 -28.046   9.080  19.528
  110    HD2  ASP  31           HD       ASP  31 -30.230  10.363  17.079
  111    H    LEU  32           H        LEU  32 -30.300   7.313  17.423
  112    HA   LEU  32           HA       LEU  32 -27.844   5.929  16.652
  113    HB2  LEU  32           HB1      LEU  32 -30.148   4.525  17.247
  114    HB3  LEU  32           HB2      LEU  32 -30.213   4.701  15.484
  115    HG   LEU  32           HG       LEU  32 -27.760   3.794  15.595
  116   HD11  LEU  32          HD11      LEU  32 -28.102   3.878  18.231
  117   HD12  LEU  32          HD12      LEU  32 -27.089   2.669  17.445
  118   HD13  LEU  32          HD13      LEU  32 -28.733   2.258  17.932
  119   HD21  LEU  32          HD21      LEU  32 -28.949   1.406  15.867
  120   HD22  LEU  32          HD22      LEU  32 -29.094   2.400  14.416
  121   HD23  LEU  32          HD23      LEU  32 -30.374   2.419  15.630
  122    H    HIS  33           H        HIS  33 -28.407   5.237  14.108
  123    HA   HIS  33           HA       HIS  33 -28.492   6.059  11.988
  124    HB2  HIS  33           HB1      HIS  33 -30.934   6.310  12.789
  125    HB3  HIS  33           HB2      HIS  33 -30.564   8.032  12.923
  126    HD1  HIS  33           HD1      HIS  33 -31.570   9.164  10.974
  127    HD2  HIS  33           HD2      HIS  33 -29.785   5.565   9.914
  128    HE1  HIS  33           HE1      HIS  33 -31.796   9.012   8.474
  129    HE2  HIS  33           HE2      HIS  33 -30.705   6.813   7.825
  130    H    GLY  34           H        GLY  34 -26.419   6.956  11.991
  131    HA2  GLY  34           HA2      GLY  34 -26.312   9.761  11.518
  132    HA3  GLY  34           HA3      GLY  34 -25.613   9.368  13.083
  133    HA1  GLY  34           HA1      GLY  34 -26.230   8.997  11.081
  134    H    ALA  35           H        ALA  35 -25.015   9.679   9.801
  135    HA   ALA  35           HA       ALA  35 -22.404   8.359  10.121
  136    HB1  ALA  35           HB1      ALA  35 -24.471   7.675   8.264
  137    HB2  ALA  35           HB2      ALA  35 -23.054   8.257   7.388
  138    HB3  ALA  35           HB3      ALA  35 -22.902   6.910   8.517
  139    H    ARG  36           H        ARG  36 -20.752   9.687   9.774
  140    HA   ARG  36           HA       ARG  36 -21.157  12.018   8.022
  141    HB2  ARG  36           HB1      ARG  36 -20.320  11.906  10.839
  142    HB3  ARG  36           HB2      ARG  36 -19.271  12.889   9.808
  143    HG2  ARG  36           HG1      ARG  36 -21.498  13.954   8.982
  144    HG3  ARG  36           HG2      ARG  36 -22.147  13.288  10.490
  145    HD2  ARG  36           HD1      ARG  36 -20.909  14.686  11.820
  146    HD3  ARG  36           HD2      ARG  36 -19.601  14.810  10.636
  147    HE   ARG  36           HE       ARG  36 -21.628  16.102   9.413
  148   HH11  ARG  36          HH11      ARG  36 -20.222  16.359  12.586
  149   HH12  ARG  36          HH12      ARG  36 -20.575  18.047  12.749
  150   HH21  ARG  36          HH21      ARG  36 -22.099  18.325   9.614
  151   HH22  ARG  36          HH22      ARG  36 -21.644  19.164  11.058
  152    H    LYS  37           H        LYS  37 -19.725  12.159   6.428
  153    HA   LYS  37           HA       LYS  37 -17.361  10.436   6.506
  154    HB2  LYS  37           HB1      LYS  37 -18.424  12.025   4.162
  155    HB3  LYS  37           HB2      LYS  37 -17.263  10.688   4.122
  156    HG2  LYS  37           HG1      LYS  37 -18.946   9.097   4.722
  157    HG3  LYS  37           HG2      LYS  37 -20.120  10.390   5.016
  158    HD2  LYS  37           HD1      LYS  37 -20.651   9.484   2.887
  159    HD3  LYS  37           HD2      LYS  37 -19.852  11.038   2.591
  160    HE2  LYS  37           HE1      LYS  37 -17.675   9.608   2.445
  161    HE3  LYS  37           HE2      LYS  37 -18.801   8.266   2.184
  162    HZ1  LYS  37           HZ1      LYS  37 -17.999  10.326   0.380
  163    HZ2  LYS  37           HZ2      LYS  37 -19.683  10.232   0.501
  164    HZ3  LYS  37           HZ3      LYS  37 -18.790   8.865   0.060
  165    H    GLY  38           H        GLY  38 -15.612  11.622   4.853
  166    HA2  GLY  38           HA2      GLY  38 -15.209  14.399   5.487
  167    HA3  GLY  38           HA3      GLY  38 -14.137  13.330   6.380
  168    HA1  GLY  38           HA1      GLY  38 -15.411  13.911   4.779
  169    H    SER  39           H        SER  39 -14.737  14.903   3.413
  170    HA   SER  39           HA       SER  39 -13.560  15.080   1.475
  171    HB2  SER  39           HB1      SER  39 -11.718  15.357   3.293
  172    HB3  SER  39           HB2      SER  39 -11.226  13.726   2.801
  173    HG   SER  39           HG       SER  39 -10.083  15.113   1.527
  174    H    GLN  40           H        GLN  40 -11.815  13.584   0.106
  175    HA   GLN  40           HA       GLN  40 -13.379  11.408  -0.786
  176    HB2  GLN  40           HB1      GLN  40 -11.466  12.883  -1.934
  177    HB3  GLN  40           HB2      GLN  40 -10.484  11.490  -1.454
  178    HG2  GLN  40           HG1      GLN  40 -11.278  11.253  -3.741
  179    HG3  GLN  40           HG2      GLN  40 -11.951  10.000  -2.689
  180   HE21  GLN  40          HE21      GLN  40 -13.698   9.609  -4.017
  181   HE22  GLN  40          HE22      GLN  40 -15.007  10.723  -4.188
  182    H    CYS  41           H        CYS  41 -10.632  11.658   1.380
  183    HA   CYS  41           HA       CYS  41 -11.160   9.023   2.417
  184    HB2  CYS  41           HB1      CYS  41  -9.020   8.041   1.969
  185    HB3  CYS  41           HB2      CYS  41  -9.701   8.580   0.433
  186    H    LEU  42           H        LEU  42 -10.433   8.772   4.492
  187    HA   LEU  42           HA       LEU  42  -9.468  11.171   5.797
  188    HB2  LEU  42           HB1      LEU  42 -10.642   8.573   6.658
  189    HB3  LEU  42           HB2      LEU  42  -9.628   9.455   7.815
  190    HG   LEU  42           HG       LEU  42 -11.686  11.114   6.561
  191   HD11  LEU  42          HD11      LEU  42 -12.536   8.873   8.390
  192   HD12  LEU  42          HD12      LEU  42 -12.885   8.962   6.663
  193   HD13  LEU  42          HD13      LEU  42 -13.555  10.169   7.762
  194   HD21  LEU  42          HD21      LEU  42 -10.395  11.934   8.402
  195   HD22  LEU  42          HD22      LEU  42 -10.813  10.531   9.386
  196   HD23  LEU  42          HD23      LEU  42 -12.055  11.706   8.952
  197    H    SER  43           H        SER  43  -8.245   8.087   4.791
  198    HA   SER  43           HA       SER  43  -5.555   8.899   5.453
  199    HB2  SER  43           HB1      SER  43  -6.083   7.927   7.573
  200    HB3  SER  43           HB2      SER  43  -6.854   6.528   6.804
  201    HG   SER  43           HG       SER  43  -4.475   6.515   7.622
  202    H    ASP  44           H        ASP  44  -3.936   7.468   4.533
  203    HA   ASP  44           HA       ASP  44  -4.482   6.695   1.925
  204    HB2  ASP  44           HB1      ASP  44  -2.309   5.320   2.181
  205    HB3  ASP  44           HB2      ASP  44  -2.223   7.072   2.407
  206    HD2  ASP  44           HD       ASP  44  -1.190   4.781   5.373
  207    H    THR  45           H        THR  45  -4.852   4.931   4.894
  208    HA   THR  45           HA       THR  45  -4.859   2.305   3.969
  209    HB   THR  45           HB       THR  45  -6.895   2.981   6.014
  210    HG1  THR  45           HG1      THR  45  -4.110   3.483   6.365
  211   HG21  THR  45          HG21      THR  45  -5.526   1.185   7.221
  212   HG22  THR  45          HG22      THR  45  -4.677   0.978   5.688
  213   HG23  THR  45          HG23      THR  45  -6.414   0.692   5.780
  214    H    ASP  46           H        ASP  46  -7.194   4.828   3.558
  215    HA   ASP  46           HA       ASP  46  -9.408   3.140   2.912
  216    HB2  ASP  46           HB1      ASP  46  -9.086   5.828   3.476
  217    HB3  ASP  46           HB2      ASP  46  -9.467   5.824   1.750
  218    HD2  ASP  46           HD       ASP  46 -12.759   5.096   2.341
  219    H    CYS  47           H        CYS  47  -6.742   4.512   1.149
  220    HA   CYS  47           HA       CYS  47  -7.804   4.253  -1.460
  221    HB2  CYS  47           HB1      CYS  47  -5.396   5.149  -0.279
  222    HB3  CYS  47           HB2      CYS  47  -4.948   3.890  -1.431
  223    H    ASN  48           H        ASN  48  -6.378   2.001   0.757
  224    HA   ASN  48           HA       ASN  48  -6.073  -0.251   0.681
  225    HB2  ASN  48           HB1      ASN  48  -8.402   0.241  -0.758
  226    HB3  ASN  48           HB2      ASN  48  -7.451  -0.797  -1.829
  227   HD21  ASN  48          HD21      ASN  48  -8.169  -2.790  -1.651
  228   HD22  ASN  48          HD22      ASN  48  -8.508  -3.620  -0.175
  229    H    THR  49           H        THR  49  -5.097  -2.034  -0.632
  230    HA   THR  49           HA       THR  49  -3.420  -2.841  -1.944
  231    HB   THR  49           HB       THR  49  -3.448  -0.667  -3.927
  232    HG1  THR  49           HG1      THR  49  -5.535  -0.664  -4.310
  233   HG21  THR  49          HG21      THR  49  -2.450  -2.525  -4.791
  234   HG22  THR  49          HG22      THR  49  -4.111  -2.874  -5.273
  235   HG23  THR  49          HG23      THR  49  -3.433  -3.632  -3.833
  236    H    ARG  50           H        ARG  50  -1.318  -2.008  -3.193
  237    HA   ARG  50           HA       ARG  50   0.180  -0.562  -1.211
  238    HB2  ARG  50           HB1      ARG  50   2.099  -0.940  -2.770
  239    HB3  ARG  50           HB2      ARG  50   1.259  -2.418  -2.278
  240    HG2  ARG  50           HG1      ARG  50  -0.011  -1.543  -4.635
  241    HG3  ARG  50           HG2      ARG  50   1.734  -1.407  -4.907
  242    HD2  ARG  50           HD1      ARG  50   2.089  -3.712  -4.352
  243    HD3  ARG  50           HD2      ARG  50   0.418  -3.876  -3.794
  244    HE   ARG  50           HE       ARG  50   0.623  -3.093  -6.549
  245   HH11  ARG  50          HH11      ARG  50   0.612  -5.782  -4.338
  246   HH12  ARG  50          HH12      ARG  50   0.085  -6.927  -5.528
  247   HH21  ARG  50          HH21      ARG  50  -0.071  -4.590  -8.124
  248   HH22  ARG  50          HH22      ARG  50  -0.302  -6.248  -7.680
  249    H    LYS  51           H        LYS  51  -1.443   1.314  -1.715
  250    HA   LYS  51           HA       LYS  51   0.041   3.229  -3.335
  251    HB2  LYS  51           HB1      LYS  51  -2.944   2.851  -3.669
  252    HB3  LYS  51           HB2      LYS  51  -1.913   4.004  -4.533
  253    HG2  LYS  51           HG1      LYS  51  -0.721   2.150  -5.604
  254    HG3  LYS  51           HG2      LYS  51  -1.769   1.002  -4.750
  255    HD2  LYS  51           HD1      LYS  51  -3.599   1.468  -6.046
  256    HD3  LYS  51           HD2      LYS  51  -3.078   3.133  -6.357
  257    HE2  LYS  51           HE1      LYS  51  -1.815   2.561  -8.160
  258    HE3  LYS  51           HE2      LYS  51  -1.353   1.003  -7.457
  259    HZ1  LYS  51           HZ1      LYS  51  -3.355   1.535  -9.349
  260    HZ2  LYS  51           HZ2      LYS  51  -4.095   0.919  -7.958
  261    HZ3  LYS  51           HZ3      LYS  51  -2.870   0.040  -8.724
  262    H    PHE  52           H        PHE  52  -0.481   5.445  -2.850
  263    HA   PHE  52           HA       PHE  52  -1.569   5.740  -0.137
  264    HB2  PHE  52           HB1      PHE  52  -0.346   7.955  -0.182
  265    HB3  PHE  52           HB2      PHE  52   0.678   6.517  -0.222
  266    HD1  PHE  52           HD1      PHE  52  -0.852   9.075  -2.436
  267    HD2  PHE  52           HD2      PHE  52   2.256   6.217  -1.901
  268    HE1  PHE  52           HE1      PHE  52   0.243   9.890  -4.482
  269    HE2  PHE  52           HE2      PHE  52   3.357   7.028  -3.946
  270    HZ   PHE  52           HZ       PHE  52   2.351   8.867  -5.239
  271    H    CYS  53           H        CYS  53  -2.505   8.029   0.241
  272    HA   CYS  53           HA       CYS  53  -4.593   8.411  -1.762
  273    HB2  CYS  53           HB1      CYS  53  -4.441   8.598   1.092
  274    HB3  CYS  53           HB2      CYS  53  -4.940  10.164   0.450
  275    H    LEU  54           H        LEU  54  -3.578   9.556  -3.389
  276    HA   LEU  54           HA       LEU  54  -2.037  11.915  -2.846
  277    HB2  LEU  54           HB1      LEU  54  -1.653  10.418  -4.797
  278    HB3  LEU  54           HB2      LEU  54  -3.201  10.969  -5.461
  279    HG   LEU  54           HG       LEU  54  -2.174  13.325  -5.375
  280   HD11  LEU  54          HD11      LEU  54  -0.218  12.384  -3.968
  281   HD12  LEU  54          HD12      LEU  54   0.122  13.574  -5.224
  282   HD13  LEU  54          HD13      LEU  54   0.432  11.863  -5.523
  283   HD21  LEU  54          HD21      LEU  54  -2.287  11.368  -7.321
  284   HD22  LEU  54          HD22      LEU  54  -0.613  11.920  -7.382
  285   HD23  LEU  54          HD23      LEU  54  -1.932  13.077  -7.576
  286    H    GLN  55           H        GLN  55  -2.727  13.948  -2.655
  287    HA   GLN  55           HA       GLN  55  -5.401  14.640  -3.652
  288    HB2  GLN  55           HB1      GLN  55  -4.312  15.497  -0.961
  289    HB3  GLN  55           HB2      GLN  55  -5.911  15.862  -1.627
  290    HG2  GLN  55           HG1      GLN  55  -6.043  13.203  -1.734
  291    HG3  GLN  55           HG2      GLN  55  -4.892  13.372  -0.401
  292   HE21  GLN  55          HE21      GLN  55  -5.732  15.529   0.938
  293   HE22  GLN  55          HE22      GLN  55  -7.327  15.292   1.558
  294    HA   PRO  56           HA       PRO  56  -2.379  17.706  -5.216
  295    HB2  PRO  56           HB1      PRO  56  -3.704  18.124  -7.577
  296    HB3  PRO  56           HB2      PRO  56  -2.575  16.795  -7.316
  297    HG2  PRO  56           HG1      PRO  56  -5.570  16.808  -7.143
  298    HG3  PRO  56           HG2      PRO  56  -4.479  15.613  -7.938
  299    HD2  PRO  56           HD1      PRO  56  -5.611  15.175  -5.508
  300    HD3  PRO  56           HD2      PRO  56  -4.000  14.572  -5.937
  301    H    ARG  57           H        ARG  57  -2.551  19.945  -5.397
  302    HA   ARG  57           HA       ARG  57  -4.897  21.090  -4.154
  303    HB2  ARG  57           HB1      ARG  57  -2.401  21.708  -3.760
  304    HB3  ARG  57           HB2      ARG  57  -2.593  22.690  -5.221
  305    HG2  ARG  57           HG1      ARG  57  -4.421  23.929  -4.176
  306    HG3  ARG  57           HG2      ARG  57  -4.242  22.944  -2.714
  307    HD2  ARG  57           HD1      ARG  57  -1.800  23.743  -2.687
  308    HD3  ARG  57           HD2      ARG  57  -2.334  24.961  -3.853
  309    HE   ARG  57           HE       ARG  57  -2.826  24.952  -1.043
  310   HH11  ARG  57          HH11      ARG  57  -4.130  25.935  -4.117
  311   HH12  ARG  57          HH12      ARG  57  -5.067  27.233  -3.453
  312   HH21  ARG  57          HH21      ARG  57  -4.054  26.658  -0.157
  313   HH22  ARG  57          HH22      ARG  57  -5.022  27.643  -1.199
  314    H    ASP  58           H        ASP  58  -3.453  20.928  -7.327
  315    HA   ASP  58           HA       ASP  58  -5.235  22.938  -8.423
  316    HB2  ASP  58           HB1      ASP  58  -3.212  21.122  -9.762
  317    HB3  ASP  58           HB2      ASP  58  -4.114  22.408 -10.571
  318    HD2  ASP  58           HD       ASP  58  -2.072  24.875  -9.282
  319    H    GLU  59           H        GLU  59  -5.119  19.516  -8.027
  320    HA   GLU  59           HA       GLU  59  -7.532  19.258  -9.701
  321    HB2  GLU  59           HB1      GLU  59  -5.193  17.397  -9.348
  322    HB3  GLU  59           HB2      GLU  59  -6.772  16.791  -9.870
  323    HG2  GLU  59           HG1      GLU  59  -6.708  17.950 -11.887
  324    HG3  GLU  59           HG2      GLU  59  -5.454  19.056 -11.310
  325    HE2  GLU  59           HE       GLU  59  -3.854  16.622 -13.453
  326    H    LYS  60           H        LYS  60  -8.569  16.953  -9.040
  327    HA   LYS  60           HA       LYS  60  -9.334  17.313  -6.262
  328    HB2  LYS  60           HB1      LYS  60 -10.434  15.872  -8.625
  329    HB3  LYS  60           HB2      LYS  60 -10.844  15.244  -7.020
  330    HG2  LYS  60           HG1      LYS  60 -12.055  17.114  -6.432
  331    HG3  LYS  60           HG2      LYS  60 -11.202  18.150  -7.591
  332    HD2  LYS  60           HD1      LYS  60 -12.392  16.262  -9.216
  333    HD3  LYS  60           HD2      LYS  60 -13.600  16.526  -7.946
  334    HE2  LYS  60           HE1      LYS  60 -13.111  19.060  -8.375
  335    HE3  LYS  60           HE2      LYS  60 -12.470  18.471  -9.917
  336    HZ1  LYS  60           HZ1      LYS  60 -14.584  18.671 -10.580
  337    HZ2  LYS  60           HZ2      LYS  60 -15.208  18.644  -9.008
  338    HZ3  LYS  60           HZ3      LYS  60 -14.822  17.194  -9.790
  339    HA   PRO  61           HA       PRO  61  -7.085  13.977  -4.513
  340    HB2  PRO  61           HB1      PRO  61  -8.892  12.897  -2.759
  341    HB3  PRO  61           HB2      PRO  61  -8.109  14.457  -2.513
  342    HG2  PRO  61           HG1      PRO  61 -10.818  13.847  -3.647
  343    HG3  PRO  61           HG2      PRO  61 -10.344  15.092  -2.430
  344    HD2  PRO  61           HD1      PRO  61 -10.791  15.690  -5.040
  345    HD3  PRO  61           HD2      PRO  61  -9.581  16.533  -4.060
  346    H    PHE  62           H        PHE  62  -6.591  11.896  -4.962
  347    HA   PHE  62           HA       PHE  62  -8.505   9.874  -5.498
  348    HB2  PHE  62           HB1      PHE  62  -8.233   9.536  -7.838
  349    HB3  PHE  62           HB2      PHE  62  -8.612  11.245  -7.618
  350    HD1  PHE  62           HD1      PHE  62  -6.501   9.024  -9.268
  351    HD2  PHE  62           HD2      PHE  62  -6.479  12.802  -7.309
  352    HE1  PHE  62           HE1      PHE  62  -4.473   9.652 -10.510
  353    HE2  PHE  62           HE2      PHE  62  -4.451  13.438  -8.549
  354    HZ   PHE  62           HZ       PHE  62  -3.446  11.862 -10.154
  355    H    CYS  63           H        CYS  63  -7.443   7.833  -6.261
  356    HA   CYS  63           HA       CYS  63  -5.010   7.447  -4.791
  357    HB2  CYS  63           HB1      CYS  63  -7.133   5.837  -5.555
  358    HB3  CYS  63           HB2      CYS  63  -5.798   5.250  -6.548
  359    H    ALA  64           H        ALA  64  -2.977   6.979  -5.554
  360    HA   ALA  64           HA       ALA  64  -2.531   6.970  -8.444
  361    HB1  ALA  64           HB1      ALA  64  -0.469   8.568  -7.400
  362    HB2  ALA  64           HB2      ALA  64  -1.765   9.052  -8.495
  363    HB3  ALA  64           HB3      ALA  64  -1.977   9.213  -6.751
  364    H    THR  65           H        THR  65  -0.848   5.716  -9.082
  365    HA   THR  65           HA       THR  65   0.125   3.700  -7.470
  366    HB   THR  65           HB       THR  65   0.307   3.423  -9.822
  367    HG1  THR  65           HG1      THR  65   2.172   2.425  -9.669
  368   HG21  THR  65          HG21      THR  65   1.815   4.821 -11.206
  369   HG22  THR  65          HG22      THR  65   2.097   5.857  -9.806
  370   HG23  THR  65          HG23      THR  65   0.482   5.740 -10.507
  371    H    CYS  66           H        CYS  66   2.332   3.263  -6.742
  372    HA   CYS  66           HA       CYS  66   3.337   5.408  -5.154
  373    HB2  CYS  66           HB1      CYS  66   5.060   3.791  -4.444
  374    HB3  CYS  66           HB2      CYS  66   3.431   3.124  -4.331
  375    H    ARG  67           H        ARG  67   5.277   6.515  -5.311
  376    HA   ARG  67           HA       ARG  67   6.159   7.194  -7.885
  377    HB2  ARG  67           HB1      ARG  67   7.661   7.568  -5.284
  378    HB3  ARG  67           HB2      ARG  67   7.891   8.483  -6.781
  379    HG2  ARG  67           HG1      ARG  67   5.398   8.493  -5.077
  380    HG3  ARG  67           HG2      ARG  67   6.630   9.766  -5.140
  381    HD2  ARG  67           HD1      ARG  67   5.336  10.704  -6.718
  382    HD3  ARG  67           HD2      ARG  67   5.998   9.454  -7.781
  383    HE   ARG  67           HE       ARG  67   3.786   8.372  -6.465
  384   HH11  ARG  67          HH11      ARG  67   4.517  10.854  -8.796
  385   HH12  ARG  67          HH12      ARG  67   2.981  10.741  -9.590
  386   HH21  ARG  67          HH21      ARG  67   1.762   8.215  -7.503
  387   HH22  ARG  67          HH22      ARG  67   1.415   9.240  -8.854
  388    H    GLY  68           H        GLY  68   7.754   6.457  -9.176
  389    HA2  GLY  68           HA2      GLY  68   8.808   3.876  -8.792
  390    HA3  GLY  68           HA3      GLY  68   9.343   5.025 -10.009
  391    HA1  GLY  68           HA1      GLY  68   8.829   4.361  -8.057
  392    H    LEU  69           H        LEU  69  11.425   3.894  -9.474
  393    HA   LEU  69           HA       LEU  69  12.686   4.425  -6.972
  394    HB2  LEU  69           HB1      LEU  69  13.578   3.357  -9.625
  395    HB3  LEU  69           HB2      LEU  69  14.780   3.814  -8.405
  396    HG   LEU  69           HG       LEU  69  12.618   1.737  -8.050
  397   HD11  LEU  69          HD11      LEU  69  14.881   0.367  -7.825
  398   HD12  LEU  69          HD12      LEU  69  15.447   1.624  -8.925
  399   HD13  LEU  69          HD13      LEU  69  14.076   0.610  -9.377
  400   HD21  LEU  69          HD21      LEU  69  14.637   1.462  -6.130
  401   HD22  LEU  69          HD22      LEU  69  12.971   1.983  -5.872
  402   HD23  LEU  69          HD23      LEU  69  14.236   3.179  -6.163
  403    H    ARG  70           H        ARG  70  13.440   5.620 -10.252
  404    HA   ARG  70           HA       ARG  70  15.229   7.606  -9.475
  405    HB2  ARG  70           HB1      ARG  70  13.409   7.397 -11.879
  406    HB3  ARG  70           HB2      ARG  70  14.616   8.678 -11.690
  407    HG2  ARG  70           HG1      ARG  70  15.495   5.840 -11.428
  408    HG3  ARG  70           HG2      ARG  70  15.161   6.499 -13.038
  409    HD2  ARG  70           HD1      ARG  70  16.659   8.504 -12.079
  410    HD3  ARG  70           HD2      ARG  70  17.319   7.169 -11.123
  411    HE   ARG  70           HE       ARG  70  17.312   6.219 -13.679
  412   HH11  ARG  70          HH11      ARG  70  18.633   9.030 -12.107
  413   HH12  ARG  70          HH12      ARG  70  19.980   9.163 -13.189
  414   HH21  ARG  70          HH21      ARG  70  19.081   6.383 -15.109
  415   HH22  ARG  70          HH22      ARG  70  20.233   7.657 -14.897
  416    H    ARG  71           H        ARG  71  11.776   7.529  -9.342
  417    HA   ARG  71           HA       ARG  71  11.225  10.284  -9.323
  418    HB2  ARG  71           HB1      ARG  71   9.815   7.868  -8.219
  419    HB3  ARG  71           HB2      ARG  71   9.192   9.495  -7.913
  420    HG2  ARG  71           HG1      ARG  71   9.774   8.546 -10.705
  421    HG3  ARG  71           HG2      ARG  71   8.235   8.203  -9.896
  422    HD2  ARG  71           HD1      ARG  71   8.107  10.725  -9.437
  423    HD3  ARG  71           HD2      ARG  71   9.405  10.869 -10.632
  424    HE   ARG  71           HE       ARG  71   7.347   9.339 -11.752
  425   HH11  ARG  71          HH11      ARG  71   7.961  12.598 -10.695
  426   HH12  ARG  71          HH12      ARG  71   6.850  13.311 -11.818
  427   HH21  ARG  71          HH21      ARG  71   5.883  10.265 -13.236
  428   HH22  ARG  71          HH22      ARG  71   5.669  11.982 -13.262
  429    H    ARG  72           H        ARG  72  10.821  11.714  -7.589
  430    HA   ARG  72           HA       ARG  72  12.624  11.343  -5.361
  431    HB2  ARG  72           HB1      ARG  72  10.777  13.639  -6.063
  432    HB3  ARG  72           HB2      ARG  72  11.986  13.657  -4.769
  433    HG2  ARG  72           HG1      ARG  72  13.286  12.880  -7.179
  434    HG3  ARG  72           HG2      ARG  72  12.317  14.330  -7.495
  435    HD2  ARG  72           HD1      ARG  72  14.023  14.212  -5.034
  436    HD3  ARG  72           HD2      ARG  72  14.771  14.538  -6.603
  437    HE   ARG  72           HE       ARG  72  12.722  16.301  -6.532
  438   HH11  ARG  72          HH11      ARG  72  15.303  15.542  -4.321
  439   HH12  ARG  72          HH12      ARG  72  15.395  17.148  -3.674
  440   HH21  ARG  72          HH21      ARG  72  12.835  18.417  -5.688
  441   HH22  ARG  72          HH22      ARG  72  13.990  18.781  -4.452
  442    H    CYS  73           H        CYS  73  12.015  11.534  -3.145
  443    HA   CYS  73           HA       CYS  73   9.183  11.100  -2.536
  444    HB2  CYS  73           HB1      CYS  73   9.845   9.279  -0.927
  445    HB3  CYS  73           HB2      CYS  73   9.995   8.860  -2.635
  446    H    GLN  74           H        GLN  74   8.602  11.569  -0.356
  447    HA   GLN  74           HA       GLN  74  10.575  13.261   1.032
  448    HB2  GLN  74           HB1      GLN  74   7.556  13.497   1.040
  449    HB3  GLN  74           HB2      GLN  74   8.683  14.554   1.906
  450    HG2  GLN  74           HG1      GLN  74   9.692  14.946  -0.481
  451    HG3  GLN  74           HG2      GLN  74   8.092  14.402  -1.007
  452   HE21  GLN  74          HE21      GLN  74   9.739  16.751   1.038
  453   HE22  GLN  74          HE22      GLN  74   8.524  17.974   0.923
  454    H    ARG  75           H        ARG  75   8.321  10.646   1.293
  455    HA   ARG  75           HA       ARG  75   9.074  10.324   4.122
  456    HB2  ARG  75           HB1      ARG  75   6.542  10.889   3.265
  457    HB3  ARG  75           HB2      ARG  75   6.516   9.120   3.306
  458    HG2  ARG  75           HG1      ARG  75   7.500   9.365   5.680
  459    HG3  ARG  75           HG2      ARG  75   6.940  11.041   5.559
  460    HD2  ARG  75           HD1      ARG  75   4.657  10.214   5.040
  461    HD3  ARG  75           HD2      ARG  75   5.247   8.562   5.270
  462    HE   ARG  75           HE       ARG  75   5.185   8.880   7.541
  463   HH11  ARG  75          HH11      ARG  75   4.902  11.954   5.934
  464   HH12  ARG  75          HH12      ARG  75   4.516  12.823   7.382
  465   HH21  ARG  75          HH21      ARG  75   4.678  10.012   9.454
  466   HH22  ARG  75          HH22      ARG  75   4.391  11.718   9.384
  467    H    ASP  76           H        ASP  76   9.119   8.118   4.891
  468    HA   ASP  76           HA       ASP  76  10.461   6.373   3.139
  469    HB2  ASP  76           HB1      ASP  76  10.035   4.663   5.006
  470    HB3  ASP  76           HB2      ASP  76  10.955   6.114   5.426
  471    HD2  ASP  76           HD       ASP  76   8.370   7.339   7.433
  472    H    ALA  77           H        ALA  77   7.138   6.334   4.390
  473    HA   ALA  77           HA       ALA  77   6.390   3.958   3.012
  474    HB1  ALA  77           HB1      ALA  77   4.364   5.988   3.818
  475    HB2  ALA  77           HB2      ALA  77   4.315   4.229   3.950
  476    HB3  ALA  77           HB3      ALA  77   5.301   5.169   5.069
  477    H    MET  78           H        MET  78   6.412   7.350   2.199
  478    HA   MET  78           HA       MET  78   4.606   7.443   0.106
  479    HB2  MET  78           HB1      MET  78   6.982   8.980   0.930
  480    HB3  MET  78           HB2      MET  78   6.583   9.097  -0.789
  481    HG2  MET  78           HG1      MET  78   4.534   9.569   1.363
  482    HG3  MET  78           HG2      MET  78   5.588  10.846   0.752
  483    HE1  MET  78           HE1      MET  78   5.460  12.005  -1.299
  484    HE2  MET  78           HE2      MET  78   5.730  10.675  -2.424
  485    HE3  MET  78           HE3      MET  78   4.344  11.745  -2.640
  486    H    CYS  79           H        CYS  79   7.851   6.135   0.194
  487    HA   CYS  79           HA       CYS  79   8.123   5.839  -2.635
  488    HB2  CYS  79           HB1      CYS  79   9.991   5.948  -0.889
  489    HB3  CYS  79           HB2      CYS  79   9.616   4.257  -0.548
  490    H    CYS  80           H        CYS  80   8.237   3.800  -3.776
  491    HA   CYS  80           HA       CYS  80   5.966   2.240  -3.548
  492    HB2  CYS  80           HB1      CYS  80   8.602   1.883  -4.920
  493    HB3  CYS  80           HB2      CYS  80   7.482   0.522  -4.870
  494    HA   PRO  81           HA       PRO  81   6.635  -0.745  -0.406
  495    HB2  PRO  81           HB1      PRO  81   5.541  -3.007  -1.498
  496    HB3  PRO  81           HB2      PRO  81   4.586  -1.633  -0.946
  497    HG2  PRO  81           HG1      PRO  81   5.509  -2.314  -3.718
  498    HG3  PRO  81           HG2      PRO  81   3.883  -1.769  -3.158
  499    HD2  PRO  81           HD1      PRO  81   5.659  -0.098  -4.351
  500    HD3  PRO  81           HD2      PRO  81   4.541   0.438  -3.086
  501    H    GLY  82           H        GLY  82   8.591  -1.489   0.129
  502    HA2  GLY  82           HA2      GLY  82  10.115  -3.363   0.065
  503    HA3  GLY  82           HA3      GLY  82   9.873  -3.438  -1.674
  504    HA1  GLY  82           HA1      GLY  82  10.082  -2.495   0.219
  505    H    THR  83           H        THR  83  10.056  -0.265  -1.147
  506    HA   THR  83           HA       THR  83  12.988  -0.221  -1.461
  507    HB   THR  83           HB       THR  83  12.382   2.086  -2.605
  508    HG1  THR  83           HG1      THR  83  10.058   0.503  -3.090
  509   HG21  THR  83          HG21      THR  83  12.772  -0.619  -3.564
  510   HG22  THR  83          HG22      THR  83  13.396   0.902  -4.205
  511   HG23  THR  83          HG23      THR  83  11.798   0.330  -4.686
  512    H    LEU  84           H        LEU  84  13.862   2.088  -0.996
  513    HA   LEU  84           HA       LEU  84  12.547   3.181   1.399
  514    HB2  LEU  84           HB1      LEU  84  15.082   1.847   1.221
  515    HB3  LEU  84           HB2      LEU  84  15.329   3.541   1.677
  516    HG   LEU  84           HG       LEU  84  13.256   2.063   3.186
  517   HD11  LEU  84          HD11      LEU  84  14.750   0.303   3.290
  518   HD12  LEU  84          HD12      LEU  84  15.203   1.261   4.699
  519   HD13  LEU  84          HD13      LEU  84  16.161   1.358   3.223
  520   HD21  LEU  84          HD21      LEU  84  14.168   3.361   5.025
  521   HD22  LEU  84          HD22      LEU  84  13.823   4.406   3.646
  522   HD23  LEU  84          HD23      LEU  84  15.484   3.928   3.997
  523    H    CYS  85           H        CYS  85  13.298   5.385   1.953
  524    HA   CYS  85           HA       CYS  85  13.684   6.939  -0.500
  525    HB2  CYS  85           HB1      CYS  85  11.741   7.348   1.112
  526    HB3  CYS  85           HB2      CYS  85  12.943   8.025   2.213
  527    H    VAL  86           H        VAL  86  15.630   7.700  -0.956
  528    HA   VAL  86           HA       VAL  86  17.418   8.451   1.258
  529    HB   VAL  86           HB       VAL  86  18.308   7.028  -1.254
  530   HG11  VAL  86          HG11      VAL  86  20.407   6.828   0.340
  531   HG12  VAL  86          HG12      VAL  86  20.159   8.241  -0.687
  532   HG13  VAL  86          HG13      VAL  86  19.729   8.306   1.022
  533   HG21  VAL  86          HG21      VAL  86  17.081   5.533   0.243
  534   HG22  VAL  86          HG22      VAL  86  18.796   5.126   0.195
  535   HG23  VAL  86          HG23      VAL  86  18.136   6.000   1.577
  536    H    ASN  87           H        ASN  87  18.141  10.466   1.098
  537    HA   ASN  87           HA       ASN  87  18.544  12.554   0.287
  538    HB2  ASN  87           HB1      ASN  87  19.463  10.773  -1.955
  539    HB3  ASN  87           HB2      ASN  87  19.518  12.530  -2.134
  540   HD21  ASN  87          HD21      ASN  87  20.319  10.154   0.384
  541   HD22  ASN  87          HD22      ASN  87  21.867  10.825   0.758
  542    H    ASP  88           H        ASP  88  15.872  11.751   0.159
  543    HA   ASP  88           HA       ASP  88  13.875  12.424  -0.699
  544    HB2  ASP  88           HB1      ASP  88  15.369  14.316  -2.512
  545    HB3  ASP  88           HB2      ASP  88  13.751  14.500  -1.820
  546    HD2  ASP  88           HD       ASP  88  16.857  15.635   0.311
  547    H    VAL  89           H        VAL  89  15.585  10.353  -2.025
  548    HA   VAL  89           HA       VAL  89  14.062  10.235  -4.530
  549    HB   VAL  89           HB       VAL  89  16.991   9.521  -4.350
  550   HG11  VAL  89          HG11      VAL  89  15.931   8.153  -5.972
  551   HG12  VAL  89          HG12      VAL  89  15.004   9.512  -6.612
  552   HG13  VAL  89          HG13      VAL  89  16.749   9.439  -6.856
  553   HG21  VAL  89          HG21      VAL  89  16.867  11.530  -6.154
  554   HG22  VAL  89          HG22      VAL  89  15.615  12.037  -5.019
  555   HG23  VAL  89          HG23      VAL  89  17.261  11.758  -4.450
  556    H    CYS  90           H        CYS  90  13.250   8.264  -5.008
  557    HA   CYS  90           HA       CYS  90  13.248   6.253  -3.008
  558    HB2  CYS  90           HB1      CYS  90  12.080   6.588  -5.727
  559    HB3  CYS  90           HB2      CYS  90  12.207   4.942  -5.101
  560    H    THR  91           H        THR  91  14.223   4.258  -2.937
  561    HA   THR  91           HA       THR  91  15.968   3.398  -5.086
  562    HB   THR  91           HB       THR  91  17.388   4.953  -3.757
  563    HG1  THR  91           HG1      THR  91  18.407   2.383  -3.268
  564   HG21  THR  91          HG21      THR  91  16.932   2.930  -1.561
  565   HG22  THR  91          HG22      THR  91  16.419   4.617  -1.557
  566   HG23  THR  91          HG23      THR  91  18.135   4.218  -1.520
  567    H    THR  92           H        THR  92  16.927   1.255  -4.646
  568    HA   THR  92           HA       THR  92  14.976  -0.483  -3.484
  569    HB   THR  92           HB       THR  92  16.774  -2.261  -3.992
  570    HG1  THR  92           HG1      THR  92  18.180  -1.222  -5.764
  571   HG21  THR  92          HG21      THR  92  15.872  -2.520  -6.069
  572   HG22  THR  92          HG22      THR  92  16.106  -0.826  -6.501
  573   HG23  THR  92          HG23      THR  92  14.762  -1.293  -5.459
  574    H    MET  93           H        MET  93  15.150  -1.800  -1.679
  575    HA   MET  93           HA       MET  93  16.387  -0.756   0.582
  576    HB2  MET  93           HB1      MET  93  14.707  -2.955  -0.043
  577    HB3  MET  93           HB2      MET  93  16.068  -3.585   0.896
  578    HG2  MET  93           HG1      MET  93  15.622  -1.820   2.612
  579    HG3  MET  93           HG2      MET  93  14.167  -1.402   1.703
  580    HE1  MET  93           HE1      MET  93  11.715  -3.307   3.656
  581    HE2  MET  93           HE2      MET  93  12.475  -1.728   3.450
  582    HE3  MET  93           HE3      MET  93  11.861  -2.602   2.045
  583    H    GLU  94           H        GLU  94  17.551  -3.067  -1.777
  584    HA   GLU  94           HA       GLU  94  19.770  -4.016  -0.297
  585    HB2  GLU  94           HB1      GLU  94  19.072  -3.968  -3.223
  586    HB3  GLU  94           HB2      GLU  94  20.647  -4.560  -2.671
  587    HG2  GLU  94           HG1      GLU  94  18.107  -5.653  -1.512
  588    HG3  GLU  94           HG2      GLU  94  18.743  -6.249  -3.052
  589    HE2  GLU  94           HE       GLU  94  20.675  -7.195   0.273
  590    H    ASP  95           H        ASP  95  19.201  -1.147  -2.153
  591    HA   ASP  95           HA       ASP  95  22.021  -0.467  -2.313
  592    HB2  ASP  95           HB1      ASP  95  19.502   0.544  -3.476
  593    HB3  ASP  95           HB2      ASP  95  20.701   1.789  -3.094
  594    HD2  ASP  95           HD       ASP  95  21.398  -0.642  -6.111
  595    H    ALA  96           H        ALA  96  19.098   0.823  -0.747
  596    HA   ALA  96           HA       ALA  96  20.310   2.927   0.630
  597    HB1  ALA  96           HB1      ALA  96  17.754   1.602   0.632
  598    HB2  ALA  96           HB2      ALA  96  18.244   2.020   2.274
  599    HB3  ALA  96           HB3      ALA  96  18.153   3.272   1.035
  600    H    THR  97           H        THR  97  20.043  -0.484   1.415
  601    HA   THR  97           HA       THR  97  22.174  -0.279   3.326
  602    HB   THR  97           HB       THR  97  20.501   0.384   4.873
  603    HG1  THR  97           HG1      THR  97  21.903  -1.580   5.354
  604   HG21  THR  97          HG21      THR  97  18.805  -1.352   3.281
  605   HG22  THR  97          HG22      THR  97  18.366  -0.014   4.341
  606   HG23  THR  97          HG23      THR  97  18.596  -1.629   5.009
  607    H    GLU  98           H        GLU  98  23.351  -1.940   2.621
  608    HA   GLU  98           HA       GLU  98  22.248  -4.259   1.404
  609    HB2  GLU  98           HB1      GLU  98  24.596  -5.144   1.570
  610    HB3  GLU  98           HB2      GLU  98  24.440  -3.585   0.744
  611    HG2  GLU  98           HG1      GLU  98  24.915  -3.321   3.614
  612    HG3  GLU  98           HG2      GLU  98  26.208  -4.169   2.753
  613    HE2  GLU  98           HE       GLU  98  25.848  -0.301   2.262
  614    H    ASN  99           H        ASN  99  22.310  -6.427   2.158
  615    HA   ASN  99           HA       ASN  99  22.124  -6.633   5.088
  616    HB2  ASN  99           HB1      ASN  99  20.523  -7.719   2.874
  617    HB3  ASN  99           HB2      ASN  99  20.939  -8.912   4.110
  618   HD21  ASN  99          HD21      ASN  99  19.289  -5.908   3.484
  619   HD22  ASN  99          HD22      ASN  99  18.331  -5.907   4.922
  620    H    LEU 100           H        LEU 100  22.677  -8.825   5.970
  621    HA   LEU 100           HA       LEU 100  24.420 -10.536   4.508
  622    HB2  LEU 100           HB1      LEU 100  25.649  -8.252   5.403
  623    HB3  LEU 100           HB2      LEU 100  25.960  -9.396   6.720
  624    HG   LEU 100           HG       LEU 100  26.582 -10.773   4.355
  625   HD11  LEU 100          HD11      LEU 100  27.430  -7.902   4.291
  626   HD12  LEU 100          HD12      LEU 100  26.764  -8.896   2.996
  627   HD13  LEU 100          HD13      LEU 100  28.417  -9.162   3.550
  628   HD21  LEU 100          HD21      LEU 100  28.730 -10.935   5.307
  629   HD22  LEU 100          HD22      LEU 100  27.616 -10.832   6.672
  630   HD23  LEU 100          HD23      LEU 100  28.545  -9.415   6.182
  631    H    TYR 101           H        TYR 101  25.162 -12.345   5.769
  632    HA   TYR 101           HA       TYR 101  23.280 -13.107   7.780
  633    HB2  TYR 101           HB1      TYR 101  24.898 -14.456   5.999
  634    HB3  TYR 101           HB2      TYR 101  25.679 -14.776   7.551
  635    HD1  TYR 101           HD1      TYR 101  25.077 -16.762   8.536
  636    HD2  TYR 101           HD2      TYR 101  22.149 -14.626   6.306
  637    HE1  TYR 101           HE1      TYR 101  23.423 -18.512   9.040
  638    HE2  TYR 101           HE2      TYR 101  20.488 -16.369   6.806
  639    HH   TYR 101           HH       TYR 101  20.629 -18.431   9.140
  640    H    PHE 102           H        PHE 102  24.480 -14.448   9.706
  641    HA   PHE 102           HA       PHE 102  25.916 -12.370  11.188
  642    HB2  PHE 102           HB1      PHE 102  23.913 -14.346  11.863
  643    HB3  PHE 102           HB2      PHE 102  25.323 -14.512  12.910
  644    HD1  PHE 102           HD1      PHE 102  22.572 -12.318  11.929
  645    HD2  PHE 102           HD2      PHE 102  25.966 -12.773  14.457
  646    HE1  PHE 102           HE1      PHE 102  21.806 -10.419  13.294
  647    HE2  PHE 102           HE2      PHE 102  25.205 -10.876  15.826
  648    HZ   PHE 102           HZ       PHE 102  23.122  -9.696  15.245
  649    H    GLN 103           H        GLN 103  28.057 -12.516  11.074
  650    HA   GLN 103           HA       GLN 103  29.286 -15.191  11.149
  651    HB2  GLN 103           HB1      GLN 103  29.589 -13.464   9.148
  652    HB3  GLN 103           HB2      GLN 103  30.834 -12.817  10.229
  653    HG2  GLN 103           HG1      GLN 103  31.164 -15.628  10.162
  654    HG3  GLN 103           HG2      GLN 103  30.969 -15.067   8.496
  655   HE21  GLN 103          HE21      GLN 103  32.898 -14.828  11.388
  656   HE22  GLN 103          HE22      GLN 103  34.287 -14.123  10.641
  657    H    SER 104           H        SER 104  29.415 -15.377  13.378
  658    HA   SER 104           HA       SER 104  31.453 -13.679  14.624
  659    HB2  SER 104           HB1      SER 104  29.238 -12.806  15.316
  660    HB3  SER 104           HB2      SER 104  28.829 -14.410  15.947
  661    HG   SER 104           HG       SER 104  30.325 -12.449  17.082
  662    H    LEU 105           H        LEU 105  32.778 -14.710  16.073
  663    HA   LEU 105           HA       LEU 105  32.534 -17.628  16.138
  664    HB2  LEU 105           HB1      LEU 105  34.719 -15.761  15.934
  665    HB3  LEU 105           HB2      LEU 105  34.953 -16.835  17.325
  666    HG   LEU 105           HG       LEU 105  36.064 -17.636  15.270
  667   HD11  LEU 105          HD11      LEU 105  34.258 -19.106  16.967
  668   HD12  LEU 105          HD12      LEU 105  35.837 -19.570  16.335
  669   HD13  LEU 105          HD13      LEU 105  34.387 -19.858  15.376
  670   HD21  LEU 105          HD21      LEU 105  33.584 -18.574  14.037
  671   HD22  LEU 105          HD22      LEU 105  35.030 -17.882  13.300
  672   HD23  LEU 105          HD23      LEU 105  33.794 -16.823  13.983
  673    H    GLU 106           H        GLU 106  31.286 -18.227  17.816
  674    HA   GLU 106           HA       GLU 106  31.215 -16.847  20.307
  675    HB2  GLU 106           HB1      GLU 106  29.806 -19.011  19.034
  676    HB3  GLU 106           HB2      GLU 106  30.247 -19.468  20.687
  677    HG2  GLU 106           HG1      GLU 106  29.218 -17.337  21.484
  678    HG3  GLU 106           HG2      GLU 106  28.640 -17.074  19.833
  679    HE2  GLU 106           HE       GLU 106  25.835 -18.745  20.975
  680    H    HIS 107           H        HIS 107  31.907 -17.615  22.360
  681    HA   HIS 107           HA       HIS 107  34.146 -19.526  22.235
  682    HB2  HIS 107           HB1      HIS 107  33.917 -16.915  23.733
  683    HB3  HIS 107           HB2      HIS 107  35.103 -18.150  24.173
  684    HD1  HIS 107           HD1      HIS 107  34.746 -15.255  22.085
  685    HD2  HIS 107           HD2      HIS 107  36.858 -18.824  21.850
  686    HE1  HIS 107           HE1      HIS 107  36.552 -14.855  20.383
  687    HE2  HIS 107           HE2      HIS 107  37.843 -17.037  20.236
  688    H    HIS 108           H        HIS 108  34.735 -20.190  24.625
  689    HA   HIS 108           HA       HIS 108  32.322 -20.584  26.228
  690    HB2  HIS 108           HB1      HIS 108  32.630 -22.964  26.413
  691    HB3  HIS 108           HB2      HIS 108  32.544 -22.545  24.700
  692    HD1  HIS 108           HD1      HIS 108  34.814 -23.999  27.240
  693    HD2  HIS 108           HD2      HIS 108  34.994 -22.773  23.274
  694    HE1  HIS 108           HE1      HIS 108  36.954 -24.961  26.335
  695    HE2  HIS 108           HE2      HIS 108  37.064 -24.213  23.911
  696    H    HIS 109           H        HIS 109  32.821 -21.481  28.393
  697    HA   HIS 109           HA       HIS 109  35.307 -20.311  29.379
  698    HB2  HIS 109           HB1      HIS 109  32.640 -20.896  30.510
  699    HB3  HIS 109           HB2      HIS 109  33.998 -21.130  31.616
  700    HD1  HIS 109           HD1      HIS 109  34.637 -19.119  32.891
  701    HD2  HIS 109           HD2      HIS 109  32.848 -18.140  29.271
  702    HE1  HIS 109           HE1      HIS 109  34.496 -16.609  32.868
  703    HE2  HIS 109           HE2      HIS 109  33.403 -16.009  30.655
  704    H    HIS 110           H        HIS 110  36.985 -21.475  30.084
  705    HA   HIS 110           HA       HIS 110  36.977 -24.319  29.752
  706    HB2  HIS 110           HB1      HIS 110  39.309 -24.234  30.338
  707    HB3  HIS 110           HB2      HIS 110  38.954 -22.875  29.268
  708    HD1  HIS 110           HD1      HIS 110  38.546 -20.507  30.572
  709    HD2  HIS 110           HD2      HIS 110  40.558 -23.493  32.645
  710    HE1  HIS 110           HE1      HIS 110  39.724 -19.337  32.461
  711    HE2  HIS 110           HE2      HIS 110  40.953 -21.161  33.729
  712    H    HIS 111           H        HIS 111  38.444 -25.381  31.734
  713    HA   HIS 111           HA       HIS 111  37.013 -24.813  34.233
  714    HB2  HIS 111           HB1      HIS 111  37.300 -27.493  32.868
  715    HB3  HIS 111           HB2      HIS 111  36.914 -27.338  34.585
  716    HD1  HIS 111           HD1      HIS 111  35.466 -26.434  31.210
  717    HD2  HIS 111           HD2      HIS 111  34.280 -26.883  35.166
  718    HE1  HIS 111           HE1      HIS 111  32.957 -26.254  31.185
  719    HE2  HIS 111           HE2      HIS 111  32.231 -26.530  33.602
  720    H    HIS 112           H        HIS 112  38.169 -25.158  36.104
  721    HA   HIS 112           HA       HIS 112  40.031 -25.219  37.413
  722    HB2  HIS 112           HB1      HIS 112  40.446 -27.535  35.539
  723    HB3  HIS 112           HB2      HIS 112  41.670 -27.133  36.749
  724    HD1  HIS 112           HD1      HIS 112  40.910 -29.659  37.546
  725    HD2  HIS 112           HD2      HIS 112  38.277 -26.531  38.284
  726    HE1  HIS 112           HE1      HIS 112  39.348 -30.501  39.328
  727    HE2  HIS 112           HE2      HIS 112  37.736 -28.590  39.779
  Start of MODEL   15
    1    H1   MET  18           H        MET  18 -56.369   0.985  48.570
    2    HA   MET  18           HA       MET  18 -56.019   1.582  46.377
    3    HB2  MET  18           HB1      MET  18 -57.020   3.583  47.542
    4    HB3  MET  18           HB2      MET  18 -55.382   4.248  47.645
    5    HG2  MET  18           HG1      MET  18 -55.194   4.470  45.306
    6    HG3  MET  18           HG2      MET  18 -56.605   3.445  45.028
    7    HE1  MET  18           HE1      MET  18 -58.262   4.869  43.647
    8    HE2  MET  18           HE2      MET  18 -58.991   4.145  45.080
    9    HE3  MET  18           HE3      MET  18 -59.387   5.806  44.630
   10    H    LEU  19           H        LEU  19 -54.071   0.275  46.173
   11    HA   LEU  19           HA       LEU  19 -51.620   1.900  45.990
   12    HB2  LEU  19           HB1      LEU  19 -51.826  -1.105  46.227
   13    HB3  LEU  19           HB2      LEU  19 -50.351  -0.126  46.278
   14    HG   LEU  19           HG       LEU  19 -52.532   0.019  48.355
   15   HD11  LEU  19          HD11      LEU  19 -51.724  -1.795  49.336
   16   HD12  LEU  19          HD12      LEU  19 -50.086  -1.146  49.281
   17   HD13  LEU  19          HD13      LEU  19 -50.713  -2.072  47.918
   18   HD21  LEU  19          HD21      LEU  19 -50.250   0.861  49.530
   19   HD22  LEU  19          HD22      LEU  19 -51.425   1.935  48.768
   20   HD23  LEU  19          HD23      LEU  19 -49.990   1.422  47.877
   21    H    VAL  20           H        VAL  20 -52.335   2.627  43.884
   22    HA   VAL  20           HA       VAL  20 -52.840   0.881  41.729
   23    HB   VAL  20           HB       VAL  20 -52.261   2.862  40.289
   24   HG11  VAL  20          HG11      VAL  20 -54.215   3.287  42.547
   25   HG12  VAL  20          HG12      VAL  20 -54.189   4.206  41.041
   26   HG13  VAL  20          HG13      VAL  20 -54.537   2.478  41.015
   27   HG21  VAL  20          HG21      VAL  20 -51.133   4.600  41.097
   28   HG22  VAL  20          HG22      VAL  20 -52.276   4.790  42.426
   29   HG23  VAL  20          HG23      VAL  20 -50.906   3.692  42.593
   30    H    LEU  21           H        LEU  21 -51.535  -0.171  40.346
   31    HA   LEU  21           HA       LEU  21 -48.690  -0.205  40.928
   32    HB2  LEU  21           HB1      LEU  21 -50.491  -2.146  40.222
   33    HB3  LEU  21           HB2      LEU  21 -49.658  -1.827  38.691
   34    HG   LEU  21           HG       LEU  21 -48.571  -3.664  39.749
   35   HD11  LEU  21          HD11      LEU  21 -46.357  -2.929  39.727
   36   HD12  LEU  21          HD12      LEU  21 -46.779  -1.341  40.367
   37   HD13  LEU  21          HD13      LEU  21 -47.204  -1.763  38.709
   38   HD21  LEU  21          HD21      LEU  21 -49.437  -2.965  42.064
   39   HD22  LEU  21          HD22      LEU  21 -47.968  -1.995  42.167
   40   HD23  LEU  21          HD23      LEU  21 -47.859  -3.744  41.969
   41    H    ASP  22           H        ASP  22 -47.237   0.927  39.835
   42    HA   ASP  22           HA       ASP  22 -47.919   1.837  37.116
   43    HB2  ASP  22           HB1      ASP  22 -46.421   3.307  39.297
   44    HB3  ASP  22           HB2      ASP  22 -46.473   3.839  37.612
   45    HD2  ASP  22           HD       ASP  22 -50.150   3.850  38.920
   46    H    PHE  23           H        PHE  23 -46.340   1.729  35.558
   47    HA   PHE  23           HA       PHE  23 -43.666   0.840  36.306
   48    HB2  PHE  23           HB1      PHE  23 -45.636  -0.980  35.438
   49    HB3  PHE  23           HB2      PHE  23 -44.566  -0.730  34.056
   50    HD1  PHE  23           HD1      PHE  23 -44.480  -1.547  37.681
   51    HD2  PHE  23           HD2      PHE  23 -42.554  -1.864  33.899
   52    HE1  PHE  23           HE1      PHE  23 -42.827  -3.087  38.656
   53    HE2  PHE  23           HE2      PHE  23 -40.898  -3.405  34.867
   54    HZ   PHE  23           HZ       PHE  23 -41.034  -4.019  37.249
   55    H    ASN  24           H        ASN  24 -45.815   1.425  33.524
   56    HA   ASN  24           HA       ASN  24 -45.531   2.606  31.601
   57    HB2  ASN  24           HB1      ASN  24 -44.173   4.101  33.668
   58    HB3  ASN  24           HB2      ASN  24 -43.348   4.304  32.118
   59   HD21  ASN  24          HD21      ASN  24 -45.190   6.002  33.871
   60   HD22  ASN  24          HD22      ASN  24 -46.334   6.644  32.746
   61    H    ASN  25           H        ASN  25 -43.828   3.236  29.899
   62    HA   ASN  25           HA       ASN  25 -41.684   1.214  29.890
   63    HB2  ASN  25           HB1      ASN  25 -43.439   2.126  27.595
   64    HB3  ASN  25           HB2      ASN  25 -42.008   1.105  27.405
   65   HD21  ASN  25          HD21      ASN  25 -45.174   1.277  28.925
   66   HD22  ASN  25          HD22      ASN  25 -45.435  -0.429  28.998
   67    H    ILE  26           H        ILE  26 -40.540   3.138  30.861
   68    HA   ILE  26           HA       ILE  26 -39.946   5.376  29.192
   69    HB   ILE  26           HB       ILE  26 -38.165   5.862  30.871
   70   HG12  ILE  26          HG11      ILE  26 -39.196   3.822  32.732
   71   HG13  ILE  26          HG12      ILE  26 -38.241   3.178  31.388
   72   HG21  ILE  26          HG21      ILE  26 -40.811   5.240  32.165
   73   HG22  ILE  26          HG22      ILE  26 -39.668   6.510  32.598
   74   HG23  ILE  26          HG23      ILE  26 -40.554   6.603  31.076
   75   HD11  ILE  26          HD11      ILE  26 -36.317   3.946  32.215
   76   HD12  ILE  26          HD12      ILE  26 -37.025   5.490  32.695
   77   HD13  ILE  26          HD13      ILE  26 -37.208   4.075  33.732
   78    H    ARG  27           H        ARG  27 -37.710   5.940  28.532
   79    HA   ARG  27           HA       ARG  27 -36.096   3.592  27.814
   80    HB2  ARG  27           HB1      ARG  27 -36.958   5.826  25.964
   81    HB3  ARG  27           HB2      ARG  27 -35.688   4.656  25.578
   82    HG2  ARG  27           HG1      ARG  27 -37.372   2.829  25.870
   83    HG3  ARG  27           HG2      ARG  27 -38.608   4.090  26.021
   84    HD2  ARG  27           HD1      ARG  27 -38.753   3.612  23.771
   85    HD3  ARG  27           HD2      ARG  27 -37.599   4.952  23.771
   86    HE   ARG  27           HE       ARG  27 -36.168   2.554  23.976
   87   HH11  ARG  27          HH11      ARG  27 -38.141   4.291  21.694
   88   HH12  ARG  27          HH12      ARG  27 -37.351   3.623  20.304
   89   HH21  ARG  27          HH21      ARG  27 -35.120   1.667  22.154
   90   HH22  ARG  27          HH22      ARG  27 -35.634   2.131  20.567
   91    H    SER  28           H        SER  28 -33.993   4.599  26.617
   92    HA   SER  28           HA       SER  28 -32.998   7.061  27.558
   93    HB2  SER  28           HB1      SER  28 -33.128   5.384  29.648
   94    HB3  SER  28           HB2      SER  28 -31.561   4.883  28.990
   95    HG   SER  28           HG       SER  28 -32.330   7.360  30.055
   96    H    SER  29           H        SER  29 -30.355   6.758  27.631
   97    HA   SER  29           HA       SER  29 -28.518   6.527  26.309
   98    HB2  SER  29           HB1      SER  29 -29.507   3.976  26.753
   99    HB3  SER  29           HB2      SER  29 -29.301   4.037  24.993
  100    HG   SER  29           HG       SER  29 -27.407   3.364  26.231
  101    H    ALA  30           H        ALA  30 -27.982   5.633  23.843
  102    HA   ALA  30           HA       ALA  30 -30.017   6.327  21.941
  103    HB1  ALA  30           HB1      ALA  30 -28.523   8.445  22.981
  104    HB2  ALA  30           HB2      ALA  30 -27.835   8.122  21.389
  105    HB3  ALA  30           HB3      ALA  30 -29.558   8.465  21.551
  106    H    ASP  31           H        ASP  31 -28.920   6.540  19.666
  107    HA   ASP  31           HA       ASP  31 -27.323   4.154  19.343
  108    HB2  ASP  31           HB1      ASP  31 -28.568   6.108  17.402
  109    HB3  ASP  31           HB2      ASP  31 -27.529   4.776  16.874
  110    HD2  ASP  31           HD       ASP  31 -30.697   3.345  18.724
  111    H    LEU  32           H        LEU  32 -26.955   7.605  18.551
  112    HA   LEU  32           HA       LEU  32 -25.124   8.883  18.112
  113    HB2  LEU  32           HB1      LEU  32 -24.737   8.002  20.502
  114    HB3  LEU  32           HB2      LEU  32 -23.537   6.937  19.752
  115    HG   LEU  32           HG       LEU  32 -22.573   9.183  18.803
  116   HD11  LEU  32          HD11      LEU  32 -24.667  10.303  20.003
  117   HD12  LEU  32          HD12      LEU  32 -23.117  11.127  19.836
  118   HD13  LEU  32          HD13      LEU  32 -23.535  10.334  21.355
  119   HD21  LEU  32          HD21      LEU  32 -21.791   9.246  21.534
  120   HD22  LEU  32          HD22      LEU  32 -20.929   8.562  20.156
  121   HD23  LEU  32          HD23      LEU  32 -22.059   7.565  21.074
  122    H    HIS  33           H        HIS  33 -25.586   7.422  15.992
  123    HA   HIS  33           HA       HIS  33 -22.914   6.715  15.047
  124    HB2  HIS  33           HB1      HIS  33 -24.650   4.722  15.764
  125    HB3  HIS  33           HB2      HIS  33 -25.007   4.905  14.045
  126    HD1  HIS  33           HD1      HIS  33 -22.303   5.339  12.814
  127    HD2  HIS  33           HD2      HIS  33 -22.963   2.595  15.863
  128    HE1  HIS  33           HE1      HIS  33 -20.432   3.669  12.632
  129    HE2  HIS  33           HE2      HIS  33 -20.834   1.991  14.494
  130    H    GLY  34           H        GLY  34 -22.513   7.725  13.193
  131    HA2  GLY  34           HA2      GLY  34 -23.657   7.806  10.838
  132    HA3  GLY  34           HA3      GLY  34 -24.769   8.856  11.702
  133    HA1  GLY  34           HA1      GLY  34 -22.913   7.902  11.299
  134    H    ALA  35           H        ALA  35 -21.390   8.463  10.748
  135    HA   ALA  35           HA       ALA  35 -21.088  11.391  10.925
  136    HB1  ALA  35           HB1      ALA  35 -19.545  10.671  12.463
  137    HB2  ALA  35           HB2      ALA  35 -19.205   9.178  11.587
  138    HB3  ALA  35           HB3      ALA  35 -18.559  10.711  11.002
  139    H    ARG  36           H        ARG  36 -20.816  12.409   9.055
  140    HA   ARG  36           HA       ARG  36 -20.044  10.829   6.700
  141    HB2  ARG  36           HB1      ARG  36 -21.304  13.573   6.683
  142    HB3  ARG  36           HB2      ARG  36 -21.206  12.407   5.354
  143    HG2  ARG  36           HG1      ARG  36 -22.772  10.932   6.454
  144    HG3  ARG  36           HG2      ARG  36 -22.808  11.998   7.869
  145    HD2  ARG  36           HD1      ARG  36 -23.785  13.792   6.545
  146    HD3  ARG  36           HD2      ARG  36 -23.667  12.793   5.089
  147    HE   ARG  36           HE       ARG  36 -25.569  11.690   5.727
  148   HH11  ARG  36          HH11      ARG  36 -24.299  13.448   8.451
  149   HH12  ARG  36          HH12      ARG  36 -25.674  13.140   9.458
  150   HH21  ARG  36          HH21      ARG  36 -27.386  11.277   7.043
  151   HH22  ARG  36          HH22      ARG  36 -27.430  11.903   8.656
  152    H    LYS  37           H        LYS  37 -18.277  11.335   5.520
  153    HA   LYS  37           HA       LYS  37 -16.780  13.761   6.257
  154    HB2  LYS  37           HB1      LYS  37 -16.007  11.162   6.855
  155    HB3  LYS  37           HB2      LYS  37 -15.087  11.551   5.394
  156    HG2  LYS  37           HG1      LYS  37 -13.598  12.466   6.781
  157    HG3  LYS  37           HG2      LYS  37 -14.748  13.809   6.892
  158    HD2  LYS  37           HD1      LYS  37 -15.097  11.447   8.697
  159    HD3  LYS  37           HD2      LYS  37 -13.838  12.641   9.061
  160    HE2  LYS  37           HE1      LYS  37 -15.380  13.945  10.006
  161    HE3  LYS  37           HE2      LYS  37 -16.156  14.105   8.423
  162    HZ1  LYS  37           HZ1      LYS  37 -17.725  13.298  10.045
  163    HZ2  LYS  37           HZ2      LYS  37 -16.721  11.994  10.435
  164    HZ3  LYS  37           HZ3      LYS  37 -17.429  12.086   8.903
  165    H    GLY  38           H        GLY  38 -15.394  14.614   4.604
  166    HA2  GLY  38           HA2      GLY  38 -16.397  13.975   1.914
  167    HA3  GLY  38           HA3      GLY  38 -15.660  15.495   2.393
  168    HA1  GLY  38           HA1      GLY  38 -15.928  13.387   2.374
  169    H    SER  39           H        SER  39 -14.218  12.509   3.400
  170    HA   SER  39           HA       SER  39 -11.960  13.056   1.604
  171    HB2  SER  39           HB1      SER  39 -11.921  11.220   4.006
  172    HB3  SER  39           HB2      SER  39 -10.547  11.973   3.175
  173    HG   SER  39           HG       SER  39 -12.532  13.565   4.386
  174    H    GLN  40           H        GLN  40 -11.730  11.806  -0.116
  175    HA   GLN  40           HA       GLN  40 -13.322   9.585  -0.692
  176    HB2  GLN  40           HB1      GLN  40 -12.077  11.020  -2.342
  177    HB3  GLN  40           HB2      GLN  40 -10.603  10.154  -1.875
  178    HG2  GLN  40           HG1      GLN  40 -11.805   8.017  -2.520
  179    HG3  GLN  40           HG2      GLN  40 -13.030   9.058  -3.257
  180   HE21  GLN  40          HE21      GLN  40  -9.856   7.767  -3.519
  181   HE22  GLN  40          HE22      GLN  40  -9.492   8.397  -5.086
  182    H    CYS  41           H        CYS  41 -10.150   9.826   0.796
  183    HA   CYS  41           HA       CYS  41 -10.378   7.044   1.646
  184    HB2  CYS  41           HB1      CYS  41  -8.148   6.452   0.959
  185    HB3  CYS  41           HB2      CYS  41  -9.033   7.038  -0.450
  186    H    LEU  42           H        LEU  42  -9.392   6.602   3.595
  187    HA   LEU  42           HA       LEU  42  -8.670   8.930   5.172
  188    HB2  LEU  42           HB1      LEU  42  -9.884   6.406   5.673
  189    HB3  LEU  42           HB2      LEU  42  -8.408   6.512   6.647
  190    HG   LEU  42           HG       LEU  42  -9.210   8.530   7.717
  191   HD11  LEU  42          HD11      LEU  42 -11.800   8.924   7.150
  192   HD12  LEU  42          HD12      LEU  42 -11.227   8.404   5.566
  193   HD13  LEU  42          HD13      LEU  42 -10.489   9.797   6.355
  194   HD21  LEU  42          HD21      LEU  42  -9.884   6.292   8.582
  195   HD22  LEU  42          HD22      LEU  42 -11.405   6.463   7.705
  196   HD23  LEU  42          HD23      LEU  42 -11.001   7.591   9.000
  197    H    SER  43           H        SER  43  -7.166   6.133   3.744
  198    HA   SER  43           HA       SER  43  -4.549   7.226   4.320
  199    HB2  SER  43           HB1      SER  43  -5.252   5.712   6.288
  200    HB3  SER  43           HB2      SER  43  -5.051   4.371   5.147
  201    HG   SER  43           HG       SER  43  -3.155   5.846   6.436
  202    H    ASP  44           H        ASP  44  -2.878   5.369   3.500
  203    HA   ASP  44           HA       ASP  44  -3.383   5.179   0.701
  204    HB2  ASP  44           HB1      ASP  44  -1.205   3.918   0.666
  205    HB3  ASP  44           HB2      ASP  44  -1.123   5.521   1.408
  206    HD2  ASP  44           HD       ASP  44  -0.595   2.356   3.733
  207    H    THR  45           H        THR  45  -3.483   2.916   3.390
  208    HA   THR  45           HA       THR  45  -3.631   0.510   2.004
  209    HB   THR  45           HB       THR  45  -5.428   0.661   4.324
  210    HG1  THR  45           HG1      THR  45  -3.956   1.362   5.765
  211   HG21  THR  45          HG21      THR  45  -3.942  -1.188   5.084
  212   HG22  THR  45          HG22      THR  45  -2.970  -0.949   3.633
  213   HG23  THR  45          HG23      THR  45  -4.652  -1.463   3.495
  214    H    ASP  46           H        ASP  46  -6.004   3.013   2.394
  215    HA   ASP  46           HA       ASP  46  -8.296   1.468   1.739
  216    HB2  ASP  46           HB1      ASP  46  -7.835   4.050   2.628
  217    HB3  ASP  46           HB2      ASP  46  -8.437   4.288   0.983
  218    HD2  ASP  46           HD       ASP  46 -10.926   2.582   3.571
  219    H    CYS  47           H        CYS  47  -5.798   2.984  -0.124
  220    HA   CYS  47           HA       CYS  47  -7.204   3.099  -2.599
  221    HB2  CYS  47           HB1      CYS  47  -4.985   4.278  -1.798
  222    HB3  CYS  47           HB2      CYS  47  -4.225   2.837  -2.476
  223    H    ASN  48           H        ASN  48  -4.499   0.983  -1.619
  224    HA   ASN  48           HA       ASN  48  -5.722  -1.423  -2.367
  225    HB2  ASN  48           HB1      ASN  48  -5.027   0.059  -4.604
  226    HB3  ASN  48           HB2      ASN  48  -3.668  -1.055  -4.413
  227   HD21  ASN  48          HD21      ASN  48  -6.878  -0.698  -5.432
  228   HD22  ASN  48          HD22      ASN  48  -7.193  -2.351  -5.822
  229    H    THR  49           H        THR  49  -3.798  -3.093  -2.990
  230    HA   THR  49           HA       THR  49  -2.070  -3.029  -0.694
  231    HB   THR  49           HB       THR  49  -2.172  -5.020  -2.969
  232    HG1  THR  49           HG1      THR  49  -3.784  -5.898  -1.909
  233   HG21  THR  49          HG21      THR  49  -0.669  -4.928  -0.381
  234   HG22  THR  49          HG22      THR  49  -0.112  -5.414  -1.982
  235   HG23  THR  49          HG23      THR  49  -1.168  -6.478  -1.055
  236    H    ARG  50           H        ARG  50  -1.772  -2.378  -4.104
  237    HA   ARG  50           HA       ARG  50   1.100  -1.842  -3.713
  238    HB2  ARG  50           HB1      ARG  50  -0.397  -2.934  -6.086
  239    HB3  ARG  50           HB2      ARG  50   1.178  -2.150  -6.276
  240    HG2  ARG  50           HG1      ARG  50   1.043  -4.245  -4.203
  241    HG3  ARG  50           HG2      ARG  50   0.859  -4.788  -5.879
  242    HD2  ARG  50           HD1      ARG  50   2.959  -3.095  -6.147
  243    HD3  ARG  50           HD2      ARG  50   3.210  -3.674  -4.494
  244    HE   ARG  50           HE       ARG  50   3.884  -5.669  -5.361
  245   HH11  ARG  50          HH11      ARG  50   1.934  -4.035  -7.738
  246   HH12  ARG  50          HH12      ARG  50   2.197  -5.230  -8.965
  247   HH21  ARG  50          HH21      ARG  50   4.238  -7.248  -6.968
  248   HH22  ARG  50          HH22      ARG  50   3.506  -7.058  -8.526
  249    H    LYS  51           H        LYS  51  -1.254  -0.085  -3.309
  250    HA   LYS  51           HA       LYS  51  -0.330   2.116  -4.998
  251    HB2  LYS  51           HB1      LYS  51  -3.140   1.074  -4.817
  252    HB3  LYS  51           HB2      LYS  51  -2.849   2.795  -5.119
  253    HG2  LYS  51           HG1      LYS  51  -2.450   2.422  -7.265
  254    HG3  LYS  51           HG2      LYS  51  -1.221   1.207  -6.866
  255    HD2  LYS  51           HD1      LYS  51  -2.759  -0.554  -6.886
  256    HD3  LYS  51           HD2      LYS  51  -4.142   0.542  -6.713
  257    HE2  LYS  51           HE1      LYS  51  -2.634   1.153  -9.112
  258    HE3  LYS  51           HE2      LYS  51  -3.135  -0.544  -9.080
  259    HZ1  LYS  51           HZ1      LYS  51  -5.270   0.000  -9.363
  260    HZ2  LYS  51           HZ2      LYS  51  -4.687   1.498  -9.888
  261    HZ3  LYS  51           HZ3      LYS  51  -5.202   1.305  -8.289
  262    H    PHE  52           H        PHE  52  -1.060   4.244  -4.184
  263    HA   PHE  52           HA       PHE  52  -1.788   4.245  -1.346
  264    HB2  PHE  52           HB1      PHE  52  -0.037   5.905  -0.844
  265    HB3  PHE  52           HB2      PHE  52   0.645   4.369  -1.379
  266    HD1  PHE  52           HD1      PHE  52   1.827   4.162  -3.457
  267    HD2  PHE  52           HD2      PHE  52   0.073   7.866  -2.306
  268    HE1  PHE  52           HE1      PHE  52   3.114   5.313  -5.210
  269    HE2  PHE  52           HE2      PHE  52   1.357   9.022  -4.057
  270    HZ   PHE  52           HZ       PHE  52   2.879   7.746  -5.513
  271    H    CYS  53           H        CYS  53  -2.139   6.605  -0.604
  272    HA   CYS  53           HA       CYS  53  -3.781   7.908  -2.659
  273    HB2  CYS  53           HB1      CYS  53  -3.961   7.595   0.274
  274    HB3  CYS  53           HB2      CYS  53  -4.418   9.186  -0.337
  275    H    LEU  54           H        LEU  54  -2.721   9.453  -3.717
  276    HA   LEU  54           HA       LEU  54  -0.647  11.004  -2.400
  277    HB2  LEU  54           HB1      LEU  54  -0.601  10.051  -4.806
  278    HB3  LEU  54           HB2      LEU  54  -1.620  11.446  -5.198
  279    HG   LEU  54           HG       LEU  54   0.832  12.127  -3.741
  280   HD11  LEU  54          HD11      LEU  54   1.925  11.922  -6.199
  281   HD12  LEU  54          HD12      LEU  54   0.928  10.467  -6.169
  282   HD13  LEU  54          HD13      LEU  54   2.144  10.729  -4.919
  283   HD21  LEU  54          HD21      LEU  54  -0.140  14.003  -4.554
  284   HD22  LEU  54          HD22      LEU  54  -0.874  13.165  -5.923
  285   HD23  LEU  54          HD23      LEU  54   0.834  13.607  -5.970
  286    H    GLN  55           H        GLN  55  -0.865  13.023  -1.659
  287    HA   GLN  55           HA       GLN  55  -3.372  14.447  -2.268
  288    HB2  GLN  55           HB1      GLN  55  -2.987  15.559   0.001
  289    HB3  GLN  55           HB2      GLN  55  -3.523  13.872   0.007
  290    HG2  GLN  55           HG1      GLN  55  -1.179  13.153   0.338
  291    HG3  GLN  55           HG2      GLN  55  -0.714  14.857   0.439
  292   HE21  GLN  55          HE21      GLN  55  -2.414  12.258   2.007
  293   HE22  GLN  55          HE22      GLN  55  -2.520  12.997   3.565
  294    HA   PRO  56           HA       PRO  56  -0.025  17.099  -3.926
  295    HB2  PRO  56           HB1      PRO  56  -1.556  18.133  -5.949
  296    HB3  PRO  56           HB2      PRO  56  -0.710  16.591  -6.059
  297    HG2  PRO  56           HG1      PRO  56  -3.576  17.140  -5.369
  298    HG3  PRO  56           HG2      PRO  56  -2.890  15.903  -6.489
  299    HD2  PRO  56           HD1      PRO  56  -3.729  15.302  -3.977
  300    HD3  PRO  56           HD2      PRO  56  -2.361  14.484  -4.751
  301    H    ARG  57           H        ARG  57   0.267  19.319  -3.756
  302    HA   ARG  57           HA       ARG  57  -1.589  20.675  -2.005
  303    HB2  ARG  57           HB1      ARG  57   1.184  20.801  -2.521
  304    HB3  ARG  57           HB2      ARG  57   0.518  22.380  -2.961
  305    HG2  ARG  57           HG1      ARG  57  -0.109  22.891  -0.821
  306    HG3  ARG  57           HG2      ARG  57  -0.293  21.190  -0.363
  307    HD2  ARG  57           HD1      ARG  57   2.442  21.667  -1.075
  308    HD3  ARG  57           HD2      ARG  57   1.918  22.891   0.088
  309    HE   ARG  57           HE       ARG  57   1.027  20.533   1.139
  310   HH11  ARG  57          HH11      ARG  57   4.115  21.769   0.111
  311   HH12  ARG  57          HH12      ARG  57   5.019  20.825   1.250
  312   HH21  ARG  57          HH21      ARG  57   2.204  19.286   2.642
  313   HH22  ARG  57          HH22      ARG  57   3.930  19.412   2.688
  314    H    ASP  58           H        ASP  58  -0.425  20.996  -5.324
  315    HA   ASP  58           HA       ASP  58  -1.973  23.372  -5.826
  316    HB2  ASP  58           HB1      ASP  58  -0.412  21.524  -7.647
  317    HB3  ASP  58           HB2      ASP  58  -1.251  22.974  -8.210
  318    HD2  ASP  58           HD       ASP  58   1.127  25.084  -6.795
  319    H    GLU  59           H        GLU  59  -2.472  19.966  -6.017
  320    HA   GLU  59           HA       GLU  59  -5.039  20.429  -7.389
  321    HB2  GLU  59           HB1      GLU  59  -3.113  18.119  -7.548
  322    HB3  GLU  59           HB2      GLU  59  -4.818  17.930  -7.986
  323    HG2  GLU  59           HG1      GLU  59  -4.640  19.500  -9.760
  324    HG3  GLU  59           HG2      GLU  59  -3.029  20.002  -9.225
  325    HE2  GLU  59           HE       GLU  59  -2.086  16.549 -10.308
  326    H    LYS  60           H        LYS  60  -6.455  18.280  -6.926
  327    HA   LYS  60           HA       LYS  60  -6.863  18.333  -4.047
  328    HB2  LYS  60           HB1      LYS  60  -8.491  17.732  -6.431
  329    HB3  LYS  60           HB2      LYS  60  -8.825  16.706  -5.026
  330    HG2  LYS  60           HG1      LYS  60 -10.056  18.305  -4.122
  331    HG3  LYS  60           HG2      LYS  60  -8.655  19.392  -4.127
  332    HD2  LYS  60           HD1      LYS  60  -9.170  20.019  -6.464
  333    HD3  LYS  60           HD2      LYS  60 -10.607  18.983  -6.394
  334    HE2  LYS  60           HE1      LYS  60 -11.318  20.371  -4.365
  335    HE3  LYS  60           HE2      LYS  60 -10.052  21.506  -4.858
  336    HZ1  LYS  60           HZ1      LYS  60 -12.553  21.648  -5.727
  337    HZ2  LYS  60           HZ2      LYS  60 -11.895  20.678  -6.946
  338    HZ3  LYS  60           HZ3      LYS  60 -11.233  22.202  -6.628
  339    HA   PRO  61           HA       PRO  61  -5.262  14.357  -3.114
  340    HB2  PRO  61           HB1      PRO  61  -7.086  13.389  -1.315
  341    HB3  PRO  61           HB2      PRO  61  -5.953  14.688  -0.947
  342    HG2  PRO  61           HG1      PRO  61  -8.826  14.851  -1.791
  343    HG3  PRO  61           HG2      PRO  61  -7.970  15.747  -0.481
  344    HD2  PRO  61           HD1      PRO  61  -8.522  16.860  -2.896
  345    HD3  PRO  61           HD2      PRO  61  -7.065  17.257  -1.969
  346    H    PHE  62           H        PHE  62  -5.237  12.471  -4.161
  347    HA   PHE  62           HA       PHE  62  -7.709  11.080  -4.779
  348    HB2  PHE  62           HB1      PHE  62  -7.380  10.944  -7.137
  349    HB3  PHE  62           HB2      PHE  62  -7.265  12.650  -6.702
  350    HD1  PHE  62           HD1      PHE  62  -4.812  13.477  -6.132
  351    HD2  PHE  62           HD2      PHE  62  -5.763  10.106  -8.551
  352    HE1  PHE  62           HE1      PHE  62  -2.605  13.632  -7.210
  353    HE2  PHE  62           HE2      PHE  62  -3.557  10.256  -9.632
  354    HZ   PHE  62           HZ       PHE  62  -1.975  12.019  -8.960
  355    H    CYS  63           H        CYS  63  -7.092   8.990  -6.089
  356    HA   CYS  63           HA       CYS  63  -5.030   7.679  -4.519
  357    HB2  CYS  63           HB1      CYS  63  -7.460   6.890  -5.873
  358    HB3  CYS  63           HB2      CYS  63  -6.120   5.849  -6.358
  359    H    ALA  64           H        ALA  64  -3.082   7.068  -5.241
  360    HA   ALA  64           HA       ALA  64  -2.530   7.351  -8.124
  361    HB1  ALA  64           HB1      ALA  64  -1.499   9.157  -6.823
  362    HB2  ALA  64           HB2      ALA  64  -0.639   7.959  -5.855
  363    HB3  ALA  64           HB3      ALA  64  -0.291   8.117  -7.576
  364    H    THR  65           H        THR  65  -0.449   6.148  -8.734
  365    HA   THR  65           HA       THR  65  -0.641   3.444  -7.611
  366    HB   THR  65           HB       THR  65   1.020   3.799 -10.007
  367    HG1  THR  65           HG1      THR  65  -1.724   4.526  -9.981
  368   HG21  THR  65          HG21      THR  65  -1.268   2.066 -10.266
  369   HG22  THR  65          HG22      THR  65  -0.438   1.773  -8.738
  370   HG23  THR  65          HG23      THR  65   0.448   1.659 -10.258
  371    H    CYS  66           H        CYS  66   1.428   2.173  -7.582
  372    HA   CYS  66           HA       CYS  66   3.267   3.290  -5.834
  373    HB2  CYS  66           HB1      CYS  66   2.822   0.789  -6.955
  374    HB3  CYS  66           HB2      CYS  66   4.442   1.214  -7.515
  375    H    ARG  67           H        ARG  67   5.491   3.871  -6.105
  376    HA   ARG  67           HA       ARG  67   6.032   5.076  -8.737
  377    HB2  ARG  67           HB1      ARG  67   6.974   5.888  -5.977
  378    HB3  ARG  67           HB2      ARG  67   7.534   6.632  -7.483
  379    HG2  ARG  67           HG1      ARG  67   4.659   6.591  -6.558
  380    HG3  ARG  67           HG2      ARG  67   5.784   7.942  -6.338
  381    HD2  ARG  67           HD1      ARG  67   5.858   7.150  -9.082
  382    HD3  ARG  67           HD2      ARG  67   4.169   7.340  -8.590
  383    HE   ARG  67           HE       ARG  67   5.390   9.572  -7.621
  384   HH11  ARG  67          HH11      ARG  67   5.167   8.072 -10.754
  385   HH12  ARG  67          HH12      ARG  67   5.284   9.567 -11.623
  386   HH21  ARG  67          HH21      ARG  67   5.544  11.547  -8.753
  387   HH22  ARG  67          HH22      ARG  67   5.500  11.542 -10.483
  388    H    GLY  68           H        GLY  68   7.934   4.670  -9.769
  389    HA2  GLY  68           HA2      GLY  68   9.378   2.328  -9.020
  390    HA3  GLY  68           HA3      GLY  68   9.759   3.398 -10.362
  391    HA1  GLY  68           HA1      GLY  68   9.254   2.898  -8.357
  392    H    LEU  69           H        LEU  69  11.916   2.512  -9.288
  393    HA   LEU  69           HA       LEU  69  12.828   3.864  -6.956
  394    HB2  LEU  69           HB1      LEU  69  14.078   2.191  -9.091
  395    HB3  LEU  69           HB2      LEU  69  15.123   3.152  -8.030
  396    HG   LEU  69           HG       LEU  69  13.175   1.033  -7.121
  397   HD11  LEU  69          HD11      LEU  69  15.456   0.000  -6.408
  398   HD12  LEU  69          HD12      LEU  69  16.107   1.028  -7.683
  399   HD13  LEU  69          HD13      LEU  69  14.885  -0.185  -8.067
  400   HD21  LEU  69          HD21      LEU  69  13.335   2.602  -5.379
  401   HD22  LEU  69          HD22      LEU  69  15.060   2.853  -5.649
  402   HD23  LEU  69          HD23      LEU  69  14.485   1.333  -4.962
  403    H    ARG  70           H        ARG  70  12.718   4.654 -10.325
  404    HA   ARG  70           HA       ARG  70  14.630   6.823 -10.074
  405    HB2  ARG  70           HB1      ARG  70  12.986   5.712 -12.338
  406    HB3  ARG  70           HB2      ARG  70  13.833   7.258 -12.492
  407    HG2  ARG  70           HG1      ARG  70  15.399   4.916 -11.538
  408    HG3  ARG  70           HG2      ARG  70  14.933   4.978 -13.247
  409    HD2  ARG  70           HD1      ARG  70  15.894   7.320 -13.315
  410    HD3  ARG  70           HD2      ARG  70  16.557   6.991 -11.707
  411    HE   ARG  70           HE       ARG  70  18.200   5.758 -12.694
  412   HH11  ARG  70          HH11      ARG  70  15.531   6.030 -14.912
  413   HH12  ARG  70          HH12      ARG  70  16.364   5.248 -16.214
  414   HH21  ARG  70          HH21      ARG  70  19.307   4.727 -14.401
  415   HH22  ARG  70          HH22      ARG  70  18.512   4.507 -15.923
  416    H    ARG  71           H        ARG  71  11.244   6.325  -9.806
  417    HA   ARG  71           HA       ARG  71  10.348   8.929 -10.463
  418    HB2  ARG  71           HB1      ARG  71   9.224   6.485  -9.336
  419    HB3  ARG  71           HB2      ARG  71   8.539   7.944  -8.607
  420    HG2  ARG  71           HG1      ARG  71   7.221   7.148 -10.523
  421    HG3  ARG  71           HG2      ARG  71   7.878   8.774 -10.775
  422    HD2  ARG  71           HD1      ARG  71   9.622   7.934 -12.197
  423    HD3  ARG  71           HD2      ARG  71   9.191   6.265 -11.804
  424    HE   ARG  71           HE       ARG  71   7.931   7.958 -13.742
  425   HH11  ARG  71          HH11      ARG  71   7.460   5.256 -11.599
  426   HH12  ARG  71          HH12      ARG  71   6.161   4.580 -12.526
  427   HH21  ARG  71          HH21      ARG  71   6.222   7.078 -14.970
  428   HH22  ARG  71          HH22      ARG  71   5.459   5.617 -14.443
  429    H    ARG  72           H        ARG  72   9.804  10.668  -9.133
  430    HA   ARG  72           HA       ARG  72  11.481  10.949  -6.796
  431    HB2  ARG  72           HB1      ARG  72   9.573  12.860  -8.165
  432    HB3  ARG  72           HB2      ARG  72  10.582  13.283  -6.775
  433    HG2  ARG  72           HG1      ARG  72  12.261  12.120  -8.759
  434    HG3  ARG  72           HG2      ARG  72  11.251  13.360  -9.521
  435    HD2  ARG  72           HD1      ARG  72  12.610  13.950  -6.914
  436    HD3  ARG  72           HD2      ARG  72  13.528  14.016  -8.425
  437    HE   ARG  72           HE       ARG  72  11.250  15.510  -8.860
  438   HH11  ARG  72          HH11      ARG  72  13.963  15.582  -6.680
  439   HH12  ARG  72          HH12      ARG  72  13.938  17.304  -6.497
  440   HH21  ARG  72          HH21      ARG  72  11.206  17.778  -8.628
  441   HH22  ARG  72          HH22      ARG  72  12.369  18.553  -7.604
  442    H    CYS  73           H        CYS  73  10.723  11.578  -4.714
  443    HA   CYS  73           HA       CYS  73   7.889  11.112  -4.157
  444    HB2  CYS  73           HB1      CYS  73   8.293   9.540  -2.413
  445    HB3  CYS  73           HB2      CYS  73   9.163   8.962  -3.836
  446    H    GLN  74           H        GLN  74   7.429  11.612  -1.770
  447    HA   GLN  74           HA       GLN  74   9.138  13.823  -0.849
  448    HB2  GLN  74           HB1      GLN  74   6.138  13.762  -1.154
  449    HB3  GLN  74           HB2      GLN  74   6.949  14.905  -0.072
  450    HG2  GLN  74           HG1      GLN  74   8.326  15.609  -2.105
  451    HG3  GLN  74           HG2      GLN  74   7.126  14.725  -3.057
  452   HE21  GLN  74          HE21      GLN  74   7.469  17.372  -3.493
  453   HE22  GLN  74          HE22      GLN  74   6.101  18.258  -2.920
  454    H    ARG  75           H        ARG  75   6.744  11.370  -0.016
  455    HA   ARG  75           HA       ARG  75   7.671  11.508   2.778
  456    HB2  ARG  75           HB1      ARG  75   4.975  11.046   1.580
  457    HB3  ARG  75           HB2      ARG  75   5.374  10.225   3.096
  458    HG2  ARG  75           HG1      ARG  75   5.978  12.464   4.057
  459    HG3  ARG  75           HG2      ARG  75   5.309  13.186   2.586
  460    HD2  ARG  75           HD1      ARG  75   3.229  13.015   3.372
  461    HD3  ARG  75           HD2      ARG  75   3.450  11.283   3.650
  462    HE   ARG  75           HE       ARG  75   4.712  12.369   5.765
  463   HH11  ARG  75          HH11      ARG  75   1.564  12.893   4.375
  464   HH12  ARG  75          HH12      ARG  75   0.823  13.312   5.885
  465   HH21  ARG  75          HH21      ARG  75   3.749  12.918   7.758
  466   HH22  ARG  75          HH22      ARG  75   2.067  13.327   7.809
  467    H    ASP  76           H        ASP  76   8.253   9.634   3.812
  468    HA   ASP  76           HA       ASP  76   9.322   7.548   2.302
  469    HB2  ASP  76           HB1      ASP  76   8.457   7.233   5.176
  470    HB3  ASP  76           HB2      ASP  76   9.833   6.485   4.355
  471    HD2  ASP  76           HD       ASP  76  11.879   9.167   5.000
  472    H    ALA  77           H        ALA  77   6.184   7.876   3.855
  473    HA   ALA  77           HA       ALA  77   5.395   5.165   3.312
  474    HB1  ALA  77           HB1      ALA  77   4.283   5.936   5.158
  475    HB2  ALA  77           HB2      ALA  77   4.089   7.561   4.500
  476    HB3  ALA  77           HB3      ALA  77   3.073   6.246   3.913
  477    H    MET  78           H        MET  78   5.252   8.202   1.656
  478    HA   MET  78           HA       MET  78   3.120   7.613  -0.112
  479    HB2  MET  78           HB1      MET  78   5.197   9.676   0.158
  480    HB3  MET  78           HB2      MET  78   4.705   9.357  -1.512
  481    HG2  MET  78           HG1      MET  78   2.381   9.800  -0.955
  482    HG3  MET  78           HG2      MET  78   2.827  10.046   0.734
  483    HE1  MET  78           HE1      MET  78   5.179  11.313  -2.176
  484    HE2  MET  78           HE2      MET  78   3.574  11.239  -2.902
  485    HE3  MET  78           HE3      MET  78   4.351  12.801  -2.636
  486    H    CYS  79           H        CYS  79   6.460   6.714  -0.033
  487    HA   CYS  79           HA       CYS  79   6.659   6.005  -2.805
  488    HB2  CYS  79           HB1      CYS  79   8.407   6.149  -0.523
  489    HB3  CYS  79           HB2      CYS  79   8.600   4.585  -1.318
  490    H    CYS  80           H        CYS  80   7.679   3.573  -3.021
  491    HA   CYS  80           HA       CYS  80   5.411   1.871  -2.722
  492    HB2  CYS  80           HB1      CYS  80   8.183   1.569  -3.815
  493    HB3  CYS  80           HB2      CYS  80   7.224   0.120  -3.505
  494    HA   PRO  81           HA       PRO  81   6.183  -0.149   1.094
  495    HB2  PRO  81           HB1      PRO  81   5.471  -2.736   0.543
  496    HB3  PRO  81           HB2      PRO  81   4.310  -1.417   0.691
  497    HG2  PRO  81           HG1      PRO  81   5.533  -2.607  -1.775
  498    HG3  PRO  81           HG2      PRO  81   3.812  -2.176  -1.451
  499    HD2  PRO  81           HD1      PRO  81   5.461  -0.608  -2.932
  500    HD3  PRO  81           HD2      PRO  81   4.185   0.055  -1.895
  501    H    GLY  82           H        GLY  82   8.166  -0.460   1.891
  502    HA2  GLY  82           HA2      GLY  82   9.937  -2.001   2.383
  503    HA3  GLY  82           HA3      GLY  82   9.797  -2.626   0.747
  504    HA1  GLY  82           HA1      GLY  82   9.789  -1.139   2.265
  505    H    THR  83           H        THR  83   9.561   0.626   0.457
  506    HA   THR  83           HA       THR  83  12.466   0.915   0.037
  507    HB   THR  83           HB       THR  83  11.907   2.582  -1.719
  508    HG1  THR  83           HG1      THR  83   9.258   1.599  -1.678
  509   HG21  THR  83          HG21      THR  83  11.509  -0.273  -1.838
  510   HG22  THR  83          HG22      THR  83  12.246   0.804  -3.023
  511   HG23  THR  83          HG23      THR  83  10.502   0.551  -3.028
  512    H    LEU  84           H        LEU  84  13.130   3.305  -0.017
  513    HA   LEU  84           HA       LEU  84  11.674   4.827   2.036
  514    HB2  LEU  84           HB1      LEU  84  14.050   3.551   2.507
  515    HB3  LEU  84           HB2      LEU  84  14.584   5.175   2.035
  516    HG   LEU  84           HG       LEU  84  12.877   5.978   3.825
  517   HD11  LEU  84          HD11      LEU  84  13.192   4.004   5.676
  518   HD12  LEU  84          HD12      LEU  84  12.898   3.078   4.206
  519   HD13  LEU  84          HD13      LEU  84  11.728   4.287   4.735
  520   HD21  LEU  84          HD21      LEU  84  14.756   6.514   4.872
  521   HD22  LEU  84          HD22      LEU  84  15.627   5.381   3.838
  522   HD23  LEU  84          HD23      LEU  84  14.986   4.844   5.391
  523    H    CYS  85           H        CYS  85  12.259   7.149   2.062
  524    HA   CYS  85           HA       CYS  85  12.517   8.118  -0.677
  525    HB2  CYS  85           HB1      CYS  85  11.330   9.130   1.840
  526    HB3  CYS  85           HB2      CYS  85  12.055  10.351   0.794
  527    H    VAL  86           H        VAL  86  14.503   8.539  -1.375
  528    HA   VAL  86           HA       VAL  86  16.341   9.970   0.428
  529    HB   VAL  86           HB       VAL  86  17.171   7.853  -1.560
  530   HG11  VAL  86          HG11      VAL  86  19.358   8.080  -0.302
  531   HG12  VAL  86          HG12      VAL  86  18.920   9.425  -1.357
  532   HG13  VAL  86          HG13      VAL  86  18.696   9.562   0.387
  533   HG21  VAL  86          HG21      VAL  86  15.994   6.869   0.343
  534   HG22  VAL  86          HG22      VAL  86  17.713   6.475   0.383
  535   HG23  VAL  86          HG23      VAL  86  17.068   7.721   1.453
  536    H    ASN  87           H        ASN  87  17.038  11.838  -0.370
  537    HA   ASN  87           HA       ASN  87  17.417  13.569  -1.797
  538    HB2  ASN  87           HB1      ASN  87  19.128  11.894  -2.597
  539    HB3  ASN  87           HB2      ASN  87  17.978  11.430  -3.858
  540   HD21  ASN  87          HD21      ASN  87  19.733  14.198  -2.553
  541   HD22  ASN  87          HD22      ASN  87  19.873  15.042  -4.052
  542    H    ASP  88           H        ASP  88  14.729  12.669  -1.560
  543    HA   ASP  88           HA       ASP  88  12.682  13.057  -2.475
  544    HB2  ASP  88           HB1      ASP  88  14.221  15.123  -3.337
  545    HB3  ASP  88           HB2      ASP  88  13.714  14.427  -4.883
  546    HD2  ASP  88           HD       ASP  88  10.679  15.953  -4.602
  547    H    VAL  89           H        VAL  89  14.395  10.759  -3.305
  548    HA   VAL  89           HA       VAL  89  12.812   9.998  -5.656
  549    HB   VAL  89           HB       VAL  89  15.781   9.511  -5.380
  550   HG11  VAL  89          HG11      VAL  89  13.692   8.337  -7.110
  551   HG12  VAL  89          HG12      VAL  89  15.215   8.770  -7.890
  552   HG13  VAL  89          HG13      VAL  89  15.207   7.646  -6.530
  553   HG21  VAL  89          HG21      VAL  89  14.190  11.563  -6.735
  554   HG22  VAL  89          HG22      VAL  89  15.890  11.572  -6.264
  555   HG23  VAL  89          HG23      VAL  89  15.393  10.781  -7.761
  556    H    CYS  90           H        CYS  90  12.192   7.866  -5.732
  557    HA   CYS  90           HA       CYS  90  12.075   6.455  -3.289
  558    HB2  CYS  90           HB1      CYS  90  10.774   6.340  -5.742
  559    HB3  CYS  90           HB2      CYS  90  11.635   4.802  -5.652
  560    H    THR  91           H        THR  91  13.745   5.492  -2.350
  561    HA   THR  91           HA       THR  91  15.651   4.016  -4.048
  562    HB   THR  91           HB       THR  91  16.207   5.410  -1.423
  563    HG1  THR  91           HG1      THR  91  17.729   6.527  -2.977
  564   HG21  THR  91          HG21      THR  91  17.938   3.690  -3.192
  565   HG22  THR  91          HG22      THR  91  17.563   3.459  -1.484
  566   HG23  THR  91          HG23      THR  91  18.594   4.797  -1.988
  567    H    THR  92           H        THR  92  15.874   1.906  -3.661
  568    HA   THR  92           HA       THR  92  14.173   0.478  -1.992
  569    HB   THR  92           HB       THR  92  16.395  -1.173  -2.254
  570    HG1  THR  92           HG1      THR  92  16.734  -0.714  -4.650
  571   HG21  THR  92          HG21      THR  92  14.997  -2.420  -3.549
  572   HG22  THR  92          HG22      THR  92  14.483  -1.039  -4.517
  573   HG23  THR  92          HG23      THR  92  13.806  -1.290  -2.909
  574    H    MET  93           H        MET  93  14.745  -0.918  -0.151
  575    HA   MET  93           HA       MET  93  16.061   0.605   1.888
  576    HB2  MET  93           HB1      MET  93  14.236  -1.613   1.744
  577    HB3  MET  93           HB2      MET  93  15.577  -2.012   2.830
  578    HG2  MET  93           HG1      MET  93  15.128   0.287   3.907
  579    HG3  MET  93           HG2      MET  93  13.584   0.205   3.055
  580    HE1  MET  93           HE1      MET  93  15.588  -0.599   6.005
  581    HE2  MET  93           HE2      MET  93  14.106   0.234   6.470
  582    HE3  MET  93           HE3      MET  93  14.426  -1.395   7.067
  583    H    GLU  94           H        GLU  94  16.834  -2.213  -0.053
  584    HA   GLU  94           HA       GLU  94  19.135  -2.983   1.443
  585    HB2  GLU  94           HB1      GLU  94  18.327  -3.604  -1.407
  586    HB3  GLU  94           HB2      GLU  94  19.662  -4.381  -0.541
  587    HG2  GLU  94           HG1      GLU  94  17.540  -4.724   1.179
  588    HG3  GLU  94           HG2      GLU  94  16.803  -4.901  -0.419
  589    HE2  GLU  94           HE       GLU  94  18.467  -7.883  -1.024
  590    H    ASP  95           H        ASP  95  18.540  -0.790  -1.209
  591    HA   ASP  95           HA       ASP  95  21.312  -0.434  -1.871
  592    HB2  ASP  95           HB1      ASP  95  19.057   0.005  -3.259
  593    HB3  ASP  95           HB2      ASP  95  19.316   1.634  -2.624
  594    HD2  ASP  95           HD       ASP  95  21.406   2.104  -5.300
  595    H    ALA  96           H        ALA  96  18.857   1.569  -0.247
  596    HA   ALA  96           HA       ALA  96  20.496   3.733   0.390
  597    HB1  ALA  96           HB1      ALA  96  18.055   2.630   1.760
  598    HB2  ALA  96           HB2      ALA  96  18.839   4.133   2.248
  599    HB3  ALA  96           HB3      ALA  96  18.153   3.982   0.631
  600    H    THR  97           H        THR  97  21.573   4.326   2.312
  601    HA   THR  97           HA       THR  97  23.035   3.999   4.028
  602    HB   THR  97           HB       THR  97  21.210   1.704   4.771
  603    HG1  THR  97           HG1      THR  97  19.972   3.187   5.786
  604   HG21  THR  97          HG21      THR  97  23.550   2.947   6.029
  605   HG22  THR  97          HG22      THR  97  22.812   1.370   6.314
  606   HG23  THR  97          HG23      THR  97  22.146   2.809   7.087
  607    H    GLU  98           H        GLU  98  24.815   3.394   2.790
  608    HA   GLU  98           HA       GLU  98  25.292   0.838   1.748
  609    HB2  GLU  98           HB1      GLU  98  27.625   1.514   1.560
  610    HB3  GLU  98           HB2      GLU  98  26.554   2.833   1.066
  611    HG2  GLU  98           HG1      GLU  98  27.007   4.101   2.958
  612    HG3  GLU  98           HG2      GLU  98  27.605   2.702   3.861
  613    HE2  GLU  98           HE       GLU  98  30.703   4.006   3.049
  614    H    ASN  99           H        ASN  99  27.127  -0.601   2.470
  615    HA   ASN  99           HA       ASN  99  27.118  -0.876   5.403
  616    HB2  ASN  99           HB1      ASN  99  26.493  -2.835   3.270
  617    HB3  ASN  99           HB2      ASN  99  27.516  -3.429   4.583
  618   HD21  ASN  99          HD21      ASN  99  24.382  -2.903   3.591
  619   HD22  ASN  99          HD22      ASN  99  23.587  -3.072   5.115
  620    H    LEU 100           H        LEU 100  29.027  -1.413   6.392
  621    HA   LEU 100           HA       LEU 100  31.400  -1.524   4.648
  622    HB2  LEU 100           HB1      LEU 100  30.858   0.461   6.359
  623    HB3  LEU 100           HB2      LEU 100  31.666  -0.660   7.469
  624    HG   LEU 100           HG       LEU 100  33.533  -0.671   5.630
  625   HD11  LEU 100          HD11      LEU 100  32.479   2.098   5.190
  626   HD12  LEU 100          HD12      LEU 100  32.005   0.761   4.142
  627   HD13  LEU 100          HD13      LEU 100  33.704   1.215   4.278
  628   HD21  LEU 100          HD21      LEU 100  32.985   0.984   7.946
  629   HD22  LEU 100          HD22      LEU 100  34.061   1.781   6.799
  630   HD23  LEU 100          HD23      LEU 100  34.482   0.196   7.448
  631    H    TYR 101           H        TYR 101  33.305  -2.607   5.690
  632    HA   TYR 101           HA       TYR 101  32.595  -4.685   7.615
  633    HB2  TYR 101           HB1      TYR 101  32.886  -5.146   4.794
  634    HB3  TYR 101           HB2      TYR 101  34.192  -5.965   5.655
  635    HD1  TYR 101           HD1      TYR 101  33.830  -8.080   6.525
  636    HD2  TYR 101           HD2      TYR 101  30.484  -5.548   5.821
  637    HE1  TYR 101           HE1      TYR 101  32.316  -9.921   7.135
  638    HE2  TYR 101           HE2      TYR 101  28.962  -7.382   6.429
  639    HH   TYR 101           HH       TYR 101  30.212 -10.565   7.395
  640    H    PHE 102           H        PHE 102  34.629  -6.010   8.162
  641    HA   PHE 102           HA       PHE 102  37.023  -4.308   8.068
  642    HB2  PHE 102           HB1      PHE 102  37.475  -4.624  10.389
  643    HB3  PHE 102           HB2      PHE 102  35.799  -4.085  10.259
  644    HD1  PHE 102           HD1      PHE 102  37.979  -6.882  11.109
  645    HD2  PHE 102           HD2      PHE 102  33.946  -5.576  10.728
  646    HE1  PHE 102           HE1      PHE 102  37.227  -8.845  12.388
  647    HE2  PHE 102           HE2      PHE 102  33.188  -7.536  12.008
  648    HZ   PHE 102           HZ       PHE 102  34.828  -9.172  12.841
  649    H    GLN 103           H        GLN 103  38.987  -5.375   8.010
  650    HA   GLN 103           HA       GLN 103  38.807  -8.270   7.523
  651    HB2  GLN 103           HB1      GLN 103  39.645  -6.562   5.735
  652    HB3  GLN 103           HB2      GLN 103  41.142  -6.591   6.679
  653    HG2  GLN 103           HG1      GLN 103  41.431  -8.934   6.309
  654    HG3  GLN 103           HG2      GLN 103  39.830  -9.058   5.569
  655   HE21  GLN 103          HE21      GLN 103  40.870  -9.988   3.739
  656   HE22  GLN 103          HE22      GLN 103  41.654  -8.984   2.572
  657    H    SER 104           H        SER 104  40.518  -9.631   8.281
  658    HA   SER 104           HA       SER 104  41.263  -9.112  10.954
  659    HB2  SER 104           HB1      SER 104  42.556 -11.207  10.801
  660    HB3  SER 104           HB2      SER 104  40.934 -11.391  10.109
  661    HG   SER 104           HG       SER 104  43.418 -11.349   8.833
  662    H    LEU 105           H        LEU 105  43.398  -8.935  11.845
  663    HA   LEU 105           HA       LEU 105  45.206  -7.423  10.090
  664    HB2  LEU 105           HB1      LEU 105  46.183  -6.555  12.207
  665    HB3  LEU 105           HB2      LEU 105  44.481  -6.132  11.956
  666    HG   LEU 105           HG       LEU 105  44.429  -8.481  13.470
  667   HD11  LEU 105          HD11      LEU 105  46.489  -6.558  14.543
  668   HD12  LEU 105          HD12      LEU 105  46.801  -8.193  13.961
  669   HD13  LEU 105          HD13      LEU 105  45.816  -7.944  15.402
  670   HD21  LEU 105          HD21      LEU 105  43.691  -6.871  15.274
  671   HD22  LEU 105          HD22      LEU 105  42.809  -6.786  13.749
  672   HD23  LEU 105          HD23      LEU 105  44.032  -5.573  14.129
  673    H    GLU 106           H        GLU 106  47.548  -7.659  10.530
  674    HA   GLU 106           HA       GLU 106  48.196 -10.461  11.168
  675    HB2  GLU 106           HB1      GLU 106  49.792  -8.580   9.419
  676    HB3  GLU 106           HB2      GLU 106  50.032 -10.323   9.622
  677    HG2  GLU 106           HG1      GLU 106  47.908 -10.779   8.534
  678    HG3  GLU 106           HG2      GLU 106  47.611  -9.042   8.375
  679    HE2  GLU 106           HE       GLU 106  49.470  -8.867   5.504
  680    H    HIS 107           H        HIS 107  50.646 -10.654  11.748
  681    HA   HIS 107           HA       HIS 107  51.149  -8.709  13.895
  682    HB2  HIS 107           HB1      HIS 107  52.467 -10.433  14.986
  683    HB3  HIS 107           HB2      HIS 107  50.859 -11.058  14.602
  684    HD1  HIS 107           HD1      HIS 107  54.381 -11.202  13.190
  685    HD2  HIS 107           HD2      HIS 107  50.845 -13.384  13.198
  686    HE1  HIS 107           HE1      HIS 107  54.917 -13.356  12.008
  687    HE2  HIS 107           HE2      HIS 107  52.758 -14.690  12.014
  688    H    HIS 108           H        HIS 108  53.630  -8.674  14.454
  689    HA   HIS 108           HA       HIS 108  55.216  -8.525  11.991
  690    HB2  HIS 108           HB1      HIS 108  54.200  -6.282  13.391
  691    HB3  HIS 108           HB2      HIS 108  55.934  -6.348  13.723
  692    HD1  HIS 108           HD1      HIS 108  53.767  -6.669  10.601
  693    HD2  HIS 108           HD2      HIS 108  57.350  -4.994  11.875
  694    HE1  HIS 108           HE1      HIS 108  54.696  -5.465   8.597
  695    HE2  HIS 108           HE2      HIS 108  56.886  -4.442   9.375
  696    H    HIS 109           H        HIS 109  57.393  -8.934  12.234
  697    HA   HIS 109           HA       HIS 109  58.139 -10.222  14.728
  698    HB2  HIS 109           HB1      HIS 109  59.054 -10.291  11.923
  699    HB3  HIS 109           HB2      HIS 109  60.340 -10.438  13.127
  700    HD1  HIS 109           HD1      HIS 109  57.087 -12.141  12.183
  701    HD2  HIS 109           HD2      HIS 109  60.620 -12.916  14.226
  702    HE1  HIS 109           HE1      HIS 109  57.016 -14.592  12.743
  703    HE2  HIS 109           HE2      HIS 109  59.174 -15.066  13.992
  704    H    HIS 110           H        HIS 110  59.404  -9.352  16.238
  705    HA   HIS 110           HA       HIS 110  60.542  -6.709  15.740
  706    HB2  HIS 110           HB1      HIS 110  59.975  -8.289  18.246
  707    HB3  HIS 110           HB2      HIS 110  60.950  -6.816  18.274
  708    HD1  HIS 110           HD1      HIS 110  59.573  -4.945  19.092
  709    HD2  HIS 110           HD2      HIS 110  57.401  -7.482  16.622
  710    HE1  HIS 110           HE1      HIS 110  57.287  -3.913  18.912
  711    HE2  HIS 110           HE2      HIS 110  55.957  -5.462  17.400
  712    H    HIS 111           H        HIS 111  62.565  -6.634  15.031
  713    HA   HIS 111           HA       HIS 111  64.404  -8.814  15.505
  714    HB2  HIS 111           HB1      HIS 111  64.329  -6.388  13.792
  715    HB3  HIS 111           HB2      HIS 111  65.929  -6.964  14.272
  716    HD1  HIS 111           HD1      HIS 111  63.535  -7.405  11.676
  717    HD2  HIS 111           HD2      HIS 111  66.181  -9.915  13.666
  718    HE1  HIS 111           HE1      HIS 111  63.818  -9.406  10.180
  719    HE2  HIS 111           HE2      HIS 111  65.433 -10.941  11.396
  720    H    HIS 112           H        HIS 112  65.962  -8.894  16.999
  721    HA   HIS 112           HA       HIS 112  66.052  -7.010  19.105
  722    HB2  HIS 112           HB1      HIS 112  68.062  -8.309  19.855
  723    HB3  HIS 112           HB2      HIS 112  66.618  -9.288  19.581
  724    HD1  HIS 112           HD1      HIS 112  68.342 -11.314  19.339
  725    HD2  HIS 112           HD2      HIS 112  68.471  -8.454  16.329
  726    HE1  HIS 112           HE1      HIS 112  69.594 -12.390  17.443
  727    HE2  HIS 112           HE2      HIS 112  69.672 -10.642  15.602
  Start of MODEL   16
    1    H1   MET  18           H        MET  18 -63.659  -7.027  20.332
    2    HA   MET  18           HA       MET  18 -64.305  -4.912  19.805
    3    HB2  MET  18           HB1      MET  18 -62.713  -4.568  22.303
    4    HB3  MET  18           HB2      MET  18 -63.153  -3.114  21.395
    5    HG2  MET  18           HG1      MET  18 -65.518  -3.712  21.536
    6    HG3  MET  18           HG2      MET  18 -65.086  -5.180  22.418
    7    HE1  MET  18           HE1      MET  18 -66.014  -1.394  22.833
    8    HE2  MET  18           HE2      MET  18 -64.790  -0.876  23.992
    9    HE3  MET  18           HE3      MET  18 -64.309  -1.406  22.380
   10    H    LEU  19           H        LEU  19 -63.626  -4.283  17.858
   11    HA   LEU  19           HA       LEU  19 -60.821  -3.452  17.547
   12    HB2  LEU  19           HB1      LEU  19 -62.655  -4.983  15.900
   13    HB3  LEU  19           HB2      LEU  19 -61.969  -3.607  15.017
   14    HG   LEU  19           HG       LEU  19 -59.814  -4.869  16.325
   15   HD11  LEU  19          HD11      LEU  19 -61.240  -6.834  16.601
   16   HD12  LEU  19          HD12      LEU  19 -59.935  -7.139  15.454
   17   HD13  LEU  19          HD13      LEU  19 -61.572  -6.840  14.868
   18   HD21  LEU  19          HD21      LEU  19 -60.460  -5.287  13.438
   19   HD22  LEU  19          HD22      LEU  19 -58.909  -4.940  14.203
   20   HD23  LEU  19          HD23      LEU  19 -60.116  -3.664  14.036
   21    H    VAL  20           H        VAL  20 -60.571  -1.327  17.700
   22    HA   VAL  20           HA       VAL  20 -62.682   0.541  17.324
   23    HB   VAL  20           HB       VAL  20 -60.966   2.270  17.606
   24   HG11  VAL  20          HG11      VAL  20 -60.233   1.650  19.855
   25   HG12  VAL  20          HG12      VAL  20 -61.919   1.201  19.583
   26   HG13  VAL  20          HG13      VAL  20 -60.657  -0.031  19.532
   27   HG21  VAL  20          HG21      VAL  20 -58.611   1.440  18.123
   28   HG22  VAL  20          HG22      VAL  20 -59.089  -0.061  17.330
   29   HG23  VAL  20          HG23      VAL  20 -59.101   1.455  16.428
   30    H    LEU  21           H        LEU  21 -62.999   2.052  15.689
   31    HA   LEU  21           HA       LEU  21 -62.159   1.187  13.065
   32    HB2  LEU  21           HB1      LEU  21 -64.352   2.597  14.157
   33    HB3  LEU  21           HB2      LEU  21 -63.537   3.695  13.030
   34    HG   LEU  21           HG       LEU  21 -63.681   1.626  11.410
   35   HD11  LEU  21          HD11      LEU  21 -66.256   1.103  12.750
   36   HD12  LEU  21          HD12      LEU  21 -64.821   0.434  13.526
   37   HD13  LEU  21          HD13      LEU  21 -65.197   0.014  11.855
   38   HD21  LEU  21          HD21      LEU  21 -66.338   2.680  11.475
   39   HD22  LEU  21          HD22      LEU  21 -65.027   3.035  10.350
   40   HD23  LEU  21          HD23      LEU  21 -65.188   3.965  11.841
   41    H    ASP  22           H        ASP  22 -60.822   2.246  11.663
   42    HA   ASP  22           HA       ASP  22 -58.920   4.070  12.824
   43    HB2  ASP  22           HB1      ASP  22 -57.695   3.856  10.767
   44    HB3  ASP  22           HB2      ASP  22 -58.290   2.253  11.220
   45    HD2  ASP  22           HD       ASP  22 -59.105   3.293   7.692
   46    H    PHE  23           H        PHE  23 -58.206   5.825  10.961
   47    HA   PHE  23           HA       PHE  23 -60.279   7.194   9.633
   48    HB2  PHE  23           HB1      PHE  23 -61.069   7.672  11.903
   49    HB3  PHE  23           HB2      PHE  23 -59.492   8.346  12.319
   50    HD1  PHE  23           HD1      PHE  23 -62.282   8.820   9.902
   51    HD2  PHE  23           HD2      PHE  23 -59.103  10.609  12.094
   52    HE1  PHE  23           HE1      PHE  23 -63.008  11.042   9.133
   53    HE2  PHE  23           HE2      PHE  23 -59.825  12.834  11.330
   54    HZ   PHE  23           HZ       PHE  23 -61.779  13.053   9.848
   55    H    ASN  24           H        ASN  24 -58.553   7.110   8.106
   56    HA   ASN  24           HA       ASN  24 -56.739   7.900   6.974
   57    HB2  ASN  24           HB1      ASN  24 -57.526  10.374   8.532
   58    HB3  ASN  24           HB2      ASN  24 -56.331  10.372   7.231
   59   HD21  ASN  24          HD21      ASN  24 -57.482  11.706   5.890
   60   HD22  ASN  24          HD22      ASN  24 -58.942  11.221   5.104
   61    H    ASN  25           H        ASN  25 -55.312   6.458   8.105
   62    HA   ASN  25           HA       ASN  25 -53.603   7.800  10.095
   63    HB2  ASN  25           HB1      ASN  25 -54.013   4.835   9.615
   64    HB3  ASN  25           HB2      ASN  25 -52.948   5.540  10.837
   65   HD21  ASN  25          HD21      ASN  25 -53.780   5.364  12.776
   66   HD22  ASN  25          HD22      ASN  25 -55.442   5.577  13.199
   67    H    ILE  26           H        ILE  26 -51.292   6.869  10.069
   68    HA   ILE  26           HA       ILE  26 -49.285   6.759   9.002
   69    HB   ILE  26           HB       ILE  26 -50.883   5.353   6.859
   70   HG12  ILE  26          HG11      ILE  26 -49.141   3.773   8.608
   71   HG13  ILE  26          HG12      ILE  26 -50.469   4.565   9.472
   72   HG21  ILE  26          HG21      ILE  26 -48.996   5.479   5.680
   73   HG22  ILE  26          HG22      ILE  26 -48.083   6.086   7.060
   74   HG23  ILE  26          HG23      ILE  26 -48.312   4.349   6.849
   75   HD11  ILE  26          HD11      ILE  26 -50.528   2.263   7.730
   76   HD12  ILE  26          HD12      ILE  26 -51.736   2.850   8.874
   77   HD13  ILE  26          HD13      ILE  26 -51.688   3.496   7.234
   78    H    ARG  27           H        ARG  27 -49.084   8.999   8.710
   79    HA   ARG  27           HA       ARG  27 -49.118   9.817   5.921
   80    HB2  ARG  27           HB1      ARG  27 -51.344  10.458   6.931
   81    HB3  ARG  27           HB2      ARG  27 -50.452  11.541   8.009
   82    HG2  ARG  27           HG1      ARG  27 -49.687  12.876   6.187
   83    HG3  ARG  27           HG2      ARG  27 -50.312  11.710   5.010
   84    HD2  ARG  27           HD1      ARG  27 -52.058  13.195   6.982
   85    HD3  ARG  27           HD2      ARG  27 -51.727  13.758   5.337
   86    HE   ARG  27           HE       ARG  27 -53.556  11.716   6.100
   87   HH11  ARG  27          HH11      ARG  27 -51.369  12.698   3.575
   88   HH12  ARG  27          HH12      ARG  27 -52.224  11.854   2.327
   89   HH21  ARG  27          HH21      ARG  27 -54.691  10.600   4.464
   90   HH22  ARG  27          HH22      ARG  27 -54.114  10.662   2.833
   91    H    SER  28           H        SER  28 -47.282  10.833   5.465
   92    HA   SER  28           HA       SER  28 -46.100  12.838   7.040
   93    HB2  SER  28           HB1      SER  28 -44.504  11.817   8.298
   94    HB3  SER  28           HB2      SER  28 -45.607  10.434   8.192
   95    HG   SER  28           HG       SER  28 -43.175  10.364   7.480
   96    H    SER  29           H        SER  29 -43.786  13.299   6.262
   97    HA   SER  29           HA       SER  29 -43.515  12.537   3.429
   98    HB2  SER  29           HB1      SER  29 -42.462  14.993   3.333
   99    HB3  SER  29           HB2      SER  29 -44.194  14.704   3.094
  100    HG   SER  29           HG       SER  29 -43.535  16.386   4.678
  101    H    ALA  30           H        ALA  30 -41.301  12.939   2.569
  102    HA   ALA  30           HA       ALA  30 -39.288  12.384   4.650
  103    HB1  ALA  30           HB1      ALA  30 -38.329  11.595   2.101
  104    HB2  ALA  30           HB2      ALA  30 -38.720  10.581   3.491
  105    HB3  ALA  30           HB3      ALA  30 -39.959  10.951   2.292
  106    H    ASP  31           H        ASP  31 -39.977  14.151   1.686
  107    HA   ASP  31           HA       ASP  31 -39.030  15.991   0.742
  108    HB2  ASP  31           HB1      ASP  31 -38.505  16.256   3.624
  109    HB3  ASP  31           HB2      ASP  31 -37.388  17.168   2.600
  110    HD2  ASP  31           HD       ASP  31 -41.091  18.226   1.790
  111    H    LEU  32           H        LEU  32 -36.800  17.090   0.349
  112    HA   LEU  32           HA       LEU  32 -34.571  15.228   0.556
  113    HB2  LEU  32           HB1      LEU  32 -34.080  15.337  -1.842
  114    HB3  LEU  32           HB2      LEU  32 -35.636  14.556  -1.507
  115    HG   LEU  32           HG       LEU  32 -36.173  17.292  -1.967
  116   HD11  LEU  32          HD11      LEU  32 -35.010  17.958  -3.778
  117   HD12  LEU  32          HD12      LEU  32 -34.864  16.324  -4.424
  118   HD13  LEU  32          HD13      LEU  32 -33.789  16.860  -3.132
  119   HD21  LEU  32          HD21      LEU  32 -36.730  14.679  -3.279
  120   HD22  LEU  32          HD22      LEU  32 -37.119  16.162  -4.149
  121   HD23  LEU  32          HD23      LEU  32 -37.844  15.849  -2.571
  122    H    HIS  33           H        HIS  33 -32.525  16.219  -0.250
  123    HA   HIS  33           HA       HIS  33 -32.522  19.087   0.380
  124    HB2  HIS  33           HB1      HIS  33 -30.393  16.952   0.535
  125    HB3  HIS  33           HB2      HIS  33 -30.006  18.672   0.649
  126    HD1  HIS  33           HD1      HIS  33 -30.159  19.707   2.906
  127    HD2  HIS  33           HD2      HIS  33 -32.227  16.110   2.689
  128    HE1  HIS  33           HE1      HIS  33 -30.921  19.226   5.254
  129    HE2  HIS  33           HE2      HIS  33 -32.186  17.029   5.122
  130    H    GLY  34           H        GLY  34 -30.873  16.791  -1.801
  131    HA2  GLY  34           HA2      GLY  34 -30.703  17.100  -4.150
  132    HA3  GLY  34           HA3      GLY  34 -31.017  18.814  -3.919
  133    HA1  GLY  34           HA1      GLY  34 -30.189  16.912  -3.458
  134    H    ALA  35           H        ALA  35 -29.290  20.082  -2.861
  135    HA   ALA  35           HA       ALA  35 -26.772  19.515  -4.096
  136    HB1  ALA  35           HB1      ALA  35 -26.063  21.634  -3.277
  137    HB2  ALA  35           HB2      ALA  35 -27.741  21.806  -3.792
  138    HB3  ALA  35           HB3      ALA  35 -27.355  21.670  -2.076
  139    H    ARG  36           H        ARG  36 -25.108  18.423  -3.284
  140    HA   ARG  36           HA       ARG  36 -24.515  18.425  -0.467
  141    HB2  ARG  36           HB1      ARG  36 -26.258  16.662  -0.663
  142    HB3  ARG  36           HB2      ARG  36 -25.208  15.803  -1.801
  143    HG2  ARG  36           HG1      ARG  36 -23.523  15.490  -0.094
  144    HG3  ARG  36           HG2      ARG  36 -24.486  16.437   1.053
  145    HD2  ARG  36           HD1      ARG  36 -25.436  13.878  -0.254
  146    HD3  ARG  36           HD2      ARG  36 -24.680  13.966   1.344
  147    HE   ARG  36           HE       ARG  36 -26.933  15.713   1.096
  148   HH11  ARG  36          HH11      ARG  36 -25.948  12.435   1.729
  149   HH12  ARG  36          HH12      ARG  36 -27.367  12.047   2.643
  150   HH21  ARG  36          HH21      ARG  36 -28.807  15.214   2.296
  151   HH22  ARG  36          HH22      ARG  36 -28.993  13.627   2.964
  152    H    LYS  37           H        LYS  37 -22.456  17.462   0.019
  153    HA   LYS  37           HA       LYS  37 -20.807  16.607  -2.216
  154    HB2  LYS  37           HB1      LYS  37 -19.035  18.265  -1.702
  155    HB3  LYS  37           HB2      LYS  37 -20.521  19.005  -2.321
  156    HG2  LYS  37           HG1      LYS  37 -20.341  18.794   0.616
  157    HG3  LYS  37           HG2      LYS  37 -19.181  19.888  -0.158
  158    HD2  LYS  37           HD1      LYS  37 -21.421  20.610  -1.473
  159    HD3  LYS  37           HD2      LYS  37 -22.121  20.093   0.071
  160    HE2  LYS  37           HE1      LYS  37 -21.696  22.370   0.397
  161    HE3  LYS  37           HE2      LYS  37 -20.322  21.561   1.163
  162    HZ1  LYS  37           HZ1      LYS  37 -20.305  23.426  -0.945
  163    HZ2  LYS  37           HZ2      LYS  37 -19.638  21.975  -1.499
  164    HZ3  LYS  37           HZ3      LYS  37 -18.990  22.736  -0.135
  165    H    GLY  38           H        GLY  38 -18.471  16.195  -1.347
  166    HA2  GLY  38           HA2      GLY  38 -18.037  15.696   1.386
  167    HA3  GLY  38           HA3      GLY  38 -18.647  14.224   0.644
  168    HA1  GLY  38           HA1      GLY  38 -17.694  16.123   0.694
  169    H    SER  39           H        SER  39 -16.261  13.967   1.708
  170    HA   SER  39           HA       SER  39 -14.104  14.675  -0.026
  171    HB2  SER  39           HB1      SER  39 -14.387  13.617   2.588
  172    HB3  SER  39           HB2      SER  39 -13.444  12.440   1.656
  173    HG   SER  39           HG       SER  39 -12.868  15.168   2.122
  174    H    GLN  40           H        GLN  40 -12.554  12.704  -0.611
  175    HA   GLN  40           HA       GLN  40 -14.180  10.913  -2.279
  176    HB2  GLN  40           HB1      GLN  40 -12.312  12.582  -3.150
  177    HB3  GLN  40           HB2      GLN  40 -11.247  11.237  -2.708
  178    HG2  GLN  40           HG1      GLN  40 -13.545  10.334  -4.233
  179    HG3  GLN  40           HG2      GLN  40 -12.605  11.557  -5.096
  180   HE21  GLN  40          HE21      GLN  40 -10.544  11.096  -5.776
  181   HE22  GLN  40          HE22      GLN  40  -9.873   9.504  -5.735
  182    H    CYS  41           H        CYS  41 -11.508  11.004   0.012
  183    HA   CYS  41           HA       CYS  41 -11.981   8.216   0.664
  184    HB2  CYS  41           HB1      CYS  41  -9.733   7.470   0.330
  185    HB3  CYS  41           HB2      CYS  41 -10.279   8.204  -1.178
  186    H    LEU  42           H        LEU  42 -11.376   7.675   2.740
  187    HA   LEU  42           HA       LEU  42 -10.735   9.937   4.465
  188    HB2  LEU  42           HB1      LEU  42 -12.645   8.310   4.887
  189    HB3  LEU  42           HB2      LEU  42 -11.395   7.130   5.318
  190    HG   LEU  42           HG       LEU  42 -10.842   9.408   6.855
  191   HD11  LEU  42          HD11      LEU  42 -13.299   9.926   6.148
  192   HD12  LEU  42          HD12      LEU  42 -12.795  10.134   7.824
  193   HD13  LEU  42          HD13      LEU  42 -13.695   8.696   7.348
  194   HD21  LEU  42          HD21      LEU  42 -10.895   7.921   8.576
  195   HD22  LEU  42          HD22      LEU  42 -10.841   6.781   7.232
  196   HD23  LEU  42          HD23      LEU  42 -12.379   7.151   8.013
  197    H    SER  43           H        SER  43  -9.369   6.932   3.339
  198    HA   SER  43           HA       SER  43  -6.805   7.681   4.496
  199    HB2  SER  43           HB1      SER  43  -6.858   4.944   4.994
  200    HB3  SER  43           HB2      SER  43  -6.996   6.231   6.205
  201    HG   SER  43           HG       SER  43  -9.275   5.347   4.809
  202    H    ASP  44           H        ASP  44  -5.021   6.340   3.647
  203    HA   ASP  44           HA       ASP  44  -5.090   6.156   0.866
  204    HB2  ASP  44           HB1      ASP  44  -2.950   4.833   1.128
  205    HB3  ASP  44           HB2      ASP  44  -2.976   6.405   1.938
  206    HD2  ASP  44           HD       ASP  44  -2.718   3.148   4.146
  207    H    THR  45           H        THR  45  -5.868   3.806   3.320
  208    HA   THR  45           HA       THR  45  -5.740   1.472   1.754
  209    HB   THR  45           HB       THR  45  -7.830   1.094   3.592
  210    HG1  THR  45           HG1      THR  45  -7.088   2.075   5.454
  211   HG21  THR  45          HG21      THR  45  -6.127  -0.177   4.842
  212   HG22  THR  45          HG22      THR  45  -4.869   0.558   3.848
  213   HG23  THR  45          HG23      THR  45  -6.065  -0.508   3.112
  214    H    ASP  46           H        ASP  46  -8.098   4.008   1.963
  215    HA   ASP  46           HA       ASP  46 -10.295   2.587   0.860
  216    HB2  ASP  46           HB1      ASP  46  -9.971   5.045   2.022
  217    HB3  ASP  46           HB2      ASP  46 -10.184   5.477   0.321
  218    HD2  ASP  46           HD       ASP  46 -13.244   3.498   1.900
  219    H    CYS  47           H        CYS  47  -7.522   4.176  -0.499
  220    HA   CYS  47           HA       CYS  47  -8.465   4.581  -3.119
  221    HB2  CYS  47           HB1      CYS  47  -6.079   5.006  -1.725
  222    HB3  CYS  47           HB2      CYS  47  -5.646   3.891  -3.022
  223    H    ASN  48           H        ASN  48  -6.444   1.941  -1.824
  224    HA   ASN  48           HA       ASN  48  -7.821  -0.070  -3.265
  225    HB2  ASN  48           HB1      ASN  48  -5.691   1.312  -4.663
  226    HB3  ASN  48           HB2      ASN  48  -5.304  -0.402  -4.459
  227   HD21  ASN  48          HD21      ASN  48  -6.557   1.651  -6.572
  228   HD22  ASN  48          HD22      ASN  48  -7.693   0.634  -7.384
  229    H    THR  49           H        THR  49  -4.345   0.323  -2.620
  230    HA   THR  49           HA       THR  49  -4.359  -1.079  -0.165
  231    HB   THR  49           HB       THR  49  -2.852  -2.939  -1.622
  232    HG1  THR  49           HG1      THR  49  -3.816  -2.807  -3.528
  233   HG21  THR  49          HG21      THR  49  -4.309  -3.190   0.454
  234   HG22  THR  49          HG22      THR  49  -4.331  -4.530  -0.694
  235   HG23  THR  49          HG23      THR  49  -5.667  -3.380  -0.653
  236    H    ARG  50           H        ARG  50  -2.180  -1.207  -2.986
  237    HA   ARG  50           HA       ARG  50  -0.015  -0.210  -1.294
  238    HB2  ARG  50           HB1      ARG  50   0.084  -1.287  -4.122
  239    HB3  ARG  50           HB2      ARG  50   1.474  -0.929  -3.086
  240    HG2  ARG  50           HG1      ARG  50   1.332  -2.874  -1.990
  241    HG3  ARG  50           HG2      ARG  50  -0.435  -2.786  -1.887
  242    HD2  ARG  50           HD1      ARG  50  -0.131  -4.629  -3.258
  243    HD3  ARG  50           HD2      ARG  50  -0.362  -3.321  -4.426
  244    HE   ARG  50           HE       ARG  50   2.320  -3.379  -4.121
  245   HH11  ARG  50          HH11      ARG  50  -0.051  -5.831  -4.818
  246   HH12  ARG  50          HH12      ARG  50   1.038  -6.804  -5.751
  247   HH21  ARG  50          HH21      ARG  50   3.763  -4.651  -5.347
  248   HH22  ARG  50          HH22      ARG  50   3.208  -6.131  -6.050
  249    H    LYS  51           H        LYS  51  -2.025   1.643  -2.006
  250    HA   LYS  51           HA       LYS  51  -0.415   3.526  -3.580
  251    HB2  LYS  51           HB1      LYS  51  -3.403   3.135  -3.886
  252    HB3  LYS  51           HB2      LYS  51  -2.421   4.350  -4.720
  253    HG2  LYS  51           HG1      LYS  51  -1.337   2.749  -6.048
  254    HG3  LYS  51           HG2      LYS  51  -1.874   1.416  -5.009
  255    HD2  LYS  51           HD1      LYS  51  -3.933   1.306  -5.963
  256    HD3  LYS  51           HD2      LYS  51  -4.008   3.057  -6.231
  257    HE2  LYS  51           HE1      LYS  51  -3.649   2.588  -8.394
  258    HE3  LYS  51           HE2      LYS  51  -1.975   2.289  -7.905
  259    HZ1  LYS  51           HZ1      LYS  51  -2.916  -0.075  -7.380
  260    HZ2  LYS  51           HZ2      LYS  51  -2.469   0.342  -8.957
  261    HZ3  LYS  51           HZ3      LYS  51  -4.099   0.361  -8.507
  262    H    PHE  52           H        PHE  52  -0.907   5.774  -3.164
  263    HA   PHE  52           HA       PHE  52  -1.972   6.165  -0.450
  264    HB2  PHE  52           HB1      PHE  52  -0.655   8.333  -0.544
  265    HB3  PHE  52           HB2      PHE  52   0.299   6.848  -0.512
  266    HD1  PHE  52           HD1      PHE  52  -1.209   9.181  -3.000
  267    HD2  PHE  52           HD2      PHE  52   2.040   6.624  -1.989
  268    HE1  PHE  52           HE1      PHE  52  -0.035   9.868  -5.051
  269    HE2  PHE  52           HE2      PHE  52   3.220   7.307  -4.038
  270    HZ   PHE  52           HZ       PHE  52   2.182   8.932  -5.571
  271    H    CYS  53           H        CYS  53  -3.266   8.015  -0.008
  272    HA   CYS  53           HA       CYS  53  -5.100   8.630  -2.137
  273    HB2  CYS  53           HB1      CYS  53  -4.984   8.994   0.791
  274    HB3  CYS  53           HB2      CYS  53  -5.855  10.256  -0.081
  275    H    LEU  54           H        LEU  54  -4.280   9.962  -3.659
  276    HA   LEU  54           HA       LEU  54  -2.745  12.308  -2.891
  277    HB2  LEU  54           HB1      LEU  54  -2.512  10.654  -4.991
  278    HB3  LEU  54           HB2      LEU  54  -3.573  11.884  -5.701
  279    HG   LEU  54           HG       LEU  54  -1.232  12.312  -6.232
  280   HD11  LEU  54          HD11      LEU  54  -1.106  14.644  -5.342
  281   HD12  LEU  54          HD12      LEU  54  -2.525  14.283  -4.359
  282   HD13  LEU  54          HD13      LEU  54  -2.635  14.233  -6.117
  283   HD21  LEU  54          HD21      LEU  54  -0.717  11.414  -3.687
  284   HD22  LEU  54          HD22      LEU  54  -0.445  13.152  -3.554
  285   HD23  LEU  54          HD23      LEU  54   0.440  12.209  -4.755
  286    H    GLN  55           H        GLN  55  -3.798  14.073  -2.278
  287    HA   GLN  55           HA       GLN  55  -6.160  14.898  -3.819
  288    HB2  GLN  55           HB1      GLN  55  -7.102  15.815  -1.657
  289    HB3  GLN  55           HB2      GLN  55  -7.097  14.050  -1.810
  290    HG2  GLN  55           HG1      GLN  55  -5.673  13.758  -0.100
  291    HG3  GLN  55           HG2      GLN  55  -4.706  15.175  -0.541
  292   HE21  GLN  55          HE21      GLN  55  -6.329  14.001   1.909
  293   HE22  GLN  55          HE22      GLN  55  -7.000  15.433   2.602
  294    HA   PRO  56           HA       PRO  56  -3.116  18.321  -3.839
  295    HB2  PRO  56           HB1      PRO  56  -3.814  19.209  -6.335
  296    HB3  PRO  56           HB2      PRO  56  -2.680  17.890  -6.053
  297    HG2  PRO  56           HG1      PRO  56  -5.604  17.776  -6.704
  298    HG3  PRO  56           HG2      PRO  56  -4.244  16.818  -7.397
  299    HD2  PRO  56           HD1      PRO  56  -5.926  15.823  -5.513
  300    HD3  PRO  56           HD2      PRO  56  -4.213  15.376  -5.599
  301    H    ARG  57           H        ARG  57  -3.430  20.542  -3.609
  302    HA   ARG  57           HA       ARG  57  -6.101  21.317  -2.830
  303    HB2  ARG  57           HB1      ARG  57  -3.931  21.928  -1.617
  304    HB3  ARG  57           HB2      ARG  57  -3.681  23.108  -2.911
  305    HG2  ARG  57           HG1      ARG  57  -6.190  23.760  -2.213
  306    HG3  ARG  57           HG2      ARG  57  -5.591  23.139  -0.666
  307    HD2  ARG  57           HD1      ARG  57  -3.544  24.776  -1.742
  308    HD3  ARG  57           HD2      ARG  57  -5.068  25.656  -1.915
  309    HE   ARG  57           HE       ARG  57  -5.051  24.670   0.663
  310   HH11  ARG  57          HH11      ARG  57  -3.089  26.809  -1.262
  311   HH12  ARG  57          HH12      ARG  57  -2.574  27.763   0.089
  312   HH21  ARG  57          HH21      ARG  57  -4.380  25.920   2.449
  313   HH22  ARG  57          HH22      ARG  57  -3.308  27.256   2.200
  314    H    ASP  58           H        ASP  58  -3.965  21.793  -5.524
  315    HA   ASP  58           HA       ASP  58  -5.572  23.959  -6.619
  316    HB2  ASP  58           HB1      ASP  58  -3.925  24.046  -8.406
  317    HB3  ASP  58           HB2      ASP  58  -3.108  24.016  -6.837
  318    HD2  ASP  58           HD       ASP  58  -2.228  20.564  -7.478
  319    H    GLU  59           H        GLU  59  -5.259  20.535  -6.870
  320    HA   GLU  59           HA       GLU  59  -7.149  20.543  -9.132
  321    HB2  GLU  59           HB1      GLU  59  -4.603  19.406  -9.055
  322    HB3  GLU  59           HB2      GLU  59  -5.707  18.043  -8.808
  323    HG2  GLU  59           HG1      GLU  59  -6.979  19.085 -10.851
  324    HG3  GLU  59           HG2      GLU  59  -5.405  19.827 -11.169
  325    HE2  GLU  59           HE       GLU  59  -3.972  16.749 -11.989
  326    H    LYS  60           H        LYS  60  -8.128  18.122  -9.205
  327    HA   LYS  60           HA       LYS  60  -9.592  17.897  -6.705
  328    HB2  LYS  60           HB1      LYS  60  -9.954  16.934  -9.502
  329    HB3  LYS  60           HB2      LYS  60 -10.704  15.989  -8.206
  330    HG2  LYS  60           HG1      LYS  60 -12.283  17.535  -7.795
  331    HG3  LYS  60           HG2      LYS  60 -11.162  18.884  -8.046
  332    HD2  LYS  60           HD1      LYS  60 -11.469  18.893 -10.357
  333    HD3  LYS  60           HD2      LYS  60 -12.088  17.233 -10.369
  334    HE2  LYS  60           HE1      LYS  60 -14.072  18.108  -9.028
  335    HE3  LYS  60           HE2      LYS  60 -13.484  19.727  -9.430
  336    HZ1  LYS  60           HZ1      LYS  60 -14.768  17.752 -11.129
  337    HZ2  LYS  60           HZ2      LYS  60 -13.502  18.618 -11.841
  338    HZ3  LYS  60           HZ3      LYS  60 -14.830  19.441 -11.194
  339    HA   PRO  61           HA       PRO  61  -7.601  14.332  -5.100
  340    HB2  PRO  61           HB1      PRO  61  -9.700  12.873  -4.113
  341    HB3  PRO  61           HB2      PRO  61  -9.124  14.369  -3.379
  342    HG2  PRO  61           HG1      PRO  61 -11.410  13.935  -5.271
  343    HG3  PRO  61           HG2      PRO  61 -11.351  14.919  -3.760
  344    HD2  PRO  61           HD1      PRO  61 -11.179  16.021  -6.235
  345    HD3  PRO  61           HD2      PRO  61 -10.319  16.679  -4.833
  346    H    PHE  62           H        PHE  62  -6.900  12.342  -5.720
  347    HA   PHE  62           HA       PHE  62  -8.511  10.558  -7.287
  348    HB2  PHE  62           HB1      PHE  62  -6.840  10.534  -9.211
  349    HB3  PHE  62           HB2      PHE  62  -7.935  11.917  -9.135
  350    HD1  PHE  62           HD1      PHE  62  -7.065  14.020  -9.416
  351    HD2  PHE  62           HD2      PHE  62  -4.550  10.932  -7.914
  352    HE1  PHE  62           HE1      PHE  62  -5.153  15.568  -9.445
  353    HE2  PHE  62           HE2      PHE  62  -2.635  12.475  -7.939
  354    HZ   PHE  62           HZ       PHE  62  -2.934  14.796  -8.705
  355    H    CYS  63           H        CYS  63  -7.150   8.631  -8.023
  356    HA   CYS  63           HA       CYS  63  -5.378   7.920  -5.812
  357    HB2  CYS  63           HB1      CYS  63  -7.430   6.541  -6.814
  358    HB3  CYS  63           HB2      CYS  63  -6.170   5.938  -7.892
  359    H    ALA  64           H        ALA  64  -3.247   7.882  -6.045
  360    HA   ALA  64           HA       ALA  64  -2.138   7.773  -8.775
  361    HB1  ALA  64           HB1      ALA  64  -1.321   9.780  -8.158
  362    HB2  ALA  64           HB2      ALA  64  -1.486   9.438  -6.435
  363    HB3  ALA  64           HB3      ALA  64  -0.105   8.805  -7.332
  364    H    THR  65           H        THR  65  -0.952   6.056  -9.272
  365    HA   THR  65           HA       THR  65  -0.590   3.851  -7.654
  366    HB   THR  65           HB       THR  65  -0.317   3.565  -9.997
  367    HG1  THR  65           HG1      THR  65   1.562   2.376 -10.006
  368   HG21  THR  65          HG21      THR  65   0.441   5.783 -10.609
  369   HG22  THR  65          HG22      THR  65   1.568   4.583 -11.244
  370   HG23  THR  65          HG23      THR  65   1.984   5.511  -9.803
  371    H    CYS  66           H        CYS  66   1.399   2.903  -6.800
  372    HA   CYS  66           HA       CYS  66   2.667   4.536  -4.935
  373    HB2  CYS  66           HB1      CYS  66   2.517   1.859  -5.341
  374    HB3  CYS  66           HB2      CYS  66   4.180   2.162  -5.847
  375    H    ARG  67           H        ARG  67   5.190   4.605  -4.812
  376    HA   ARG  67           HA       ARG  67   6.102   5.870  -7.300
  377    HB2  ARG  67           HB1      ARG  67   7.270   6.148  -4.524
  378    HB3  ARG  67           HB2      ARG  67   7.663   7.120  -5.949
  379    HG2  ARG  67           HG1      ARG  67   4.941   7.457  -5.732
  380    HG3  ARG  67           HG2      ARG  67   5.482   7.404  -4.046
  381    HD2  ARG  67           HD1      ARG  67   6.651   9.347  -4.200
  382    HD3  ARG  67           HD2      ARG  67   7.109   9.046  -5.882
  383    HE   ARG  67           HE       ARG  67   4.849  10.533  -4.961
  384   HH11  ARG  67          HH11      ARG  67   6.044   8.540  -7.553
  385   HH12  ARG  67          HH12      ARG  67   4.992   9.230  -8.744
  386   HH21  ARG  67          HH21      ARG  67   3.459  11.450  -6.519
  387   HH22  ARG  67          HH22      ARG  67   3.523  10.886  -8.154
  388    H    GLY  68           H        GLY  68   7.509   4.799  -8.515
  389    HA2  GLY  68           HA2      GLY  68   8.738   2.378  -7.623
  390    HA3  GLY  68           HA3      GLY  68   8.996   3.167  -9.173
  391    HA1  GLY  68           HA1      GLY  68   8.813   3.053  -7.058
  392    H    LEU  69           H        LEU  69  11.214   2.238  -8.533
  393    HA   LEU  69           HA       LEU  69  12.736   3.567  -6.544
  394    HB2  LEU  69           HB1      LEU  69  13.340   1.770  -8.854
  395    HB3  LEU  69           HB2      LEU  69  14.666   2.653  -8.079
  396    HG   LEU  69           HG       LEU  69  12.812   0.710  -6.701
  397   HD11  LEU  69          HD11      LEU  69  15.727   0.249  -7.021
  398   HD12  LEU  69          HD12      LEU  69  14.683  -0.034  -8.413
  399   HD13  LEU  69          HD13      LEU  69  14.401  -0.908  -6.908
  400   HD21  LEU  69          HD21      LEU  69  14.504   0.923  -4.862
  401   HD22  LEU  69          HD22      LEU  69  13.507   2.354  -5.126
  402   HD23  LEU  69          HD23      LEU  69  15.168   2.312  -5.722
  403    H    ARG  70           H        ARG  70  11.966   4.280  -9.855
  404    HA   ARG  70           HA       ARG  70  13.998   6.358 -10.028
  405    HB2  ARG  70           HB1      ARG  70  12.070   5.104 -11.950
  406    HB3  ARG  70           HB2      ARG  70  12.761   6.691 -12.320
  407    HG2  ARG  70           HG1      ARG  70  14.999   5.308 -11.642
  408    HG3  ARG  70           HG2      ARG  70  14.005   4.039 -12.376
  409    HD2  ARG  70           HD1      ARG  70  13.952   5.070 -14.448
  410    HD3  ARG  70           HD2      ARG  70  14.259   6.669 -13.759
  411    HE   ARG  70           HE       ARG  70  16.525   5.141 -13.283
  412   HH11  ARG  70          HH11      ARG  70  14.749   6.360 -16.019
  413   HH12  ARG  70          HH12      ARG  70  16.144   6.464 -17.041
  414   HH21  ARG  70          HH21      ARG  70  18.367   5.273 -14.621
  415   HH22  ARG  70          HH22      ARG  70  18.201   5.844 -16.246
  416    H    ARG  71           H        ARG  71  11.355   6.281  -8.354
  417    HA   ARG  71           HA       ARG  71  10.263   8.851  -9.269
  418    HB2  ARG  71           HB1      ARG  71   9.146   6.669  -7.510
  419    HB3  ARG  71           HB2      ARG  71   8.411   8.276  -7.602
  420    HG2  ARG  71           HG1      ARG  71   8.814   6.407  -9.939
  421    HG3  ARG  71           HG2      ARG  71   7.295   6.661  -9.064
  422    HD2  ARG  71           HD1      ARG  71   8.183   9.231  -9.748
  423    HD3  ARG  71           HD2      ARG  71   8.475   8.228 -11.176
  424    HE   ARG  71           HE       ARG  71   5.860   7.856 -10.059
  425   HH11  ARG  71          HH11      ARG  71   7.799   9.821 -12.180
  426   HH12  ARG  71          HH12      ARG  71   6.450  10.372 -13.117
  427   HH21  ARG  71          HH21      ARG  71   4.076   8.575 -11.285
  428   HH22  ARG  71          HH22      ARG  71   4.332   9.664 -12.606
  429    H    ARG  72           H        ARG  72  10.198  10.626  -7.941
  430    HA   ARG  72           HA       ARG  72  12.146  10.717  -5.839
  431    HB2  ARG  72           HB1      ARG  72  10.167  12.778  -6.840
  432    HB3  ARG  72           HB2      ARG  72  11.422  13.097  -5.632
  433    HG2  ARG  72           HG1      ARG  72  12.247  11.944  -8.254
  434    HG3  ARG  72           HG2      ARG  72  11.794  13.654  -8.175
  435    HD2  ARG  72           HD1      ARG  72  13.479  14.125  -6.551
  436    HD3  ARG  72           HD2      ARG  72  13.803  12.402  -6.317
  437    HE   ARG  72           HE       ARG  72  15.144  12.427  -8.174
  438   HH11  ARG  72          HH11      ARG  72  13.209  15.321  -8.112
  439   HH12  ARG  72          HH12      ARG  72  14.053  16.070  -9.427
  440   HH21  ARG  72          HH21      ARG  72  16.262  13.402  -9.907
  441   HH22  ARG  72          HH22      ARG  72  15.789  14.977 -10.447
  442    H    CYS  73           H        CYS  73  11.822  11.052  -3.649
  443    HA   CYS  73           HA       CYS  73   9.080  10.955  -2.634
  444    HB2  CYS  73           HB1      CYS  73   9.490   9.136  -1.154
  445    HB3  CYS  73           HB2      CYS  73  10.011   8.616  -2.758
  446    H    GLN  74           H        GLN  74   9.021  11.346  -0.239
  447    HA   GLN  74           HA       GLN  74  11.241  13.091   0.598
  448    HB2  GLN  74           HB1      GLN  74   8.272  13.556   0.716
  449    HB3  GLN  74           HB2      GLN  74   9.366  14.371   1.847
  450    HG2  GLN  74           HG1      GLN  74   9.994  15.865   0.331
  451    HG3  GLN  74           HG2      GLN  74  10.294  14.608  -0.878
  452   HE21  GLN  74          HE21      GLN  74   7.971  13.535  -1.446
  453   HE22  GLN  74          HE22      GLN  74   6.835  14.703  -2.021
  454    H    ARG  75           H        ARG  75   8.639  10.931   1.575
  455    HA   ARG  75           HA       ARG  75   9.975  10.608   4.183
  456    HB2  ARG  75           HB1      ARG  75   7.501  11.565   3.923
  457    HB3  ARG  75           HB2      ARG  75   7.118   9.838   3.852
  458    HG2  ARG  75           HG1      ARG  75   8.651   9.753   6.005
  459    HG3  ARG  75           HG2      ARG  75   8.162  11.453   6.111
  460    HD2  ARG  75           HD1      ARG  75   6.053  10.945   6.705
  461    HD3  ARG  75           HD2      ARG  75   5.952   9.635   5.521
  462    HE   ARG  75           HE       ARG  75   7.621   8.807   7.610
  463   HH11  ARG  75          HH11      ARG  75   4.277   9.577   7.023
  464   HH12  ARG  75          HH12      ARG  75   3.680   8.508   8.250
  465   HH21  ARG  75          HH21      ARG  75   6.848   7.396   9.228
  466   HH22  ARG  75          HH22      ARG  75   5.144   7.268   9.503
  467    H    ASP  76           H        ASP  76  10.345   8.552   4.937
  468    HA   ASP  76           HA       ASP  76  10.820   6.514   3.113
  469    HB2  ASP  76           HB1      ASP  76  10.227   6.047   6.040
  470    HB3  ASP  76           HB2      ASP  76  11.285   5.107   4.981
  471    HD2  ASP  76           HD       ASP  76  13.384   8.202   5.098
  472    H    ALA  77           H        ALA  77   7.906   7.371   4.785
  473    HA   ALA  77           HA       ALA  77   6.583   4.857   4.266
  474    HB1  ALA  77           HB1      ALA  77   5.833   7.423   5.571
  475    HB2  ALA  77           HB2      ALA  77   4.549   6.356   5.003
  476    HB3  ALA  77           HB3      ALA  77   5.725   5.772   6.180
  477    H    MET  78           H        MET  78   6.909   7.957   2.726
  478    HA   MET  78           HA       MET  78   4.647   7.862   1.050
  479    HB2  MET  78           HB1      MET  78   7.101   9.441   1.271
  480    HB3  MET  78           HB2      MET  78   6.551   9.243  -0.400
  481    HG2  MET  78           HG1      MET  78   4.716  10.172   1.798
  482    HG3  MET  78           HG2      MET  78   5.717  11.278   0.855
  483    HE1  MET  78           HE1      MET  78   5.826  11.434  -1.474
  484    HE2  MET  78           HE2      MET  78   5.187  10.141  -2.490
  485    HE3  MET  78           HE3      MET  78   4.344  11.688  -2.396
  486    H    CYS  79           H        CYS  79   7.795   6.375   0.849
  487    HA   CYS  79           HA       CYS  79   7.314   5.487  -1.891
  488    HB2  CYS  79           HB1      CYS  79   9.563   6.357  -1.089
  489    HB3  CYS  79           HB2      CYS  79   9.706   4.864  -0.158
  490    H    CYS  80           H        CYS  80   7.053   3.359  -2.488
  491    HA   CYS  80           HA       CYS  80   5.619   1.663  -0.850
  492    HB2  CYS  80           HB1      CYS  80   6.966   1.467  -3.448
  493    HB3  CYS  80           HB2      CYS  80   6.852  -0.075  -2.602
  494    HA   PRO  81           HA       PRO  81   8.409  -0.447   1.797
  495    HB2  PRO  81           HB1      PRO  81   7.427  -3.004   1.778
  496    HB3  PRO  81           HB2      PRO  81   6.614  -1.655   2.572
  497    HG2  PRO  81           HG1      PRO  81   6.125  -2.842  -0.139
  498    HG3  PRO  81           HG2      PRO  81   4.935  -2.367   1.129
  499    HD2  PRO  81           HD1      PRO  81   5.456  -0.825  -1.044
  500    HD3  PRO  81           HD2      PRO  81   5.049  -0.142   0.539
  501    H    GLY  82           H        GLY  82  10.128  -1.991   1.920
  502    HA2  GLY  82           HA2      GLY  82  11.587  -3.617   1.029
  503    HA3  GLY  82           HA3      GLY  82  10.814  -3.418  -0.537
  504    HA1  GLY  82           HA1      GLY  82  11.628  -2.785   1.322
  505    H    THR  83           H        THR  83  11.089  -0.392  -0.025
  506    HA   THR  83           HA       THR  83  13.910  -0.216  -0.865
  507    HB   THR  83           HB       THR  83  13.207   1.887  -2.073
  508    HG1  THR  83           HG1      THR  83  11.228   2.324  -1.151
  509   HG21  THR  83          HG21      THR  83  11.974  -0.731  -2.938
  510   HG22  THR  83          HG22      THR  83  13.601  -0.162  -3.306
  511   HG23  THR  83          HG23      THR  83  12.202   0.671  -3.982
  512    H    LEU  84           H        LEU  84  14.735   2.140  -0.593
  513    HA   LEU  84           HA       LEU  84  13.825   3.213   1.991
  514    HB2  LEU  84           HB1      LEU  84  16.036   1.786   1.896
  515    HB3  LEU  84           HB2      LEU  84  16.714   3.295   1.263
  516    HG   LEU  84           HG       LEU  84  15.738   4.385   3.383
  517   HD11  LEU  84          HD11      LEU  84  15.514   1.469   4.028
  518   HD12  LEU  84          HD12      LEU  84  14.338   2.757   4.282
  519   HD13  LEU  84          HD13      LEU  84  15.781   2.669   5.291
  520   HD21  LEU  84          HD21      LEU  84  18.143   3.992   2.889
  521   HD22  LEU  84          HD22      LEU  84  18.013   2.431   3.699
  522   HD23  LEU  84          HD23      LEU  84  17.748   3.921   4.606
  523    H    CYS  85           H        CYS  85  13.600   5.372   2.088
  524    HA   CYS  85           HA       CYS  85  13.841   6.892  -0.330
  525    HB2  CYS  85           HB1      CYS  85  12.731   7.305   2.386
  526    HB3  CYS  85           HB2      CYS  85  13.277   8.760   1.551
  527    H    VAL  86           H        VAL  86  15.821   7.451  -0.994
  528    HA   VAL  86           HA       VAL  86  17.557   8.856   0.922
  529    HB   VAL  86           HB       VAL  86  18.488   6.889  -1.175
  530   HG11  VAL  86          HG11      VAL  86  20.015   8.779  -0.947
  531   HG12  VAL  86          HG12      VAL  86  20.077   8.528   0.799
  532   HG13  VAL  86          HG13      VAL  86  20.730   7.306  -0.294
  533   HG21  VAL  86          HG21      VAL  86  17.661   5.631   0.632
  534   HG22  VAL  86          HG22      VAL  86  19.402   5.718   0.895
  535   HG23  VAL  86          HG23      VAL  86  18.318   6.753   1.823
  536    H    ASN  87           H        ASN  87  18.618  10.641   0.156
  537    HA   ASN  87           HA       ASN  87  18.993  12.463  -1.153
  538    HB2  ASN  87           HB1      ASN  87  20.093  10.489  -2.482
  539    HB3  ASN  87           HB2      ASN  87  18.756  10.756  -3.607
  540   HD21  ASN  87          HD21      ASN  87  19.152  12.098  -5.199
  541   HD22  ASN  87          HD22      ASN  87  20.305  13.384  -5.188
  542    H    ASP  88           H        ASP  88  16.261  11.765  -0.492
  543    HA   ASP  88           HA       ASP  88  14.154  12.508  -0.921
  544    HB2  ASP  88           HB1      ASP  88  15.240  14.171  -3.187
  545    HB3  ASP  88           HB2      ASP  88  13.874  14.515  -2.117
  546    HD2  ASP  88           HD       ASP  88  16.302  15.246   0.492
  547    H    VAL  89           H        VAL  89  15.388  10.236  -2.411
  548    HA   VAL  89           HA       VAL  89  13.255   9.941  -4.370
  549    HB   VAL  89           HB       VAL  89  15.145  10.851  -5.670
  550   HG11  VAL  89          HG11      VAL  89  16.577   8.411  -4.636
  551   HG12  VAL  89          HG12      VAL  89  17.137   9.371  -6.006
  552   HG13  VAL  89          HG13      VAL  89  17.023  10.101  -4.403
  553   HG21  VAL  89          HG21      VAL  89  15.144   9.160  -7.413
  554   HG22  VAL  89          HG22      VAL  89  14.584   7.946  -6.264
  555   HG23  VAL  89          HG23      VAL  89  13.538   9.297  -6.696
  556    H    CYS  90           H        CYS  90  12.740   7.788  -4.852
  557    HA   CYS  90           HA       CYS  90  13.144   5.935  -2.782
  558    HB2  CYS  90           HB1      CYS  90  12.106   5.647  -5.602
  559    HB3  CYS  90           HB2      CYS  90  12.177   4.284  -4.484
  560    H    THR  91           H        THR  91  14.831   4.699  -2.328
  561    HA   THR  91           HA       THR  91  16.530   3.735  -4.521
  562    HB   THR  91           HB       THR  91  17.561   4.951  -1.951
  563    HG1  THR  91           HG1      THR  91  18.578   6.392  -3.543
  564   HG21  THR  91          HG21      THR  91  19.791   4.507  -2.854
  565   HG22  THR  91          HG22      THR  91  19.072   3.709  -4.253
  566   HG23  THR  91          HG23      THR  91  18.887   3.008  -2.647
  567    H    THR  92           H        THR  92  16.586   1.595  -4.458
  568    HA   THR  92           HA       THR  92  15.538  -0.018  -2.474
  569    HB   THR  92           HB       THR  92  17.595  -1.535  -3.665
  570    HG1  THR  92           HG1      THR  92  17.444  -0.960  -5.832
  571   HG21  THR  92          HG21      THR  92  15.826  -2.720  -4.657
  572   HG22  THR  92          HG22      THR  92  14.798  -1.289  -4.741
  573   HG23  THR  92          HG23      THR  92  15.130  -2.046  -3.183
  574    H    MET  93           H        MET  93  16.463  -1.339  -0.862
  575    HA   MET  93           HA       MET  93  18.485  -0.092   0.677
  576    HB2  MET  93           HB1      MET  93  16.897  -2.612   0.866
  577    HB3  MET  93           HB2      MET  93  18.351  -2.465   1.865
  578    HG2  MET  93           HG1      MET  93  16.618  -0.107   1.970
  579    HG3  MET  93           HG2      MET  93  15.853  -1.591   2.545
  580    HE1  MET  93           HE1      MET  93  16.403  -2.480   5.255
  581    HE2  MET  93           HE2      MET  93  16.532  -0.902   6.031
  582    HE3  MET  93           HE3      MET  93  15.417  -1.135   4.683
  583    H    GLU  94           H        GLU  94  18.482  -2.752  -1.606
  584    HA   GLU  94           HA       GLU  94  21.025  -3.803  -0.988
  585    HB2  GLU  94           HB1      GLU  94  19.359  -3.852  -3.507
  586    HB3  GLU  94           HB2      GLU  94  20.912  -4.690  -3.370
  587    HG2  GLU  94           HG1      GLU  94  18.994  -5.254  -1.208
  588    HG3  GLU  94           HG2      GLU  94  18.522  -5.813  -2.819
  589    HE2  GLU  94           HE       GLU  94  22.011  -7.330  -1.753
  590    H    ASP  95           H        ASP  95  20.003  -1.049  -2.841
  591    HA   ASP  95           HA       ASP  95  22.560  -0.692  -4.139
  592    HB2  ASP  95           HB1      ASP  95  20.036   0.967  -4.025
  593    HB3  ASP  95           HB2      ASP  95  21.504   1.522  -4.839
  594    HD2  ASP  95           HD       ASP  95  20.770  -0.314  -7.621
  595    H    ALA  96           H        ALA  96  20.723   0.905  -1.555
  596    HA   ALA  96           HA       ALA  96  22.440   2.988  -0.971
  597    HB1  ALA  96           HB1      ALA  96  21.443   1.965   1.488
  598    HB2  ALA  96           HB2      ALA  96  20.882   3.358   0.563
  599    HB3  ALA  96           HB3      ALA  96  20.201   1.760   0.253
  600    H    THR  97           H        THR  97  23.754   3.154   1.118
  601    HA   THR  97           HA       THR  97  25.637   2.607   2.276
  602    HB   THR  97           HB       THR  97  24.997  -0.310   1.963
  603    HG1  THR  97           HG1      THR  97  23.726   1.459   3.803
  604   HG21  THR  97          HG21      THR  97  26.445   1.428   3.893
  605   HG22  THR  97          HG22      THR  97  26.858  -0.175   3.285
  606   HG23  THR  97          HG23      THR  97  25.620   0.005   4.527
  607    H    GLU  98           H        GLU  98  25.902   2.970  -0.500
  608    HA   GLU  98           HA       GLU  98  28.020   1.031  -1.164
  609    HB2  GLU  98           HB1      GLU  98  27.618   1.502  -3.510
  610    HB3  GLU  98           HB2      GLU  98  26.113   0.994  -2.728
  611    HG2  GLU  98           HG1      GLU  98  25.614   3.493  -2.462
  612    HG3  GLU  98           HG2      GLU  98  26.911   3.732  -3.642
  613    HE2  GLU  98           HE       GLU  98  23.819   3.430  -5.488
  614    H    ASN  99           H        ASN  99  29.615   2.084  -2.826
  615    HA   ASN  99           HA       ASN  99  30.251   4.826  -1.981
  616    HB2  ASN  99           HB1      ASN  99  31.612   2.704  -0.982
  617    HB3  ASN  99           HB2      ASN  99  32.556   3.028  -2.440
  618   HD21  ASN  99          HD21      ASN  99  34.356   3.836  -1.502
  619   HD22  ASN  99          HD22      ASN  99  34.396   5.307  -0.596
  620    H    LEU 100           H        LEU 100  31.266   2.243  -4.223
  621    HA   LEU 100           HA       LEU 100  31.780   2.262  -6.437
  622    HB2  LEU 100           HB1      LEU 100  29.454   3.651  -6.199
  623    HB3  LEU 100           HB2      LEU 100  30.494   4.849  -6.988
  624    HG   LEU 100           HG       LEU 100  30.983   2.831  -8.627
  625   HD11  LEU 100          HD11      LEU 100  29.472   1.160  -8.725
  626   HD12  LEU 100          HD12      LEU 100  28.139   2.183  -8.187
  627   HD13  LEU 100          HD13      LEU 100  29.280   1.531  -7.011
  628   HD21  LEU 100          HD21      LEU 100  30.092   4.937  -9.352
  629   HD22  LEU 100          HD22      LEU 100  28.518   4.568  -8.646
  630   HD23  LEU 100          HD23      LEU 100  29.102   3.647 -10.034
  631    H    TYR 101           H        TYR 101  32.539   4.011  -8.264
  632    HA   TYR 101           HA       TYR 101  34.239   5.349  -8.965
  633    HB2  TYR 101           HB1      TYR 101  33.197   6.619  -6.568
  634    HB3  TYR 101           HB2      TYR 101  34.921   6.947  -6.776
  635    HD1  TYR 101           HD1      TYR 101  32.005   6.704  -9.112
  636    HD2  TYR 101           HD2      TYR 101  35.330   8.987  -7.756
  637    HE1  TYR 101           HE1      TYR 101  31.493   8.433 -10.786
  638    HE2  TYR 101           HE2      TYR 101  34.826  10.722  -9.426
  639    HH   TYR 101           HH       TYR 101  31.973  11.015 -10.972
  640    H    PHE 102           H        PHE 102  35.985   4.103  -9.259
  641    HA   PHE 102           HA       PHE 102  37.730   3.631  -6.931
  642    HB2  PHE 102           HB1      PHE 102  36.698   1.786  -8.967
  643    HB3  PHE 102           HB2      PHE 102  38.449   1.697  -8.761
  644    HD1  PHE 102           HD1      PHE 102  39.336   0.352  -7.116
  645    HD2  PHE 102           HD2      PHE 102  35.327   1.732  -6.729
  646    HE1  PHE 102           HE1      PHE 102  39.054  -1.041  -5.108
  647    HE2  PHE 102           HE2      PHE 102  35.039   0.341  -4.719
  648    HZ   PHE 102           HZ       PHE 102  36.904  -1.047  -3.906
  649    H    GLN 103           H        GLN 103  39.514   4.809  -7.062
  650    HA   GLN 103           HA       GLN 103  40.419   5.860  -9.600
  651    HB2  GLN 103           HB1      GLN 103  41.048   6.330  -6.727
  652    HB3  GLN 103           HB2      GLN 103  42.305   6.716  -7.912
  653    HG2  GLN 103           HG1      GLN 103  40.607   8.114  -9.129
  654    HG3  GLN 103           HG2      GLN 103  39.534   7.867  -7.746
  655   HE21  GLN 103          HE21      GLN 103  40.750  10.315  -8.820
  656   HE22  GLN 103          HE22      GLN 103  41.611  11.027  -7.501
  657    H    SER 104           H        SER 104  42.518   5.560 -10.464
  658    HA   SER 104           HA       SER 104  43.740   2.996  -9.689
  659    HB2  SER 104           HB1      SER 104  44.600   2.895 -12.023
  660    HB3  SER 104           HB2      SER 104  42.829   2.932 -11.942
  661    HG   SER 104           HG       SER 104  43.716   4.380 -13.519
  662    H    LEU 105           H        LEU 105  44.290   5.669  -8.557
  663    HA   LEU 105           HA       LEU 105  46.046   6.989  -7.956
  664    HB2  LEU 105           HB1      LEU 105  46.807   4.361  -7.722
  665    HB3  LEU 105           HB2      LEU 105  48.110   5.057  -8.704
  666    HG   LEU 105           HG       LEU 105  48.278   6.845  -6.869
  667   HD11  LEU 105          HD11      LEU 105  47.583   5.961  -4.627
  668   HD12  LEU 105          HD12      LEU 105  46.617   4.756  -5.478
  669   HD13  LEU 105          HD13      LEU 105  46.259   6.472  -5.675
  670   HD21  LEU 105          HD21      LEU 105  49.742   5.423  -5.529
  671   HD22  LEU 105          HD22      LEU 105  49.957   5.114  -7.253
  672   HD23  LEU 105          HD23      LEU 105  49.028   3.987  -6.264
  673    H    GLU 106           H        GLU 106  48.595   7.347  -8.808
  674    HA   GLU 106           HA       GLU 106  48.437   7.759 -11.709
  675    HB2  GLU 106           HB1      GLU 106  49.304  10.034 -11.492
  676    HB3  GLU 106           HB2      GLU 106  47.757   9.861 -10.649
  677    HG2  GLU 106           HG1      GLU 106  49.138   9.473  -8.534
  678    HG3  GLU 106           HG2      GLU 106  50.504  10.093  -9.475
  679    HE2  GLU 106           HE       GLU 106  47.828  12.635  -8.129
  680    H    HIS 107           H        HIS 107  50.545   8.233 -12.694
  681    HA   HIS 107           HA       HIS 107  52.987   8.014 -11.344
  682    HB2  HIS 107           HB1      HIS 107  51.703   5.574 -11.392
  683    HB3  HIS 107           HB2      HIS 107  52.769   5.477 -12.797
  684    HD1  HIS 107           HD1      HIS 107  54.535   3.926 -11.914
  685    HD2  HIS 107           HD2      HIS 107  53.824   7.144  -9.384
  686    HE1  HIS 107           HE1      HIS 107  56.329   3.809 -10.156
  687    HE2  HIS 107           HE2      HIS 107  55.895   5.775  -8.609
  688    H    HIS 108           H        HIS 108  54.653   6.875 -13.130
  689    HA   HIS 108           HA       HIS 108  55.722   7.208 -15.111
  690    HB2  HIS 108           HB1      HIS 108  52.956   6.783 -15.781
  691    HB3  HIS 108           HB2      HIS 108  53.660   7.957 -16.897
  692    HD1  HIS 108           HD1      HIS 108  53.298   4.423 -16.467
  693    HD2  HIS 108           HD2      HIS 108  56.223   6.911 -18.054
  694    HE1  HIS 108           HE1      HIS 108  54.716   2.948 -17.929
  695    HE2  HIS 108           HE2      HIS 108  56.503   4.468 -18.902
  696    H    HIS 109           H        HIS 109  56.288   8.875 -16.721
  697    HA   HIS 109           HA       HIS 109  55.190  11.458 -16.713
  698    HB2  HIS 109           HB1      HIS 109  56.826  10.883 -14.444
  699    HB3  HIS 109           HB2      HIS 109  57.690  12.035 -15.467
  700    HD1  HIS 109           HD1      HIS 109  55.400  12.023 -12.774
  701    HD2  HIS 109           HD2      HIS 109  55.778  14.285 -16.238
  702    HE1  HIS 109           HE1      HIS 109  54.096  14.130 -12.347
  703    HE2  HIS 109           HE2      HIS 109  54.324  15.512 -14.464
  704    H    HIS 110           H        HIS 110  56.043  12.673 -18.338
  705    HA   HIS 110           HA       HIS 110  58.632  11.912 -19.466
  706    HB2  HIS 110           HB1      HIS 110  56.359  10.898 -20.568
  707    HB3  HIS 110           HB2      HIS 110  56.530  12.401 -21.481
  708    HD1  HIS 110           HD1      HIS 110  57.328  11.517 -23.688
  709    HD2  HIS 110           HD2      HIS 110  59.561  10.079 -20.493
  710    HE1  HIS 110           HE1      HIS 110  59.270  10.297 -24.720
  711    HE2  HIS 110           HE2      HIS 110  60.634   9.416 -22.768
  712    H    HIS 111           H        HIS 111  59.549  13.518 -20.871
  713    HA   HIS 111           HA       HIS 111  58.617  16.210 -20.195
  714    HB2  HIS 111           HB1      HIS 111  61.228  14.971 -20.764
  715    HB3  HIS 111           HB2      HIS 111  61.000  16.561 -21.497
  716    HD1  HIS 111           HD1      HIS 111  60.411  18.553 -19.803
  717    HD2  HIS 111           HD2      HIS 111  61.804  15.038 -18.077
  718    HE1  HIS 111           HE1      HIS 111  61.108  19.179 -17.469
  719    HE2  HIS 111           HE2      HIS 111  61.958  17.033 -16.413
  720    H    HIS 112           H        HIS 112  59.864  14.447 -23.032
  721    HA   HIS 112           HA       HIS 112  59.518  14.718 -25.267
  722    HB2  HIS 112           HB1      HIS 112  56.970  14.882 -23.964
  723    HB3  HIS 112           HB2      HIS 112  56.977  15.987 -25.343
  724    HD1  HIS 112           HD1      HIS 112  55.450  14.605 -26.832
  725    HD2  HIS 112           HD2      HIS 112  58.799  12.517 -25.529
  726    HE1  HIS 112           HE1      HIS 112  55.487  12.484 -28.182
  727    HE2  HIS 112           HE2      HIS 112  57.533  11.208 -27.388
  Start of MODEL   17
    1    H1   MET  18           H        MET  18 -29.697 -48.631   4.800
    2    HA   MET  18           HA       MET  18 -29.056 -46.226   4.950
    3    HB2  MET  18           HB1      MET  18 -31.393 -45.287   4.804
    4    HB3  MET  18           HB2      MET  18 -31.036 -46.619   3.693
    5    HG2  MET  18           HG1      MET  18 -32.677 -47.868   4.515
    6    HG3  MET  18           HG2      MET  18 -32.101 -47.625   6.167
    7    HE1  MET  18           HE1      MET  18 -34.360 -46.422   7.878
    8    HE2  MET  18           HE2      MET  18 -35.633 -46.975   6.792
    9    HE3  MET  18           HE3      MET  18 -34.170 -47.938   6.998
   10    H    LEU  19           H        LEU  19 -28.074 -45.321   6.673
   11    HA   LEU  19           HA       LEU  19 -29.768 -44.337   8.816
   12    HB2  LEU  19           HB1      LEU  19 -28.452 -46.676   9.251
   13    HB3  LEU  19           HB2      LEU  19 -27.252 -45.495   9.803
   14    HG   LEU  19           HG       LEU  19 -29.138 -44.535  11.254
   15   HD11  LEU  19          HD11      LEU  19 -30.302 -47.250  10.651
   16   HD12  LEU  19          HD12      LEU  19 -30.982 -45.699  10.159
   17   HD13  LEU  19          HD13      LEU  19 -30.888 -46.117  11.869
   18   HD21  LEU  19          HD21      LEU  19 -28.809 -46.912  12.647
   19   HD22  LEU  19          HD22      LEU  19 -27.771 -45.488  12.728
   20   HD23  LEU  19          HD23      LEU  19 -27.380 -46.803  11.619
   21    H    VAL  20           H        VAL  20 -28.218 -43.238   6.562
   22    HA   VAL  20           HA       VAL  20 -26.150 -41.701   7.962
   23    HB   VAL  20           HB       VAL  20 -25.487 -40.920   5.700
   24   HG11  VAL  20          HG11      VAL  20 -24.665 -43.182   4.908
   25   HG12  VAL  20          HG12      VAL  20 -24.255 -42.741   6.567
   26   HG13  VAL  20          HG13      VAL  20 -25.569 -43.876   6.254
   27   HG21  VAL  20          HG21      VAL  20 -27.714 -41.192   4.652
   28   HG22  VAL  20          HG22      VAL  20 -26.418 -41.946   3.723
   29   HG23  VAL  20          HG23      VAL  20 -27.494 -42.941   4.705
   30    H    LEU  21           H        LEU  21 -26.166 -39.464   8.036
   31    HA   LEU  21           HA       LEU  21 -28.636 -38.191   8.297
   32    HB2  LEU  21           HB1      LEU  21 -25.912 -37.553   8.694
   33    HB3  LEU  21           HB2      LEU  21 -26.598 -36.281   7.667
   34    HG   LEU  21           HG       LEU  21 -26.685 -35.651  10.014
   35   HD11  LEU  21          HD11      LEU  21 -29.537 -36.176   9.547
   36   HD12  LEU  21          HD12      LEU  21 -28.688 -35.398   8.213
   37   HD13  LEU  21          HD13      LEU  21 -28.687 -34.654   9.811
   38   HD21  LEU  21          HD21      LEU  21 -27.555 -36.918  11.692
   39   HD22  LEU  21          HD22      LEU  21 -27.013 -38.213  10.625
   40   HD23  LEU  21          HD23      LEU  21 -28.709 -37.730  10.634
   41    H    ASP  22           H        ASP  22 -29.900 -37.005   6.965
   42    HA   ASP  22           HA       ASP  22 -28.932 -36.250   4.324
   43    HB2  ASP  22           HB1      ASP  22 -31.139 -38.235   4.829
   44    HB3  ASP  22           HB2      ASP  22 -31.137 -37.236   3.369
   45    HD2  ASP  22           HD       ASP  22 -29.082 -40.418   3.179
   46    H    PHE  23           H        PHE  23 -29.226 -34.289   5.843
   47    HA   PHE  23           HA       PHE  23 -31.742 -33.038   5.100
   48    HB2  PHE  23           HB1      PHE  23 -30.923 -33.640   7.911
   49    HB3  PHE  23           HB2      PHE  23 -31.742 -32.111   7.589
   50    HD1  PHE  23           HD1      PHE  23 -32.326 -35.283   8.683
   51    HD2  PHE  23           HD2      PHE  23 -33.832 -32.494   5.843
   52    HE1  PHE  23           HE1      PHE  23 -34.509 -36.420   8.728
   53    HE2  PHE  23           HE2      PHE  23 -36.016 -33.626   5.883
   54    HZ   PHE  23           HZ       PHE  23 -36.357 -35.591   7.328
   55    H    ASN  24           H        ASN  24 -28.864 -32.496   7.142
   56    HA   ASN  24           HA       ASN  24 -27.346 -30.805   7.212
   57    HB2  ASN  24           HB1      ASN  24 -28.184 -29.933   4.459
   58    HB3  ASN  24           HB2      ASN  24 -26.572 -29.927   5.187
   59   HD21  ASN  24          HD21      ASN  24 -25.635 -32.074   5.677
   60   HD22  ASN  24          HD22      ASN  24 -25.926 -33.354   4.553
   61    H    ASN  25           H        ASN  25 -27.173 -28.279   6.619
   62    HA   ASN  25           HA       ASN  25 -29.622 -26.824   6.645
   63    HB2  ASN  25           HB1      ASN  25 -28.644 -27.772   9.168
   64    HB3  ASN  25           HB2      ASN  25 -28.486 -26.011   9.120
   65   HD21  ASN  25          HD21      ASN  25 -30.092 -25.615  10.590
   66   HD22  ASN  25          HD22      ASN  25 -31.765 -25.887  10.256
   67    H    ILE  26           H        ILE  26 -29.241 -24.467   6.963
   68    HA   ILE  26           HA       ILE  26 -26.551 -23.760   6.004
   69    HB   ILE  26           HB       ILE  26 -27.617 -21.676   5.146
   70   HG12  ILE  26          HG11      ILE  26 -30.272 -23.033   5.510
   71   HG13  ILE  26          HG12      ILE  26 -29.610 -22.016   6.801
   72   HG21  ILE  26          HG21      ILE  26 -27.217 -23.475   3.618
   73   HG22  ILE  26          HG22      ILE  26 -28.675 -24.313   4.146
   74   HG23  ILE  26          HG23      ILE  26 -28.803 -22.794   3.259
   75   HD11  ILE  26          HD11      ILE  26 -30.661 -21.246   4.145
   76   HD12  ILE  26          HD12      ILE  26 -30.823 -20.448   5.710
   77   HD13  ILE  26          HD13      ILE  26 -29.321 -20.305   4.800
   78    H    ARG  27           H        ARG  27 -25.495 -21.926   6.833
   79    HA   ARG  27           HA       ARG  27 -26.625 -20.771   9.284
   80    HB2  ARG  27           HB1      ARG  27 -24.479 -20.958  10.427
   81    HB3  ARG  27           HB2      ARG  27 -25.076 -22.554   9.951
   82    HG2  ARG  27           HG1      ARG  27 -23.552 -21.901   7.792
   83    HG3  ARG  27           HG2      ARG  27 -22.664 -21.123   9.112
   84    HD2  ARG  27           HD1      ARG  27 -21.731 -23.261   9.030
   85    HD3  ARG  27           HD2      ARG  27 -22.919 -23.370  10.338
   86    HE   ARG  27           HE       ARG  27 -24.031 -24.138   7.826
   87   HH11  ARG  27          HH11      ARG  27 -22.049 -25.236  10.468
   88   HH12  ARG  27          HH12      ARG  27 -22.415 -26.910  10.220
   89   HH21  ARG  27          HH21      ARG  27 -24.523 -26.339   7.489
   90   HH22  ARG  27          HH22      ARG  27 -23.823 -27.538   8.524
   91    H    SER  28           H        SER  28 -26.086 -18.647   9.683
   92    HA   SER  28           HA       SER  28 -25.603 -16.493   9.114
   93    HB2  SER  28           HB1      SER  28 -23.154 -18.055   8.824
   94    HB3  SER  28           HB2      SER  28 -23.158 -16.618   7.787
   95    HG   SER  28           HG       SER  28 -22.587 -16.657  10.304
   96    H    SER  29           H        SER  29 -27.265 -16.249   7.588
   97    HA   SER  29           HA       SER  29 -26.317 -16.170   4.804
   98    HB2  SER  29           HB1      SER  29 -28.487 -16.929   4.004
   99    HB3  SER  29           HB2      SER  29 -27.829 -18.114   5.145
  100    HG   SER  29           HG       SER  29 -30.166 -17.119   5.297
  101    H    ALA  30           H        ALA  30 -26.320 -14.042   6.684
  102    HA   ALA  30           HA       ALA  30 -28.139 -12.208   5.301
  103    HB1  ALA  30           HB1      ALA  30 -28.809 -11.133   7.363
  104    HB2  ALA  30           HB2      ALA  30 -29.225 -12.847   7.418
  105    HB3  ALA  30           HB3      ALA  30 -27.818 -12.252   8.299
  106    H    ASP  31           H        ASP  31 -27.566  -9.873   5.881
  107    HA   ASP  31           HA       ASP  31 -24.885  -9.356   6.759
  108    HB2  ASP  31           HB1      ASP  31 -24.121  -8.353   4.607
  109    HB3  ASP  31           HB2      ASP  31 -24.326 -10.109   4.536
  110    HD2  ASP  31           HD       ASP  31 -26.660  -9.870   2.047
  111    H    LEU  32           H        LEU  32 -24.412  -7.092   6.907
  112    HA   LEU  32           HA       LEU  32 -26.749  -5.341   6.551
  113    HB2  LEU  32           HB1      LEU  32 -25.016  -5.742   8.965
  114    HB3  LEU  32           HB2      LEU  32 -25.792  -4.176   8.673
  115    HG   LEU  32           HG       LEU  32 -27.453  -6.661   8.700
  116   HD11  LEU  32          HD11      LEU  32 -27.808  -6.282  11.135
  117   HD12  LEU  32          HD12      LEU  32 -26.431  -5.181  11.116
  118   HD13  LEU  32          HD13      LEU  32 -26.201  -6.886  10.726
  119   HD21  LEU  32          HD21      LEU  32 -27.944  -3.782   9.453
  120   HD22  LEU  32          HD22      LEU  32 -29.136  -5.079   9.553
  121   HD23  LEU  32          HD23      LEU  32 -28.490  -4.593   7.984
  122    H    HIS  33           H        HIS  33 -26.166  -3.004   6.581
  123    HA   HIS  33           HA       HIS  33 -23.444  -2.255   6.077
  124    HB2  HIS  33           HB1      HIS  33 -24.649  -3.309   3.896
  125    HB3  HIS  33           HB2      HIS  33 -25.138  -1.619   3.732
  126    HD1  HIS  33           HD1      HIS  33 -22.294  -3.861   3.194
  127    HD2  HIS  33           HD2      HIS  33 -22.916   0.233   3.536
  128    HE1  HIS  33           HE1      HIS  33 -20.214  -2.784   2.277
  129    HE2  HIS  33           HE2      HIS  33 -20.594  -0.282   2.486
  130    H    GLY  34           H        GLY  34 -23.173   0.039   5.834
  131    HA2  GLY  34           HA2      GLY  34 -25.592   1.615   6.437
  132    HA3  GLY  34           HA3      GLY  34 -24.150   1.787   7.428
  133    HA1  GLY  34           HA1      GLY  34 -25.255   1.378   5.658
  134    H    ALA  35           H        ALA  35 -23.748   3.918   6.965
  135    HA   ALA  35           HA       ALA  35 -23.199   4.570   4.145
  136    HB1  ALA  35           HB1      ALA  35 -23.426   6.771   6.094
  137    HB2  ALA  35           HB2      ALA  35 -24.038   6.643   4.445
  138    HB3  ALA  35           HB3      ALA  35 -24.905   5.867   5.771
  139    H    ARG  36           H        ARG  36 -22.104   5.631   7.376
  140    HA   ARG  36           HA       ARG  36 -20.048   6.198   8.170
  141    HB2  ARG  36           HB1      ARG  36 -19.461   3.929   6.297
  142    HB3  ARG  36           HB2      ARG  36 -18.127   4.793   7.078
  143    HG2  ARG  36           HG1      ARG  36 -18.520   3.881   9.093
  144    HG3  ARG  36           HG2      ARG  36 -20.278   3.951   8.888
  145    HD2  ARG  36           HD1      ARG  36 -20.405   1.852   8.077
  146    HD3  ARG  36           HD2      ARG  36 -18.942   2.054   7.102
  147    HE   ARG  36           HE       ARG  36 -18.293   1.866   9.856
  148   HH11  ARG  36          HH11      ARG  36 -19.292  -0.042   7.121
  149   HH12  ARG  36          HH12      ARG  36 -18.566  -1.501   7.708
  150   HH21  ARG  36          HH21      ARG  36 -17.333  -0.048  10.641
  151   HH22  ARG  36          HH22      ARG  36 -17.452  -1.504   9.710
  152    H    LYS  37           H        LYS  37 -20.536   8.280   7.016
  153    HA   LYS  37           HA       LYS  37 -18.613   8.761   4.838
  154    HB2  LYS  37           HB1      LYS  37 -21.233   9.200   4.678
  155    HB3  LYS  37           HB2      LYS  37 -20.770  10.721   5.456
  156    HG2  LYS  37           HG1      LYS  37 -19.628  11.490   3.635
  157    HG3  LYS  37           HG2      LYS  37 -19.234   9.857   3.067
  158    HD2  LYS  37           HD1      LYS  37 -21.221   9.595   1.965
  159    HD3  LYS  37           HD2      LYS  37 -22.096  10.651   3.088
  160    HE2  LYS  37           HE1      LYS  37 -20.015  11.747   1.206
  161    HE3  LYS  37           HE2      LYS  37 -21.691  11.498   0.697
  162    HZ1  LYS  37           HZ1      LYS  37 -22.154  12.831   2.898
  163    HZ2  LYS  37           HZ2      LYS  37 -21.818  13.625   1.443
  164    HZ3  LYS  37           HZ3      LYS  37 -20.601  13.432   2.601
  165    H    GLY  38           H        GLY  38 -17.596  10.924   4.819
  166    HA2  GLY  38           HA2      GLY  38 -17.406  12.922   6.484
  167    HA3  GLY  38           HA3      GLY  38 -16.817  11.658   7.553
  168    HA1  GLY  38           HA1      GLY  38 -17.200  12.601   5.686
  169    H    SER  39           H        SER  39 -15.343  10.162   5.671
  170    HA   SER  39           HA       SER  39 -13.349  12.046   4.645
  171    HB2  SER  39           HB1      SER  39 -11.634  11.359   5.967
  172    HB3  SER  39           HB2      SER  39 -12.942  10.897   7.070
  173    HG   SER  39           HG       SER  39 -11.297   9.239   6.528
  174    H    GLN  40           H        GLN  40 -12.405  11.415   2.780
  175    HA   GLN  40           HA       GLN  40 -13.546   9.384   1.237
  176    HB2  GLN  40           HB1      GLN  40 -11.000  10.972   0.985
  177    HB3  GLN  40           HB2      GLN  40 -11.424   9.721  -0.194
  178    HG2  GLN  40           HG1      GLN  40 -12.482  11.340  -1.297
  179    HG3  GLN  40           HG2      GLN  40 -13.729  11.181  -0.053
  180   HE21  GLN  40          HE21      GLN  40 -13.355  13.532  -1.431
  181   HE22  GLN  40          HE22      GLN  40 -12.752  14.739  -0.354
  182    H    CYS  41           H        CYS  41 -10.302   9.472   2.719
  183    HA   CYS  41           HA       CYS  41 -10.410   6.545   2.934
  184    HB2  CYS  41           HB1      CYS  41  -8.038   6.399   2.275
  185    HB3  CYS  41           HB2      CYS  41  -9.052   7.027   0.975
  186    H    LEU  42           H        LEU  42  -9.366   5.663   4.708
  187    HA   LEU  42           HA       LEU  42  -8.791   7.562   6.847
  188    HB2  LEU  42           HB1      LEU  42 -10.346   5.540   7.062
  189    HB3  LEU  42           HB2      LEU  42  -8.863   4.570   7.088
  190    HG   LEU  42           HG       LEU  42  -8.422   6.487   9.035
  191   HD11  LEU  42          HD11      LEU  42 -10.327   6.686  10.372
  192   HD12  LEU  42          HD12      LEU  42 -11.189   5.423   9.492
  193   HD13  LEU  42          HD13      LEU  42 -10.911   6.992   8.737
  194   HD21  LEU  42          HD21      LEU  42  -9.004   4.506  10.571
  195   HD22  LEU  42          HD22      LEU  42  -7.699   4.307   9.403
  196   HD23  LEU  42          HD23      LEU  42  -9.290   3.619   9.075
  197    H    SER  43           H        SER  43  -7.194   5.301   4.765
  198    HA   SER  43           HA       SER  43  -4.618   6.195   5.726
  199    HB2  SER  43           HB1      SER  43  -5.714   3.764   6.714
  200    HB3  SER  43           HB2      SER  43  -4.417   3.339   5.582
  201    HG   SER  43           HG       SER  43  -3.423   3.645   7.513
  202    H    ASP  44           H        ASP  44  -2.827   5.266   4.383
  203    HA   ASP  44           HA       ASP  44  -3.380   5.608   1.652
  204    HB2  ASP  44           HB1      ASP  44  -1.085   5.071   1.249
  205    HB3  ASP  44           HB2      ASP  44  -1.156   5.955   2.779
  206    HD2  ASP  44           HD       ASP  44  -0.102   2.139   2.874
  207    H    THR  45           H        THR  45  -3.422   2.800   3.683
  208    HA   THR  45           HA       THR  45  -3.234   0.855   1.605
  209    HB   THR  45           HB       THR  45  -4.158  -0.717   3.344
  210    HG1  THR  45           HG1      THR  45  -3.829   1.401   5.188
  211   HG21  THR  45          HG21      THR  45  -2.138  -0.849   4.532
  212   HG22  THR  45          HG22      THR  45  -1.880   0.895   4.461
  213   HG23  THR  45          HG23      THR  45  -1.694  -0.084   3.006
  214    H    ASP  46           H        ASP  46  -5.797   2.772   2.916
  215    HA   ASP  46           HA       ASP  46  -7.980   1.150   2.112
  216    HB2  ASP  46           HB1      ASP  46  -7.919   3.159   3.760
  217    HB3  ASP  46           HB2      ASP  46  -8.134   4.144   2.308
  218    HD2  ASP  46           HD       ASP  46 -11.344   2.911   3.804
  219    H    CYS  47           H        CYS  47  -5.920   3.383   0.447
  220    HA   CYS  47           HA       CYS  47  -7.477   4.187  -1.685
  221    HB2  CYS  47           HB1      CYS  47  -4.786   4.321  -0.997
  222    HB3  CYS  47           HB2      CYS  47  -4.788   3.442  -2.527
  223    H    ASN  48           H        ASN  48  -5.199   1.442  -1.816
  224    HA   ASN  48           HA       ASN  48  -7.130  -0.252  -3.095
  225    HB2  ASN  48           HB1      ASN  48  -5.254   1.329  -4.699
  226    HB3  ASN  48           HB2      ASN  48  -5.155  -0.407  -5.021
  227   HD21  ASN  48          HD21      ASN  48  -7.567  -1.371  -4.937
  228   HD22  ASN  48          HD22      ASN  48  -8.637  -0.581  -6.039
  229    H    THR  49           H        THR  49  -3.594  -0.059  -3.410
  230    HA   THR  49           HA       THR  49  -3.149  -2.099  -1.436
  231    HB   THR  49           HB       THR  49  -2.420  -2.843  -4.265
  232    HG1  THR  49           HG1      THR  49  -4.282  -3.986  -4.401
  233   HG21  THR  49          HG21      THR  49  -1.082  -4.003  -2.697
  234   HG22  THR  49          HG22      THR  49  -2.353  -5.135  -3.161
  235   HG23  THR  49          HG23      THR  49  -2.450  -4.282  -1.620
  236    H    ARG  50           H        ARG  50  -1.505  -1.132  -4.450
  237    HA   ARG  50           HA       ARG  50   0.854  -0.445  -2.838
  238    HB2  ARG  50           HB1      ARG  50   0.676  -0.975  -5.814
  239    HB3  ARG  50           HB2      ARG  50   2.156  -0.729  -4.874
  240    HG2  ARG  50           HG1      ARG  50   1.615  -2.778  -3.569
  241    HG3  ARG  50           HG2      ARG  50   0.251  -3.047  -4.666
  242    HD2  ARG  50           HD1      ARG  50   3.120  -2.783  -5.583
  243    HD3  ARG  50           HD2      ARG  50   2.324  -4.327  -5.242
  244    HE   ARG  50           HE       ARG  50   1.955  -2.667  -7.558
  245   HH11  ARG  50          HH11      ARG  50   0.527  -5.114  -5.536
  246   HH12  ARG  50          HH12      ARG  50  -0.520  -5.716  -6.779
  247   HH21  ARG  50          HH21      ARG  50   0.583  -3.450  -9.203
  248   HH22  ARG  50          HH22      ARG  50  -0.487  -4.769  -8.864
  249    H    LYS  51           H        LYS  51  -1.396   1.331  -3.081
  250    HA   LYS  51           HA       LYS  51  -0.005   3.620  -4.262
  251    HB2  LYS  51           HB1      LYS  51  -2.812   2.722  -4.890
  252    HB3  LYS  51           HB2      LYS  51  -2.314   4.411  -5.082
  253    HG2  LYS  51           HG1      LYS  51  -1.678   3.873  -7.141
  254    HG3  LYS  51           HG2      LYS  51  -0.334   2.996  -6.389
  255    HD2  LYS  51           HD1      LYS  51  -1.134   1.148  -7.356
  256    HD3  LYS  51           HD2      LYS  51  -2.468   1.237  -6.193
  257    HE2  LYS  51           HE1      LYS  51  -3.771   2.592  -7.769
  258    HE3  LYS  51           HE2      LYS  51  -2.432   2.522  -8.924
  259    HZ1  LYS  51           HZ1      LYS  51  -2.687   0.095  -8.978
  260    HZ2  LYS  51           HZ2      LYS  51  -4.084   0.895  -9.495
  261    HZ3  LYS  51           HZ3      LYS  51  -4.024   0.213  -7.948
  262    H    PHE  52           H        PHE  52  -0.266   5.519  -3.166
  263    HA   PHE  52           HA       PHE  52  -1.707   5.330  -0.621
  264    HB2  PHE  52           HB1      PHE  52  -0.364   7.336   0.020
  265    HB3  PHE  52           HB2      PHE  52   0.613   5.919  -0.371
  266    HD1  PHE  52           HD1      PHE  52   2.140   5.909  -2.181
  267    HD2  PHE  52           HD2      PHE  52  -0.505   9.197  -1.624
  268    HE1  PHE  52           HE1      PHE  52   3.416   7.210  -3.834
  269    HE2  PHE  52           HE2      PHE  52   0.766  10.504  -3.277
  270    HZ   PHE  52           HZ       PHE  52   2.729   9.511  -4.385
  271    H    CYS  53           H        CYS  53  -2.908   7.194   0.151
  272    HA   CYS  53           HA       CYS  53  -4.681   8.201  -1.843
  273    HB2  CYS  53           HB1      CYS  53  -4.745   7.852   0.926
  274    HB3  CYS  53           HB2      CYS  53  -4.819   9.601   0.702
  275    H    LEU  54           H        LEU  54  -3.714   9.555  -3.280
  276    HA   LEU  54           HA       LEU  54  -2.045  11.739  -2.345
  277    HB2  LEU  54           HB1      LEU  54  -1.403  10.505  -4.354
  278    HB3  LEU  54           HB2      LEU  54  -2.930  10.969  -5.123
  279    HG   LEU  54           HG       LEU  54  -1.993  13.411  -4.643
  280   HD11  LEU  54          HD11      LEU  54   0.043  12.370  -3.532
  281   HD12  LEU  54          HD12      LEU  54   0.344  13.601  -4.759
  282   HD13  LEU  54          HD13      LEU  54   0.548  11.895  -5.154
  283   HD21  LEU  54          HD21      LEU  54  -2.568  12.160  -6.826
  284   HD22  LEU  54          HD22      LEU  54  -0.828  11.898  -6.951
  285   HD23  LEU  54          HD23      LEU  54  -1.472  13.540  -6.902
  286    H    GLN  55           H        GLN  55  -2.768  13.713  -1.915
  287    HA   GLN  55           HA       GLN  55  -5.303  14.585  -3.128
  288    HB2  GLN  55           HB1      GLN  55  -5.727  15.828  -0.956
  289    HB3  GLN  55           HB2      GLN  55  -5.903  14.066  -0.898
  290    HG2  GLN  55           HG1      GLN  55  -4.308  13.842   0.633
  291    HG3  GLN  55           HG2      GLN  55  -3.208  14.909  -0.252
  292   HE21  GLN  55          HE21      GLN  55  -2.477  16.069   1.461
  293   HE22  GLN  55          HE22      GLN  55  -3.469  17.124   2.403
  294    HA   PRO  56           HA       PRO  56  -2.104  17.702  -4.143
  295    HB2  PRO  56           HB1      PRO  56  -3.214  18.363  -6.559
  296    HB3  PRO  56           HB2      PRO  56  -2.134  16.989  -6.327
  297    HG2  PRO  56           HG1      PRO  56  -5.131  17.061  -6.408
  298    HG3  PRO  56           HG2      PRO  56  -3.996  15.915  -7.213
  299    HD2  PRO  56           HD1      PRO  56  -5.342  15.290  -4.939
  300    HD3  PRO  56           HD2      PRO  56  -3.711  14.688  -5.282
  301    H    ARG  57           H        ARG  57  -2.223  19.956  -4.154
  302    HA   ARG  57           HA       ARG  57  -4.620  21.049  -2.976
  303    HB2  ARG  57           HB1      ARG  57  -3.338  23.096  -2.709
  304    HB3  ARG  57           HB2      ARG  57  -2.385  21.705  -2.170
  305    HG2  ARG  57           HG1      ARG  57  -1.412  21.756  -4.586
  306    HG3  ARG  57           HG2      ARG  57  -2.019  23.421  -4.583
  307    HD2  ARG  57           HD1      ARG  57  -0.572  24.105  -2.912
  308    HD3  ARG  57           HD2      ARG  57  -0.386  22.464  -2.276
  309    HE   ARG  57           HE       ARG  57   1.349  22.132  -3.732
  310   HH11  ARG  57          HH11      ARG  57  -0.469  24.923  -4.744
  311   HH12  ARG  57          HH12      ARG  57   0.667  25.381  -5.969
  312   HH21  ARG  57          HH21      ARG  57   2.852  22.725  -5.341
  313   HH22  ARG  57          HH22      ARG  57   2.557  24.129  -6.308
  314    H    ASP  58           H        ASP  58  -3.115  20.969  -6.095
  315    HA   ASP  58           HA       ASP  58  -4.789  23.119  -7.128
  316    HB2  ASP  58           HB1      ASP  58  -2.252  22.168  -7.787
  317    HB3  ASP  58           HB2      ASP  58  -3.281  21.623  -9.117
  318    HD2  ASP  58           HD       ASP  58  -2.635  25.503  -8.709
  319    H    GLU  59           H        GLU  59  -4.715  19.677  -6.958
  320    HA   GLU  59           HA       GLU  59  -7.032  19.550  -8.775
  321    HB2  GLU  59           HB1      GLU  59  -4.572  18.140  -8.904
  322    HB3  GLU  59           HB2      GLU  59  -5.827  16.975  -8.454
  323    HG2  GLU  59           HG1      GLU  59  -6.612  16.904 -10.523
  324    HG3  GLU  59           HG2      GLU  59  -6.765  18.666 -10.573
  325    HE2  GLU  59           HE       GLU  59  -3.859  17.012 -12.558
  326    H    LYS  60           H        LYS  60  -8.144  17.235  -8.298
  327    HA   LYS  60           HA       LYS  60  -9.052  17.459  -5.546
  328    HB2  LYS  60           HB1      LYS  60 -10.116  16.371  -8.070
  329    HB3  LYS  60           HB2      LYS  60 -10.524  15.431  -6.627
  330    HG2  LYS  60           HG1      LYS  60 -11.926  16.997  -5.822
  331    HG3  LYS  60           HG2      LYS  60 -10.909  18.335  -6.383
  332    HD2  LYS  60           HD1      LYS  60 -11.675  17.693  -8.750
  333    HD3  LYS  60           HD2      LYS  60 -12.928  16.742  -7.935
  334    HE2  LYS  60           HE1      LYS  60 -12.462  19.693  -7.454
  335    HE3  LYS  60           HE2      LYS  60 -13.644  19.041  -8.600
  336    HZ1  LYS  60           HZ1      LYS  60 -13.705  18.143  -5.800
  337    HZ2  LYS  60           HZ2      LYS  60 -14.966  18.232  -6.923
  338    HZ3  LYS  60           HZ3      LYS  60 -14.372  19.644  -6.205
  339    HA   PRO  61           HA       PRO  61  -7.017  13.928  -3.921
  340    HB2  PRO  61           HB1      PRO  61  -8.947  12.807  -2.335
  341    HB3  PRO  61           HB2      PRO  61  -8.123  14.315  -1.944
  342    HG2  PRO  61           HG1      PRO  61 -10.792  13.890  -3.245
  343    HG3  PRO  61           HG2      PRO  61 -10.335  15.031  -1.926
  344    HD2  PRO  61           HD1      PRO  61 -10.628  15.816  -4.508
  345    HD3  PRO  61           HD2      PRO  61  -9.439  16.546  -3.416
  346    H    PHE  62           H        PHE  62  -6.555  11.895  -4.544
  347    HA   PHE  62           HA       PHE  62  -8.498   9.959  -5.265
  348    HB2  PHE  62           HB1      PHE  62  -8.193   9.793  -7.617
  349    HB3  PHE  62           HB2      PHE  62  -8.536  11.489  -7.277
  350    HD1  PHE  62           HD1      PHE  62  -6.322  12.921  -6.749
  351    HD2  PHE  62           HD2      PHE  62  -6.500   9.393  -9.123
  352    HE1  PHE  62           HE1      PHE  62  -4.258  13.599  -7.906
  353    HE2  PHE  62           HE2      PHE  62  -4.437  10.064 -10.282
  354    HZ   PHE  62           HZ       PHE  62  -3.312  12.170  -9.673
  355    H    CYS  63           H        CYS  63  -7.320   8.063  -6.492
  356    HA   CYS  63           HA       CYS  63  -4.951   7.487  -4.914
  357    HB2  CYS  63           HB1      CYS  63  -6.749   5.839  -6.684
  358    HB3  CYS  63           HB2      CYS  63  -5.219   5.202  -6.080
  359    H    ALA  64           H        ALA  64  -2.936   7.623  -5.645
  360    HA   ALA  64           HA       ALA  64  -2.492   7.630  -8.558
  361    HB1  ALA  64           HB1      ALA  64  -1.957   9.792  -8.304
  362    HB2  ALA  64           HB2      ALA  64  -1.759   9.642  -6.557
  363    HB3  ALA  64           HB3      ALA  64  -0.447   9.170  -7.637
  364    H    THR  65           H        THR  65  -0.679   6.580  -9.306
  365    HA   THR  65           HA       THR  65   0.272   4.374  -7.951
  366    HB   THR  65           HB       THR  65   2.165   4.364  -9.587
  367    HG1  THR  65           HG1      THR  65   2.651   6.380 -10.146
  368   HG21  THR  65          HG21      THR  65  -0.561   4.005 -10.035
  369   HG22  THR  65          HG22      THR  65   0.762   3.413 -11.041
  370   HG23  THR  65          HG23      THR  65  -0.004   4.958 -11.409
  371    H    CYS  66           H        CYS  66   2.457   3.890  -7.180
  372    HA   CYS  66           HA       CYS  66   3.411   6.020  -5.441
  373    HB2  CYS  66           HB1      CYS  66   4.658   4.303  -4.288
  374    HB3  CYS  66           HB2      CYS  66   3.004   3.744  -4.537
  375    H    ARG  67           H        ARG  67   5.419   6.932  -5.514
  376    HA   ARG  67           HA       ARG  67   6.726   7.178  -7.955
  377    HB2  ARG  67           HB1      ARG  67   7.968   7.590  -5.226
  378    HB3  ARG  67           HB2      ARG  67   8.476   8.332  -6.750
  379    HG2  ARG  67           HG1      ARG  67   5.881   8.830  -5.290
  380    HG3  ARG  67           HG2      ARG  67   7.259   9.934  -5.426
  381    HD2  ARG  67           HD1      ARG  67   6.954   9.964  -7.893
  382    HD3  ARG  67           HD2      ARG  67   5.517   8.954  -7.684
  383    HE   ARG  67           HE       ARG  67   5.215  11.213  -6.072
  384   HH11  ARG  67          HH11      ARG  67   5.401  10.386  -9.449
  385   HH12  ARG  67          HH12      ARG  67   4.413  11.713  -9.962
  386   HH21  ARG  67          HH21      ARG  67   3.912  12.964  -6.737
  387   HH22  ARG  67          HH22      ARG  67   3.568  13.180  -8.419
  388    H    GLY  68           H        GLY  68   7.771   5.658  -9.054
  389    HA2  GLY  68           HA2      GLY  68   8.699   3.235  -7.961
  390    HA3  GLY  68           HA3      GLY  68   9.113   3.864  -9.549
  391    HA1  GLY  68           HA1      GLY  68   8.865   3.925  -7.439
  392    H    LEU  69           H        LEU  69  11.117   2.599  -8.673
  393    HA   LEU  69           HA       LEU  69  12.788   3.806  -6.754
  394    HB2  LEU  69           HB1      LEU  69  13.312   1.925  -9.049
  395    HB3  LEU  69           HB2      LEU  69  14.607   2.505  -7.986
  396    HG   LEU  69           HG       LEU  69  12.215   0.870  -7.142
  397   HD11  LEU  69          HD11      LEU  69  15.103   0.055  -7.086
  398   HD12  LEU  69          HD12      LEU  69  14.074  -0.237  -8.487
  399   HD13  LEU  69          HD13      LEU  69  13.666  -0.956  -6.930
  400   HD21  LEU  69          HD21      LEU  69  12.599   1.709  -5.115
  401   HD22  LEU  69          HD22      LEU  69  14.075   2.516  -5.647
  402   HD23  LEU  69          HD23      LEU  69  14.127   0.827  -5.137
  403    H    ARG  70           H        ARG  70  12.263   4.422 -10.142
  404    HA   ARG  70           HA       ARG  70  14.556   6.227 -10.273
  405    HB2  ARG  70           HB1      ARG  70  12.611   5.192 -12.336
  406    HB3  ARG  70           HB2      ARG  70  13.766   6.485 -12.687
  407    HG2  ARG  70           HG1      ARG  70  15.438   4.649 -11.634
  408    HG3  ARG  70           HG2      ARG  70  14.208   3.596 -12.356
  409    HD2  ARG  70           HD1      ARG  70  14.468   5.057 -14.464
  410    HD3  ARG  70           HD2      ARG  70  15.959   5.627 -13.700
  411    HE   ARG  70           HE       ARG  70  16.941   3.602 -14.151
  412   HH11  ARG  70          HH11      ARG  70  13.502   3.364 -14.639
  413   HH12  ARG  70          HH12      ARG  70  13.583   1.799 -15.376
  414   HH21  ARG  70          HH21      ARG  70  17.061   1.539 -15.118
  415   HH22  ARG  70          HH22      ARG  70  15.608   0.761 -15.647
  416    H    ARG  71           H        ARG  71  11.776   6.563  -8.873
  417    HA   ARG  71           HA       ARG  71  11.134   9.190 -10.036
  418    HB2  ARG  71           HB1      ARG  71   9.460   7.332  -8.332
  419    HB3  ARG  71           HB2      ARG  71   8.961   8.955  -8.828
  420    HG2  ARG  71           HG1      ARG  71   9.595   6.681 -10.711
  421    HG3  ARG  71           HG2      ARG  71   7.972   7.205 -10.231
  422    HD2  ARG  71           HD1      ARG  71  10.016   8.906 -11.679
  423    HD3  ARG  71           HD2      ARG  71   8.614   8.117 -12.414
  424    HE   ARG  71           HE       ARG  71   7.528   9.635 -10.441
  425   HH11  ARG  71          HH11      ARG  71   9.682  10.290 -13.097
  426   HH12  ARG  71          HH12      ARG  71   9.140  11.923 -13.304
  427   HH21  ARG  71          HH21      ARG  71   6.805  11.783 -10.704
  428   HH22  ARG  71          HH22      ARG  71   7.504  12.771 -11.942
  429    H    ARG  72           H        ARG  72  10.861  10.982  -8.673
  430    HA   ARG  72           HA       ARG  72  12.607  11.030  -6.415
  431    HB2  ARG  72           HB1      ARG  72  10.636  13.134  -7.342
  432    HB3  ARG  72           HB2      ARG  72  11.996  13.380  -6.235
  433    HG2  ARG  72           HG1      ARG  72  12.811  12.217  -8.783
  434    HG3  ARG  72           HG2      ARG  72  12.030  13.797  -8.948
  435    HD2  ARG  72           HD1      ARG  72  13.989  13.622  -6.754
  436    HD3  ARG  72           HD2      ARG  72  14.665  13.420  -8.377
  437    HE   ARG  72           HE       ARG  72  13.062  15.627  -8.571
  438   HH11  ARG  72          HH11      ARG  72  15.748  14.684  -6.567
  439   HH12  ARG  72          HH12      ARG  72  16.324  16.304  -6.349
  440   HH21  ARG  72          HH21      ARG  72  13.810  17.764  -8.292
  441   HH22  ARG  72          HH22      ARG  72  15.220  18.055  -7.331
  442    H    CYS  73           H        CYS  73  11.974  11.804  -4.265
  443    HA   CYS  73           HA       CYS  73   9.215  11.457  -3.469
  444    HB2  CYS  73           HB1      CYS  73   9.625   9.692  -1.859
  445    HB3  CYS  73           HB2      CYS  73  10.081   9.140  -3.472
  446    H    GLN  74           H        GLN  74   8.875  11.992  -1.181
  447    HA   GLN  74           HA       GLN  74  10.977  13.797  -0.180
  448    HB2  GLN  74           HB1      GLN  74   8.044  14.108  -0.459
  449    HB3  GLN  74           HB2      GLN  74   8.760  14.747   1.029
  450    HG2  GLN  74           HG1      GLN  74  10.170  16.231  -0.161
  451    HG3  GLN  74           HG2      GLN  74   9.789  15.451  -1.702
  452   HE21  GLN  74          HE21      GLN  74   9.086  18.007   0.299
  453   HE22  GLN  74          HE22      GLN  74   7.591  18.503  -0.408
  454    H    ARG  75           H        ARG  75   8.801  11.206   0.545
  455    HA   ARG  75           HA       ARG  75  10.028  10.963   3.196
  456    HB2  ARG  75           HB1      ARG  75   7.342  11.738   2.739
  457    HB3  ARG  75           HB2      ARG  75   7.307  10.071   3.335
  458    HG2  ARG  75           HG1      ARG  75   8.793  10.820   5.229
  459    HG3  ARG  75           HG2      ARG  75   8.491  12.479   4.686
  460    HD2  ARG  75           HD1      ARG  75   6.047  12.077   4.934
  461    HD3  ARG  75           HD2      ARG  75   6.425  10.479   5.594
  462    HE   ARG  75           HE       ARG  75   6.894  11.474   7.590
  463   HH11  ARG  75          HH11      ARG  75   7.091  13.876   5.078
  464   HH12  ARG  75          HH12      ARG  75   7.337  15.193   6.176
  465   HH21  ARG  75          HH21      ARG  75   7.217  13.201   9.046
  466   HH22  ARG  75          HH22      ARG  75   7.410  14.808   8.433
  467    H    ASP  76           H        ASP  76   9.962   8.811   4.075
  468    HA   ASP  76           HA       ASP  76  10.246   6.803   2.029
  469    HB2  ASP  76           HB1      ASP  76  10.329   6.213   4.975
  470    HB3  ASP  76           HB2      ASP  76  11.253   5.472   3.660
  471    HD2  ASP  76           HD       ASP  76  12.598   8.863   5.207
  472    H    ALA  77           H        ALA  77   7.841   7.756   4.329
  473    HA   ALA  77           HA       ALA  77   6.390   5.285   4.321
  474    HB1  ALA  77           HB1      ALA  77   6.376   7.195   6.081
  475    HB2  ALA  77           HB2      ALA  77   5.143   7.904   5.037
  476    HB3  ALA  77           HB3      ALA  77   4.888   6.309   5.745
  477    H    MET  78           H        MET  78   6.488   8.103   2.313
  478    HA   MET  78           HA       MET  78   3.950   7.487   1.031
  479    HB2  MET  78           HB1      MET  78   4.288   9.503  -0.253
  480    HB3  MET  78           HB2      MET  78   4.619   9.840   1.452
  481    HG2  MET  78           HG1      MET  78   6.970   9.865   1.098
  482    HG3  MET  78           HG2      MET  78   6.782   9.212  -0.532
  483    HE1  MET  78           HE1      MET  78   5.135  12.166  -2.457
  484    HE2  MET  78           HE2      MET  78   6.194  10.781  -2.714
  485    HE3  MET  78           HE3      MET  78   4.641  10.565  -1.907
  486    H    CYS  79           H        CYS  79   7.291   6.831   0.631
  487    HA   CYS  79           HA       CYS  79   7.424   6.493  -2.158
  488    HB2  CYS  79           HB1      CYS  79   9.139   6.137   0.060
  489    HB3  CYS  79           HB2      CYS  79   9.105   4.594  -0.795
  490    H    CYS  80           H        CYS  80   7.785   4.335  -3.229
  491    HA   CYS  80           HA       CYS  80   5.482   2.815  -3.219
  492    HB2  CYS  80           HB1      CYS  80   8.268   2.346  -4.207
  493    HB3  CYS  80           HB2      CYS  80   7.119   1.009  -4.242
  494    HA   PRO  81           HA       PRO  81   5.667  -0.012   0.130
  495    HB2  PRO  81           HB1      PRO  81   4.678  -2.309  -0.986
  496    HB3  PRO  81           HB2      PRO  81   3.686  -0.895  -0.632
  497    HG2  PRO  81           HG1      PRO  81   4.949  -1.734  -3.220
  498    HG3  PRO  81           HG2      PRO  81   3.278  -1.135  -2.909
  499    HD2  PRO  81           HD1      PRO  81   5.232   0.444  -3.938
  500    HD3  PRO  81           HD2      PRO  81   3.969   1.063  -2.860
  501    H    GLY  82           H        GLY  82   7.517  -0.755   0.955
  502    HA2  GLY  82           HA2      GLY  82   9.144  -2.422   1.275
  503    HA3  GLY  82           HA3      GLY  82   8.859  -2.985  -0.365
  504    HA1  GLY  82           HA1      GLY  82   9.122  -1.546   1.178
  505    H    THR  83           H        THR  83   9.517   0.343   0.582
  506    HA   THR  83           HA       THR  83  12.270   0.169  -0.324
  507    HB   THR  83           HB       THR  83  11.930   2.104  -1.920
  508    HG1  THR  83           HG1      THR  83   9.714   2.170  -2.771
  509   HG21  THR  83          HG21      THR  83  11.273   0.685  -3.774
  510   HG22  THR  83          HG22      THR  83  10.554  -0.481  -2.661
  511   HG23  THR  83          HG23      THR  83  12.299  -0.225  -2.665
  512    H    LEU  84           H        LEU  84  13.262   2.476  -0.283
  513    HA   LEU  84           HA       LEU  84  12.106   3.998   1.955
  514    HB2  LEU  84           HB1      LEU  84  14.788   2.789   1.659
  515    HB3  LEU  84           HB2      LEU  84  14.743   4.442   2.294
  516    HG   LEU  84           HG       LEU  84  12.898   2.555   3.598
  517   HD11  LEU  84          HD11      LEU  84  14.407   1.181   4.614
  518   HD12  LEU  84          HD12      LEU  84  15.742   2.317   4.425
  519   HD13  LEU  84          HD13      LEU  84  15.189   1.370   3.045
  520   HD21  LEU  84          HD21      LEU  84  13.034   4.686   4.551
  521   HD22  LEU  84          HD22      LEU  84  14.791   4.737   4.412
  522   HD23  LEU  84          HD23      LEU  84  14.031   3.679   5.601
  523    H    CYS  85           H        CYS  85  12.939   6.238   2.100
  524    HA   CYS  85           HA       CYS  85  13.268   7.348  -0.596
  525    HB2  CYS  85           HB1      CYS  85  11.341   8.043   0.934
  526    HB3  CYS  85           HB2      CYS  85  12.554   8.887   1.896
  527    H    VAL  86           H        VAL  86  15.290   7.794  -1.154
  528    HA   VAL  86           HA       VAL  86  17.023   9.139   0.798
  529    HB   VAL  86           HB       VAL  86  18.017   6.967  -1.047
  530   HG11  VAL  86          HG11      VAL  86  19.317   8.526   1.181
  531   HG12  VAL  86          HG12      VAL  86  20.037   7.114   0.404
  532   HG13  VAL  86          HG13      VAL  86  19.721   8.574  -0.535
  533   HG21  VAL  86          HG21      VAL  86  17.276   6.863   1.868
  534   HG22  VAL  86          HG22      VAL  86  16.656   5.864   0.554
  535   HG23  VAL  86          HG23      VAL  86  18.323   5.672   1.097
  536    H    ASN  87           H        ASN  87  18.294  10.742  -0.019
  537    HA   ASN  87           HA       ASN  87  18.910  12.403  -1.449
  538    HB2  ASN  87           HB1      ASN  87  20.094  10.212  -2.326
  539    HB3  ASN  87           HB2      ASN  87  19.013  10.440  -3.705
  540   HD21  ASN  87          HD21      ASN  87  20.056  11.343  -5.315
  541   HD22  ASN  87          HD22      ASN  87  21.180  12.650  -5.199
  542    H    ASP  88           H        ASP  88  16.124  12.057  -1.145
  543    HA   ASP  88           HA       ASP  88  14.145  12.745  -2.032
  544    HB2  ASP  88           HB1      ASP  88  15.923  14.610  -2.758
  545    HB3  ASP  88           HB2      ASP  88  15.467  14.031  -4.366
  546    HD2  ASP  88           HD       ASP  88  12.248  15.336  -4.084
  547    H    VAL  89           H        VAL  89  15.432  10.232  -2.962
  548    HA   VAL  89           HA       VAL  89  13.691   9.802  -5.270
  549    HB   VAL  89           HB       VAL  89  16.604   8.998  -5.242
  550   HG11  VAL  89          HG11      VAL  89  14.349   8.361  -7.120
  551   HG12  VAL  89          HG12      VAL  89  16.040   8.276  -7.618
  552   HG13  VAL  89          HG13      VAL  89  15.451   7.250  -6.309
  553   HG21  VAL  89          HG21      VAL  89  15.162  10.887  -7.096
  554   HG22  VAL  89          HG22      VAL  89  16.159  11.396  -5.734
  555   HG23  VAL  89          HG23      VAL  89  16.887  10.520  -7.080
  556    H    CYS  90           H        CYS  90  12.793   7.788  -5.363
  557    HA   CYS  90           HA       CYS  90  12.805   6.223  -2.996
  558    HB2  CYS  90           HB1      CYS  90  11.082   6.529  -5.086
  559    HB3  CYS  90           HB2      CYS  90  11.788   4.956  -5.460
  560    H    THR  91           H        THR  91  14.142   4.660  -2.397
  561    HA   THR  91           HA       THR  91  15.654   3.215  -4.471
  562    HB   THR  91           HB       THR  91  17.098   4.894  -3.319
  563    HG1  THR  91           HG1      THR  91  18.738   3.494  -3.356
  564   HG21  THR  91          HG21      THR  91  17.760   4.493  -1.001
  565   HG22  THR  91          HG22      THR  91  16.615   3.156  -0.895
  566   HG23  THR  91          HG23      THR  91  16.028   4.806  -1.110
  567    H    THR  92           H        THR  92  16.327   1.076  -3.893
  568    HA   THR  92           HA       THR  92  14.352  -0.338  -2.388
  569    HB   THR  92           HB       THR  92  16.252  -2.221  -2.808
  570    HG1  THR  92           HG1      THR  92  17.734  -1.431  -4.087
  571   HG21  THR  92          HG21      THR  92  13.828  -1.363  -4.055
  572   HG22  THR  92          HG22      THR  92  14.516  -2.985  -3.973
  573   HG23  THR  92          HG23      THR  92  14.952  -1.907  -5.300
  574    H    MET  93           H        MET  93  14.873  -1.884  -0.657
  575    HA   MET  93           HA       MET  93  16.217  -0.614   1.483
  576    HB2  MET  93           HB1      MET  93  14.277  -2.292   1.573
  577    HB3  MET  93           HB2      MET  93  15.520  -3.542   1.405
  578    HG2  MET  93           HG1      MET  93  16.578  -2.867   3.456
  579    HG3  MET  93           HG2      MET  93  15.500  -1.477   3.589
  580    HE1  MET  93           HE1      MET  93  12.523  -2.024   4.216
  581    HE2  MET  93           HE2      MET  93  12.967  -2.557   5.838
  582    HE3  MET  93           HE3      MET  93  13.926  -1.322   5.021
  583    H    GLU  94           H        GLU  94  17.186  -2.992  -0.878
  584    HA   GLU  94           HA       GLU  94  19.520  -3.887   0.484
  585    HB2  GLU  94           HB1      GLU  94  18.326  -4.212  -2.204
  586    HB3  GLU  94           HB2      GLU  94  20.084  -4.394  -2.117
  587    HG2  GLU  94           HG1      GLU  94  19.981  -6.274  -0.805
  588    HG3  GLU  94           HG2      GLU  94  18.388  -5.856  -0.157
  589    HE2  GLU  94           HE       GLU  94  18.182  -8.503  -2.743
  590    H    ASP  95           H        ASP  95  18.828  -1.289  -1.767
  591    HA   ASP  95           HA       ASP  95  21.541  -0.613  -2.307
  592    HB2  ASP  95           HB1      ASP  95  18.943   0.276  -3.127
  593    HB3  ASP  95           HB2      ASP  95  19.891   1.680  -2.618
  594    HD2  ASP  95           HD       ASP  95  21.929   1.502  -5.379
  595    H    ALA  96           H        ALA  96  19.070   0.845  -0.197
  596    HA   ALA  96           HA       ALA  96  20.839   2.752   0.944
  597    HB1  ALA  96           HB1      ALA  96  19.049   3.126   2.582
  598    HB2  ALA  96           HB2      ALA  96  18.439   3.111   0.927
  599    HB3  ALA  96           HB3      ALA  96  18.202   1.705   1.967
  600    H    THR  97           H        THR  97  19.982  -0.542   1.732
  601    HA   THR  97           HA       THR  97  20.742  -2.010   3.298
  602    HB   THR  97           HB       THR  97  23.156  -0.300   3.773
  603    HG1  THR  97           HG1      THR  97  23.646  -0.350   1.723
  604   HG21  THR  97          HG21      THR  97  23.852  -2.932   3.174
  605   HG22  THR  97          HG22      THR  97  22.375  -3.063   4.130
  606   HG23  THR  97          HG23      THR  97  23.770  -2.198   4.775
  607    H    GLU  98           H        GLU  98  19.131  -1.542   4.833
  608    HA   GLU  98           HA       GLU  98  19.731   0.440   6.887
  609    HB2  GLU  98           HB1      GLU  98  17.314  -1.300   6.361
  610    HB3  GLU  98           HB2      GLU  98  17.462  -0.231   7.764
  611    HG2  GLU  98           HG1      GLU  98  17.534   0.649   4.878
  612    HG3  GLU  98           HG2      GLU  98  16.146   0.778   5.968
  613    HE2  GLU  98           HE       GLU  98  17.499   3.521   7.610
  614    H    ASN  99           H        ASN  99  21.407  -0.446   8.058
  615    HA   ASN  99           HA       ASN  99  20.695  -2.335  10.064
  616    HB2  ASN  99           HB1      ASN  99  21.176  -3.794   8.031
  617    HB3  ASN  99           HB2      ASN  99  22.857  -3.267   8.176
  618   HD21  ASN  99          HD21      ASN  99  21.670  -5.928   8.465
  619   HD22  ASN  99          HD22      ASN  99  22.136  -6.483  10.034
  620    H    LEU 100           H        LEU 100  23.455  -0.932   8.315
  621    HA   LEU 100           HA       LEU 100  25.348   0.105   9.029
  622    HB2  LEU 100           HB1      LEU 100  23.223   1.204  10.423
  623    HB3  LEU 100           HB2      LEU 100  24.401   0.811  11.688
  624    HG   LEU 100           HG       LEU 100  26.099   2.131  10.383
  625   HD11  LEU 100          HD11      LEU 100  24.324   3.821   8.985
  626   HD12  LEU 100          HD12      LEU 100  23.975   2.168   8.484
  627   HD13  LEU 100          HD13      LEU 100  25.611   2.807   8.332
  628   HD21  LEU 100          HD21      LEU 100  23.662   3.308  11.646
  629   HD22  LEU 100          HD22      LEU 100  24.885   4.369  10.945
  630   HD23  LEU 100          HD23      LEU 100  25.321   3.253  12.240
  631    H    TYR 101           H        TYR 101  26.820   0.316  11.163
  632    HA   TYR 101           HA       TYR 101  27.306  -2.451  11.965
  633    HB2  TYR 101           HB1      TYR 101  28.956   0.008  11.700
  634    HB3  TYR 101           HB2      TYR 101  29.423  -1.127  12.971
  635    HD1  TYR 101           HD1      TYR 101  29.657  -3.630  12.257
  636    HD2  TYR 101           HD2      TYR 101  29.758  -0.357   9.540
  637    HE1  TYR 101           HE1      TYR 101  30.826  -5.038  10.615
  638    HE2  TYR 101           HE2      TYR 101  30.925  -1.757   7.889
  639    HH   TYR 101           HH       TYR 101  32.537  -4.053   8.236
  640    H    PHE 102           H        PHE 102  28.225  -2.713  14.243
  641    HA   PHE 102           HA       PHE 102  26.924  -0.952  16.185
  642    HB2  PHE 102           HB1      PHE 102  26.012  -2.865  17.431
  643    HB3  PHE 102           HB2      PHE 102  25.327  -2.760  15.808
  644    HD1  PHE 102           HD1      PHE 102  26.142  -4.294  14.013
  645    HD2  PHE 102           HD2      PHE 102  27.204  -4.794  18.104
  646    HE1  PHE 102           HE1      PHE 102  26.799  -6.621  13.555
  647    HE2  PHE 102           HE2      PHE 102  27.863  -7.121  17.653
  648    HZ   PHE 102           HZ       PHE 102  27.661  -8.037  15.376
  649    H    GLN 103           H        GLN 103  27.610  -1.559  18.469
  650    HA   GLN 103           HA       GLN 103  29.988  -3.056  18.864
  651    HB2  GLN 103           HB1      GLN 103  30.345  -0.421  17.874
  652    HB3  GLN 103           HB2      GLN 103  30.826  -0.412  19.579
  653    HG2  GLN 103           HG1      GLN 103  32.280  -2.394  19.103
  654    HG3  GLN 103           HG2      GLN 103  31.918  -2.154  17.387
  655   HE21  GLN 103          HE21      GLN 103  33.339  -0.642  20.224
  656   HE22  GLN 103          HE22      GLN 103  34.402   0.411  19.360
  657    H    SER 104           H        SER 104  28.414  -0.109  20.116
  658    HA   SER 104           HA       SER 104  27.643   0.443  22.184
  659    HB2  SER 104           HB1      SER 104  26.853  -2.255  21.722
  660    HB3  SER 104           HB2      SER 104  27.346  -2.119  23.419
  661    HG   SER 104           HG       SER 104  25.162  -1.065  22.145
  662    H    LEU 105           H        LEU 105  28.015  -0.092  24.651
  663    HA   LEU 105           HA       LEU 105  30.870  -0.708  25.031
  664    HB2  LEU 105           HB1      LEU 105  29.663   1.780  25.331
  665    HB3  LEU 105           HB2      LEU 105  29.795   1.148  26.982
  666    HG   LEU 105           HG       LEU 105  32.237   0.803  26.580
  667   HD11  LEU 105          HD11      LEU 105  33.171   1.112  24.590
  668   HD12  LEU 105          HD12      LEU 105  32.414   2.693  24.404
  669   HD13  LEU 105          HD13      LEU 105  31.542   1.237  23.926
  670   HD21  LEU 105          HD21      LEU 105  31.022   2.920  27.545
  671   HD22  LEU 105          HD22      LEU 105  31.641   3.680  26.079
  672   HD23  LEU 105          HD23      LEU 105  32.757   2.940  27.228
  673    H    GLU 106           H        GLU 106  31.427  -1.325  27.268
  674    HA   GLU 106           HA       GLU 106  29.223  -2.336  28.882
  675    HB2  GLU 106           HB1      GLU 106  31.445  -4.122  27.860
  676    HB3  GLU 106           HB2      GLU 106  30.199  -4.588  29.029
  677    HG2  GLU 106           HG1      GLU 106  28.465  -4.195  27.321
  678    HG3  GLU 106           HG2      GLU 106  29.743  -3.818  26.156
  679    HE2  GLU 106           HE       GLU 106  29.516  -7.616  27.322
  680    H    HIS 107           H        HIS 107  29.922  -3.057  31.021
  681    HA   HIS 107           HA       HIS 107  32.359  -1.642  31.869
  682    HB2  HIS 107           HB1      HIS 107  29.675  -2.023  33.091
  683    HB3  HIS 107           HB2      HIS 107  31.057  -2.009  34.190
  684    HD1  HIS 107           HD1      HIS 107  28.700   0.230  32.786
  685    HD2  HIS 107           HD2      HIS 107  32.768   0.437  33.601
  686    HE1  HIS 107           HE1      HIS 107  29.248   2.684  32.854
  687    HE2  HIS 107           HE2      HIS 107  31.735   2.811  33.351
  688    H    HIS 108           H        HIS 108  33.665  -2.593  33.529
  689    HA   HIS 108           HA       HIS 108  33.351  -5.506  33.802
  690    HB2  HIS 108           HB1      HIS 108  35.167  -4.607  32.135
  691    HB3  HIS 108           HB2      HIS 108  36.077  -4.274  33.610
  692    HD1  HIS 108           HD1      HIS 108  35.255  -6.971  31.294
  693    HD2  HIS 108           HD2      HIS 108  36.604  -6.651  35.211
  694    HE1  HIS 108           HE1      HIS 108  36.177  -9.238  31.875
  695    HE2  HIS 108           HE2      HIS 108  37.000  -9.043  34.269
  696    H    HIS 109           H        HIS 109  34.271  -6.430  35.703
  697    HA   HIS 109           HA       HIS 109  35.321  -4.694  37.758
  698    HB2  HIS 109           HB1      HIS 109  32.507  -5.316  37.647
  699    HB3  HIS 109           HB2      HIS 109  33.224  -6.021  39.100
  700    HD1  HIS 109           HD1      HIS 109  32.652  -2.687  37.451
  701    HD2  HIS 109           HD2      HIS 109  33.924  -4.237  41.091
  702    HE1  HIS 109           HE1      HIS 109  32.748  -0.726  39.022
  703    HE2  HIS 109           HE2      HIS 109  33.525  -1.671  41.246
  704    H    HIS 110           H        HIS 110  36.865  -5.801  38.748
  705    HA   HIS 110           HA       HIS 110  36.561  -8.720  39.006
  706    HB2  HIS 110           HB1      HIS 110  38.332  -7.717  37.343
  707    HB3  HIS 110           HB2      HIS 110  39.265  -7.445  38.817
  708    HD1  HIS 110           HD1      HIS 110  37.887 -10.278  39.963
  709    HD2  HIS 110           HD2      HIS 110  40.387  -9.648  36.706
  710    HE1  HIS 110           HE1      HIS 110  38.978 -12.499  39.514
  711    HE2  HIS 110           HE2      HIS 110  40.505 -12.116  37.523
  712    H    HIS 111           H        HIS 111  35.724  -8.514  41.107
  713    HA   HIS 111           HA       HIS 111  37.556  -7.399  43.118
  714    HB2  HIS 111           HB1      HIS 111  34.755  -7.194  42.773
  715    HB3  HIS 111           HB2      HIS 111  35.014  -8.186  44.212
  716    HD1  HIS 111           HD1      HIS 111  35.911  -7.054  46.304
  717    HD2  HIS 111           HD2      HIS 111  35.752  -4.527  43.009
  718    HE1  HIS 111           HE1      HIS 111  36.333  -4.744  47.206
  719    HE2  HIS 111           HE2      HIS 111  36.237  -3.200  45.193
  720    H    HIS 112           H        HIS 112  37.787  -8.581  45.151
  721    HA   HIS 112           HA       HIS 112  38.667 -11.182  44.817
  722    HB2  HIS 112           HB1      HIS 112  38.679 -11.348  47.275
  723    HB3  HIS 112           HB2      HIS 112  39.350  -9.813  46.713
  724    HD1  HIS 112           HD1      HIS 112  38.493  -7.804  47.868
  725    HD2  HIS 112           HD2      HIS 112  35.804 -10.964  48.069
  726    HE1  HIS 112           HE1      HIS 112  36.600  -6.984  49.304
  727    HE2  HIS 112           HE2      HIS 112  34.955  -8.915  49.429
  Start of MODEL   18
    1    H1   MET  18           H        MET  18 -55.575  11.851  53.731
    2    HA   MET  18           HA       MET  18 -53.387  10.908  53.047
    3    HB2  MET  18           HB1      MET  18 -55.680   9.668  52.796
    4    HB3  MET  18           HB2      MET  18 -55.396   9.901  51.066
    5    HG2  MET  18           HG1      MET  18 -53.328   8.668  51.169
    6    HG3  MET  18           HG2      MET  18 -53.457   8.552  52.925
    7    HE1  MET  18           HE1      MET  18 -53.437   5.486  52.807
    8    HE2  MET  18           HE2      MET  18 -53.886   6.752  53.950
    9    HE3  MET  18           HE3      MET  18 -55.014   5.442  53.596
   10    H    LEU  19           H        LEU  19 -51.737  11.011  51.630
   11    HA   LEU  19           HA       LEU  19 -51.927  12.902  49.462
   12    HB2  LEU  19           HB1      LEU  19 -49.894  11.953  51.145
   13    HB3  LEU  19           HB2      LEU  19 -49.464  11.404  49.516
   14    HG   LEU  19           HG       LEU  19 -50.207  14.264  49.891
   15   HD11  LEU  19          HD11      LEU  19 -47.555  13.073  50.683
   16   HD12  LEU  19          HD12      LEU  19 -48.699  13.899  51.740
   17   HD13  LEU  19          HD13      LEU  19 -47.871  14.794  50.466
   18   HD21  LEU  19          HD21      LEU  19 -48.024  13.016  48.242
   19   HD22  LEU  19          HD22      LEU  19 -48.770  14.603  48.052
   20   HD23  LEU  19          HD23      LEU  19 -49.690  13.145  47.678
   21    H    VAL  20           H        VAL  20 -52.191  12.469  47.366
   22    HA   VAL  20           HA       VAL  20 -52.247   9.648  46.542
   23    HB   VAL  20           HB       VAL  20 -54.344  10.874  46.208
   24   HG11  VAL  20          HG11      VAL  20 -53.405  12.516  43.991
   25   HG12  VAL  20          HG12      VAL  20 -54.483  12.923  45.327
   26   HG13  VAL  20          HG13      VAL  20 -52.735  13.002  45.549
   27   HG21  VAL  20          HG21      VAL  20 -54.794  10.054  44.079
   28   HG22  VAL  20          HG22      VAL  20 -53.181  10.442  43.480
   29   HG23  VAL  20          HG23      VAL  20 -53.408   9.090  44.590
   30    H    LEU  21           H        LEU  21 -51.135   8.935  44.748
   31    HA   LEU  21           HA       LEU  21 -48.876  10.580  43.955
   32    HB2  LEU  21           HB1      LEU  21 -49.542   7.749  43.135
   33    HB3  LEU  21           HB2      LEU  21 -47.988   8.582  42.951
   34    HG   LEU  21           HG       LEU  21 -48.634   8.621  45.707
   35   HD11  LEU  21          HD11      LEU  21 -50.087   6.611  44.751
   36   HD12  LEU  21          HD12      LEU  21 -49.265   6.526  46.308
   37   HD13  LEU  21          HD13      LEU  21 -48.539   5.776  44.887
   38   HD21  LEU  21          HD21      LEU  21 -46.638   6.933  45.649
   39   HD22  LEU  21          HD22      LEU  21 -46.395   8.617  45.184
   40   HD23  LEU  21          HD23      LEU  21 -46.575   7.375  43.943
   41    H    ASP  22           H        ASP  22 -48.769  11.692  42.121
   42    HA   ASP  22           HA       ASP  22 -50.301  10.830  39.794
   43    HB2  ASP  22           HB1      ASP  22 -51.693  12.468  41.142
   44    HB3  ASP  22           HB2      ASP  22 -50.467  13.685  40.762
   45    HD2  ASP  22           HD       ASP  22 -52.193  12.352  37.472
   46    H    PHE  23           H        PHE  23 -48.284  10.335  38.877
   47    HA   PHE  23           HA       PHE  23 -46.577  12.659  38.277
   48    HB2  PHE  23           HB1      PHE  23 -44.795  10.957  37.795
   49    HB3  PHE  23           HB2      PHE  23 -45.318  11.014  39.478
   50    HD1  PHE  23           HD1      PHE  23 -45.356   9.036  36.404
   51    HD2  PHE  23           HD2      PHE  23 -46.549   9.203  40.486
   52    HE1  PHE  23           HE1      PHE  23 -45.844   6.625  36.356
   53    HE2  PHE  23           HE2      PHE  23 -47.038   6.792  40.444
   54    HZ   PHE  23           HZ       PHE  23 -46.686   5.500  38.378
   55    H    ASN  24           H        ASN  24 -46.176  13.212  36.201
   56    HA   ASN  24           HA       ASN  24 -46.540  11.456  33.993
   57    HB2  ASN  24           HB1      ASN  24 -48.928  12.239  34.826
   58    HB3  ASN  24           HB2      ASN  24 -48.512  13.701  33.922
   59   HD21  ASN  24          HD21      ASN  24 -49.371  10.376  33.723
   60   HD22  ASN  24          HD22      ASN  24 -49.532  10.297  32.005
   61    H    ASN  25           H        ASN  25 -44.877  12.085  32.792
   62    HA   ASN  25           HA       ASN  25 -44.743  14.668  31.637
   63    HB2  ASN  25           HB1      ASN  25 -42.440  15.214  32.625
   64    HB3  ASN  25           HB2      ASN  25 -43.849  15.499  33.653
   65   HD21  ASN  25          HD21      ASN  25 -40.844  14.080  33.476
   66   HD22  ASN  25          HD22      ASN  25 -40.945  13.066  34.871
   67    H    ILE  26           H        ILE  26 -44.505  13.645  29.696
   68    HA   ILE  26           HA       ILE  26 -41.927  12.300  29.265
   69    HB   ILE  26           HB       ILE  26 -43.111  10.807  27.597
   70   HG12  ILE  26          HG11      ILE  26 -45.623  10.921  29.080
   71   HG13  ILE  26          HG12      ILE  26 -45.286  12.423  28.203
   72   HG21  ILE  26          HG21      ILE  26 -43.845   9.212  29.327
   73   HG22  ILE  26          HG22      ILE  26 -42.291   9.954  29.705
   74   HG23  ILE  26          HG23      ILE  26 -43.752  10.501  30.527
   75   HD11  ILE  26          HD11      ILE  26 -46.167   9.872  27.192
   76   HD12  ILE  26          HD12      ILE  26 -46.140  11.452  26.407
   77   HD13  ILE  26          HD13      ILE  26 -44.707  10.425  26.371
   78    H    ARG  27           H        ARG  27 -41.050  12.515  27.174
   79    HA   ARG  27           HA       ARG  27 -42.401  14.423  25.397
   80    HB2  ARG  27           HB1      ARG  27 -39.718  14.661  26.673
   81    HB3  ARG  27           HB2      ARG  27 -39.886  15.215  25.002
   82    HG2  ARG  27           HG1      ARG  27 -41.932  16.148  26.937
   83    HG3  ARG  27           HG2      ARG  27 -40.294  16.808  27.091
   84    HD2  ARG  27           HD1      ARG  27 -40.906  16.847  24.335
   85    HD3  ARG  27           HD2      ARG  27 -42.335  17.455  25.183
   86    HE   ARG  27           HE       ARG  27 -39.923  18.651  26.141
   87   HH11  ARG  27          HH11      ARG  27 -42.309  18.761  23.608
   88   HH12  ARG  27          HH12      ARG  27 -42.037  20.433  23.246
   89   HH21  ARG  27          HH21      ARG  27 -39.555  20.852  25.673
   90   HH22  ARG  27          HH22      ARG  27 -40.470  21.621  24.420
   91    H    SER  28           H        SER  28 -39.525  12.329  25.658
   92    HA   SER  28           HA       SER  28 -38.524  10.926  24.171
   93    HB2  SER  28           HB1      SER  28 -40.604   9.673  24.404
   94    HB3  SER  28           HB2      SER  28 -41.367  10.677  23.160
   95    HG   SER  28           HG       SER  28 -40.030   8.462  22.784
   96    H    SER  29           H        SER  29 -37.331  12.667  23.233
   97    HA   SER  29           HA       SER  29 -37.984  13.055  20.416
   98    HB2  SER  29           HB1      SER  29 -37.173  15.548  20.839
   99    HB3  SER  29           HB2      SER  29 -38.872  15.087  21.041
  100    HG   SER  29           HG       SER  29 -38.530  14.920  23.262
  101    H    ALA  30           H        ALA  30 -36.118  14.145  19.258
  102    HA   ALA  30           HA       ALA  30 -33.538  14.199  20.406
  103    HB1  ALA  30           HB1      ALA  30 -34.012  11.720  20.388
  104    HB2  ALA  30           HB2      ALA  30 -33.971  11.812  18.627
  105    HB3  ALA  30           HB3      ALA  30 -32.537  12.228  19.565
  106    H    ASP  31           H        ASP  31 -31.822  14.464  18.736
  107    HA   ASP  31           HA       ASP  31 -32.622  14.975  16.025
  108    HB2  ASP  31           HB1      ASP  31 -31.721  17.431  16.265
  109    HB3  ASP  31           HB2      ASP  31 -33.406  17.059  16.648
  110    HD2  ASP  31           HD       ASP  31 -30.992  17.813  19.713
  111    H    LEU  32           H        LEU  32 -30.868  13.233  16.315
  112    HA   LEU  32           HA       LEU  32 -28.205  14.488  16.305
  113    HB2  LEU  32           HB1      LEU  32 -29.202  12.188  17.621
  114    HB3  LEU  32           HB2      LEU  32 -28.080  11.633  16.368
  115    HG   LEU  32           HG       LEU  32 -27.410  13.625  18.533
  116   HD11  LEU  32          HD11      LEU  32 -27.646  11.584  19.640
  117   HD12  LEU  32          HD12      LEU  32 -25.923  11.681  19.277
  118   HD13  LEU  32          HD13      LEU  32 -26.977  10.668  18.289
  119   HD21  LEU  32          HD21      LEU  32 -26.183  13.797  16.331
  120   HD22  LEU  32          HD22      LEU  32 -25.542  12.187  16.663
  121   HD23  LEU  32          HD23      LEU  32 -25.180  13.525  17.756
  122    H    HIS  33           H        HIS  33 -26.952  14.373  14.529
  123    HA   HIS  33           HA       HIS  33 -27.329  12.414  12.477
  124    HB2  HIS  33           HB1      HIS  33 -29.201  13.930  11.961
  125    HB3  HIS  33           HB2      HIS  33 -28.070  15.281  11.850
  126    HD1  HIS  33           HD1      HIS  33 -28.427  15.795   9.394
  127    HD2  HIS  33           HD2      HIS  33 -27.327  11.850  10.093
  128    HE1  HIS  33           HE1      HIS  33 -27.924  14.825   7.129
  129    HE2  HIS  33           HE2      HIS  33 -27.251  12.415   7.555
  130    H    GLY  34           H        GLY  34 -25.544  12.222  11.193
  131    HA2  GLY  34           HA2      GLY  34 -23.574  14.381  11.160
  132    HA3  GLY  34           HA3      GLY  34 -23.073  12.859  11.880
  133    HA1  GLY  34           HA1      GLY  34 -24.206  14.123  10.600
  134    H    ALA  35           H        ALA  35 -23.110  14.630   9.081
  135    HA   ALA  35           HA       ALA  35 -22.090  12.425   7.545
  136    HB1  ALA  35           HB1      ALA  35 -24.834  12.895   7.376
  137    HB2  ALA  35           HB2      ALA  35 -24.149  13.608   5.915
  138    HB3  ALA  35           HB3      ALA  35 -23.850  11.911   6.293
  139    H    ARG  36           H        ARG  36 -21.665  13.230   5.192
  140    HA   ARG  36           HA       ARG  36 -21.389  16.010   4.731
  141    HB2  ARG  36           HB1      ARG  36 -19.499  15.126   6.476
  142    HB3  ARG  36           HB2      ARG  36 -18.674  14.879   4.930
  143    HG2  ARG  36           HG1      ARG  36 -19.174  17.263   4.356
  144    HG3  ARG  36           HG2      ARG  36 -19.773  17.461   6.012
  145    HD2  ARG  36           HD1      ARG  36 -17.013  16.395   5.437
  146    HD3  ARG  36           HD2      ARG  36 -17.350  18.128   5.543
  147    HE   ARG  36           HE       ARG  36 -18.342  16.735   7.818
  148   HH11  ARG  36          HH11      ARG  36 -15.443  18.012   6.374
  149   HH12  ARG  36          HH12      ARG  36 -14.629  18.229   7.888
  150   HH21  ARG  36          HH21      ARG  36 -17.281  17.015   9.817
  151   HH22  ARG  36          HH22      ARG  36 -15.674  17.661   9.846
  152    H    LYS  37           H        LYS  37 -19.499  13.062   4.038
  153    HA   LYS  37           HA       LYS  37 -18.969  12.017   2.089
  154    HB2  LYS  37           HB1      LYS  37 -21.586  12.251   1.965
  155    HB3  LYS  37           HB2      LYS  37 -21.212  13.397   0.668
  156    HG2  LYS  37           HG1      LYS  37 -19.897  11.622  -0.468
  157    HG3  LYS  37           HG2      LYS  37 -20.441  10.489   0.782
  158    HD2  LYS  37           HD1      LYS  37 -22.439  12.098  -0.784
  159    HD3  LYS  37           HD2      LYS  37 -21.738  10.619  -1.462
  160    HE2  LYS  37           HE1      LYS  37 -22.673  10.317   1.304
  161    HE3  LYS  37           HE2      LYS  37 -23.949  10.733   0.150
  162    HZ1  LYS  37           HZ1      LYS  37 -23.515   8.298   0.469
  163    HZ2  LYS  37           HZ2      LYS  37 -22.034   8.521  -0.317
  164    HZ3  LYS  37           HZ3      LYS  37 -23.481   8.831  -1.137
  165    H    GLY  38           H        GLY  38 -17.592  14.364   2.627
  166    HA2  GLY  38           HA2      GLY  38 -17.349  15.617  -0.037
  167    HA3  GLY  38           HA3      GLY  38 -16.922  16.408   1.474
  168    HA1  GLY  38           HA1      GLY  38 -17.137  14.775   0.128
  169    H    SER  39           H        SER  39 -15.727  13.718   2.330
  170    HA   SER  39           HA       SER  39 -13.132  14.184   1.043
  171    HB2  SER  39           HB1      SER  39 -12.604  12.472   3.116
  172    HB3  SER  39           HB2      SER  39 -12.532  14.240   3.225
  173    HG   SER  39           HG       SER  39 -13.849  13.177   4.861
  174    H    GLN  40           H        GLN  40 -11.984  12.560   0.062
  175    HA   GLN  40           HA       GLN  40 -13.535  10.241  -0.752
  176    HB2  GLN  40           HB1      GLN  40 -10.917  11.432  -1.660
  177    HB3  GLN  40           HB2      GLN  40 -11.469   9.845  -2.220
  178    HG2  GLN  40           HG1      GLN  40 -13.271  12.220  -2.472
  179    HG3  GLN  40           HG2      GLN  40 -11.960  11.967  -3.631
  180   HE21  GLN  40          HE21      GLN  40 -14.991  10.790  -2.438
  181   HE22  GLN  40          HE22      GLN  40 -15.292   9.662  -3.712
  182    H    CYS  41           H        CYS  41 -10.233  10.797   0.487
  183    HA   CYS  41           HA       CYS  41 -10.467   8.331   2.048
  184    HB2  CYS  41           HB1      CYS  41  -8.314   7.513   1.339
  185    HB3  CYS  41           HB2      CYS  41  -9.317   7.779  -0.088
  186    H    LEU  42           H        LEU  42  -9.336   8.326   3.963
  187    HA   LEU  42           HA       LEU  42  -8.440  10.925   4.886
  188    HB2  LEU  42           HB1      LEU  42  -9.936   9.244   6.156
  189    HB3  LEU  42           HB2      LEU  42  -8.415   8.403   6.506
  190    HG   LEU  42           HG       LEU  42  -7.949  11.058   7.233
  191   HD11  LEU  42          HD11      LEU  42  -9.864  11.244   8.957
  192   HD12  LEU  42          HD12      LEU  42 -10.748  10.198   7.846
  193   HD13  LEU  42          HD13      LEU  42 -10.154  11.765   7.296
  194   HD21  LEU  42          HD21      LEU  42  -8.741   8.753   9.007
  195   HD22  LEU  42          HD22      LEU  42  -7.771  10.156   9.453
  196   HD23  LEU  42          HD23      LEU  42  -7.138   8.975   8.306
  197    H    SER  43           H        SER  43  -7.088   7.863   3.961
  198    HA   SER  43           HA       SER  43  -4.436   8.962   3.968
  199    HB2  SER  43           HB1      SER  43  -5.331   7.466   6.259
  200    HB3  SER  43           HB2      SER  43  -4.063   6.558   5.416
  201    HG   SER  43           HG       SER  43  -2.637   8.116   5.812
  202    H    ASP  44           H        ASP  44  -2.816   7.252   3.248
  203    HA   ASP  44           HA       ASP  44  -3.584   6.165   0.824
  204    HB2  ASP  44           HB1      ASP  44  -1.484   4.813   0.959
  205    HB3  ASP  44           HB2      ASP  44  -1.256   6.532   1.310
  206    HD2  ASP  44           HD       ASP  44  -0.611   3.916   4.195
  207    H    THR  45           H        THR  45  -3.736   4.780   4.028
  208    HA   THR  45           HA       THR  45  -4.041   2.083   3.410
  209    HB   THR  45           HB       THR  45  -5.037   1.790   5.561
  210    HG1  THR  45           HG1      THR  45  -6.082   3.396   6.631
  211   HG21  THR  45          HG21      THR  45  -3.450   2.846   6.988
  212   HG22  THR  45          HG22      THR  45  -3.220   4.178   5.855
  213   HG23  THR  45          HG23      THR  45  -2.638   2.563   5.449
  214    H    ASP  46           H        ASP  46  -6.315   4.730   3.204
  215    HA   ASP  46           HA       ASP  46  -8.664   3.152   2.948
  216    HB2  ASP  46           HB1      ASP  46  -8.007   5.918   3.035
  217    HB3  ASP  46           HB2      ASP  46  -8.943   5.639   1.561
  218    HD2  ASP  46           HD       ASP  46 -11.590   4.319   3.694
  219    H    CYS  47           H        CYS  47  -6.184   4.170   0.740
  220    HA   CYS  47           HA       CYS  47  -7.688   3.640  -1.646
  221    HB2  CYS  47           HB1      CYS  47  -5.639   5.203  -1.323
  222    HB3  CYS  47           HB2      CYS  47  -4.686   3.730  -1.514
  223    H    ASN  48           H        ASN  48  -8.147   1.700  -2.425
  224    HA   ASN  48           HA       ASN  48  -7.240  -0.706  -1.326
  225    HB2  ASN  48           HB1      ASN  48  -8.557  -0.056  -3.968
  226    HB3  ASN  48           HB2      ASN  48  -8.180  -1.713  -3.480
  227   HD21  ASN  48          HD21      ASN  48 -10.039   1.139  -2.656
  228   HD22  ASN  48          HD22      ASN  48 -11.230   0.320  -1.709
  229    H    THR  49           H        THR  49  -6.052  -2.435  -2.475
  230    HA   THR  49           HA       THR  49  -4.128  -3.245  -3.382
  231    HB   THR  49           HB       THR  49  -3.695  -1.170  -5.384
  232    HG1  THR  49           HG1      THR  49  -5.662  -1.098  -6.252
  233   HG21  THR  49          HG21      THR  49  -4.654  -3.926  -5.994
  234   HG22  THR  49          HG22      THR  49  -3.074  -3.732  -5.234
  235   HG23  THR  49          HG23      THR  49  -3.406  -2.966  -6.787
  236    H    ARG  50           H        ARG  50  -1.828  -2.434  -4.224
  237    HA   ARG  50           HA       ARG  50  -0.719  -0.961  -2.025
  238    HB2  ARG  50           HB1      ARG  50   1.450  -1.340  -3.201
  239    HB3  ARG  50           HB2      ARG  50   0.535  -2.820  -2.880
  240    HG2  ARG  50           HG1      ARG  50  -0.207  -1.820  -5.453
  241    HG3  ARG  50           HG2      ARG  50   1.558  -1.906  -5.340
  242    HD2  ARG  50           HD1      ARG  50   1.451  -4.237  -4.667
  243    HD3  ARG  50           HD2      ARG  50  -0.317  -4.165  -4.649
  244    HE   ARG  50           HE       ARG  50  -0.320  -4.414  -6.924
  245   HH11  ARG  50          HH11      ARG  50   2.880  -3.532  -5.876
  246   HH12  ARG  50          HH12      ARG  50   3.602  -3.787  -7.430
  247   HH21  ARG  50          HH21      ARG  50   0.618  -4.754  -8.976
  248   HH22  ARG  50          HH22      ARG  50   2.313  -4.482  -9.193
  249    H    LYS  51           H        LYS  51  -2.178   0.935  -2.741
  250    HA   LYS  51           HA       LYS  51  -0.530   2.728  -4.391
  251    HB2  LYS  51           HB1      LYS  51  -3.558   2.648  -4.392
  252    HB3  LYS  51           HB2      LYS  51  -2.530   3.722  -5.356
  253    HG2  LYS  51           HG1      LYS  51  -1.767   1.957  -6.722
  254    HG3  LYS  51           HG2      LYS  51  -2.409   0.733  -5.612
  255    HD2  LYS  51           HD1      LYS  51  -4.500   0.867  -6.453
  256    HD3  LYS  51           HD2      LYS  51  -4.408   2.628  -6.637
  257    HE2  LYS  51           HE1      LYS  51  -3.007   2.336  -8.652
  258    HE3  LYS  51           HE2      LYS  51  -3.161   0.581  -8.472
  259    HZ1  LYS  51           HZ1      LYS  51  -5.248   0.589  -9.269
  260    HZ2  LYS  51           HZ2      LYS  51  -4.786   2.056  -9.974
  261    HZ3  LYS  51           HZ3      LYS  51  -5.661   2.053  -8.527
  262    H    PHE  52           H        PHE  52  -0.747   4.989  -3.887
  263    HA   PHE  52           HA       PHE  52  -1.497   5.416  -1.078
  264    HB2  PHE  52           HB1      PHE  52  -0.036   7.472  -1.284
  265    HB3  PHE  52           HB2      PHE  52   0.803   5.924  -1.406
  266    HD1  PHE  52           HD1      PHE  52  -0.731   8.544  -3.560
  267    HD2  PHE  52           HD2      PHE  52   2.244   5.526  -3.164
  268    HE1  PHE  52           HE1      PHE  52   0.233   9.216  -5.722
  269    HE2  PHE  52           HE2      PHE  52   3.213   6.193  -5.324
  270    HZ   PHE  52           HZ       PHE  52   2.209   8.040  -6.605
  271    H    CYS  53           H        CYS  53  -2.084   7.826  -0.659
  272    HA   CYS  53           HA       CYS  53  -4.233   8.501  -2.543
  273    HB2  CYS  53           HB1      CYS  53  -3.886   8.715   0.390
  274    HB3  CYS  53           HB2      CYS  53  -4.736  10.056  -0.380
  275    H    LEU  54           H        LEU  54  -3.252   9.776  -4.053
  276    HA   LEU  54           HA       LEU  54  -1.451  11.895  -3.299
  277    HB2  LEU  54           HB1      LEU  54  -1.632  10.430  -5.515
  278    HB3  LEU  54           HB2      LEU  54  -2.670  11.780  -6.004
  279    HG   LEU  54           HG       LEU  54  -0.384  12.063  -6.812
  280   HD11  LEU  54          HD11      LEU  54  -1.678  14.052  -6.357
  281   HD12  LEU  54          HD12      LEU  54   0.009  14.326  -5.924
  282   HD13  LEU  54          HD13      LEU  54  -1.184  14.020  -4.663
  283   HD21  LEU  54          HD21      LEU  54   1.446  11.770  -5.564
  284   HD22  LEU  54          HD22      LEU  54   0.374  10.971  -4.414
  285   HD23  LEU  54          HD23      LEU  54   0.779  12.675  -4.207
  286    H    GLN  55           H        GLN  55  -2.228  13.668  -2.365
  287    HA   GLN  55           HA       GLN  55  -4.734  14.812  -3.411
  288    HB2  GLN  55           HB1      GLN  55  -4.924  15.908  -1.137
  289    HB3  GLN  55           HB2      GLN  55  -5.154  14.153  -1.172
  290    HG2  GLN  55           HG1      GLN  55  -3.424  13.777   0.177
  291    HG3  GLN  55           HG2      GLN  55  -2.387  14.902  -0.713
  292   HE21  GLN  55          HE21      GLN  55  -4.682  14.564   1.881
  293   HE22  GLN  55          HE22      GLN  55  -4.337  16.073   2.650
  294    HA   PRO  56           HA       PRO  56  -1.483  17.850  -4.497
  295    HB2  PRO  56           HB1      PRO  56  -2.759  18.727  -6.756
  296    HB3  PRO  56           HB2      PRO  56  -1.735  17.293  -6.712
  297    HG2  PRO  56           HG1      PRO  56  -4.720  17.503  -6.521
  298    HG3  PRO  56           HG2      PRO  56  -3.717  16.367  -7.499
  299    HD2  PRO  56           HD1      PRO  56  -4.893  15.642  -5.161
  300    HD3  PRO  56           HD2      PRO  56  -3.329  14.996  -5.686
  301    H    ARG  57           H        ARG  57  -1.486  20.094  -4.324
  302    HA   ARG  57           HA       ARG  57  -3.746  21.206  -2.906
  303    HB2  ARG  57           HB1      ARG  57  -0.976  21.641  -2.915
  304    HB3  ARG  57           HB2      ARG  57  -1.688  23.128  -3.560
  305    HG2  ARG  57           HG1      ARG  57  -3.298  22.915  -1.505
  306    HG3  ARG  57           HG2      ARG  57  -1.991  21.906  -0.862
  307    HD2  ARG  57           HD1      ARG  57  -0.699  24.150  -1.917
  308    HD3  ARG  57           HD2      ARG  57  -2.143  24.781  -1.113
  309    HE   ARG  57           HE       ARG  57   0.152  23.574   0.141
  310   HH11  ARG  57          HH11      ARG  57  -3.219  24.379   0.469
  311   HH12  ARG  57          HH12      ARG  57  -3.184  24.381   2.201
  312   HH21  ARG  57          HH21      ARG  57   0.210  23.574   2.421
  313   HH22  ARG  57          HH22      ARG  57  -1.232  23.924   3.311
  314    H    ASP  58           H        ASP  58  -2.327  21.399  -6.080
  315    HA   ASP  58           HA       ASP  58  -3.940  23.693  -6.839
  316    HB2  ASP  58           HB1      ASP  58  -1.718  22.136  -8.052
  317    HB3  ASP  58           HB2      ASP  58  -2.862  22.889  -9.171
  318    HD2  ASP  58           HD       ASP  58  -1.895  26.119  -8.111
  319    H    GLU  59           H        GLU  59  -4.078  20.252  -6.977
  320    HA   GLU  59           HA       GLU  59  -6.491  20.433  -8.659
  321    HB2  GLU  59           HB1      GLU  59  -4.124  18.891  -9.053
  322    HB3  GLU  59           HB2      GLU  59  -5.454  17.779  -8.696
  323    HG2  GLU  59           HG1      GLU  59  -6.705  18.468 -10.548
  324    HG3  GLU  59           HG2      GLU  59  -5.741  19.938 -10.750
  325    HE2  GLU  59           HE       GLU  59  -4.691  16.895 -12.821
  326    H    LYS  60           H        LYS  60  -7.705  18.139  -8.348
  327    HA   LYS  60           HA       LYS  60  -8.463  18.137  -5.545
  328    HB2  LYS  60           HB1      LYS  60  -9.659  17.191  -8.098
  329    HB3  LYS  60           HB2      LYS  60 -10.108  16.312  -6.627
  330    HG2  LYS  60           HG1      LYS  60 -11.385  17.984  -5.847
  331    HG3  LYS  60           HG2      LYS  60 -10.248  19.230  -6.392
  332    HD2  LYS  60           HD1      LYS  60 -11.300  19.526  -8.369
  333    HD3  LYS  60           HD2      LYS  60 -11.640  17.796  -8.550
  334    HE2  LYS  60           HE1      LYS  60 -13.770  18.659  -8.269
  335    HE3  LYS  60           HE2      LYS  60 -13.336  18.196  -6.617
  336    HZ1  LYS  60           HZ1      LYS  60 -13.850  20.276  -6.079
  337    HZ2  LYS  60           HZ2      LYS  60 -13.875  20.792  -7.689
  338    HZ3  LYS  60           HZ3      LYS  60 -12.413  20.747  -6.839
  339    HA   PRO  61           HA       PRO  61  -6.493  14.410  -4.327
  340    HB2  PRO  61           HB1      PRO  61  -8.391  13.223  -2.750
  341    HB3  PRO  61           HB2      PRO  61  -7.492  14.662  -2.274
  342    HG2  PRO  61           HG1      PRO  61 -10.231  14.441  -3.476
  343    HG3  PRO  61           HG2      PRO  61  -9.672  15.449  -2.089
  344    HD2  PRO  61           HD1      PRO  61 -10.051  16.466  -4.578
  345    HD3  PRO  61           HD2      PRO  61  -8.788  17.055  -3.485
  346    H    PHE  62           H        PHE  62  -6.150  12.400  -5.104
  347    HA   PHE  62           HA       PHE  62  -8.295  10.733  -6.047
  348    HB2  PHE  62           HB1      PHE  62  -7.701  10.616  -8.351
  349    HB3  PHE  62           HB2      PHE  62  -7.857  12.330  -7.955
  350    HD1  PHE  62           HD1      PHE  62  -5.581  13.443  -7.106
  351    HD2  PHE  62           HD2      PHE  62  -5.873  10.016  -9.613
  352    HE1  PHE  62           HE1      PHE  62  -3.310  13.871  -7.950
  353    HE2  PHE  62           HE2      PHE  62  -3.603  10.438 -10.460
  354    HZ   PHE  62           HZ       PHE  62  -2.318  12.368  -9.628
  355    H    CYS  63           H        CYS  63  -7.639   8.585  -6.472
  356    HA   CYS  63           HA       CYS  63  -5.290   7.799  -5.015
  357    HB2  CYS  63           HB1      CYS  63  -7.661   6.477  -6.174
  358    HB3  CYS  63           HB2      CYS  63  -6.194   5.498  -6.167
  359    H    ALA  64           H        ALA  64  -3.323   7.631  -5.838
  360    HA   ALA  64           HA       ALA  64  -3.041   7.176  -8.737
  361    HB1  ALA  64           HB1      ALA  64  -1.478   8.770  -8.849
  362    HB2  ALA  64           HB2      ALA  64  -2.088   9.292  -7.278
  363    HB3  ALA  64           HB3      ALA  64  -0.687   8.225  -7.370
  364    H    THR  65           H        THR  65  -1.418   5.763  -9.469
  365    HA   THR  65           HA       THR  65  -1.039   3.450  -7.886
  366    HB   THR  65           HB       THR  65   0.810   3.841 -10.158
  367    HG1  THR  65           HG1      THR  65  -0.677   4.314 -11.592
  368   HG21  THR  65          HG21      THR  65  -1.088   1.719  -9.194
  369   HG22  THR  65          HG22      THR  65   0.670   1.653  -9.320
  370   HG23  THR  65          HG23      THR  65  -0.321   1.624 -10.779
  371    H    CYS  66           H        CYS  66   1.151   2.462  -7.510
  372    HA   CYS  66           HA       CYS  66   2.649   4.055  -5.761
  373    HB2  CYS  66           HB1      CYS  66   2.463   1.406  -6.175
  374    HB3  CYS  66           HB2      CYS  66   3.984   1.717  -7.018
  375    H    ARG  67           H        ARG  67   5.059   4.395  -5.963
  376    HA   ARG  67           HA       ARG  67   5.658   5.454  -8.646
  377    HB2  ARG  67           HB1      ARG  67   6.458   6.383  -5.891
  378    HB3  ARG  67           HB2      ARG  67   7.309   6.922  -7.347
  379    HG2  ARG  67           HG1      ARG  67   4.333   7.235  -7.010
  380    HG3  ARG  67           HG2      ARG  67   5.499   8.449  -6.457
  381    HD2  ARG  67           HD1      ARG  67   5.891   9.201  -8.539
  382    HD3  ARG  67           HD2      ARG  67   5.973   7.561  -9.196
  383    HE   ARG  67           HE       ARG  67   3.776   7.732  -9.819
  384   HH11  ARG  67          HH11      ARG  67   4.522  10.261  -7.546
  385   HH12  ARG  67          HH12      ARG  67   3.008  11.077  -7.758
  386   HH21  ARG  67          HH21      ARG  67   1.780   8.798 -10.107
  387   HH22  ARG  67          HH22      ARG  67   1.449  10.243  -9.214
  388    H    GLY  68           H        GLY  68   7.651   5.064  -9.580
  389    HA2  GLY  68           HA2      GLY  68   8.921   2.625  -8.879
  390    HA3  GLY  68           HA3      GLY  68   9.475   3.766 -10.097
  391    HA1  GLY  68           HA1      GLY  68   8.771   3.153  -8.187
  392    H    LEU  69           H        LEU  69  11.624   3.176  -9.333
  393    HA   LEU  69           HA       LEU  69  12.402   3.992  -6.678
  394    HB2  LEU  69           HB1      LEU  69  14.012   3.058  -9.060
  395    HB3  LEU  69           HB2      LEU  69  14.689   3.402  -7.459
  396    HG   LEU  69           HG       LEU  69  12.762   1.198  -8.180
  397   HD11  LEU  69          HD11      LEU  69  14.533  -0.286  -7.702
  398   HD12  LEU  69          HD12      LEU  69  15.525   0.999  -7.013
  399   HD13  LEU  69          HD13      LEU  69  15.212   0.962  -8.747
  400   HD21  LEU  69          HD21      LEU  69  13.317   0.575  -5.708
  401   HD22  LEU  69          HD22      LEU  69  12.034   1.732  -6.061
  402   HD23  LEU  69          HD23      LEU  69  13.620   2.305  -5.544
  403    H    ARG  70           H        ARG  70  13.395   4.999  -9.956
  404    HA   ARG  70           HA       ARG  70  14.864   7.237  -9.214
  405    HB2  ARG  70           HB1      ARG  70  13.435   6.394 -11.698
  406    HB3  ARG  70           HB2      ARG  70  14.030   8.057 -11.592
  407    HG2  ARG  70           HG1      ARG  70  16.075   7.406 -12.131
  408    HG3  ARG  70           HG2      ARG  70  16.104   6.300 -10.747
  409    HD2  ARG  70           HD1      ARG  70  15.627   4.479 -12.005
  410    HD3  ARG  70           HD2      ARG  70  14.524   5.380 -13.051
  411    HE   ARG  70           HE       ARG  70  16.985   6.315 -13.738
  412   HH11  ARG  70          HH11      ARG  70  15.541   3.154 -13.538
  413   HH12  ARG  70          HH12      ARG  70  16.513   2.487 -14.808
  414   HH21  ARG  70          HH21      ARG  70  18.271   5.448 -15.412
  415   HH22  ARG  70          HH22      ARG  70  18.065   3.792 -15.873
  416    H    ARG  71           H        ARG  71  11.439   6.771  -9.349
  417    HA   ARG  71           HA       ARG  71  10.537   9.393  -9.623
  418    HB2  ARG  71           HB1      ARG  71   9.427   6.954  -8.266
  419    HB3  ARG  71           HB2      ARG  71   8.584   8.505  -8.147
  420    HG2  ARG  71           HG1      ARG  71   9.329   7.202 -10.763
  421    HG3  ARG  71           HG2      ARG  71   7.761   7.005  -9.961
  422    HD2  ARG  71           HD1      ARG  71   7.998   9.714  -9.946
  423    HD3  ARG  71           HD2      ARG  71   8.854   9.302 -11.438
  424    HE   ARG  71           HE       ARG  71   6.294   8.014 -11.172
  425   HH11  ARG  71          HH11      ARG  71   7.980  10.864 -12.249
  426   HH12  ARG  71          HH12      ARG  71   6.751  11.323 -13.380
  427   HH21  ARG  71          HH21      ARG  71   4.669   8.608 -12.659
  428   HH22  ARG  71          HH22      ARG  71   4.867  10.039 -13.612
  429    H    ARG  72           H        ARG  72  10.320  11.099  -8.270
  430    HA   ARG  72           HA       ARG  72  11.933  11.211  -5.940
  431    HB2  ARG  72           HB1      ARG  72   9.841  13.107  -7.025
  432    HB3  ARG  72           HB2      ARG  72  10.888  13.471  -5.644
  433    HG2  ARG  72           HG1      ARG  72  12.326  12.593  -8.048
  434    HG3  ARG  72           HG2      ARG  72  11.439  14.116  -8.223
  435    HD2  ARG  72           HD1      ARG  72  12.590  14.534  -5.816
  436    HD3  ARG  72           HD2      ARG  72  13.793  13.473  -6.561
  437    HE   ARG  72           HE       ARG  72  12.984  15.628  -8.271
  438   HH11  ARG  72          HH11      ARG  72  15.111  14.695  -5.677
  439   HH12  ARG  72          HH12      ARG  72  16.289  15.914  -6.031
  440   HH21  ARG  72          HH21      ARG  72  14.529  17.238  -8.746
  441   HH22  ARG  72          HH22      ARG  72  15.957  17.361  -7.776
  442    H    CYS  73           H        CYS  73  11.247  11.674  -3.768
  443    HA   CYS  73           HA       CYS  73   8.498  11.145  -3.038
  444    HB2  CYS  73           HB1      CYS  73   8.927   9.237  -1.643
  445    HB3  CYS  73           HB2      CYS  73   9.517   8.876  -3.266
  446    H    GLN  74           H        GLN  74   8.099  11.495  -0.742
  447    HA   GLN  74           HA       GLN  74  10.141  13.239   0.470
  448    HB2  GLN  74           HB1      GLN  74   7.132  13.390   0.773
  449    HB3  GLN  74           HB2      GLN  74   8.311  14.477   1.524
  450    HG2  GLN  74           HG1      GLN  74   8.890  15.473  -0.515
  451    HG3  GLN  74           HG2      GLN  74   8.140  14.171  -1.450
  452   HE21  GLN  74          HE21      GLN  74   7.563  16.781  -1.999
  453   HE22  GLN  74          HE22      GLN  74   5.930  17.128  -1.554
  454    H    ARG  75           H        ARG  75   8.012  10.549   0.902
  455    HA   ARG  75           HA       ARG  75   9.179  10.090   3.551
  456    HB2  ARG  75           HB1      ARG  75   6.235  10.069   2.873
  457    HB3  ARG  75           HB2      ARG  75   6.895   9.260   4.302
  458    HG2  ARG  75           HG1      ARG  75   6.524  11.186   5.362
  459    HG3  ARG  75           HG2      ARG  75   7.970  11.764   4.516
  460    HD2  ARG  75           HD1      ARG  75   6.121  12.182   2.593
  461    HD3  ARG  75           HD2      ARG  75   5.121  12.376   4.039
  462    HE   ARG  75           HE       ARG  75   7.532  13.862   4.258
  463   HH11  ARG  75          HH11      ARG  75   4.396  13.869   2.748
  464   HH12  ARG  75          HH12      ARG  75   4.317  15.596   2.621
  465   HH21  ARG  75          HH21      ARG  75   7.440  16.136   4.097
  466   HH22  ARG  75          HH22      ARG  75   6.049  16.884   3.387
  467    H    ASP  76           H        ASP  76   8.812   7.823   4.299
  468    HA   ASP  76           HA       ASP  76   9.407   6.012   2.139
  469    HB2  ASP  76           HB1      ASP  76   9.976   6.138   4.900
  470    HB3  ASP  76           HB2      ASP  76   9.002   4.681   4.663
  471    HD2  ASP  76           HD       ASP  76  11.516   3.104   2.864
  472    H    ALA  77           H        ALA  77   6.646   6.862   4.028
  473    HA   ALA  77           HA       ALA  77   5.141   4.492   3.745
  474    HB1  ALA  77           HB1      ALA  77   4.638   6.316   5.354
  475    HB2  ALA  77           HB2      ALA  77   4.074   7.299   4.002
  476    HB3  ALA  77           HB3      ALA  77   3.241   5.799   4.410
  477    H    MET  78           H        MET  78   5.295   7.451   1.790
  478    HA   MET  78           HA       MET  78   3.320   6.637  -0.077
  479    HB2  MET  78           HB1      MET  78   3.913   8.545  -1.341
  480    HB3  MET  78           HB2      MET  78   4.130   9.003   0.355
  481    HG2  MET  78           HG1      MET  78   6.117   9.783  -0.313
  482    HG3  MET  78           HG2      MET  78   6.606   8.087  -0.250
  483    HE1  MET  78           HE1      MET  78   5.926  11.024  -3.327
  484    HE2  MET  78           HE2      MET  78   4.681   9.894  -3.859
  485    HE3  MET  78           HE3      MET  78   4.660  10.516  -2.209
  486    H    CYS  79           H        CYS  79   6.705   5.994   0.264
  487    HA   CYS  79           HA       CYS  79   7.064   5.101  -2.457
  488    HB2  CYS  79           HB1      CYS  79   8.867   6.131  -0.988
  489    HB3  CYS  79           HB2      CYS  79   8.906   4.596  -0.121
  490    H    CYS  80           H        CYS  80   7.057   3.040  -3.209
  491    HA   CYS  80           HA       CYS  80   5.489   1.100  -2.029
  492    HB2  CYS  80           HB1      CYS  80   7.367   1.231  -4.282
  493    HB3  CYS  80           HB2      CYS  80   7.216  -0.383  -3.583
  494    HA   PRO  81           HA       PRO  81   7.862  -0.986   1.014
  495    HB2  PRO  81           HB1      PRO  81   7.160  -3.604   0.625
  496    HB3  PRO  81           HB2      PRO  81   6.072  -2.397   1.308
  497    HG2  PRO  81           HG1      PRO  81   6.275  -3.392  -1.515
  498    HG3  PRO  81           HG2      PRO  81   4.808  -3.122  -0.503
  499    HD2  PRO  81           HD1      PRO  81   5.614  -1.367  -2.412
  500    HD3  PRO  81           HD2      PRO  81   4.822  -0.854  -0.912
  501    H    GLY  82           H        GLY  82   9.718  -2.249   1.394
  502    HA2  GLY  82           HA2      GLY  82  11.526  -3.627   0.793
  503    HA3  GLY  82           HA3      GLY  82  10.996  -3.554  -0.880
  504    HA1  GLY  82           HA1      GLY  82  11.402  -2.795   1.063
  505    H    THR  83           H        THR  83  10.771  -0.503  -0.367
  506    HA   THR  83           HA       THR  83  13.633   0.051  -0.807
  507    HB   THR  83           HB       THR  83  12.829   2.059  -2.113
  508    HG1  THR  83           HG1      THR  83  10.356   0.646  -1.961
  509   HG21  THR  83          HG21      THR  83  12.730  -0.760  -2.896
  510   HG22  THR  83          HG22      THR  83  13.519   0.608  -3.683
  511   HG23  THR  83          HG23      THR  83  11.802   0.305  -3.950
  512    H    LEU  84           H        LEU  84  14.095   2.492  -0.438
  513    HA   LEU  84           HA       LEU  84  12.644   3.483   1.911
  514    HB2  LEU  84           HB1      LEU  84  14.883   2.174   2.345
  515    HB3  LEU  84           HB2      LEU  84  15.617   3.705   1.835
  516    HG   LEU  84           HG       LEU  84  14.231   4.811   3.655
  517   HD11  LEU  84          HD11      LEU  84  12.941   2.446   3.805
  518   HD12  LEU  84          HD12      LEU  84  13.008   3.620   5.119
  519   HD13  LEU  84          HD13      LEU  84  14.121   2.252   5.102
  520   HD21  LEU  84          HD21      LEU  84  16.356   2.811   4.417
  521   HD22  LEU  84          HD22      LEU  84  15.821   4.163   5.416
  522   HD23  LEU  84          HD23      LEU  84  16.621   4.468   3.873
  523    H    CYS  85           H        CYS  85  12.300   5.630   1.913
  524    HA   CYS  85           HA       CYS  85  12.896   7.140  -0.424
  525    HB2  CYS  85           HB1      CYS  85  10.876   7.361   1.147
  526    HB3  CYS  85           HB2      CYS  85  11.947   8.300   2.190
  527    H    VAL  86           H        VAL  86  14.894   7.815  -0.854
  528    HA   VAL  86           HA       VAL  86  16.336   9.293   1.229
  529    HB   VAL  86           HB       VAL  86  17.599   7.210  -0.558
  530   HG11  VAL  86          HG11      VAL  86  18.846   9.010   1.517
  531   HG12  VAL  86          HG12      VAL  86  19.673   7.728   0.631
  532   HG13  VAL  86          HG13      VAL  86  19.056   9.140  -0.229
  533   HG21  VAL  86          HG21      VAL  86  17.053   5.785   1.062
  534   HG22  VAL  86          HG22      VAL  86  18.165   6.661   2.114
  535   HG23  VAL  86          HG23      VAL  86  16.453   7.085   2.091
  536    H    ASN  87           H        ASN  87  17.499  11.039   0.515
  537    HA   ASN  87           HA       ASN  87  18.068  12.773  -0.842
  538    HB2  ASN  87           HB1      ASN  87  19.402  10.798  -1.847
  539    HB3  ASN  87           HB2      ASN  87  18.197  10.834  -3.140
  540   HD21  ASN  87          HD21      ASN  87  18.555  12.128  -4.796
  541   HD22  ASN  87          HD22      ASN  87  19.677  13.441  -4.829
  542    H    ASP  88           H        ASP  88  15.262  12.063  -0.552
  543    HA   ASP  88           HA       ASP  88  13.241  12.764  -1.328
  544    HB2  ASP  88           HB1      ASP  88  15.023  14.720  -2.114
  545    HB3  ASP  88           HB2      ASP  88  14.211  14.296  -3.627
  546    HD2  ASP  88           HD       ASP  88  11.175  15.597  -2.535
  547    H    VAL  89           H        VAL  89  14.695  10.423  -2.480
  548    HA   VAL  89           HA       VAL  89  12.868   9.978  -4.702
  549    HB   VAL  89           HB       VAL  89  14.817  10.803  -5.868
  550   HG11  VAL  89          HG11      VAL  89  16.531  10.476  -4.231
  551   HG12  VAL  89          HG12      VAL  89  16.329   8.724  -4.294
  552   HG13  VAL  89          HG13      VAL  89  16.989   9.588  -5.683
  553   HG21  VAL  89          HG21      VAL  89  13.605   8.976  -6.916
  554   HG22  VAL  89          HG22      VAL  89  15.328   8.853  -7.275
  555   HG23  VAL  89          HG23      VAL  89  14.602   7.799  -6.061
  556    H    CYS  90           H        CYS  90  12.330   7.836  -5.014
  557    HA   CYS  90           HA       CYS  90  12.558   6.106  -2.819
  558    HB2  CYS  90           HB1      CYS  90  11.579   5.849  -5.631
  559    HB3  CYS  90           HB2      CYS  90  11.829   4.373  -4.696
  560    H    THR  91           H        THR  91  14.466   5.345  -2.151
  561    HA   THR  91           HA       THR  91  16.273   4.166  -4.160
  562    HB   THR  91           HB       THR  91  16.975   5.330  -1.459
  563    HG1  THR  91           HG1      THR  91  17.399   6.213  -4.131
  564   HG21  THR  91          HG21      THR  91  19.299   4.912  -2.089
  565   HG22  THR  91          HG22      THR  91  18.764   4.146  -3.584
  566   HG23  THR  91          HG23      THR  91  18.385   3.406  -2.028
  567    H    THR  92           H        THR  92  16.317   2.026  -4.138
  568    HA   THR  92           HA       THR  92  15.044   0.366  -2.340
  569    HB   THR  92           HB       THR  92  17.493  -0.781  -3.521
  570    HG1  THR  92           HG1      THR  92  16.665  -0.580  -5.650
  571   HG21  THR  92          HG21      THR  92  14.642  -1.470  -3.134
  572   HG22  THR  92          HG22      THR  92  16.086  -2.467  -2.945
  573   HG23  THR  92          HG23      THR  92  15.430  -2.158  -4.553
  574    H    MET  93           H        MET  93  15.793  -1.032  -0.680
  575    HA   MET  93           HA       MET  93  17.525   0.201   1.181
  576    HB2  MET  93           HB1      MET  93  15.654  -1.891   1.196
  577    HB3  MET  93           HB2      MET  93  17.189  -2.624   1.686
  578    HG2  MET  93           HG1      MET  93  17.392  -1.275   3.576
  579    HG3  MET  93           HG2      MET  93  16.231  -0.095   2.959
  580    HE1  MET  93           HE1      MET  93  13.393  -0.804   5.056
  581    HE2  MET  93           HE2      MET  93  14.562   0.302   4.334
  582    HE3  MET  93           HE3      MET  93  13.365  -0.500   3.318
  583    H    GLU  94           H        GLU  94  18.035  -2.110  -1.353
  584    HA   GLU  94           HA       GLU  94  20.438  -3.263  -0.453
  585    HB2  GLU  94           HB1      GLU  94  19.354  -2.815  -3.239
  586    HB3  GLU  94           HB2      GLU  94  20.821  -3.746  -2.898
  587    HG2  GLU  94           HG1      GLU  94  19.523  -5.314  -1.537
  588    HG3  GLU  94           HG2      GLU  94  18.057  -4.390  -1.896
  589    HE2  GLU  94           HE       GLU  94  19.620  -6.488  -4.894
  590    H    ASP  95           H        ASP  95  19.734  -0.245  -2.063
  591    HA   ASP  95           HA       ASP  95  22.567   0.319  -2.473
  592    HB2  ASP  95           HB1      ASP  95  20.027   1.751  -3.259
  593    HB3  ASP  95           HB2      ASP  95  21.624   2.489  -3.451
  594    HD2  ASP  95           HD       ASP  95  21.311  -0.804  -5.609
  595    H    ALA  96           H        ALA  96  19.917   1.187  -0.386
  596    HA   ALA  96           HA       ALA  96  21.066   3.522   0.740
  597    HB1  ALA  96           HB1      ALA  96  19.264   1.930   2.442
  598    HB2  ALA  96           HB2      ALA  96  19.192   3.634   1.989
  599    HB3  ALA  96           HB3      ALA  96  18.619   2.398   0.868
  600    H    THR  97           H        THR  97  21.440   3.557   3.232
  601    HA   THR  97           HA       THR  97  22.775   3.013   4.994
  602    HB   THR  97           HB       THR  97  22.847   0.146   4.104
  603    HG1  THR  97           HG1      THR  97  20.676   1.347   5.503
  604   HG21  THR  97          HG21      THR  97  22.612  -0.183   6.588
  605   HG22  THR  97          HG22      THR  97  22.786   1.563   6.765
  606   HG23  THR  97          HG23      THR  97  24.102   0.610   6.080
  607    H    GLU  98           H        GLU  98  24.536   4.168   4.122
  608    HA   GLU  98           HA       GLU  98  26.758   2.445   3.315
  609    HB2  GLU  98           HB1      GLU  98  27.455   3.988   1.554
  610    HB3  GLU  98           HB2      GLU  98  25.835   3.349   1.232
  611    HG2  GLU  98           HG1      GLU  98  25.222   5.615   2.593
  612    HG3  GLU  98           HG2      GLU  98  26.706   6.098   1.761
  613    HE2  GLU  98           HE       GLU  98  23.799   4.948  -0.691
  614    H    ASN  99           H        ASN  99  28.681   3.003   4.194
  615    HA   ASN  99           HA       ASN  99  28.718   5.436   5.852
  616    HB2  ASN  99           HB1      ASN  99  29.092   2.848   6.657
  617    HB3  ASN  99           HB2      ASN  99  30.757   3.377   6.383
  618   HD21  ASN  99          HD21      ASN  99  31.672   4.891   7.707
  619   HD22  ASN  99          HD22      ASN  99  30.926   5.453   9.160
  620    H    LEU 100           H        LEU 100  30.059   7.009   5.279
  621    HA   LEU 100           HA       LEU 100  31.753   6.807   3.024
  622    HB2  LEU 100           HB1      LEU 100  30.770   8.850   4.747
  623    HB3  LEU 100           HB2      LEU 100  32.532   9.011   4.638
  624    HG   LEU 100           HG       LEU 100  31.132   8.671   2.066
  625   HD11  LEU 100          HD11      LEU 100  30.066  10.705   1.969
  626   HD12  LEU 100          HD12      LEU 100  30.996  11.381   3.305
  627   HD13  LEU 100          HD13      LEU 100  29.715  10.211   3.626
  628   HD21  LEU 100          HD21      LEU 100  33.307   9.168   1.680
  629   HD22  LEU 100          HD22      LEU 100  33.490  10.054   3.194
  630   HD23  LEU 100          HD23      LEU 100  32.705  10.821   1.812
  631    H    TYR 101           H        TYR 101  34.109   7.851   3.380
  632    HA   TYR 101           HA       TYR 101  35.474   5.970   5.173
  633    HB2  TYR 101           HB1      TYR 101  36.587   7.576   2.857
  634    HB3  TYR 101           HB2      TYR 101  37.459   6.356   3.789
  635    HD1  TYR 101           HD1      TYR 101  35.345   6.924   0.967
  636    HD2  TYR 101           HD2      TYR 101  36.574   3.953   3.753
  637    HE1  TYR 101           HE1      TYR 101  34.574   5.171  -0.574
  638    HE2  TYR 101           HE2      TYR 101  35.807   2.189   2.218
  639    HH   TYR 101           HH       TYR 101  35.461   2.049  -0.397
  640    H    PHE 102           H        PHE 102  37.628   6.825   6.032
  641    HA   PHE 102           HA       PHE 102  37.371   9.634   6.866
  642    HB2  PHE 102           HB1      PHE 102  37.954   9.102   9.129
  643    HB3  PHE 102           HB2      PHE 102  36.611   8.056   8.663
  644    HD1  PHE 102           HD1      PHE 102  36.992   5.669   8.164
  645    HD2  PHE 102           HD2      PHE 102  40.077   8.172   9.690
  646    HE1  PHE 102           HE1      PHE 102  38.286   3.677   8.804
  647    HE2  PHE 102           HE2      PHE 102  41.377   6.185  10.331
  648    HZ   PHE 102           HZ       PHE 102  40.482   3.933   9.889
  649    H    GLN 103           H        GLN 103  39.416  10.551   7.703
  650    HA   GLN 103           HA       GLN 103  41.842   9.191   6.831
  651    HB2  GLN 103           HB1      GLN 103  40.636  11.540   5.507
  652    HB3  GLN 103           HB2      GLN 103  42.365  11.674   5.859
  653    HG2  GLN 103           HG1      GLN 103  42.258   9.184   4.782
  654    HG3  GLN 103           HG2      GLN 103  40.965  10.004   3.898
  655   HE21  GLN 103          HE21      GLN 103  41.492  11.242   2.229
  656   HE22  GLN 103          HE22      GLN 103  43.092  11.755   1.825
  657    H    SER 104           H        SER 104  43.624   9.722   8.007
  658    HA   SER 104           HA       SER 104  43.739  12.105   9.613
  659    HB2  SER 104           HB1      SER 104  43.871  10.978  11.789
  660    HB3  SER 104           HB2      SER 104  42.303  10.680  11.020
  661    HG   SER 104           HG       SER 104  43.961   8.877  11.906
  662    H    LEU 105           H        LEU 105  45.758  12.048  11.040
  663    HA   LEU 105           HA       LEU 105  47.899  10.701   9.535
  664    HB2  LEU 105           HB1      LEU 105  47.586  13.360   9.985
  665    HB3  LEU 105           HB2      LEU 105  48.603  12.899  11.359
  666    HG   LEU 105           HG       LEU 105  49.557  11.890   8.777
  667   HD11  LEU 105          HD11      LEU 105  50.480  14.126   8.143
  668   HD12  LEU 105          HD12      LEU 105  49.367  14.849   9.303
  669   HD13  LEU 105          HD13      LEU 105  48.739  13.956   7.918
  670   HD21  LEU 105          HD21      LEU 105  50.893  11.665  10.753
  671   HD22  LEU 105          HD22      LEU 105  50.777  13.393  11.088
  672   HD23  LEU 105          HD23      LEU 105  51.680  12.826   9.682
  673    H    GLU 106           H        GLU 106  49.550   9.638  10.621
  674    HA   GLU 106           HA       GLU 106  48.847   8.734  13.299
  675    HB2  GLU 106           HB1      GLU 106  50.602   7.744  11.102
  676    HB3  GLU 106           HB2      GLU 106  51.016   7.286  12.761
  677    HG2  GLU 106           HG1      GLU 106  48.203   6.919  11.857
  678    HG3  GLU 106           HG2      GLU 106  49.440   5.798  11.271
  679    HE2  GLU 106           HE       GLU 106  49.840   4.371  14.423
  680    H    HIS 107           H        HIS 107  50.834   8.294  14.763
  681    HA   HIS 107           HA       HIS 107  52.530  10.703  14.767
  682    HB2  HIS 107           HB1      HIS 107  52.533  10.552  17.243
  683    HB3  HIS 107           HB2      HIS 107  50.925  10.847  16.573
  684    HD1  HIS 107           HD1      HIS 107  52.952   8.127  18.203
  685    HD2  HIS 107           HD2      HIS 107  49.025   8.911  17.097
  686    HE1  HIS 107           HE1      HIS 107  51.580   6.301  19.256
  687    HE2  HIS 107           HE2      HIS 107  49.179   6.780  18.580
  688    H    HIS 108           H        HIS 108  54.675  10.420  14.910
  689    HA   HIS 108           HA       HIS 108  55.656   7.688  15.421
  690    HB2  HIS 108           HB1      HIS 108  56.120   9.497  13.224
  691    HB3  HIS 108           HB2      HIS 108  57.644   9.135  14.038
  692    HD1  HIS 108           HD1      HIS 108  54.712   7.215  12.562
  693    HD2  HIS 108           HD2      HIS 108  58.786   6.803  13.267
  694    HE1  HIS 108           HE1      HIS 108  55.360   5.028  11.503
  695    HE2  HIS 108           HE2      HIS 108  57.850   4.776  11.932
  696    H    HIS 109           H        HIS 109  57.541   7.429  16.641
  697    HA   HIS 109           HA       HIS 109  58.887   9.715  17.767
  698    HB2  HIS 109           HB1      HIS 109  56.957   8.060  19.356
  699    HB3  HIS 109           HB2      HIS 109  58.393   8.717  20.150
  700    HD1  HIS 109           HD1      HIS 109  58.617  11.369  20.169
  701    HD2  HIS 109           HD2      HIS 109  54.920   9.882  18.993
  702    HE1  HIS 109           HE1      HIS 109  57.029  13.313  20.326
  703    HE2  HIS 109           HE2      HIS 109  54.769  12.404  19.607
  704    H    HIS 110           H        HIS 110  60.633   8.658  16.691
  705    HA   HIS 110           HA       HIS 110  61.587   6.229  18.060
  706    HB2  HIS 110           HB1      HIS 110  61.258   6.764  15.307
  707    HB3  HIS 110           HB2      HIS 110  63.000   6.765  15.607
  708    HD1  HIS 110           HD1      HIS 110  60.022   4.503  16.299
  709    HD2  HIS 110           HD2      HIS 110  64.118   4.299  15.641
  710    HE1  HIS 110           HE1      HIS 110  60.567   2.050  16.205
  711    HE2  HIS 110           HE2      HIS 110  63.069   1.923  15.802
  712    H    HIS 111           H        HIS 111  62.995   6.808  19.587
  713    HA   HIS 111           HA       HIS 111  64.783   9.071  19.142
  714    HB2  HIS 111           HB1      HIS 111  65.341   8.874  21.506
  715    HB3  HIS 111           HB2      HIS 111  63.589   8.924  21.291
  716    HD1  HIS 111           HD1      HIS 111  62.248   6.763  21.799
  717    HD2  HIS 111           HD2      HIS 111  66.324   6.464  22.549
  718    HE1  HIS 111           HE1      HIS 111  62.530   4.663  23.152
  719    HE2  HIS 111           HE2      HIS 111  65.021   4.478  23.611
  720    H    HIS 112           H        HIS 112  64.844   5.588  19.518
  721    HA   HIS 112           HA       HIS 112  67.770   5.603  19.236
  722    HB2  HIS 112           HB1      HIS 112  66.651   4.349  21.149
  723    HB3  HIS 112           HB2      HIS 112  66.043   3.226  19.929
  724    HD1  HIS 112           HD1      HIS 112  69.405   4.553  21.111
  725    HD2  HIS 112           HD2      HIS 112  67.723   1.175  19.371
  726    HE1  HIS 112           HE1      HIS 112  71.266   2.866  20.983
  727    HE2  HIS 112           HE2      HIS 112  70.238   0.802  19.919
  Start of MODEL   19
    1    H1   MET  18           H        MET  18 -27.399 -41.878  29.898
    2    HA   MET  18           HA       MET  18 -25.098 -41.254  30.236
    3    HB2  MET  18           HB1      MET  18 -24.554 -38.783  29.986
    4    HB3  MET  18           HB2      MET  18 -24.847 -39.682  28.490
    5    HG2  MET  18           HG1      MET  18 -27.321 -38.581  29.453
    6    HG3  MET  18           HG2      MET  18 -26.089 -37.321  29.354
    7    HE1  MET  18           HE1      MET  18 -26.942 -36.120  26.103
    8    HE2  MET  18           HE2      MET  18 -26.555 -35.903  27.810
    9    HE3  MET  18           HE3      MET  18 -25.279 -36.304  26.660
   10    H    LEU  19           H        LEU  19 -24.188 -39.981  32.059
   11    HA   LEU  19           HA       LEU  19 -26.289 -39.358  34.029
   12    HB2  LEU  19           HB1      LEU  19 -24.632 -40.005  35.759
   13    HB3  LEU  19           HB2      LEU  19 -25.108 -41.329  34.683
   14    HG   LEU  19           HG       LEU  19 -22.676 -39.908  33.857
   15   HD11  LEU  19          HD11      LEU  19 -21.994 -39.763  36.043
   16   HD12  LEU  19          HD12      LEU  19 -21.422 -41.376  35.621
   17   HD13  LEU  19          HD13      LEU  19 -22.915 -41.183  36.541
   18   HD21  LEU  19          HD21      LEU  19 -23.505 -41.939  32.769
   19   HD22  LEU  19          HD22      LEU  19 -23.340 -42.819  34.289
   20   HD23  LEU  19          HD23      LEU  19 -21.908 -42.186  33.475
   21    H    VAL  20           H        VAL  20 -23.245 -38.372  32.619
   22    HA   VAL  20           HA       VAL  20 -22.710 -36.222  34.393
   23    HB   VAL  20           HB       VAL  20 -21.099 -35.459  32.754
   24   HG11  VAL  20          HG11      VAL  20 -21.055 -38.470  32.762
   25   HG12  VAL  20          HG12      VAL  20 -19.679 -37.368  32.685
   26   HG13  VAL  20          HG13      VAL  20 -20.636 -37.485  34.163
   27   HG21  VAL  20          HG21      VAL  20 -21.028 -37.107  30.638
   28   HG22  VAL  20          HG22      VAL  20 -22.767 -37.071  30.923
   29   HG23  VAL  20          HG23      VAL  20 -21.890 -35.569  30.635
   30    H    LEU  21           H        LEU  21 -23.235 -34.084  34.293
   31    HA   LEU  21           HA       LEU  21 -25.606 -33.370  32.883
   32    HB2  LEU  21           HB1      LEU  21 -23.684 -31.945  34.685
   33    HB3  LEU  21           HB2      LEU  21 -24.881 -31.019  33.764
   34    HG   LEU  21           HG       LEU  21 -26.286 -33.106  35.043
   35   HD11  LEU  21          HD11      LEU  21 -25.750 -32.870  37.345
   36   HD12  LEU  21          HD12      LEU  21 -24.584 -31.591  37.009
   37   HD13  LEU  21          HD13      LEU  21 -24.248 -33.245  36.499
   38   HD21  LEU  21          HD21      LEU  21 -27.378 -31.246  36.198
   39   HD22  LEU  21          HD22      LEU  21 -27.167 -30.905  34.480
   40   HD23  LEU  21          HD23      LEU  21 -26.094 -30.161  35.667
   41    H    ASP  22           H        ASP  22 -25.763 -32.710  30.855
   42    HA   ASP  22           HA       ASP  22 -23.466 -31.319  29.641
   43    HB2  ASP  22           HB1      ASP  22 -24.949 -33.690  28.742
   44    HB3  ASP  22           HB2      ASP  22 -24.784 -32.438  27.503
   45    HD2  ASP  22           HD       ASP  22 -21.251 -33.569  28.858
   46    H    PHE  23           H        PHE  23 -23.926 -29.662  28.167
   47    HA   PHE  23           HA       PHE  23 -26.604 -28.940  27.481
   48    HB2  PHE  23           HB1      PHE  23 -26.852 -26.936  28.746
   49    HB3  PHE  23           HB2      PHE  23 -26.428 -28.211  29.890
   50    HD1  PHE  23           HD1      PHE  23 -25.410 -25.070  28.423
   51    HD2  PHE  23           HD2      PHE  23 -24.143 -28.344  30.831
   52    HE1  PHE  23           HE1      PHE  23 -23.516 -23.730  29.242
   53    HE2  PHE  23           HE2      PHE  23 -22.248 -27.009  31.655
   54    HZ   PHE  23           HZ       PHE  23 -21.933 -24.699  30.861
   55    H    ASN  24           H        ASN  24 -26.702 -27.082  26.086
   56    HA   ASN  24           HA       ASN  24 -24.222 -25.840  25.263
   57    HB2  ASN  24           HB1      ASN  24 -25.067 -28.173  23.951
   58    HB3  ASN  24           HB2      ASN  24 -25.521 -26.844  22.879
   59   HD21  ASN  24          HD21      ASN  24 -23.925 -25.497  22.027
   60   HD22  ASN  24          HD22      ASN  24 -22.262 -25.966  21.995
   61    H    ASN  25           H        ASN  25 -24.522 -23.961  24.036
   62    HA   ASN  25           HA       ASN  25 -27.076 -23.176  23.036
   63    HB2  ASN  25           HB1      ASN  25 -27.643 -21.441  24.571
   64    HB3  ASN  25           HB2      ASN  25 -27.356 -22.898  25.531
   65   HD21  ASN  25          HD21      ASN  25 -26.532 -19.668  25.074
   66   HD22  ASN  25          HD22      ASN  25 -25.204 -19.589  26.177
   67    H    ILE  26           H        ILE  26 -27.042 -20.887  22.254
   68    HA   ILE  26           HA       ILE  26 -24.322 -19.887  21.781
   69    HB   ILE  26           HB       ILE  26 -25.030 -19.351  19.412
   70   HG12  ILE  26          HG11      ILE  26 -27.015 -21.584  19.736
   71   HG13  ILE  26          HG12      ILE  26 -27.498 -19.907  20.044
   72   HG21  ILE  26          HG21      ILE  26 -23.442 -21.008  19.513
   73   HG22  ILE  26          HG22      ILE  26 -24.471 -22.086  20.454
   74   HG23  ILE  26          HG23      ILE  26 -24.770 -21.865  18.731
   75   HD11  ILE  26          HD11      ILE  26 -27.880 -19.653  17.885
   76   HD12  ILE  26          HD12      ILE  26 -26.159 -19.891  17.579
   77   HD13  ILE  26          HD13      ILE  26 -27.258 -21.269  17.551
   78    H    ARG  27           H        ARG  27 -24.610 -17.698  20.433
   79    HA   ARG  27           HA       ARG  27 -26.909 -16.132  20.940
   80    HB2  ARG  27           HB1      ARG  27 -25.617 -16.472  23.244
   81    HB3  ARG  27           HB2      ARG  27 -24.648 -15.136  22.602
   82    HG2  ARG  27           HG1      ARG  27 -26.569 -13.710  22.450
   83    HG3  ARG  27           HG2      ARG  27 -27.643 -15.052  22.877
   84    HD2  ARG  27           HD1      ARG  27 -27.476 -14.289  24.983
   85    HD3  ARG  27           HD2      ARG  27 -25.880 -15.053  24.966
   86    HE   ARG  27           HE       ARG  27 -25.672 -12.454  23.910
   87   HH11  ARG  27          HH11      ARG  27 -26.231 -14.105  26.924
   88   HH12  ARG  27          HH12      ARG  27 -25.562 -12.835  27.894
   89   HH21  ARG  27          HH21      ARG  27 -24.789 -10.775  25.177
   90   HH22  ARG  27          HH22      ARG  27 -24.743 -10.941  26.899
   91    H    SER  28           H        SER  28 -26.913 -14.504  19.525
   92    HA   SER  28           HA       SER  28 -24.622 -12.961  18.864
   93    HB2  SER  28           HB1      SER  28 -24.053 -15.022  17.614
   94    HB3  SER  28           HB2      SER  28 -25.586 -14.886  16.733
   95    HG   SER  28           HG       SER  28 -24.717 -13.443  15.484
   96    H    SER  29           H        SER  29 -25.152 -11.112  17.738
   97    HA   SER  29           HA       SER  29 -27.719 -10.844  16.444
   98    HB2  SER  29           HB1      SER  29 -28.111  -8.726  18.005
   99    HB3  SER  29           HB2      SER  29 -28.686 -10.336  18.471
  100    HG   SER  29           HG       SER  29 -26.137  -9.374  19.231
  101    H    ALA  30           H        ALA  30 -28.024  -8.565  15.622
  102    HA   ALA  30           HA       ALA  30 -25.688  -7.759  14.231
  103    HB1  ALA  30           HB1      ALA  30 -28.393  -7.388  13.898
  104    HB2  ALA  30           HB2      ALA  30 -27.814  -5.771  14.300
  105    HB3  ALA  30           HB3      ALA  30 -27.119  -6.640  12.933
  106    H    ASP  31           H        ASP  31 -25.030  -5.376  14.188
  107    HA   ASP  31           HA       ASP  31 -24.818  -4.371  16.952
  108    HB2  ASP  31           HB1      ASP  31 -22.749  -4.778  14.844
  109    HB3  ASP  31           HB2      ASP  31 -22.597  -3.345  15.869
  110    HD2  ASP  31           HD       ASP  31 -22.569  -6.685  17.990
  111    H    LEU  32           H        LEU  32 -23.886  -3.061  13.780
  112    HA   LEU  32           HA       LEU  32 -25.984  -1.150  13.679
  113    HB2  LEU  32           HB1      LEU  32 -24.773  -0.117  15.500
  114    HB3  LEU  32           HB2      LEU  32 -23.267  -0.195  14.569
  115    HG   LEU  32           HG       LEU  32 -25.470   1.331  13.328
  116   HD11  LEU  32          HD11      LEU  32 -23.930   2.619  15.552
  117   HD12  LEU  32          HD12      LEU  32 -25.481   1.833  15.849
  118   HD13  LEU  32          HD13      LEU  32 -25.380   3.189  14.725
  119   HD21  LEU  32          HD21      LEU  32 -22.546   1.929  13.758
  120   HD22  LEU  32          HD22      LEU  32 -23.653   2.782  12.681
  121   HD23  LEU  32          HD23      LEU  32 -23.213   1.106  12.349
  122    H    HIS  33           H        HIS  33 -25.998   0.023  11.748
  123    HA   HIS  33           HA       HIS  33 -23.829  -0.607   9.858
  124    HB2  HIS  33           HB1      HIS  33 -26.806  -0.840   9.503
  125    HB3  HIS  33           HB2      HIS  33 -25.762  -0.545   8.108
  126    HD1  HIS  33           HD1      HIS  33 -25.309  -2.647   6.912
  127    HD2  HIS  33           HD2      HIS  33 -25.494  -3.234  11.020
  128    HE1  HIS  33           HE1      HIS  33 -24.854  -5.096   7.261
  129    HE2  HIS  33           HE2      HIS  33 -24.966  -5.456   9.773
  130    H    GLY  34           H        GLY  34 -22.962   1.110   8.886
  131    HA2  GLY  34           HA2      GLY  34 -24.362   3.342   7.934
  132    HA3  GLY  34           HA3      GLY  34 -23.738   3.739   9.528
  133    HA1  GLY  34           HA1      GLY  34 -23.818   2.696   7.677
  134    H    ALA  35           H        ALA  35 -22.576   5.400   8.253
  135    HA   ALA  35           HA       ALA  35 -20.007   4.311   7.326
  136    HB1  ALA  35           HB1      ALA  35 -19.979   6.197   5.631
  137    HB2  ALA  35           HB2      ALA  35 -21.071   4.853   5.298
  138    HB3  ALA  35           HB3      ALA  35 -21.706   6.367   5.942
  139    H    ARG  36           H        ARG  36 -21.675   7.354   8.157
  140    HA   ARG  36           HA       ARG  36 -21.031   9.157   9.385
  141    HB2  ARG  36           HB1      ARG  36 -20.082   6.829  10.773
  142    HB3  ARG  36           HB2      ARG  36 -18.922   8.150  10.981
  143    HG2  ARG  36           HG1      ARG  36 -20.709   9.610  11.802
  144    HG3  ARG  36           HG2      ARG  36 -21.866   8.282  11.601
  145    HD2  ARG  36           HD1      ARG  36 -21.270   8.296  13.898
  146    HD3  ARG  36           HD2      ARG  36 -20.419   6.931  13.161
  147    HE   ARG  36           HE       ARG  36 -18.756   9.203  13.116
  148   HH11  ARG  36          HH11      ARG  36 -20.108   6.883  15.331
  149   HH12  ARG  36          HH12      ARG  36 -18.806   7.013  16.466
  150   HH21  ARG  36          HH21      ARG  36 -17.036   9.382  14.603
  151   HH22  ARG  36          HH22      ARG  36 -17.059   8.435  16.051
  152    H    LYS  37           H        LYS  37 -18.926  10.388  10.161
  153    HA   LYS  37           HA       LYS  37 -17.063  11.537   9.540
  154    HB2  LYS  37           HB1      LYS  37 -16.515   8.751   8.825
  155    HB3  LYS  37           HB2      LYS  37 -15.595   9.915   7.859
  156    HG2  LYS  37           HG1      LYS  37 -14.123   9.792   9.548
  157    HG3  LYS  37           HG2      LYS  37 -15.227  10.937  10.331
  158    HD2  LYS  37           HD1      LYS  37 -15.210   9.420  12.005
  159    HD3  LYS  37           HD2      LYS  37 -16.414   8.603  10.990
  160    HE2  LYS  37           HE1      LYS  37 -13.488   8.059  10.591
  161    HE3  LYS  37           HE2      LYS  37 -14.380   7.263  11.897
  162    HZ1  LYS  37           HZ1      LYS  37 -15.923   6.375  10.274
  163    HZ2  LYS  37           HZ2      LYS  37 -14.341   5.920   9.884
  164    HZ3  LYS  37           HZ3      LYS  37 -15.104   7.157   9.018
  165    H    GLY  38           H        GLY  38 -15.689  12.092   7.429
  166    HA2  GLY  38           HA2      GLY  38 -17.253  11.982   4.993
  167    HA3  GLY  38           HA3      GLY  38 -17.158  13.575   5.729
  168    HA1  GLY  38           HA1      GLY  38 -16.525  11.592   5.302
  169    H    SER  39           H        SER  39 -15.289  10.972   4.280
  170    HA   SER  39           HA       SER  39 -13.395  12.918   3.260
  171    HB2  SER  39           HB1      SER  39 -12.353  10.540   4.820
  172    HB3  SER  39           HB2      SER  39 -11.429  11.903   4.165
  173    HG   SER  39           HG       SER  39 -13.310  11.975   6.287
  174    H    GLN  40           H        GLN  40 -11.773  11.821   1.785
  175    HA   GLN  40           HA       GLN  40 -13.219  10.089   0.005
  176    HB2  GLN  40           HB1      GLN  40 -11.306  12.002  -0.353
  177    HB3  GLN  40           HB2      GLN  40 -10.353  10.518  -0.510
  178    HG2  GLN  40           HG1      GLN  40 -11.093  11.224  -2.687
  179    HG3  GLN  40           HG2      GLN  40 -11.909   9.721  -2.238
  180   HE21  GLN  40          HE21      GLN  40 -13.630  10.043  -3.609
  181   HE22  GLN  40          HE22      GLN  40 -14.833  11.251  -3.335
  182    H    CYS  41           H        CYS  41 -10.085   9.811   1.688
  183    HA   CYS  41           HA       CYS  41 -10.531   6.912   1.858
  184    HB2  CYS  41           HB1      CYS  41  -8.233   6.443   1.283
  185    HB3  CYS  41           HB2      CYS  41  -8.961   7.405  -0.005
  186    H    LEU  42           H        LEU  42  -9.879   5.949   3.735
  187    HA   LEU  42           HA       LEU  42  -9.446   7.656   5.989
  188    HB2  LEU  42           HB1      LEU  42 -10.368   5.035   5.540
  189    HB3  LEU  42           HB2      LEU  42  -8.919   4.887   6.550
  190    HG   LEU  42           HG       LEU  42 -11.105   6.785   7.319
  191   HD11  LEU  42          HD11      LEU  42 -11.698   4.668   8.836
  192   HD12  LEU  42          HD12      LEU  42 -11.174   3.831   7.375
  193   HD13  LEU  42          HD13      LEU  42 -12.492   4.999   7.296
  194   HD21  LEU  42          HD21      LEU  42  -8.964   6.903   8.491
  195   HD22  LEU  42          HD22      LEU  42  -9.084   5.190   8.894
  196   HD23  LEU  42          HD23      LEU  42 -10.248   6.337   9.559
  197    H    SER  43           H        SER  43  -7.437   5.672   3.943
  198    HA   SER  43           HA       SER  43  -5.059   6.885   4.996
  199    HB2  SER  43           HB1      SER  43  -3.957   4.926   5.826
  200    HB3  SER  43           HB2      SER  43  -5.541   5.006   6.615
  201    HG   SER  43           HG       SER  43  -5.309   2.930   5.908
  202    H    ASP  44           H        ASP  44  -3.064   5.806   3.916
  203    HA   ASP  44           HA       ASP  44  -3.447   5.950   1.117
  204    HB2  ASP  44           HB1      ASP  44  -1.039   5.216   1.008
  205    HB3  ASP  44           HB2      ASP  44  -1.341   6.643   2.008
  206    HD2  ASP  44           HD       ASP  44  -0.012   3.365   3.751
  207    H    THR  45           H        THR  45  -3.400   3.319   3.381
  208    HA   THR  45           HA       THR  45  -3.120   1.292   1.330
  209    HB   THR  45           HB       THR  45  -3.296  -0.331   3.117
  210    HG1  THR  45           HG1      THR  45  -3.712   0.394   5.265
  211   HG21  THR  45          HG21      THR  45  -1.175   1.076   2.778
  212   HG22  THR  45          HG22      THR  45  -1.326   0.175   4.286
  213   HG23  THR  45          HG23      THR  45  -1.650   1.908   4.258
  214    H    ASP  46           H        ASP  46  -5.562   3.261   2.082
  215    HA   ASP  46           HA       ASP  46  -7.767   1.503   2.407
  216    HB2  ASP  46           HB1      ASP  46  -7.834   3.900   3.021
  217    HB3  ASP  46           HB2      ASP  46  -7.730   4.322   1.308
  218    HD2  ASP  46           HD       ASP  46 -11.221   3.448   2.780
  219    H    CYS  47           H        CYS  47  -5.964   2.611  -0.338
  220    HA   CYS  47           HA       CYS  47  -7.915   2.050  -2.328
  221    HB2  CYS  47           HB1      CYS  47  -5.266   3.090  -2.226
  222    HB3  CYS  47           HB2      CYS  47  -5.272   1.754  -3.378
  223    H    ASN  48           H        ASN  48  -7.651   0.357  -4.003
  224    HA   ASN  48           HA       ASN  48  -7.531  -2.216  -2.787
  225    HB2  ASN  48           HB1      ASN  48  -8.902  -1.314  -4.868
  226    HB3  ASN  48           HB2      ASN  48  -7.490  -1.899  -5.758
  227   HD21  ASN  48          HD21      ASN  48  -6.768  -4.161  -5.020
  228   HD22  ASN  48          HD22      ASN  48  -8.032  -5.329  -4.873
  229    H    THR  49           H        THR  49  -5.613  -0.771  -5.426
  230    HA   THR  49           HA       THR  49  -3.608  -2.836  -5.201
  231    HB   THR  49           HB       THR  49  -2.906  -0.464  -6.783
  232    HG1  THR  49           HG1      THR  49  -4.595  -0.488  -8.116
  233   HG21  THR  49          HG21      THR  49  -3.275  -3.001  -8.160
  234   HG22  THR  49          HG22      THR  49  -2.260  -3.151  -6.726
  235   HG23  THR  49          HG23      THR  49  -1.829  -2.006  -7.996
  236    H    ARG  50           H        ARG  50  -1.222  -1.869  -5.380
  237    HA   ARG  50           HA       ARG  50  -0.723  -0.676  -2.819
  238    HB2  ARG  50           HB1      ARG  50   1.047  -1.588  -5.084
  239    HB3  ARG  50           HB2      ARG  50   1.700  -0.772  -3.655
  240    HG2  ARG  50           HG1      ARG  50   1.503  -2.588  -2.357
  241    HG3  ARG  50           HG2      ARG  50  -0.073  -3.018  -3.043
  242    HD2  ARG  50           HD1      ARG  50   1.165  -3.789  -5.117
  243    HD3  ARG  50           HD2      ARG  50   2.653  -3.598  -4.178
  244    HE   ARG  50           HE       ARG  50   0.797  -5.208  -2.770
  245   HH11  ARG  50          HH11      ARG  50   3.001  -5.269  -5.464
  246   HH12  ARG  50          HH12      ARG  50   3.281  -6.976  -5.365
  247   HH21  ARG  50          HH21      ARG  50   1.156  -7.457  -2.630
  248   HH22  ARG  50          HH22      ARG  50   2.230  -8.220  -3.753
  249    H    LYS  51           H        LYS  51  -1.945   1.322  -3.340
  250    HA   LYS  51           HA       LYS  51  -0.156   3.298  -4.587
  251    HB2  LYS  51           HB1      LYS  51  -3.174   3.391  -4.754
  252    HB3  LYS  51           HB2      LYS  51  -2.015   4.442  -5.583
  253    HG2  LYS  51           HG1      LYS  51  -1.168   2.284  -6.709
  254    HG3  LYS  51           HG2      LYS  51  -2.700   1.586  -6.154
  255    HD2  LYS  51           HD1      LYS  51  -2.748   4.201  -7.605
  256    HD3  LYS  51           HD2      LYS  51  -2.508   2.706  -8.526
  257    HE2  LYS  51           HE1      LYS  51  -4.572   1.792  -7.377
  258    HE3  LYS  51           HE2      LYS  51  -4.842   3.431  -6.766
  259    HZ1  LYS  51           HZ1      LYS  51  -6.106   3.305  -8.701
  260    HZ2  LYS  51           HZ2      LYS  51  -4.902   2.491  -9.567
  261    HZ3  LYS  51           HZ3      LYS  51  -4.713   4.130  -9.194
  262    H    PHE  52           H        PHE  52  -0.501   5.513  -3.823
  263    HA   PHE  52           HA       PHE  52  -1.333   5.522  -1.003
  264    HB2  PHE  52           HB1      PHE  52   0.095   7.609  -0.866
  265    HB3  PHE  52           HB2      PHE  52   0.967   6.106  -1.171
  266    HD1  PHE  52           HD1      PHE  52  -0.589   8.928  -3.043
  267    HD2  PHE  52           HD2      PHE  52   2.522   6.027  -2.864
  268    HE1  PHE  52           HE1      PHE  52   0.436   9.909  -5.053
  269    HE2  PHE  52           HE2      PHE  52   3.553   7.005  -4.872
  270    HZ   PHE  52           HZ       PHE  52   2.511   8.948  -5.970
  271    H    CYS  53           H        CYS  53  -2.105   7.721  -0.223
  272    HA   CYS  53           HA       CYS  53  -4.211   8.612  -2.034
  273    HB2  CYS  53           HB1      CYS  53  -3.730   8.819   0.921
  274    HB3  CYS  53           HB2      CYS  53  -4.863   9.925   0.140
  275    H    LEU  54           H        LEU  54  -3.493  10.118  -3.426
  276    HA   LEU  54           HA       LEU  54  -1.741  12.251  -2.460
  277    HB2  LEU  54           HB1      LEU  54  -1.120  11.077  -4.524
  278    HB3  LEU  54           HB2      LEU  54  -2.654  11.581  -5.254
  279    HG   LEU  54           HG       LEU  54  -1.576  13.984  -4.547
  280   HD11  LEU  54          HD11      LEU  54   0.679  14.048  -4.670
  281   HD12  LEU  54          HD12      LEU  54   0.770  12.690  -5.793
  282   HD13  LEU  54          HD13      LEU  54   0.525  12.396  -4.071
  283   HD21  LEU  54          HD21      LEU  54  -0.655  13.663  -7.092
  284   HD22  LEU  54          HD22      LEU  54  -2.317  14.070  -6.661
  285   HD23  LEU  54          HD23      LEU  54  -1.876  12.393  -6.989
  286    H    GLN  55           H        GLN  55  -2.374  14.321  -2.231
  287    HA   GLN  55           HA       GLN  55  -5.033  15.084  -3.221
  288    HB2  GLN  55           HB1      GLN  55  -3.962  15.851  -0.500
  289    HB3  GLN  55           HB2      GLN  55  -5.577  16.176  -1.150
  290    HG2  GLN  55           HG1      GLN  55  -5.734  13.575  -1.319
  291    HG3  GLN  55           HG2      GLN  55  -4.433  13.625  -0.121
  292   HE21  GLN  55          HE21      GLN  55  -7.236  12.720   0.071
  293   HE22  GLN  55          HE22      GLN  55  -7.914  13.601   1.393
  294    HA   PRO  56           HA       PRO  56  -1.982  18.200  -4.623
  295    HB2  PRO  56           HB1      PRO  56  -3.295  18.741  -6.966
  296    HB3  PRO  56           HB2      PRO  56  -2.175  17.393  -6.765
  297    HG2  PRO  56           HG1      PRO  56  -5.170  17.419  -6.605
  298    HG3  PRO  56           HG2      PRO  56  -4.084  16.255  -7.451
  299    HD2  PRO  56           HD1      PRO  56  -5.231  15.710  -5.052
  300    HD3  PRO  56           HD2      PRO  56  -3.622  15.116  -5.500
  301    H    ARG  57           H        ARG  57  -2.161  20.462  -4.806
  302    HA   ARG  57           HA       ARG  57  -4.439  21.576  -3.427
  303    HB2  ARG  57           HB1      ARG  57  -1.960  22.892  -4.560
  304    HB3  ARG  57           HB2      ARG  57  -3.170  23.697  -3.550
  305    HG2  ARG  57           HG1      ARG  57  -2.434  22.745  -1.633
  306    HG3  ARG  57           HG2      ARG  57  -1.968  21.239  -2.443
  307    HD2  ARG  57           HD1      ARG  57   0.087  22.089  -3.147
  308    HD3  ARG  57           HD2      ARG  57  -0.449  23.765  -2.962
  309    HE   ARG  57           HE       ARG  57  -0.467  22.518  -0.445
  310   HH11  ARG  57          HH11      ARG  57   1.763  23.638  -2.873
  311   HH12  ARG  57          HH12      ARG  57   3.037  23.955  -1.742
  312   HH21  ARG  57          HH21      ARG  57   1.203  22.931   1.053
  313   HH22  ARG  57          HH22      ARG  57   2.718  23.551   0.490
  314    H    ASP  58           H        ASP  58  -3.122  21.571  -6.679
  315    HA   ASP  58           HA       ASP  58  -5.037  23.521  -7.633
  316    HB2  ASP  58           HB1      ASP  58  -2.634  23.187  -8.496
  317    HB3  ASP  58           HB2      ASP  58  -3.282  21.789  -9.363
  318    HD2  ASP  58           HD       ASP  58  -4.825  25.266 -10.507
  319    H    GLU  59           H        GLU  59  -4.802  20.096  -7.330
  320    HA   GLU  59           HA       GLU  59  -7.252  19.790  -8.939
  321    HB2  GLU  59           HB1      GLU  59  -4.756  18.395  -9.072
  322    HB3  GLU  59           HB2      GLU  59  -6.017  17.263  -8.559
  323    HG2  GLU  59           HG1      GLU  59  -6.023  17.076 -10.873
  324    HG3  GLU  59           HG2      GLU  59  -7.373  18.164 -10.528
  325    HE2  GLU  59           HE       GLU  59  -4.151  20.007 -11.942
  326    H    LYS  60           H        LYS  60  -8.317  17.543  -8.230
  327    HA   LYS  60           HA       LYS  60  -8.985  17.914  -5.423
  328    HB2  LYS  60           HB1      LYS  60 -10.242  16.580  -7.769
  329    HB3  LYS  60           HB2      LYS  60 -10.619  15.929  -6.165
  330    HG2  LYS  60           HG1      LYS  60 -11.319  18.211  -5.454
  331    HG3  LYS  60           HG2      LYS  60 -11.084  18.742  -7.129
  332    HD2  LYS  60           HD1      LYS  60 -12.869  16.413  -6.448
  333    HD3  LYS  60           HD2      LYS  60 -13.454  18.085  -6.410
  334    HE2  LYS  60           HE1      LYS  60 -13.366  18.329  -8.680
  335    HE3  LYS  60           HE2      LYS  60 -11.987  17.232  -8.839
  336    HZ1  LYS  60           HZ1      LYS  60 -14.620  16.650  -9.367
  337    HZ2  LYS  60           HZ2      LYS  60 -14.291  15.844  -7.917
  338    HZ3  LYS  60           HZ3      LYS  60 -13.338  15.548  -9.284
  339    HA   PRO  61           HA       PRO  61  -6.843  14.440  -3.813
  340    HB2  PRO  61           HB1      PRO  61  -8.636  13.420  -2.011
  341    HB3  PRO  61           HB2      PRO  61  -7.767  14.934  -1.768
  342    HG2  PRO  61           HG1      PRO  61 -10.543  14.478  -2.811
  343    HG3  PRO  61           HG2      PRO  61  -9.964  15.676  -1.593
  344    HD2  PRO  61           HD1      PRO  61 -10.475  16.341  -4.176
  345    HD3  PRO  61           HD2      PRO  61  -9.190  17.108  -3.226
  346    H    PHE  62           H        PHE  62  -6.449  12.381  -4.389
  347    HA   PHE  62           HA       PHE  62  -8.486  10.452  -4.865
  348    HB2  PHE  62           HB1      PHE  62  -8.312  10.151  -7.218
  349    HB3  PHE  62           HB2      PHE  62  -8.599  11.872  -6.951
  350    HD1  PHE  62           HD1      PHE  62  -6.356  13.296  -6.651
  351    HD2  PHE  62           HD2      PHE  62  -6.687   9.610  -8.756
  352    HE1  PHE  62           HE1      PHE  62  -4.344  13.861  -7.951
  353    HE2  PHE  62           HE2      PHE  62  -4.675  10.169 -10.057
  354    HZ   PHE  62           HZ       PHE  62  -3.500  12.295  -9.656
  355    H    CYS  63           H        CYS  63  -7.427   8.462  -6.051
  356    HA   CYS  63           HA       CYS  63  -4.974   7.915  -4.586
  357    HB2  CYS  63           HB1      CYS  63  -7.227   6.407  -5.244
  358    HB3  CYS  63           HB2      CYS  63  -5.946   5.748  -6.264
  359    H    ALA  64           H        ALA  64  -3.055   8.211  -5.486
  360    HA   ALA  64           HA       ALA  64  -2.835   8.136  -8.419
  361    HB1  ALA  64           HB1      ALA  64  -1.154   9.507  -6.331
  362    HB2  ALA  64           HB2      ALA  64  -0.687   9.383  -8.029
  363    HB3  ALA  64           HB3      ALA  64  -2.155  10.250  -7.580
  364    H    THR  65           H        THR  65  -1.272   6.904  -9.426
  365    HA   THR  65           HA       THR  65  -0.621   4.436  -8.368
  366    HB   THR  65           HB       THR  65   1.419   4.852 -10.174
  367    HG1  THR  65           HG1      THR  65   0.130   6.002 -11.885
  368   HG21  THR  65          HG21      THR  65  -0.796   4.156 -11.720
  369   HG22  THR  65          HG22      THR  65  -1.176   3.577 -10.097
  370   HG23  THR  65          HG23      THR  65   0.308   3.056 -10.897
  371    H    CYS  66           H        CYS  66   1.230   3.529  -7.472
  372    HA   CYS  66           HA       CYS  66   2.629   5.076  -5.607
  373    HB2  CYS  66           HB1      CYS  66   2.331   2.375  -6.143
  374    HB3  CYS  66           HB2      CYS  66   4.048   2.660  -6.440
  375    H    ARG  67           H        ARG  67   5.140   5.000  -5.530
  376    HA   ARG  67           HA       ARG  67   6.092   6.162  -8.054
  377    HB2  ARG  67           HB1      ARG  67   6.882   6.542  -5.176
  378    HB3  ARG  67           HB2      ARG  67   7.970   7.015  -6.490
  379    HG2  ARG  67           HG1      ARG  67   6.121   8.439  -7.408
  380    HG3  ARG  67           HG2      ARG  67   5.220   8.089  -5.922
  381    HD2  ARG  67           HD1      ARG  67   6.697   9.276  -4.576
  382    HD3  ARG  67           HD2      ARG  67   8.009   9.150  -5.755
  383    HE   ARG  67           HE       ARG  67   7.251  11.063  -6.749
  384   HH11  ARG  67          HH11      ARG  67   4.732   9.765  -4.727
  385   HH12  ARG  67          HH12      ARG  67   3.688  11.134  -4.925
  386   HH21  ARG  67          HH21      ARG  67   5.886  12.870  -7.018
  387   HH22  ARG  67          HH22      ARG  67   4.345  12.899  -6.229
  388    H    GLY  68           H        GLY  68   7.924   5.434  -9.062
  389    HA2  GLY  68           HA2      GLY  68   8.794   2.763  -8.319
  390    HA3  GLY  68           HA3      GLY  68   9.212   3.626  -9.792
  391    HA1  GLY  68           HA1      GLY  68   8.867   3.395  -7.707
  392    H    LEU  69           H        LEU  69  11.329   2.560  -9.111
  393    HA   LEU  69           HA       LEU  69  12.774   3.651  -6.919
  394    HB2  LEU  69           HB1      LEU  69  13.417   1.949  -9.285
  395    HB3  LEU  69           HB2      LEU  69  14.750   2.725  -8.409
  396    HG   LEU  69           HG       LEU  69  12.734   0.829  -7.205
  397   HD11  LEU  69          HD11      LEU  69  14.016  -0.807  -7.969
  398   HD12  LEU  69          HD12      LEU  69  15.370  -0.151  -7.049
  399   HD13  LEU  69          HD13      LEU  69  15.110   0.358  -8.717
  400   HD21  LEU  69          HD21      LEU  69  15.102   2.294  -6.067
  401   HD22  LEU  69          HD22      LEU  69  14.416   0.855  -5.312
  402   HD23  LEU  69          HD23      LEU  69  13.431   2.307  -5.501
  403    H    ARG  70           H        ARG  70  12.287   4.612 -10.222
  404    HA   ARG  70           HA       ARG  70  14.423   6.597 -10.084
  405    HB2  ARG  70           HB1      ARG  70  12.617   5.601 -12.277
  406    HB3  ARG  70           HB2      ARG  70  13.543   7.097 -12.467
  407    HG2  ARG  70           HG1      ARG  70  15.415   5.258 -11.553
  408    HG3  ARG  70           HG2      ARG  70  14.411   4.353 -12.700
  409    HD2  ARG  70           HD1      ARG  70  14.727   6.249 -14.334
  410    HD3  ARG  70           HD2      ARG  70  15.916   6.914 -13.202
  411    HE   ARG  70           HE       ARG  70  16.782   4.376 -13.594
  412   HH11  ARG  70          HH11      ARG  70  15.936   6.987 -15.737
  413   HH12  ARG  70          HH12      ARG  70  17.047   6.503 -16.975
  414   HH21  ARG  70          HH21      ARG  70  18.248   3.730 -15.216
  415   HH22  ARG  70          HH22      ARG  70  18.361   4.650 -16.679
  416    H    ARG  71           H        ARG  71  11.616   6.541  -8.701
  417    HA   ARG  71           HA       ARG  71  10.653   9.153  -9.620
  418    HB2  ARG  71           HB1      ARG  71   9.426   6.805  -8.330
  419    HB3  ARG  71           HB2      ARG  71   8.882   8.365  -7.698
  420    HG2  ARG  71           HG1      ARG  71   8.861   7.646 -10.628
  421    HG3  ARG  71           HG2      ARG  71   7.479   7.442  -9.538
  422    HD2  ARG  71           HD1      ARG  71   7.031   9.665  -9.451
  423    HD3  ARG  71           HD2      ARG  71   8.743  10.104  -9.511
  424    HE   ARG  71           HE       ARG  71   8.589  10.286 -11.789
  425   HH11  ARG  71          HH11      ARG  71   5.815   8.560 -10.586
  426   HH12  ARG  71          HH12      ARG  71   4.989   8.564 -12.109
  427   HH21  ARG  71          HH21      ARG  71   7.512  10.298 -13.799
  428   HH22  ARG  71          HH22      ARG  71   5.956   9.553 -13.937
  429    H    ARG  72           H        ARG  72  10.646  10.941  -8.338
  430    HA   ARG  72           HA       ARG  72  12.396  10.905  -6.045
  431    HB2  ARG  72           HB1      ARG  72  11.964  13.364  -6.005
  432    HB3  ARG  72           HB2      ARG  72  12.595  12.766  -7.547
  433    HG2  ARG  72           HG1      ARG  72   9.781  12.648  -7.730
  434    HG3  ARG  72           HG2      ARG  72  10.198  14.223  -7.034
  435    HD2  ARG  72           HD1      ARG  72  12.044  14.108  -8.991
  436    HD3  ARG  72           HD2      ARG  72  10.767  13.124  -9.719
  437    HE   ARG  72           HE       ARG  72   9.719  15.550  -8.676
  438   HH11  ARG  72          HH11      ARG  72  11.512  14.223 -11.348
  439   HH12  ARG  72          HH12      ARG  72  11.017  15.454 -12.462
  440   HH21  ARG  72          HH21      ARG  72   9.060  17.178 -10.133
  441   HH22  ARG  72          HH22      ARG  72   9.623  17.135 -11.769
  442    H    CYS  73           H        CYS  73  11.857  11.152  -3.931
  443    HA   CYS  73           HA       CYS  73   9.021  11.526  -3.262
  444    HB2  CYS  73           HB1      CYS  73   9.261   9.798  -1.477
  445    HB3  CYS  73           HB2      CYS  73   9.367   9.151  -3.115
  446    H    GLN  74           H        GLN  74   8.689  12.113  -0.965
  447    HA   GLN  74           HA       GLN  74  10.975  13.662   0.062
  448    HB2  GLN  74           HB1      GLN  74   9.023  14.985  -0.844
  449    HB3  GLN  74           HB2      GLN  74   8.060  14.319   0.485
  450    HG2  GLN  74           HG1      GLN  74  10.579  15.517   1.363
  451    HG3  GLN  74           HG2      GLN  74   9.484  16.650   0.558
  452   HE21  GLN  74          HE21      GLN  74   7.052  16.008   1.294
  453   HE22  GLN  74          HE22      GLN  74   6.855  16.052   3.010
  454    H    ARG  75           H        ARG  75   8.296  11.548   0.836
  455    HA   ARG  75           HA       ARG  75   9.300  11.352   3.600
  456    HB2  ARG  75           HB1      ARG  75   6.735  11.960   2.736
  457    HB3  ARG  75           HB2      ARG  75   6.643  10.240   3.145
  458    HG2  ARG  75           HG1      ARG  75   7.805  10.928   5.355
  459    HG3  ARG  75           HG2      ARG  75   7.271  12.561   4.919
  460    HD2  ARG  75           HD1      ARG  75   4.946  11.753   4.750
  461    HD3  ARG  75           HD2      ARG  75   5.499  10.140   5.227
  462    HE   ARG  75           HE       ARG  75   4.999  12.349   6.953
  463   HH11  ARG  75          HH11      ARG  75   7.006   9.536   6.530
  464   HH12  ARG  75          HH12      ARG  75   7.310   9.337   8.223
  465   HH21  ARG  75          HH21      ARG  75   5.392  12.098   9.185
  466   HH22  ARG  75          HH22      ARG  75   6.391  10.794   9.734
  467    H    ASP  76           H        ASP  76   8.826   9.159   4.603
  468    HA   ASP  76           HA       ASP  76  10.005   7.145   2.921
  469    HB2  ASP  76           HB1      ASP  76  10.767   7.160   5.164
  470    HB3  ASP  76           HB2      ASP  76   9.117   7.190   5.801
  471    HD2  ASP  76           HD       ASP  76  10.530   3.699   4.536
  472    H    ALA  77           H        ALA  77   6.922   7.464   4.672
  473    HA   ALA  77           HA       ALA  77   5.788   5.069   3.713
  474    HB1  ALA  77           HB1      ALA  77   3.882   5.685   4.821
  475    HB2  ALA  77           HB2      ALA  77   5.068   6.696   5.649
  476    HB3  ALA  77           HB3      ALA  77   4.047   7.386   4.388
  477    H    MET  78           H        MET  78   6.107   8.228   2.317
  478    HA   MET  78           HA       MET  78   4.041   8.218   0.454
  479    HB2  MET  78           HB1      MET  78   6.666   9.563   0.716
  480    HB3  MET  78           HB2      MET  78   5.979   9.513  -0.915
  481    HG2  MET  78           HG1      MET  78   3.819  10.397   0.216
  482    HG3  MET  78           HG2      MET  78   4.906  10.837   1.538
  483    HE1  MET  78           HE1      MET  78   4.788  12.603  -2.680
  484    HE2  MET  78           HE2      MET  78   5.676  11.091  -2.502
  485    HE3  MET  78           HE3      MET  78   3.962  11.161  -2.089
  486    H    CYS  79           H        CYS  79   7.044   6.471   0.501
  487    HA   CYS  79           HA       CYS  79   6.708   5.613  -2.273
  488    HB2  CYS  79           HB1      CYS  79   8.937   5.823  -0.400
  489    HB3  CYS  79           HB2      CYS  79   8.906   4.270  -1.238
  490    H    CYS  80           H        CYS  80   6.455   3.456  -2.873
  491    HA   CYS  80           HA       CYS  80   4.724   1.895  -1.394
  492    HB2  CYS  80           HB1      CYS  80   6.406   1.520  -3.780
  493    HB3  CYS  80           HB2      CYS  80   6.022   0.025  -2.925
  494    HA   PRO  81           HA       PRO  81   7.023  -0.285   1.639
  495    HB2  PRO  81           HB1      PRO  81   5.900  -2.782   1.554
  496    HB3  PRO  81           HB2      PRO  81   5.075  -1.365   2.204
  497    HG2  PRO  81           HG1      PRO  81   4.864  -2.607  -0.518
  498    HG3  PRO  81           HG2      PRO  81   3.553  -2.025   0.575
  499    HD2  PRO  81           HD1      PRO  81   4.436  -0.583  -1.549
  500    HD3  PRO  81           HD2      PRO  81   3.873   0.171  -0.048
  501    H    GLY  82           H        GLY  82   8.867  -1.474   1.876
  502    HA2  GLY  82           HA2      GLY  82  10.273  -3.342   1.273
  503    HA3  GLY  82           HA3      GLY  82   9.687  -3.188  -0.377
  504    HA1  GLY  82           HA1      GLY  82  10.307  -2.501   1.537
  505    H    THR  83           H        THR  83   9.980  -0.180  -0.084
  506    HA   THR  83           HA       THR  83  12.904  -0.087  -0.454
  507    HB   THR  83           HB       THR  83  12.320   1.955  -1.946
  508    HG1  THR  83           HG1      THR  83  10.271   1.918  -2.825
  509   HG21  THR  83          HG21      THR  83  13.014   0.545  -3.524
  510   HG22  THR  83          HG22      THR  83  11.415  -0.198  -3.580
  511   HG23  THR  83          HG23      THR  83  12.636  -0.815  -2.468
  512    H    LEU  84           H        LEU  84  13.731   2.256  -0.282
  513    HA   LEU  84           HA       LEU  84  12.344   3.682   1.884
  514    HB2  LEU  84           HB1      LEU  84  14.660   2.198   2.223
  515    HB3  LEU  84           HB2      LEU  84  15.243   3.861   2.035
  516    HG   LEU  84           HG       LEU  84  13.022   3.603   3.922
  517   HD11  LEU  84          HD11      LEU  84  15.592   2.592   4.996
  518   HD12  LEU  84          HD12      LEU  84  14.586   1.465   4.086
  519   HD13  LEU  84          HD13      LEU  84  13.937   2.269   5.515
  520   HD21  LEU  84          HD21      LEU  84  15.793   4.773   4.142
  521   HD22  LEU  84          HD22      LEU  84  14.453   5.041   5.258
  522   HD23  LEU  84          HD23      LEU  84  14.355   5.639   3.602
  523    H    CYS  85           H        CYS  85  12.558   5.910   1.890
  524    HA   CYS  85           HA       CYS  85  13.186   7.093  -0.652
  525    HB2  CYS  85           HB1      CYS  85  11.300   7.751   0.981
  526    HB3  CYS  85           HB2      CYS  85  12.557   8.618   1.866
  527    H    VAL  86           H        VAL  86  15.344   7.060  -1.072
  528    HA   VAL  86           HA       VAL  86  17.130   8.316   0.904
  529    HB   VAL  86           HB       VAL  86  17.837   6.474  -1.385
  530   HG11  VAL  86          HG11      VAL  86  19.706   7.827  -1.146
  531   HG12  VAL  86          HG12      VAL  86  19.492   7.988   0.598
  532   HG13  VAL  86          HG13      VAL  86  20.072   6.468  -0.083
  533   HG21  VAL  86          HG21      VAL  86  16.742   5.249   0.369
  534   HG22  VAL  86          HG22      VAL  86  18.470   4.905   0.438
  535   HG23  VAL  86          HG23      VAL  86  17.747   6.022   1.595
  536    H    ASN  87           H        ASN  87  18.211  10.135   0.401
  537    HA   ASN  87           HA       ASN  87  18.746  12.057  -0.692
  538    HB2  ASN  87           HB1      ASN  87  19.931  10.084  -2.041
  539    HB3  ASN  87           HB2      ASN  87  18.845  10.646  -3.316
  540   HD21  ASN  87          HD21      ASN  87  20.827  11.187  -4.432
  541   HD22  ASN  87          HD22      ASN  87  21.599  12.696  -4.101
  542    H    ASP  88           H        ASP  88  15.984  11.549  -0.396
  543    HA   ASP  88           HA       ASP  88  13.974  12.384  -1.056
  544    HB2  ASP  88           HB1      ASP  88  15.483  13.989  -3.128
  545    HB3  ASP  88           HB2      ASP  88  13.928  14.372  -2.378
  546    HD2  ASP  88           HD       ASP  88  17.126  15.683  -0.653
  547    H    VAL  89           H        VAL  89  15.207  10.035  -2.383
  548    HA   VAL  89           HA       VAL  89  13.320   9.873  -4.596
  549    HB   VAL  89           HB       VAL  89  16.243   9.204  -4.968
  550   HG11  VAL  89          HG11      VAL  89  13.945   9.072  -6.919
  551   HG12  VAL  89          HG12      VAL  89  15.634   8.703  -7.270
  552   HG13  VAL  89          HG13      VAL  89  14.722   7.687  -6.154
  553   HG21  VAL  89          HG21      VAL  89  15.957  11.587  -5.006
  554   HG22  VAL  89          HG22      VAL  89  16.173  11.024  -6.664
  555   HG23  VAL  89          HG23      VAL  89  14.564  11.449  -6.078
  556    H    CYS  90           H        CYS  90  12.546   7.828  -4.963
  557    HA   CYS  90           HA       CYS  90  12.675   5.959  -2.881
  558    HB2  CYS  90           HB1      CYS  90  11.133   6.324  -5.160
  559    HB3  CYS  90           HB2      CYS  90  11.954   4.792  -5.458
  560    H    THR  91           H        THR  91  14.217   4.577  -2.343
  561    HA   THR  91           HA       THR  91  15.880   3.397  -4.458
  562    HB   THR  91           HB       THR  91  16.959   4.481  -1.848
  563    HG1  THR  91           HG1      THR  91  17.764   5.374  -4.392
  564   HG21  THR  91          HG21      THR  91  18.560   2.945  -2.184
  565   HG22  THR  91          HG22      THR  91  19.083   3.969  -3.521
  566   HG23  THR  91          HG23      THR  91  18.008   2.603  -3.823
  567    H    THR  92           H        THR  92  16.463   1.285  -4.147
  568    HA   THR  92           HA       THR  92  14.884  -0.285  -2.413
  569    HB   THR  92           HB       THR  92  16.845  -2.016  -3.069
  570    HG1  THR  92           HG1      THR  92  17.689  -1.423  -5.086
  571   HG21  THR  92          HG21      THR  92  14.910  -2.767  -3.929
  572   HG22  THR  92          HG22      THR  92  15.420  -1.956  -5.409
  573   HG23  THR  92          HG23      THR  92  14.332  -1.141  -4.287
  574    H    MET  93           H        MET  93  15.500  -1.576  -0.629
  575    HA   MET  93           HA       MET  93  17.099  -0.285   1.284
  576    HB2  MET  93           HB1      MET  93  15.386  -2.576   1.160
  577    HB3  MET  93           HB2      MET  93  16.891  -3.033   1.972
  578    HG2  MET  93           HG1      MET  93  16.323  -0.638   3.167
  579    HG3  MET  93           HG2      MET  93  14.716  -1.310   2.882
  580    HE1  MET  93           HE1      MET  93  14.838  -1.246   6.014
  581    HE2  MET  93           HE2      MET  93  16.387  -1.826   6.627
  582    HE3  MET  93           HE3      MET  93  16.339  -0.515   5.447
  583    H    GLU  94           H        GLU  94  17.846  -2.654  -1.143
  584    HA   GLU  94           HA       GLU  94  20.325  -3.504   0.010
  585    HB2  GLU  94           HB1      GLU  94  19.362  -3.726  -2.852
  586    HB3  GLU  94           HB2      GLU  94  20.706  -4.621  -2.128
  587    HG2  GLU  94           HG1      GLU  94  19.271  -5.895  -0.754
  588    HG3  GLU  94           HG2      GLU  94  17.898  -4.832  -1.092
  589    HE2  GLU  94           HE       GLU  94  18.215  -6.346  -4.513
  590    H    ASP  95           H        ASP  95  19.304  -0.916  -2.065
  591    HA   ASP  95           HA       ASP  95  21.953  -0.276  -3.000
  592    HB2  ASP  95           HB1      ASP  95  19.212   0.799  -3.374
  593    HB3  ASP  95           HB2      ASP  95  20.540   1.955  -3.552
  594    HD2  ASP  95           HD       ASP  95  20.878   0.848  -6.769
  595    H    ALA  96           H        ALA  96  19.748   0.891  -0.511
  596    HA   ALA  96           HA       ALA  96  21.251   3.164   0.244
  597    HB1  ALA  96           HB1      ALA  96  19.688   3.477   1.866
  598    HB2  ALA  96           HB2      ALA  96  18.791   2.360   0.837
  599    HB3  ALA  96           HB3      ALA  96  19.611   1.764   2.280
  600    H    THR  97           H        THR  97  21.855   3.187   2.793
  601    HA   THR  97           HA       THR  97  23.991   1.191   3.027
  602    HB   THR  97           HB       THR  97  24.364   3.053   5.060
  603    HG1  THR  97           HG1      THR  97  23.375   4.798   4.403
  604   HG21  THR  97          HG21      THR  97  25.953   1.950   3.337
  605   HG22  THR  97          HG22      THR  97  26.346   3.559   3.945
  606   HG23  THR  97          HG23      THR  97  25.612   3.373   2.353
  607    H    GLU  98           H        GLU  98  21.103   2.351   4.581
  608    HA   GLU  98           HA       GLU  98  21.581   0.992   7.071
  609    HB2  GLU  98           HB1      GLU  98  20.166   3.076   6.760
  610    HB3  GLU  98           HB2      GLU  98  18.935   2.019   6.051
  611    HG2  GLU  98           HG1      GLU  98  18.336   1.125   8.035
  612    HG3  GLU  98           HG2      GLU  98  19.982   1.199   8.680
  613    HE2  GLU  98           HE       GLU  98  18.435   4.798   8.858
  614    H    ASN  99           H        ASN  99  21.479  -1.137   7.269
  615    HA   ASN  99           HA       ASN  99  19.382  -2.587   5.799
  616    HB2  ASN  99           HB1      ASN  99  22.096  -3.780   6.364
  617    HB3  ASN  99           HB2      ASN  99  20.855  -4.355   5.243
  618   HD21  ASN  99          HD21      ASN  99  23.705  -3.622   4.857
  619   HD22  ASN  99          HD22      ASN  99  23.702  -2.470   3.569
  620    H    LEU 100           H        LEU 100  19.024  -4.819   6.765
  621    HA   LEU 100           HA       LEU 100  19.035  -4.571   9.696
  622    HB2  LEU 100           HB1      LEU 100  16.898  -4.872   8.097
  623    HB3  LEU 100           HB2      LEU 100  17.313  -6.575   8.365
  624    HG   LEU 100           HG       LEU 100  17.339  -5.593  10.914
  625   HD11  LEU 100          HD11      LEU 100  16.309  -3.483   9.666
  626   HD12  LEU 100          HD12      LEU 100  15.788  -3.977  11.277
  627   HD13  LEU 100          HD13      LEU 100  14.828  -4.421   9.865
  628   HD21  LEU 100          HD21      LEU 100  16.241  -7.646   9.884
  629   HD22  LEU 100          HD22      LEU 100  14.841  -6.615   9.590
  630   HD23  LEU 100          HD23      LEU 100  15.405  -6.888  11.240
  631    H    TYR 101           H        TYR 101  18.732  -6.953  10.669
  632    HA   TYR 101           HA       TYR 101  20.319  -8.969   9.372
  633    HB2  TYR 101           HB1      TYR 101  22.061  -9.085  11.116
  634    HB3  TYR 101           HB2      TYR 101  22.119  -7.568  10.216
  635    HD1  TYR 101           HD1      TYR 101  21.455  -5.453  11.252
  636    HD2  TYR 101           HD2      TYR 101  21.457  -9.085  13.469
  637    HE1  TYR 101           HE1      TYR 101  21.329  -4.168  13.346
  638    HE2  TYR 101           HE2      TYR 101  21.329  -7.810  15.568
  639    HH   TYR 101           HH       TYR 101  20.782  -5.711  16.418
  640    H    PHE 102           H        PHE 102  20.900 -10.681  11.292
  641    HA   PHE 102           HA       PHE 102  18.446 -11.003  12.885
  642    HB2  PHE 102           HB1      PHE 102  18.438 -13.389  12.418
  643    HB3  PHE 102           HB2      PHE 102  18.384 -12.481  10.907
  644    HD1  PHE 102           HD1      PHE 102  20.373 -12.319   9.460
  645    HD2  PHE 102           HD2      PHE 102  20.300 -14.800  12.919
  646    HE1  PHE 102           HE1      PHE 102  22.340 -13.538   8.624
  647    HE2  PHE 102           HE2      PHE 102  22.267 -16.021  12.089
  648    HZ   PHE 102           HZ       PHE 102  23.291 -15.390   9.940
  649    H    GLN 103           H        GLN 103  18.697 -12.491  14.730
  650    HA   GLN 103           HA       GLN 103  21.288 -12.061  15.998
  651    HB2  GLN 103           HB1      GLN 103  20.190 -12.621  18.079
  652    HB3  GLN 103           HB2      GLN 103  19.218 -11.431  17.200
  653    HG2  GLN 103           HG1      GLN 103  17.826 -13.351  16.344
  654    HG3  GLN 103           HG2      GLN 103  18.690 -14.371  17.503
  655   HE21  GLN 103          HE21      GLN 103  18.736 -13.398  19.784
  656   HE22  GLN 103          HE22      GLN 103  17.228 -12.792  20.367
  657    H    SER 104           H        SER 104  22.516 -13.713  16.926
  658    HA   SER 104           HA       SER 104  22.214 -16.288  15.607
  659    HB2  SER 104           HB1      SER 104  24.444 -15.964  17.505
  660    HB3  SER 104           HB2      SER 104  24.459 -16.495  15.815
  661    HG   SER 104           HG       SER 104  24.649 -13.910  16.869
  662    H    LEU 105           H        LEU 105  22.303 -18.294  16.755
  663    HA   LEU 105           HA       LEU 105  21.529 -18.142  19.586
  664    HB2  LEU 105           HB1      LEU 105  19.943 -19.085  17.336
  665    HB3  LEU 105           HB2      LEU 105  20.152 -20.328  18.582
  666    HG   LEU 105           HG       LEU 105  19.412 -18.275  20.141
  667   HD11  LEU 105          HD11      LEU 105  18.592 -17.572  17.398
  668   HD12  LEU 105          HD12      LEU 105  18.876 -16.543  18.802
  669   HD13  LEU 105          HD13      LEU 105  17.353 -17.418  18.643
  670   HD21  LEU 105          HD21      LEU 105  18.411 -20.549  19.949
  671   HD22  LEU 105          HD22      LEU 105  17.443 -19.957  18.598
  672   HD23  LEU 105          HD23      LEU 105  17.234 -19.261  20.206
  673    H    GLU 106           H        GLU 106  22.107 -19.920  20.858
  674    HA   GLU 106           HA       GLU 106  23.211 -22.313  19.893
  675    HB2  GLU 106           HB1      GLU 106  24.960 -20.274  19.454
  676    HB3  GLU 106           HB2      GLU 106  25.464 -20.815  21.062
  677    HG2  GLU 106           HG1      GLU 106  25.038 -23.049  19.258
  678    HG3  GLU 106           HG2      GLU 106  26.231 -21.899  18.637
  679    HE2  GLU 106           HE       GLU 106  28.099 -22.469  21.728
  680    H    HIS 107           H        HIS 107  23.952 -23.703  21.579
  681    HA   HIS 107           HA       HIS 107  23.963 -22.765  24.305
  682    HB2  HIS 107           HB1      HIS 107  21.538 -23.004  23.812
  683    HB3  HIS 107           HB2      HIS 107  21.813 -24.707  23.435
  684    HD1  HIS 107           HD1      HIS 107  20.507 -25.743  25.325
  685    HD2  HIS 107           HD2      HIS 107  23.319 -22.979  26.634
  686    HE1  HIS 107           HE1      HIS 107  20.569 -25.981  27.828
  687    HE2  HIS 107           HE2      HIS 107  22.287 -24.291  28.629
  688    H    HIS 108           H        HIS 108  23.389 -25.811  22.533
  689    HA   HIS 108           HA       HIS 108  25.781 -26.913  23.851
  690    HB2  HIS 108           HB1      HIS 108  23.056 -27.800  24.054
  691    HB3  HIS 108           HB2      HIS 108  24.016 -29.048  23.253
  692    HD1  HIS 108           HD1      HIS 108  23.505 -27.418  26.547
  693    HD2  HIS 108           HD2      HIS 108  26.078 -30.189  24.829
  694    HE1  HIS 108           HE1      HIS 108  24.702 -28.506  28.471
  695    HE2  HIS 108           HE2      HIS 108  26.275 -30.200  27.422
  696    H    HIS 109           H        HIS 109  27.145 -28.112  22.605
  697    HA   HIS 109           HA       HIS 109  26.337 -28.718  19.850
  698    HB2  HIS 109           HB1      HIS 109  28.574 -27.929  19.051
  699    HB3  HIS 109           HB2      HIS 109  27.517 -26.639  19.632
  700    HD1  HIS 109           HD1      HIS 109  28.061 -25.703  22.087
  701    HD2  HIS 109           HD2      HIS 109  31.004 -28.051  20.329
  702    HE1  HIS 109           HE1      HIS 109  30.157 -25.248  23.399
  703    HE2  HIS 109           HE2      HIS 109  31.957 -26.683  22.326
  704    H    HIS 110           H        HIS 110  26.299 -30.679  21.601
  705    HA   HIS 110           HA       HIS 110  28.600 -32.302  20.846
  706    HB2  HIS 110           HB1      HIS 110  28.150 -31.280  23.516
  707    HB3  HIS 110           HB2      HIS 110  28.094 -33.045  23.508
  708    HD1  HIS 110           HD1      HIS 110  30.428 -30.249  22.456
  709    HD2  HIS 110           HD2      HIS 110  30.521 -34.281  23.451
  710    HE1  HIS 110           HE1      HIS 110  32.865 -30.860  22.552
  711    HE2  HIS 110           HE2      HIS 110  32.923 -33.325  23.159
  712    H    HIS 111           H        HIS 111  28.231 -34.641  21.444
  713    HA   HIS 111           HA       HIS 111  25.381 -35.330  21.546
  714    HB2  HIS 111           HB1      HIS 111  27.305 -35.883  19.360
  715    HB3  HIS 111           HB2      HIS 111  26.268 -37.230  19.837
  716    HD1  HIS 111           HD1      HIS 111  23.600 -35.952  20.289
  717    HD2  HIS 111           HD2      HIS 111  26.100 -34.847  17.160
  718    HE1  HIS 111           HE1      HIS 111  22.097 -34.907  18.564
  719    HE2  HIS 111           HE2      HIS 111  23.624 -34.230  16.651
  720    H    HIS 112           H        HIS 112  25.031 -37.664  22.012
  721    HA   HIS 112           HA       HIS 112  25.327 -39.489  23.337
  722    HB2  HIS 112           HB1      HIS 112  27.715 -39.196  21.858
  723    HB3  HIS 112           HB2      HIS 112  28.201 -39.575  23.514
  724    HD1  HIS 112           HD1      HIS 112  28.394 -41.988  23.966
  725    HD2  HIS 112           HD2      HIS 112  25.585 -41.203  21.008
  726    HE1  HIS 112           HE1      HIS 112  27.558 -44.238  23.218
  727    HE2  HIS 112           HE2      HIS 112  25.841 -43.759  21.410
  Start of MODEL   20
    1    H1   MET  18           H        MET  18 -37.588  38.259  21.558
    2    HA   MET  18           HA       MET  18 -39.020  37.467  19.857
    3    HB2  MET  18           HB1      MET  18 -40.097  35.921  22.181
    4    HB3  MET  18           HB2      MET  18 -41.144  36.199  20.779
    5    HG2  MET  18           HG1      MET  18 -39.784  34.968  19.342
    6    HG3  MET  18           HG2      MET  18 -38.397  35.074  20.431
    7    HE1  MET  18           HE1      MET  18 -39.484  32.961  23.416
    8    HE2  MET  18           HE2      MET  18 -38.020  32.800  22.445
    9    HE3  MET  18           HE3      MET  18 -38.647  34.402  22.839
   10    H    LEU  19           H        LEU  19 -39.753  39.434  19.303
   11    HA   LEU  19           HA       LEU  19 -42.093  40.457  20.755
   12    HB2  LEU  19           HB1      LEU  19 -39.548  41.880  20.091
   13    HB3  LEU  19           HB2      LEU  19 -41.074  42.781  20.078
   14    HG   LEU  19           HG       LEU  19 -40.609  41.198  22.510
   15   HD11  LEU  19          HD11      LEU  19 -38.841  43.540  21.824
   16   HD12  LEU  19          HD12      LEU  19 -38.329  41.881  22.130
   17   HD13  LEU  19          HD13      LEU  19 -39.020  42.845  23.434
   18   HD21  LEU  19          HD21      LEU  19 -41.590  43.067  23.562
   19   HD22  LEU  19          HD22      LEU  19 -42.463  42.864  22.043
   20   HD23  LEU  19          HD23      LEU  19 -41.235  44.122  22.194
   21    H    VAL  20           H        VAL  20 -40.151  40.564  17.796
   22    HA   VAL  20           HA       VAL  20 -42.085  41.904  16.215
   23    HB   VAL  20           HB       VAL  20 -40.777  41.163  14.282
   24   HG11  VAL  20          HG11      VAL  20 -39.439  42.865  14.768
   25   HG12  VAL  20          HG12      VAL  20 -39.820  42.688  16.483
   26   HG13  VAL  20          HG13      VAL  20 -38.461  41.807  15.784
   27   HG21  VAL  20          HG21      VAL  20 -40.137  38.972  14.683
   28   HG22  VAL  20          HG22      VAL  20 -38.624  39.853  14.891
   29   HG23  VAL  20          HG23      VAL  20 -39.542  39.334  16.304
   30    H    LEU  21           H        LEU  21 -43.814  41.174  15.135
   31    HA   LEU  21           HA       LEU  21 -44.686  38.466  15.568
   32    HB2  LEU  21           HB1      LEU  21 -45.887  40.823  14.117
   33    HB3  LEU  21           HB2      LEU  21 -46.658  39.229  14.178
   34    HG   LEU  21           HG       LEU  21 -45.935  40.599  16.732
   35   HD11  LEU  21          HD11      LEU  21 -47.315  42.042  14.966
   36   HD12  LEU  21          HD12      LEU  21 -47.654  42.075  16.695
   37   HD13  LEU  21          HD13      LEU  21 -48.637  41.077  15.623
   38   HD21  LEU  21          HD21      LEU  21 -47.654  38.392  15.812
   39   HD22  LEU  21          HD22      LEU  21 -48.344  39.425  17.064
   40   HD23  LEU  21          HD23      LEU  21 -46.803  38.612  17.341
   41    H    ASP  22           H        ASP  22 -44.661  36.803  14.170
   42    HA   ASP  22           HA       ASP  22 -44.351  37.184  11.337
   43    HB2  ASP  22           HB1      ASP  22 -42.014  36.834  12.968
   44    HB3  ASP  22           HB2      ASP  22 -42.230  35.404  11.948
   45    HD2  ASP  22           HD       ASP  22 -41.103  38.766  10.266
   46    H    PHE  23           H        PHE  23 -44.954  35.394  10.164
   47    HA   PHE  23           HA       PHE  23 -45.092  32.768  11.197
   48    HB2  PHE  23           HB1      PHE  23 -46.969  34.044  12.446
   49    HB3  PHE  23           HB2      PHE  23 -47.818  34.005  10.899
   50    HD1  PHE  23           HD1      PHE  23 -46.846  32.104  13.806
   51    HD2  PHE  23           HD2      PHE  23 -48.425  31.832   9.863
   52    HE1  PHE  23           HE1      PHE  23 -47.668  29.836  14.295
   53    HE2  PHE  23           HE2      PHE  23 -49.250  29.565  10.345
   54    HZ   PHE  23           HZ       PHE  23 -48.872  28.564  12.564
   55    H    ASN  24           H        ASN  24 -44.357  32.000   9.291
   56    HA   ASN  24           HA       ASN  24 -46.178  32.178   7.006
   57    HB2  ASN  24           HB1      ASN  24 -43.732  33.579   7.144
   58    HB3  ASN  24           HB2      ASN  24 -43.451  32.205   6.068
   59   HD21  ASN  24          HD21      ASN  24 -44.940  35.250   6.431
   60   HD22  ASN  24          HD22      ASN  24 -45.659  35.343   4.862
   61    H    ASN  25           H        ASN  25 -45.764  30.512   5.371
   62    HA   ASN  25           HA       ASN  25 -45.460  27.968   6.520
   63    HB2  ASN  25           HB1      ASN  25 -45.873  29.069   3.811
   64    HB3  ASN  25           HB2      ASN  25 -45.084  27.488   3.860
   65   HD21  ASN  25          HD21      ASN  25 -46.828  26.425   2.968
   66   HD22  ASN  25          HD22      ASN  25 -48.295  26.150   3.840
   67    H    ILE  26           H        ILE  26 -43.853  26.355   6.136
   68    HA   ILE  26           HA       ILE  26 -41.179  27.479   5.609
   69    HB   ILE  26           HB       ILE  26 -40.329  25.600   7.065
   70   HG12  ILE  26          HG11      ILE  26 -43.221  25.491   7.955
   71   HG13  ILE  26          HG12      ILE  26 -42.437  24.261   6.949
   72   HG21  ILE  26          HG21      ILE  26 -40.380  26.929   8.929
   73   HG22  ILE  26          HG22      ILE  26 -40.872  28.092   7.699
   74   HG23  ILE  26          HG23      ILE  26 -42.085  27.334   8.729
   75   HD11  ILE  26          HD11      ILE  26 -40.906  24.768   9.337
   76   HD12  ILE  26          HD12      ILE  26 -42.563  24.297   9.714
   77   HD13  ILE  26          HD13      ILE  26 -41.556  23.254   8.711
   78    H    ARG  27           H        ARG  27 -43.413  24.871   5.010
   79    HA   ARG  27           HA       ARG  27 -43.401  23.117   3.559
   80    HB2  ARG  27           HB1      ARG  27 -41.747  25.201   2.180
   81    HB3  ARG  27           HB2      ARG  27 -41.888  23.589   1.461
   82    HG2  ARG  27           HG1      ARG  27 -44.139  23.816   1.020
   83    HG3  ARG  27           HG2      ARG  27 -44.358  25.048   2.273
   84    HD2  ARG  27           HD1      ARG  27 -44.388  26.464   0.507
   85    HD3  ARG  27           HD2      ARG  27 -42.630  26.336   0.665
   86    HE   ARG  27           HE       ARG  27 -42.579  25.267  -1.347
   87   HH11  ARG  27          HH11      ARG  27 -45.802  25.045  -0.052
   88   HH12  ARG  27          HH12      ARG  27 -46.462  24.301  -1.471
   89   HH21  ARG  27          HH21      ARG  27 -43.435  24.287  -3.220
   90   HH22  ARG  27          HH22      ARG  27 -45.114  23.870  -3.273
   91    H    SER  28           H        SER  28 -42.374  21.750   5.123
   92    HA   SER  28           HA       SER  28 -39.584  21.452   5.357
   93    HB2  SER  28           HB1      SER  28 -41.622  20.530   6.804
   94    HB3  SER  28           HB2      SER  28 -41.362  19.095   5.797
   95    HG   SER  28           HG       SER  28 -39.993  19.823   7.925
   96    H    SER  29           H        SER  29 -38.801  18.957   4.977
   97    HA   SER  29           HA       SER  29 -39.568  17.735   2.549
   98    HB2  SER  29           HB1      SER  29 -38.290  20.000   1.944
   99    HB3  SER  29           HB2      SER  29 -36.874  18.967   2.203
  100    HG   SER  29           HG       SER  29 -37.827  19.044   0.000
  101    H    ALA  30           H        ALA  30 -39.230  15.711   3.179
  102    HA   ALA  30           HA       ALA  30 -36.648  15.048   4.438
  103    HB1  ALA  30           HB1      ALA  30 -39.105  13.375   4.801
  104    HB2  ALA  30           HB2      ALA  30 -37.665  13.482   5.816
  105    HB3  ALA  30           HB3      ALA  30 -38.832  14.806   5.797
  106    H    ASP  31           H        ASP  31 -35.390  13.622   3.422
  107    HA   ASP  31           HA       ASP  31 -36.382  11.472   1.847
  108    HB2  ASP  31           HB1      ASP  31 -35.663  14.011   0.504
  109    HB3  ASP  31           HB2      ASP  31 -34.969  12.547  -0.205
  110    HD2  ASP  31           HD       ASP  31 -38.540  13.323  -1.220
  111    H    LEU  32           H        LEU  32 -33.624  13.628   2.412
  112    HA   LEU  32           HA       LEU  32 -31.981  11.459   3.277
  113    HB2  LEU  32           HB1      LEU  32 -30.206  11.848   1.528
  114    HB3  LEU  32           HB2      LEU  32 -31.660  10.988   0.993
  115    HG   LEU  32           HG       LEU  32 -31.974  13.798   0.509
  116   HD11  LEU  32          HD11      LEU  32 -30.197  14.246  -0.989
  117   HD12  LEU  32          HD12      LEU  32 -29.589  12.595  -0.875
  118   HD13  LEU  32          HD13      LEU  32 -29.458  13.681   0.509
  119   HD21  LEU  32          HD21      LEU  32 -31.546  11.926  -1.725
  120   HD22  LEU  32          HD22      LEU  32 -32.875  13.043  -1.414
  121   HD23  LEU  32          HD23      LEU  32 -32.820  11.486  -0.588
  122    H    HIS  33           H        HIS  33 -29.568  12.351   3.403
  123    HA   HIS  33           HA       HIS  33 -29.673  15.166   4.251
  124    HB2  HIS  33           HB1      HIS  33 -29.111  12.784   5.854
  125    HB3  HIS  33           HB2      HIS  33 -27.836  14.001   5.963
  126    HD1  HIS  33           HD1      HIS  33 -29.179  16.597   6.172
  127    HD2  HIS  33           HD2      HIS  33 -30.781  13.198   7.944
  128    HE1  HIS  33           HE1      HIS  33 -30.704  17.439   7.987
  129    HE2  HIS  33           HE2      HIS  33 -31.683  15.362   9.070
  130    H    GLY  34           H        GLY  34 -27.383  12.464   3.774
  131    HA2  GLY  34           HA2      GLY  34 -25.702  12.527   2.062
  132    HA3  GLY  34           HA3      GLY  34 -25.733  14.282   2.150
  133    HA1  GLY  34           HA1      GLY  34 -25.817  12.296   2.905
  134    H    ALA  35           H        ALA  35 -23.617  12.077   2.511
  135    HA   ALA  35           HA       ALA  35 -22.556  13.075   5.075
  136    HB1  ALA  35           HB1      ALA  35 -21.982  10.411   3.782
  137    HB2  ALA  35           HB2      ALA  35 -21.376  10.978   5.339
  138    HB3  ALA  35           HB3      ALA  35 -23.100  10.675   5.122
  139    H    ARG  36           H        ARG  36 -21.847  12.263   1.730
  140    HA   ARG  36           HA       ARG  36 -19.068  12.842   1.844
  141    HB2  ARG  36           HB1      ARG  36 -19.110  12.750  -0.566
  142    HB3  ARG  36           HB2      ARG  36 -20.127  11.453   0.079
  143    HG2  ARG  36           HG1      ARG  36 -22.111  12.987  -0.279
  144    HG3  ARG  36           HG2      ARG  36 -21.007  14.023  -1.198
  145    HD2  ARG  36           HD1      ARG  36 -20.870  12.582  -2.951
  146    HD3  ARG  36           HD2      ARG  36 -21.000  11.157  -1.910
  147    HE   ARG  36           HE       ARG  36 -23.461  12.535  -1.952
  148   HH11  ARG  36          HH11      ARG  36 -21.428  10.534  -3.947
  149   HH12  ARG  36          HH12      ARG  36 -22.745   9.890  -4.871
  150   HH21  ARG  36          HH21      ARG  36 -25.204  11.694  -3.161
  151   HH22  ARG  36          HH22      ARG  36 -24.891  10.552  -4.425
  152    H    LYS  37           H        LYS  37 -18.087  14.613   0.474
  153    HA   LYS  37           HA       LYS  37 -19.640  17.062   0.320
  154    HB2  LYS  37           HB1      LYS  37 -18.822  17.044   2.642
  155    HB3  LYS  37           HB2      LYS  37 -17.163  16.877   2.046
  156    HG2  LYS  37           HG1      LYS  37 -17.061  19.049   1.275
  157    HG3  LYS  37           HG2      LYS  37 -18.822  19.189   1.150
  158    HD2  LYS  37           HD1      LYS  37 -18.524  18.742   3.823
  159    HD3  LYS  37           HD2      LYS  37 -17.052  19.655   3.449
  160    HE2  LYS  37           HE1      LYS  37 -18.295  21.496   2.581
  161    HE3  LYS  37           HE2      LYS  37 -19.794  20.555   2.593
  162    HZ1  LYS  37           HZ1      LYS  37 -18.403  21.849   4.813
  163    HZ2  LYS  37           HZ2      LYS  37 -19.227  20.410   5.143
  164    HZ3  LYS  37           HZ3      LYS  37 -20.060  21.733   4.499
  165    H    GLY  38           H        GLY  38 -16.222  16.015   0.317
  166    HA2  GLY  38           HA2      GLY  38 -15.926  16.452  -2.485
  167    HA3  GLY  38           HA3      GLY  38 -15.264  17.794  -1.564
  168    HA1  GLY  38           HA1      GLY  38 -15.895  15.792  -1.900
  169    H    SER  39           H        SER  39 -15.224  14.231  -1.361
  170    HA   SER  39           HA       SER  39 -12.315  14.272  -1.458
  171    HB2  SER  39           HB1      SER  39 -13.926  13.517   0.952
  172    HB3  SER  39           HB2      SER  39 -12.452  12.599   0.593
  173    HG   SER  39           HG       SER  39 -12.551  14.850   1.851
  174    H    GLN  40           H        GLN  40 -11.393  12.303  -2.071
  175    HA   GLN  40           HA       GLN  40 -13.303  10.413  -3.242
  176    HB2  GLN  40           HB1      GLN  40 -11.135  11.652  -4.354
  177    HB3  GLN  40           HB2      GLN  40 -10.451  10.089  -3.881
  178    HG2  GLN  40           HG1      GLN  40 -13.051  10.037  -5.304
  179    HG3  GLN  40           HG2      GLN  40 -11.621  10.505  -6.236
  180   HE21  GLN  40          HE21      GLN  40 -13.456   7.952  -5.174
  181   HE22  GLN  40          HE22      GLN  40 -12.332   6.671  -5.454
  182    H    CYS  41           H        CYS  41 -10.534  10.611  -1.082
  183    HA   CYS  41           HA       CYS  41 -11.274   8.049   0.076
  184    HB2  CYS  41           HB1      CYS  41  -9.120   7.036  -0.131
  185    HB3  CYS  41           HB2      CYS  41  -9.622   7.545  -1.744
  186    H    LEU  42           H        LEU  42 -10.698   7.841   2.215
  187    HA   LEU  42           HA       LEU  42  -9.616  10.270   3.455
  188    HB2  LEU  42           HB1      LEU  42 -11.344   8.026   4.482
  189    HB3  LEU  42           HB2      LEU  42 -10.548   9.179   5.567
  190    HG   LEU  42           HG       LEU  42 -11.787  10.958   4.082
  191   HD11  LEU  42          HD11      LEU  42 -13.026   8.399   3.317
  192   HD12  LEU  42          HD12      LEU  42 -12.945   9.931   2.448
  193   HD13  LEU  42          HD13      LEU  42 -14.143   9.702   3.722
  194   HD21  LEU  42          HD21      LEU  42 -13.847   9.848   5.722
  195   HD22  LEU  42          HD22      LEU  42 -12.840  11.268   6.008
  196   HD23  LEU  42          HD23      LEU  42 -12.294   9.676   6.541
  197    H    SER  43           H        SER  43  -9.179   6.789   3.258
  198    HA   SER  43           HA       SER  43  -6.639   7.090   4.724
  199    HB2  SER  43           HB1      SER  43  -8.811   5.439   5.372
  200    HB3  SER  43           HB2      SER  43  -7.611   4.357   4.643
  201    HG   SER  43           HG       SER  43  -7.596   5.424   7.083
  202    H    ASP  44           H        ASP  44  -4.850   5.891   3.982
  203    HA   ASP  44           HA       ASP  44  -4.584   5.734   1.190
  204    HB2  ASP  44           HB1      ASP  44  -2.422   4.560   1.691
  205    HB3  ASP  44           HB2      ASP  44  -2.631   6.104   2.531
  206    HD2  ASP  44           HD       ASP  44  -2.939   4.506   5.639
  207    H    THR  45           H        THR  45  -5.621   3.419   3.554
  208    HA   THR  45           HA       THR  45  -5.319   1.152   1.775
  209    HB   THR  45           HB       THR  45  -6.817   0.137   3.753
  210    HG1  THR  45           HG1      THR  45  -7.105   1.736   5.144
  211   HG21  THR  45          HG21      THR  45  -4.905  -0.995   3.922
  212   HG22  THR  45          HG22      THR  45  -4.248   0.320   4.898
  213   HG23  THR  45          HG23      THR  45  -4.021   0.320   3.149
  214    H    ASP  46           H        ASP  46  -7.379   3.634   1.754
  215    HA   ASP  46           HA       ASP  46  -9.916   2.343   1.585
  216    HB2  ASP  46           HB1      ASP  46  -9.576   4.770   2.118
  217    HB3  ASP  46           HB2      ASP  46  -9.122   5.020   0.428
  218    HD2  ASP  46           HD       ASP  46 -12.406   4.828  -0.648
  219    H    CYS  47           H        CYS  47  -7.322   2.929  -0.638
  220    HA   CYS  47           HA       CYS  47  -8.834   2.582  -3.033
  221    HB2  CYS  47           HB1      CYS  47  -6.222   3.359  -2.371
  222    HB3  CYS  47           HB2      CYS  47  -6.037   1.873  -3.304
  223    H    ASN  48           H        ASN  48  -8.501   0.785  -4.555
  224    HA   ASN  48           HA       ASN  48  -9.074  -1.702  -3.340
  225    HB2  ASN  48           HB1      ASN  48  -8.329  -1.017  -6.197
  226    HB3  ASN  48           HB2      ASN  48  -8.914  -2.600  -5.671
  227   HD21  ASN  48          HD21      ASN  48 -10.252  -1.248  -7.606
  228   HD22  ASN  48          HD22      ASN  48 -11.775  -0.699  -7.002
  229    H    THR  49           H        THR  49  -6.402  -1.056  -5.604
  230    HA   THR  49           HA       THR  49  -4.872  -3.247  -4.569
  231    HB   THR  49           HB       THR  49  -3.327  -1.377  -6.166
  232    HG1  THR  49           HG1      THR  49  -5.133  -0.733  -7.207
  233   HG21  THR  49          HG21      THR  49  -4.202  -3.962  -7.285
  234   HG22  THR  49          HG22      THR  49  -3.356  -4.048  -5.740
  235   HG23  THR  49          HG23      THR  49  -2.583  -3.285  -7.128
  236    H    ARG  50           H        ARG  50  -2.315  -2.501  -4.423
  237    HA   ARG  50           HA       ARG  50  -2.208  -1.106  -1.907
  238    HB2  ARG  50           HB1      ARG  50  -0.205  -2.522  -3.643
  239    HB3  ARG  50           HB2      ARG  50   0.334  -1.514  -2.291
  240    HG2  ARG  50           HG1      ARG  50  -0.294  -3.007  -0.736
  241    HG3  ARG  50           HG2      ARG  50  -1.773  -3.434  -1.613
  242    HD2  ARG  50           HD1      ARG  50  -0.684  -4.994  -2.971
  243    HD3  ARG  50           HD2      ARG  50   0.907  -4.295  -2.635
  244    HE   ARG  50           HE       ARG  50  -0.229  -5.296  -0.250
  245   HH11  ARG  50          HH11      ARG  50   1.223  -6.351  -3.233
  246   HH12  ARG  50          HH12      ARG  50   1.820  -7.835  -2.569
  247   HH21  ARG  50          HH21      ARG  50   0.554  -7.246   0.637
  248   HH22  ARG  50          HH22      ARG  50   1.439  -8.344  -0.368
  249    H    LYS  51           H        LYS  51  -3.041   0.936  -2.831
  250    HA   LYS  51           HA       LYS  51  -0.850   2.532  -3.990
  251    HB2  LYS  51           HB1      LYS  51  -3.764   2.427  -4.647
  252    HB3  LYS  51           HB2      LYS  51  -2.922   3.979  -4.784
  253    HG2  LYS  51           HG1      LYS  51  -2.604   3.241  -6.901
  254    HG3  LYS  51           HG2      LYS  51  -1.194   2.484  -6.138
  255    HD2  LYS  51           HD1      LYS  51  -1.978   0.408  -6.463
  256    HD3  LYS  51           HD2      LYS  51  -3.610   0.860  -5.940
  257    HE2  LYS  51           HE1      LYS  51  -4.336   1.237  -8.048
  258    HE3  LYS  51           HE2      LYS  51  -2.798   1.957  -8.543
  259    HZ1  LYS  51           HZ1      LYS  51  -2.075   0.025  -9.355
  260    HZ2  LYS  51           HZ2      LYS  51  -3.685  -0.486  -9.284
  261    HZ3  LYS  51           HZ3      LYS  51  -2.621  -0.866  -8.025
  262    H    PHE  52           H        PHE  52  -1.025   4.885  -3.495
  263    HA   PHE  52           HA       PHE  52  -1.888   5.233  -0.708
  264    HB2  PHE  52           HB1      PHE  52  -0.323   7.215  -0.750
  265    HB3  PHE  52           HB2      PHE  52   0.450   5.638  -0.925
  266    HD1  PHE  52           HD1      PHE  52   1.962   5.287  -2.626
  267    HD2  PHE  52           HD2      PHE  52  -0.896   8.418  -3.005
  268    HE1  PHE  52           HE1      PHE  52   3.049   6.023  -4.708
  269    HE2  PHE  52           HE2      PHE  52   0.185   9.157  -5.088
  270    HZ   PHE  52           HZ       PHE  52   2.160   7.959  -5.942
  271    H    CYS  53           H        CYS  53  -2.557   7.508  -0.138
  272    HA   CYS  53           HA       CYS  53  -4.530   8.400  -2.102
  273    HB2  CYS  53           HB1      CYS  53  -4.243   8.606   0.862
  274    HB3  CYS  53           HB2      CYS  53  -5.145   9.875   0.033
  275    H    LEU  54           H        LEU  54  -3.317   9.619  -3.527
  276    HA   LEU  54           HA       LEU  54  -1.517  11.663  -2.625
  277    HB2  LEU  54           HB1      LEU  54  -1.636  10.275  -4.886
  278    HB3  LEU  54           HB2      LEU  54  -2.614  11.664  -5.386
  279    HG   LEU  54           HG       LEU  54  -0.283  11.900  -6.079
  280   HD11  LEU  54          HD11      LEU  54  -1.157  13.832  -3.938
  281   HD12  LEU  54          HD12      LEU  54  -1.536  13.914  -5.659
  282   HD13  LEU  54          HD13      LEU  54   0.126  14.133  -5.111
  283   HD21  LEU  54          HD21      LEU  54   0.319  10.754  -3.655
  284   HD22  LEU  54          HD22      LEU  54   0.777  12.441  -3.421
  285   HD23  LEU  54          HD23      LEU  54   1.471  11.515  -4.752
  286    H    GLN  55           H        GLN  55  -2.271  13.435  -1.667
  287    HA   GLN  55           HA       GLN  55  -4.690  14.699  -2.775
  288    HB2  GLN  55           HB1      GLN  55  -4.897  15.771  -0.492
  289    HB3  GLN  55           HB2      GLN  55  -5.191  14.025  -0.557
  290    HG2  GLN  55           HG1      GLN  55  -3.503  13.560   0.817
  291    HG3  GLN  55           HG2      GLN  55  -2.411  14.678  -0.015
  292   HE21  GLN  55          HE21      GLN  55  -5.301  14.817   2.043
  293   HE22  GLN  55          HE22      GLN  55  -4.738  16.111   3.038
  294    HA   PRO  56           HA       PRO  56  -1.301  17.629  -3.733
  295    HB2  PRO  56           HB1      PRO  56  -2.486  18.585  -6.010
  296    HB3  PRO  56           HB2      PRO  56  -1.517  17.114  -5.962
  297    HG2  PRO  56           HG1      PRO  56  -4.497  17.432  -5.843
  298    HG3  PRO  56           HG2      PRO  56  -3.512  16.273  -6.812
  299    HD2  PRO  56           HD1      PRO  56  -4.773  15.560  -4.516
  300    HD3  PRO  56           HD2      PRO  56  -3.221  14.863  -5.012
  301    H    ARG  57           H        ARG  57  -1.224  19.865  -3.515
  302    HA   ARG  57           HA       ARG  57  -3.481  21.041  -2.144
  303    HB2  ARG  57           HB1      ARG  57  -1.954  23.000  -1.867
  304    HB3  ARG  57           HB2      ARG  57  -1.310  21.480  -1.226
  305    HG2  ARG  57           HG1      ARG  57   0.357  21.351  -2.769
  306    HG3  ARG  57           HG2      ARG  57  -0.588  22.194  -4.008
  307    HD2  ARG  57           HD1      ARG  57   0.841  23.890  -3.538
  308    HD3  ARG  57           HD2      ARG  57  -0.323  24.189  -2.240
  309    HE   ARG  57           HE       ARG  57   1.477  22.434  -1.162
  310   HH11  ARG  57          HH11      ARG  57   1.668  25.568  -2.665
  311   HH12  ARG  57          HH12      ARG  57   3.057  26.064  -1.757
  312   HH21  ARG  57          HH21      ARG  57   3.306  23.075   0.040
  313   HH22  ARG  57          HH22      ARG  57   3.989  24.644  -0.219
  314    H    ASP  58           H        ASP  58  -2.026  21.167  -5.289
  315    HA   ASP  58           HA       ASP  58  -3.497  23.559  -6.051
  316    HB2  ASP  58           HB1      ASP  58  -1.102  22.353  -6.909
  317    HB3  ASP  58           HB2      ASP  58  -2.231  22.196  -8.260
  318    HD2  ASP  58           HD       ASP  58  -2.328  25.646  -8.764
  319    H    GLU  59           H        GLU  59  -3.781  20.129  -6.233
  320    HA   GLU  59           HA       GLU  59  -6.152  20.434  -7.956
  321    HB2  GLU  59           HB1      GLU  59  -3.839  18.821  -8.359
  322    HB3  GLU  59           HB2      GLU  59  -5.206  17.745  -8.029
  323    HG2  GLU  59           HG1      GLU  59  -6.265  19.567  -9.809
  324    HG3  GLU  59           HG2      GLU  59  -4.610  19.329 -10.388
  325    HE2  GLU  59           HE       GLU  59  -7.042  16.185 -10.465
  326    H    LYS  60           H        LYS  60  -7.466  18.195  -7.712
  327    HA   LYS  60           HA       LYS  60  -8.278  18.166  -4.929
  328    HB2  LYS  60           HB1      LYS  60  -9.462  17.442  -7.519
  329    HB3  LYS  60           HB2      LYS  60  -9.873  16.331  -6.202
  330    HG2  LYS  60           HG1      LYS  60 -10.874  18.046  -4.918
  331    HG3  LYS  60           HG2      LYS  60 -10.203  19.307  -5.968
  332    HD2  LYS  60           HD1      LYS  60 -11.697  17.551  -7.622
  333    HD3  LYS  60           HD2      LYS  60 -12.689  17.924  -6.200
  334    HE2  LYS  60           HE1      LYS  60 -12.628  20.243  -6.612
  335    HE3  LYS  60           HE2      LYS  60 -11.270  20.080  -7.734
  336    HZ1  LYS  60           HZ1      LYS  60 -12.643  19.713  -9.426
  337    HZ2  LYS  60           HZ2      LYS  60 -13.904  20.214  -8.417
  338    HZ3  LYS  60           HZ3      LYS  60 -13.549  18.567  -8.572
  339    HA   PRO  61           HA       PRO  61  -6.438  14.377  -3.705
  340    HB2  PRO  61           HB1      PRO  61  -8.403  13.223  -2.187
  341    HB3  PRO  61           HB2      PRO  61  -7.479  14.633  -1.674
  342    HG2  PRO  61           HG1      PRO  61 -10.193  14.498  -2.943
  343    HG3  PRO  61           HG2      PRO  61  -9.642  15.476  -1.533
  344    HD2  PRO  61           HD1      PRO  61  -9.934  16.526  -4.020
  345    HD3  PRO  61           HD2      PRO  61  -8.681  17.072  -2.890
  346    H    PHE  62           H        PHE  62  -6.098  12.421  -4.582
  347    HA   PHE  62           HA       PHE  62  -8.276  10.808  -5.578
  348    HB2  PHE  62           HB1      PHE  62  -7.609  10.703  -7.861
  349    HB3  PHE  62           HB2      PHE  62  -7.720  12.415  -7.446
  350    HD1  PHE  62           HD1      PHE  62  -5.774  10.075  -9.093
  351    HD2  PHE  62           HD2      PHE  62  -5.425  13.418  -6.483
  352    HE1  PHE  62           HE1      PHE  62  -3.463  10.427  -9.859
  353    HE2  PHE  62           HE2      PHE  62  -3.114  13.777  -7.246
  354    HZ   PHE  62           HZ       PHE  62  -2.130  12.281  -8.936
  355    H    CYS  63           H        CYS  63  -7.288   8.776  -6.710
  356    HA   CYS  63           HA       CYS  63  -5.170   7.813  -4.930
  357    HB2  CYS  63           HB1      CYS  63  -7.567   6.674  -6.030
  358    HB3  CYS  63           HB2      CYS  63  -6.179   5.704  -6.532
  359    H    ALA  64           H        ALA  64  -3.160   7.753  -5.660
  360    HA   ALA  64           HA       ALA  64  -2.715   7.514  -8.562
  361    HB1  ALA  64           HB1      ALA  64  -1.762   9.412  -6.759
  362    HB2  ALA  64           HB2      ALA  64  -0.385   8.359  -7.087
  363    HB3  ALA  64           HB3      ALA  64  -1.223   9.155  -8.419
  364    H    THR  65           H        THR  65  -0.961   6.211  -9.299
  365    HA   THR  65           HA       THR  65  -0.712   3.753  -7.851
  366    HB   THR  65           HB       THR  65   1.088   4.269 -10.154
  367    HG1  THR  65           HG1      THR  65  -0.469   4.743 -11.509
  368   HG21  THR  65          HG21      THR  65  -0.304   2.045  -8.881
  369   HG22  THR  65          HG22      THR  65   1.149   2.045  -9.881
  370   HG23  THR  65          HG23      THR  65  -0.444   2.030 -10.638
  371    H    CYS  66           H        CYS  66   1.388   2.717  -7.407
  372    HA   CYS  66           HA       CYS  66   2.974   4.267  -5.698
  373    HB2  CYS  66           HB1      CYS  66   2.701   1.563  -6.306
  374    HB3  CYS  66           HB2      CYS  66   4.368   1.936  -6.751
  375    H    ARG  67           H        ARG  67   5.445   4.347  -5.937
  376    HA   ARG  67           HA       ARG  67   6.046   5.474  -8.588
  377    HB2  ARG  67           HB1      ARG  67   7.274   6.038  -5.879
  378    HB3  ARG  67           HB2      ARG  67   7.849   6.730  -7.404
  379    HG2  ARG  67           HG1      ARG  67   4.977   7.085  -6.718
  380    HG3  ARG  67           HG2      ARG  67   6.179   8.027  -5.821
  381    HD2  ARG  67           HD1      ARG  67   6.920   8.174  -8.544
  382    HD3  ARG  67           HD2      ARG  67   5.173   8.439  -8.471
  383    HE   ARG  67           HE       ARG  67   7.228  10.196  -7.503
  384   HH11  ARG  67          HH11      ARG  67   3.894   9.247  -7.181
  385   HH12  ARG  67          HH12      ARG  67   3.389  10.769  -6.526
  386   HH21  ARG  67          HH21      ARG  67   6.575  12.204  -6.639
  387   HH22  ARG  67          HH22      ARG  67   4.914  12.450  -6.218
  388    H    GLY  68           H        GLY  68   8.437   5.362  -9.167
  389    HA2  GLY  68           HA2      GLY  68   9.338   2.599  -8.693
  390    HA3  GLY  68           HA3      GLY  68   9.748   3.574 -10.096
  391    HA1  GLY  68           HA1      GLY  68   9.332   3.198  -8.046
  392    H    LEU  69           H        LEU  69  11.870   2.500  -9.196
  393    HA   LEU  69           HA       LEU  69  13.108   3.742  -6.958
  394    HB2  LEU  69           HB1      LEU  69  13.955   1.925  -9.158
  395    HB3  LEU  69           HB2      LEU  69  15.216   2.815  -8.287
  396    HG   LEU  69           HG       LEU  69  13.220   0.931  -7.033
  397   HD11  LEU  69          HD11      LEU  69  14.797  -0.303  -8.353
  398   HD12  LEU  69          HD12      LEU  69  15.225  -0.480  -6.651
  399   HD13  LEU  69          HD13      LEU  69  16.145   0.616  -7.682
  400   HD21  LEU  69          HD21      LEU  69  13.775   2.567  -5.421
  401   HD22  LEU  69          HD22      LEU  69  15.473   2.572  -5.901
  402   HD23  LEU  69          HD23      LEU  69  14.795   1.172  -5.069
  403    H    ARG  70           H        ARG  70  12.783   4.571 -10.301
  404    HA   ARG  70           HA       ARG  70  14.855   6.627 -10.103
  405    HB2  ARG  70           HB1      ARG  70  13.192   5.706 -12.461
  406    HB3  ARG  70           HB2      ARG  70  14.463   6.936 -12.527
  407    HG2  ARG  70           HG1      ARG  70  15.924   4.992 -11.484
  408    HG3  ARG  70           HG2      ARG  70  14.691   3.990 -12.266
  409    HD2  ARG  70           HD1      ARG  70  15.120   5.141 -14.408
  410    HD3  ARG  70           HD2      ARG  70  16.381   6.093 -13.613
  411    HE   ARG  70           HE       ARG  70  16.854   3.315 -13.279
  412   HH11  ARG  70          HH11      ARG  70  17.059   5.892 -15.610
  413   HH12  ARG  70          HH12      ARG  70  18.345   5.155 -16.507
  414   HH21  ARG  70          HH21      ARG  70  18.547   2.334 -14.451
  415   HH22  ARG  70          HH22      ARG  70  19.190   3.130 -15.847
  416    H    ARG  71           H        ARG  71  11.939   6.515  -8.972
  417    HA   ARG  71           HA       ARG  71  10.984   9.051 -10.099
  418    HB2  ARG  71           HB1      ARG  71   9.671   6.792  -8.634
  419    HB3  ARG  71           HB2      ARG  71   8.944   8.402  -8.574
  420    HG2  ARG  71           HG1      ARG  71   9.571   6.887 -11.108
  421    HG3  ARG  71           HG2      ARG  71   7.979   6.985 -10.337
  422    HD2  ARG  71           HD1      ARG  71   7.630   8.776 -11.643
  423    HD3  ARG  71           HD2      ARG  71   8.702   9.621 -10.517
  424    HE   ARG  71           HE       ARG  71  10.109   8.277 -12.628
  425   HH11  ARG  71          HH11      ARG  71   8.430  11.187 -11.717
  426   HH12  ARG  71          HH12      ARG  71   9.246  12.179 -12.879
  427   HH21  ARG  71          HH21      ARG  71  11.191   9.572 -14.163
  428   HH22  ARG  71          HH22      ARG  71  10.817  11.259 -14.271
  429    H    ARG  72           H        ARG  72  10.744  10.869  -8.875
  430    HA   ARG  72           HA       ARG  72  12.315  11.076  -6.505
  431    HB2  ARG  72           HB1      ARG  72  10.503  12.974  -7.986
  432    HB3  ARG  72           HB2      ARG  72  11.269  13.424  -6.456
  433    HG2  ARG  72           HG1      ARG  72  13.146  12.304  -8.397
  434    HG3  ARG  72           HG2      ARG  72  12.347  13.788  -8.942
  435    HD2  ARG  72           HD1      ARG  72  12.948  14.568  -6.461
  436    HD3  ARG  72           HD2      ARG  72  14.224  13.362  -6.684
  437    HE   ARG  72           HE       ARG  72  15.279  14.811  -8.094
  438   HH11  ARG  72          HH11      ARG  72  11.934  15.741  -7.841
  439   HH12  ARG  72          HH12      ARG  72  12.131  17.190  -8.769
  440   HH21  ARG  72          HH21      ARG  72  15.552  16.716  -9.318
  441   HH22  ARG  72          HH22      ARG  72  14.189  17.743  -9.610
  442    H    CYS  73           H        CYS  73  11.591  11.739  -4.411
  443    HA   CYS  73           HA       CYS  73   8.780  11.508  -3.766
  444    HB2  CYS  73           HB1      CYS  73   9.124   9.731  -2.082
  445    HB3  CYS  73           HB2      CYS  73   9.414   9.167  -3.728
  446    H    GLN  74           H        GLN  74   8.269  12.260  -1.661
  447    HA   GLN  74           HA       GLN  74  10.368  13.966  -0.529
  448    HB2  GLN  74           HB1      GLN  74   7.486  14.216  -0.914
  449    HB3  GLN  74           HB2      GLN  74   7.990  14.626   0.734
  450    HG2  GLN  74           HG1      GLN  74   9.826  16.033  -0.540
  451    HG3  GLN  74           HG2      GLN  74   8.620  15.977  -1.832
  452   HE21  GLN  74          HE21      GLN  74   8.805  16.586   1.659
  453   HE22  GLN  74          HE22      GLN  74   7.704  17.916   1.659
  454    H    ARG  75           H        ARG  75   8.334  11.255   0.178
  455    HA   ARG  75           HA       ARG  75   9.664  10.967   2.767
  456    HB2  ARG  75           HB1      ARG  75   6.677  10.637   2.401
  457    HB3  ARG  75           HB2      ARG  75   7.588  10.411   3.901
  458    HG2  ARG  75           HG1      ARG  75   8.038  12.721   4.111
  459    HG3  ARG  75           HG2      ARG  75   7.506  13.039   2.452
  460    HD2  ARG  75           HD1      ARG  75   5.210  12.199   3.173
  461    HD3  ARG  75           HD2      ARG  75   5.823  12.293   4.830
  462    HE   ARG  75           HE       ARG  75   6.154  14.726   3.326
  463   HH11  ARG  75          HH11      ARG  75   4.027  12.870   5.365
  464   HH12  ARG  75          HH12      ARG  75   3.122  14.247   5.898
  465   HH21  ARG  75          HH21      ARG  75   4.968  16.547   4.020
  466   HH22  ARG  75          HH22      ARG  75   3.658  16.339   5.131
  467    H    ASP  76           H        ASP  76   9.454   8.767   3.655
  468    HA   ASP  76           HA       ASP  76   9.793   6.820   1.560
  469    HB2  ASP  76           HB1      ASP  76  11.316   6.693   3.403
  470    HB3  ASP  76           HB2      ASP  76   9.986   6.651   4.569
  471    HD2  ASP  76           HD       ASP  76  10.300   3.241   4.498
  472    H    ALA  77           H        ALA  77   7.302   7.750   3.777
  473    HA   ALA  77           HA       ALA  77   5.799   5.386   3.871
  474    HB1  ALA  77           HB1      ALA  77   4.181   7.806   3.837
  475    HB2  ALA  77           HB2      ALA  77   4.392   6.600   5.108
  476    HB3  ALA  77           HB3      ALA  77   5.560   7.911   4.932
  477    H    MET  78           H        MET  78   5.692   8.111   1.601
  478    HA   MET  78           HA       MET  78   3.520   7.115   0.075
  479    HB2  MET  78           HB1      MET  78   4.263   8.759  -1.637
  480    HB3  MET  78           HB2      MET  78   4.068   9.458  -0.022
  481    HG2  MET  78           HG1      MET  78   6.261   9.939   0.203
  482    HG3  MET  78           HG2      MET  78   6.768   8.487  -0.665
  483    HE1  MET  78           HE1      MET  78   5.157   9.270  -3.900
  484    HE2  MET  78           HE2      MET  78   6.894   9.172  -4.184
  485    HE3  MET  78           HE3      MET  78   6.132   8.103  -3.006
  486    H    CYS  79           H        CYS  79   6.922   6.466   0.096
  487    HA   CYS  79           HA       CYS  79   7.019   5.310  -2.531
  488    HB2  CYS  79           HB1      CYS  79   8.885   5.881  -0.364
  489    HB3  CYS  79           HB2      CYS  79   9.189   4.309  -1.106
  490    H    CYS  80           H        CYS  80   7.002   3.166  -3.106
  491    HA   CYS  80           HA       CYS  80   5.360   1.407  -1.754
  492    HB2  CYS  80           HB1      CYS  80   7.237   1.255  -4.007
  493    HB3  CYS  80           HB2      CYS  80   7.023  -0.280  -3.162
  494    HA   PRO  81           HA       PRO  81   7.655  -0.481   1.472
  495    HB2  PRO  81           HB1      PRO  81   6.851  -3.095   1.323
  496    HB3  PRO  81           HB2      PRO  81   5.813  -1.788   1.892
  497    HG2  PRO  81           HG1      PRO  81   5.972  -3.045  -0.828
  498    HG3  PRO  81           HG2      PRO  81   4.517  -2.627   0.152
  499    HD2  PRO  81           HD1      PRO  81   5.388  -1.089  -1.908
  500    HD3  PRO  81           HD2      PRO  81   4.619  -0.409  -0.463
  501    H    GLY  82           H        GLY  82   9.480  -1.735   1.962
  502    HA2  GLY  82           HA2      GLY  82  11.227  -3.244   1.498
  503    HA3  GLY  82           HA3      GLY  82  10.696  -3.309  -0.176
  504    HA1  GLY  82           HA1      GLY  82  11.135  -2.386   1.687
  505    H    THR  83           H        THR  83  10.575  -0.243  -0.042
  506    HA   THR  83           HA       THR  83  13.466   0.186  -0.441
  507    HB   THR  83           HB       THR  83  12.840   1.951  -2.077
  508    HG1  THR  83           HG1      THR  83  10.754   2.455  -1.525
  509   HG21  THR  83          HG21      THR  83  13.171  -0.634  -2.551
  510   HG22  THR  83          HG22      THR  83  12.708   0.485  -3.833
  511   HG23  THR  83          HG23      THR  83  11.483  -0.513  -3.049
  512    H    LEU  84           H        LEU  84  14.005   2.621  -0.355
  513    HA   LEU  84           HA       LEU  84  12.465   3.979   1.738
  514    HB2  LEU  84           HB1      LEU  84  15.059   2.793   2.044
  515    HB3  LEU  84           HB2      LEU  84  15.187   4.553   2.205
  516    HG   LEU  84           HG       LEU  84  14.892   3.337   4.359
  517   HD11  LEU  84          HD11      LEU  84  12.745   5.292   3.556
  518   HD12  LEU  84          HD12      LEU  84  14.330   5.672   4.229
  519   HD13  LEU  84          HD13      LEU  84  13.129   4.844   5.219
  520   HD21  LEU  84          HD21      LEU  84  13.213   1.711   3.221
  521   HD22  LEU  84          HD22      LEU  84  12.021   2.944   3.630
  522   HD23  LEU  84          HD23      LEU  84  12.972   2.179   4.904
  523    H    CYS  85           H        CYS  85  12.387   6.177   1.566
  524    HA   CYS  85           HA       CYS  85  13.115   7.320  -0.949
  525    HB2  CYS  85           HB1      CYS  85  11.081   7.898   0.487
  526    HB3  CYS  85           HB2      CYS  85  12.188   8.839   1.488
  527    H    VAL  86           H        VAL  86  15.222   7.638  -1.343
  528    HA   VAL  86           HA       VAL  86  16.768   9.160   0.654
  529    HB   VAL  86           HB       VAL  86  17.860   7.094  -1.261
  530   HG11  VAL  86          HG11      VAL  86  19.399   8.958  -0.770
  531   HG12  VAL  86          HG12      VAL  86  19.242   8.608   0.952
  532   HG13  VAL  86          HG13      VAL  86  19.972   7.420  -0.129
  533   HG21  VAL  86          HG21      VAL  86  17.137   6.989   1.641
  534   HG22  VAL  86          HG22      VAL  86  16.791   5.825   0.361
  535   HG23  VAL  86          HG23      VAL  86  18.426   5.969   1.003
  536    H    ASN  87           H        ASN  87  17.901  10.904  -0.050
  537    HA   ASN  87           HA       ASN  87  18.453  12.665  -1.381
  538    HB2  ASN  87           HB1      ASN  87  19.899  10.814  -2.339
  539    HB3  ASN  87           HB2      ASN  87  18.682  10.637  -3.608
  540   HD21  ASN  87          HD21      ASN  87  19.031  11.726  -5.393
  541   HD22  ASN  87          HD22      ASN  87  19.982  13.162  -5.544
  542    H    ASP  88           H        ASP  88  15.674  12.070  -1.118
  543    HA   ASP  88           HA       ASP  88  13.669  12.759  -1.944
  544    HB2  ASP  88           HB1      ASP  88  15.555  14.606  -2.890
  545    HB3  ASP  88           HB2      ASP  88  14.560  14.196  -4.294
  546    HD2  ASP  88           HD       ASP  88  13.070  16.633  -1.711
  547    H    VAL  89           H        VAL  89  15.043  10.333  -2.966
  548    HA   VAL  89           HA       VAL  89  13.258   9.865  -5.220
  549    HB   VAL  89           HB       VAL  89  16.217   9.288  -5.415
  550   HG11  VAL  89          HG11      VAL  89  14.789   7.599  -6.491
  551   HG12  VAL  89          HG12      VAL  89  14.017   8.873  -7.437
  552   HG13  VAL  89          HG13      VAL  89  15.730   8.520  -7.664
  553   HG21  VAL  89          HG21      VAL  89  14.514  11.305  -6.875
  554   HG22  VAL  89          HG22      VAL  89  15.772  11.659  -5.690
  555   HG23  VAL  89          HG23      VAL  89  16.200  10.938  -7.242
  556    H    CYS  90           H        CYS  90  12.531   7.789  -5.348
  557    HA   CYS  90           HA       CYS  90  12.691   6.142  -3.093
  558    HB2  CYS  90           HB1      CYS  90  11.175   6.225  -5.416
  559    HB3  CYS  90           HB2      CYS  90  12.050   4.698  -5.548
  560    H    THR  91           H        THR  91  14.491   5.197  -2.394
  561    HA   THR  91           HA       THR  91  16.156   3.759  -4.357
  562    HB   THR  91           HB       THR  91  17.171   5.074  -1.831
  563    HG1  THR  91           HG1      THR  91  16.454   6.422  -3.775
  564   HG21  THR  91          HG21      THR  91  18.354   3.021  -2.821
  565   HG22  THR  91          HG22      THR  91  19.328   4.459  -2.517
  566   HG23  THR  91          HG23      THR  91  18.795   4.084  -4.156
  567    H    THR  92           H        THR  92  16.398   1.652  -3.994
  568    HA   THR  92           HA       THR  92  15.010   0.236  -2.069
  569    HB   THR  92           HB       THR  92  17.416  -1.198  -2.760
  570    HG1  THR  92           HG1      THR  92  17.699  -0.601  -4.765
  571   HG21  THR  92          HG21      THR  92  14.626  -1.539  -3.851
  572   HG22  THR  92          HG22      THR  92  15.114  -2.091  -2.249
  573   HG23  THR  92          HG23      THR  92  15.881  -2.766  -3.686
  574    H    MET  93           H        MET  93  15.468  -0.598  -0.069
  575    HA   MET  93           HA       MET  93  17.129   0.810   1.652
  576    HB2  MET  93           HB1      MET  93  15.718  -1.819   1.778
  577    HB3  MET  93           HB2      MET  93  16.912  -1.449   3.030
  578    HG2  MET  93           HG1      MET  93  15.309   0.851   2.789
  579    HG3  MET  93           HG2      MET  93  14.213  -0.533   2.773
  580    HE1  MET  93           HE1      MET  93  15.918   1.762   5.786
  581    HE2  MET  93           HE2      MET  93  17.296   0.662   5.788
  582    HE3  MET  93           HE3      MET  93  16.801   1.453   4.291
  583    H    GLU  94           H        GLU  94  17.782  -2.045  -0.281
  584    HA   GLU  94           HA       GLU  94  20.194  -2.823   0.932
  585    HB2  GLU  94           HB1      GLU  94  19.056  -3.199  -1.831
  586    HB3  GLU  94           HB2      GLU  94  20.659  -3.815  -1.401
  587    HG2  GLU  94           HG1      GLU  94  18.560  -4.538   0.509
  588    HG3  GLU  94           HG2      GLU  94  18.320  -5.181  -1.121
  589    HE2  GLU  94           HE       GLU  94  20.752  -7.544  -0.667
  590    H    ASP  95           H        ASP  95  19.439  -0.320  -1.366
  591    HA   ASP  95           HA       ASP  95  22.187   0.160  -2.098
  592    HB2  ASP  95           HB1      ASP  95  19.599   0.961  -3.043
  593    HB3  ASP  95           HB2      ASP  95  20.578   2.405  -2.746
  594    HD2  ASP  95           HD       ASP  95  21.804  -0.090  -5.581
  595    H    ALA  96           H        ALA  96  19.827   1.518   0.122
  596    HA   ALA  96           HA       ALA  96  21.144   3.876   0.820
  597    HB1  ALA  96           HB1      ALA  96  19.845   3.780   2.905
  598    HB2  ALA  96           HB2      ALA  96  18.856   3.431   1.488
  599    HB3  ALA  96           HB3      ALA  96  19.393   2.116   2.533
  600    H    THR  97           H        THR  97  21.849   4.112   3.301
  601    HA   THR  97           HA       THR  97  23.596   3.861   4.742
  602    HB   THR  97           HB       THR  97  23.122   0.913   4.259
  603    HG1  THR  97           HG1      THR  97  21.776   1.114   6.114
  604   HG21  THR  97          HG21      THR  97  23.945   1.497   6.909
  605   HG22  THR  97          HG22      THR  97  25.077   2.289   5.812
  606   HG23  THR  97          HG23      THR  97  24.793   0.553   5.685
  607    H    GLU  98           H        GLU  98  25.081   4.798   3.228
  608    HA   GLU  98           HA       GLU  98  27.261   3.009   2.596
  609    HB2  GLU  98           HB1      GLU  98  25.381   3.622   0.594
  610    HB3  GLU  98           HB2      GLU  98  26.802   4.620   0.249
  611    HG2  GLU  98           HG1      GLU  98  28.229   2.653   0.235
  612    HG3  GLU  98           HG2      GLU  98  26.839   1.637   0.643
  613    HE2  GLU  98           HE       GLU  98  26.131   1.273  -2.675
  614    H    ASN  99           H        ASN  99  29.214   4.020   2.624
  615    HA   ASN  99           HA       ASN  99  29.171   6.889   3.244
  616    HB2  ASN  99           HB1      ASN  99  30.407   4.743   4.522
  617    HB3  ASN  99           HB2      ASN  99  31.722   5.549   3.658
  618   HD21  ASN  99          HD21      ASN  99  29.081   6.103   5.917
  619   HD22  ASN  99          HD22      ASN  99  29.808   7.452   6.717
  620    H    LEU 100           H        LEU 100  31.258   8.051   2.573
  621    HA   LEU 100           HA       LEU 100  31.590   7.623  -0.290
  622    HB2  LEU 100           HB1      LEU 100  31.821   9.882   1.570
  623    HB3  LEU 100           HB2      LEU 100  33.083   9.829   0.326
  624    HG   LEU 100           HG       LEU 100  31.218  11.256  -0.343
  625   HD11  LEU 100          HD11      LEU 100  31.016   8.838  -2.083
  626   HD12  LEU 100          HD12      LEU 100  32.553   9.690  -1.936
  627   HD13  LEU 100          HD13      LEU 100  31.127  10.540  -2.531
  628   HD21  LEU 100          HD21      LEU 100  29.257   9.278  -0.946
  629   HD22  LEU 100          HD22      LEU 100  29.111  10.708   0.076
  630   HD23  LEU 100          HD23      LEU 100  29.656   9.180   0.768
  631    H    TYR 101           H        TYR 101  33.913   8.268  -1.085
  632    HA   TYR 101           HA       TYR 101  35.692   6.291   0.037
  633    HB2  TYR 101           HB1      TYR 101  35.614   7.977  -2.420
  634    HB3  TYR 101           HB2      TYR 101  37.196   7.417  -1.872
  635    HD1  TYR 101           HD1      TYR 101  37.238   4.816  -1.203
  636    HD2  TYR 101           HD2      TYR 101  34.516   6.611  -3.936
  637    HE1  TYR 101           HE1      TYR 101  36.863   2.626  -2.259
  638    HE2  TYR 101           HE2      TYR 101  34.133   4.426  -5.000
  639    HH   TYR 101           HH       TYR 101  34.880   1.567  -3.647
  640    H    PHE 102           H        PHE 102  38.062   6.891   0.279
  641    HA   PHE 102           HA       PHE 102  38.643   9.585   1.108
  642    HB2  PHE 102           HB1      PHE 102  39.118   9.139   3.420
  643    HB3  PHE 102           HB2      PHE 102  37.464   8.618   3.091
  644    HD1  PHE 102           HD1      PHE 102  40.774   7.565   4.094
  645    HD2  PHE 102           HD2      PHE 102  36.924   6.215   2.879
  646    HE1  PHE 102           HE1      PHE 102  41.285   5.325   4.973
  647    HE2  PHE 102           HE2      PHE 102  37.430   3.973   3.757
  648    HZ   PHE 102           HZ       PHE 102  39.612   3.525   4.807
  649    H    GLN 103           H        GLN 103  40.928   9.612   2.167
  650    HA   GLN 103           HA       GLN 103  43.160   9.245   1.928
  651    HB2  GLN 103           HB1      GLN 103  42.340   6.948   2.786
  652    HB3  GLN 103           HB2      GLN 103  42.564   6.414   1.113
  653    HG2  GLN 103           HG1      GLN 103  44.887   7.850   2.065
  654    HG3  GLN 103           HG2      GLN 103  44.481   6.489   3.121
  655   HE21  GLN 103          HE21      GLN 103  44.119   4.392   2.037
  656   HE22  GLN 103          HE22      GLN 103  45.102   4.002   0.672
  657    H    SER 104           H        SER 104  43.667  10.493   0.196
  658    HA   SER 104           HA       SER 104  43.393   9.306  -2.480
  659    HB2  SER 104           HB1      SER 104  42.361  11.578  -1.983
  660    HB3  SER 104           HB2      SER 104  44.018  12.194  -1.849
  661    HG   SER 104           HG       SER 104  44.049  12.306  -3.935
  662    H    LEU 105           H        LEU 105  45.198  10.213  -4.016
  663    HA   LEU 105           HA       LEU 105  47.769   9.630  -2.710
  664    HB2  LEU 105           HB1      LEU 105  46.552   8.851  -5.262
  665    HB3  LEU 105           HB2      LEU 105  48.226   9.416  -5.402
  666    HG   LEU 105           HG       LEU 105  47.555   7.331  -3.371
  667   HD11  LEU 105          HD11      LEU 105  46.802   5.938  -4.933
  668   HD12  LEU 105          HD12      LEU 105  48.438   5.936  -5.588
  669   HD13  LEU 105          HD13      LEU 105  47.231   7.046  -6.237
  670   HD21  LEU 105          HD21      LEU 105  49.855   8.633  -4.054
  671   HD22  LEU 105          HD22      LEU 105  49.977   7.153  -5.005
  672   HD23  LEU 105          HD23      LEU 105  49.776   7.062  -3.255
  673    H    GLU 106           H        GLU 106  49.615  10.849  -3.258
  674    HA   GLU 106           HA       GLU 106  49.298  13.215  -4.904
  675    HB2  GLU 106           HB1      GLU 106  48.774  13.436  -2.202
  676    HB3  GLU 106           HB2      GLU 106  50.470  13.930  -2.324
  677    HG2  GLU 106           HG1      GLU 106  49.994  15.841  -3.413
  678    HG3  GLU 106           HG2      GLU 106  48.662  15.111  -4.319
  679    HE2  GLU 106           HE       GLU 106  47.722  17.320  -1.330
  680    H    HIS 107           H        HIS 107  51.467  14.562  -4.672
  681    HA   HIS 107           HA       HIS 107  53.800  12.933  -4.175
  682    HB2  HIS 107           HB1      HIS 107  52.660  13.016  -6.784
  683    HB3  HIS 107           HB2      HIS 107  54.168  13.937  -6.825
  684    HD1  HIS 107           HD1      HIS 107  52.880  10.502  -6.740
  685    HD2  HIS 107           HD2      HIS 107  56.502  12.419  -6.063
  686    HE1  HIS 107           HE1      HIS 107  54.620   8.686  -6.784
  687    HE2  HIS 107           HE2      HIS 107  56.834   9.859  -6.370
  688    H    HIS 108           H        HIS 108  55.817  14.249  -5.068
  689    HA   HIS 108           HA       HIS 108  55.493  17.104  -5.058
  690    HB2  HIS 108           HB1      HIS 108  55.867  15.752  -2.569
  691    HB3  HIS 108           HB2      HIS 108  57.342  16.653  -2.936
  692    HD1  HIS 108           HD1      HIS 108  56.153  19.160  -4.242
  693    HD2  HIS 108           HD2      HIS 108  54.672  17.427  -0.770
  694    HE1  HIS 108           HE1      HIS 108  54.922  20.998  -3.047
  695    HE2  HIS 108           HE2      HIS 108  54.015  19.941  -0.925
  696    H    HIS 109           H        HIS 109  57.705  18.198  -5.043
  697    HA   HIS 109           HA       HIS 109  59.832  16.472  -6.065
  698    HB2  HIS 109           HB1      HIS 109  58.570  18.772  -7.560
  699    HB3  HIS 109           HB2      HIS 109  60.199  18.194  -7.926
  700    HD1  HIS 109           HD1      HIS 109  60.438  15.927  -9.118
  701    HD2  HIS 109           HD2      HIS 109  56.503  17.025  -8.362
  702    HE1  HIS 109           HE1      HIS 109  59.026  14.346 -10.473
  703    HE2  HIS 109           HE2      HIS 109  56.620  15.016 -10.011
  704    H    HIS 110           H        HIS 110  61.834  17.949  -6.563
  705    HA   HIS 110           HA       HIS 110  62.022  20.176  -4.684
  706    HB2  HIS 110           HB1      HIS 110  64.201  19.239  -3.812
  707    HB3  HIS 110           HB2      HIS 110  62.743  18.394  -3.281
  708    HD1  HIS 110           HD1      HIS 110  65.836  17.917  -5.285
  709    HD2  HIS 110           HD2      HIS 110  62.386  15.798  -4.349
  710    HE1  HIS 110           HE1      HIS 110  66.291  15.546  -5.988
  711    HE2  HIS 110           HE2      HIS 110  64.184  14.250  -5.414
  712    H    HIS 111           H        HIS 111  63.030  21.825  -5.615
  713    HA   HIS 111           HA       HIS 111  64.117  21.693  -8.202
  714    HB2  HIS 111           HB1      HIS 111  63.963  23.746  -6.051
  715    HB3  HIS 111           HB2      HIS 111  65.153  24.007  -7.329
  716    HD1  HIS 111           HD1      HIS 111  64.273  24.466  -9.722
  717    HD2  HIS 111           HD2      HIS 111  61.292  24.039  -6.860
  718    HE1  HIS 111           HE1      HIS 111  62.168  25.302 -10.815
  719    HE2  HIS 111           HE2      HIS 111  60.345  25.041  -9.067
  720    H    HIS 112           H        HIS 112  66.376  22.517  -8.722
  721    HA   HIS 112           HA       HIS 112  68.311  21.101  -7.011
  722    HB2  HIS 112           HB1      HIS 112  68.048  21.396  -9.974
  723    HB3  HIS 112           HB2      HIS 112  69.669  21.242  -9.288
  724    HD1  HIS 112           HD1      HIS 112  70.460  18.943  -8.709
  725    HD2  HIS 112           HD2      HIS 112  66.360  19.088  -9.364
  726    HE1  HIS 112           HE1      HIS 112  69.691  16.549  -8.684
  727    HE2  HIS 112           HE2      HIS 112  67.185  16.636  -9.083
  Start of MODEL   21
    1    H1   MET  18           H        MET  18   8.780  31.564  21.021
    2    HA   MET  18           HA       MET  18   6.946  32.919  19.875
    3    HB2  MET  18           HB1      MET  18   8.255  32.891  17.738
    4    HB3  MET  18           HB2      MET  18   7.841  31.178  17.573
    5    HG2  MET  18           HG1      MET  18   5.438  32.651  18.038
    6    HG3  MET  18           HG2      MET  18   6.356  33.431  16.746
    7    HE1  MET  18           HE1      MET  18   3.458  31.792  15.365
    8    HE2  MET  18           HE2      MET  18   4.494  33.217  15.450
    9    HE3  MET  18           HE3      MET  18   4.668  32.077  14.115
   10    H    LEU  19           H        LEU  19   5.453  31.971  21.121
   11    HA   LEU  19           HA       LEU  19   4.654  29.231  20.446
   12    HB2  LEU  19           HB1      LEU  19   4.987  30.286  23.261
   13    HB3  LEU  19           HB2      LEU  19   4.348  28.695  22.811
   14    HG   LEU  19           HG       LEU  19   6.820  28.711  21.606
   15   HD11  LEU  19          HD11      LEU  19   7.179  29.906  24.344
   16   HD12  LEU  19          HD12      LEU  19   7.291  30.839  22.853
   17   HD13  LEU  19          HD13      LEU  19   8.424  29.523  23.154
   18   HD21  LEU  19          HD21      LEU  19   6.466  26.746  22.623
   19   HD22  LEU  19          HD22      LEU  19   5.542  27.477  23.936
   20   HD23  LEU  19          HD23      LEU  19   7.305  27.486  23.987
   21    H    VAL  20           H        VAL  20   3.206  30.976  19.301
   22    HA   VAL  20           HA       VAL  20   1.211  32.283  20.835
   23    HB   VAL  20           HB       VAL  20   1.786  32.959  18.531
   24   HG11  VAL  20          HG11      VAL  20   0.133  30.755  17.413
   25   HG12  VAL  20          HG12      VAL  20   1.447  31.672  16.673
   26   HG13  VAL  20          HG13      VAL  20   1.805  30.406  17.848
   27   HG21  VAL  20          HG21      VAL  20  -0.238  33.879  18.294
   28   HG22  VAL  20          HG22      VAL  20  -1.031  32.312  18.135
   29   HG23  VAL  20          HG23      VAL  20  -0.683  32.965  19.736
   30    H    LEU  21           H        LEU  21  -0.881  31.707  21.316
   31    HA   LEU  21           HA       LEU  21  -1.440  29.052  21.908
   32    HB2  LEU  21           HB1      LEU  21  -3.161  31.492  21.587
   33    HB3  LEU  21           HB2      LEU  21  -3.881  29.909  21.935
   34    HG   LEU  21           HG       LEU  21  -1.701  30.805  23.730
   35   HD11  LEU  21          HD11      LEU  21  -2.665  32.838  23.946
   36   HD12  LEU  21          HD12      LEU  21  -3.754  31.944  25.006
   37   HD13  LEU  21          HD13      LEU  21  -4.228  32.285  23.342
   38   HD21  LEU  21          HD21      LEU  21  -3.793  28.870  23.680
   39   HD22  LEU  21          HD22      LEU  21  -4.036  29.938  25.063
   40   HD23  LEU  21          HD23      LEU  21  -2.506  29.081  24.867
   41    H    ASP  22           H        ASP  22  -2.025  27.370  20.713
   42    HA   ASP  22           HA       ASP  22  -3.476  27.826  18.205
   43    HB2  ASP  22           HB1      ASP  22  -0.951  27.478  17.872
   44    HB3  ASP  22           HB2      ASP  22  -1.246  25.809  18.376
   45    HD2  ASP  22           HD       ASP  22  -1.590  26.074  14.746
   46    H    PHE  23           H        PHE  23  -5.374  26.878  18.573
   47    HA   PHE  23           HA       PHE  23  -5.580  24.076  18.896
   48    HB2  PHE  23           HB1      PHE  23  -5.417  25.616  21.321
   49    HB3  PHE  23           HB2      PHE  23  -7.025  24.902  21.187
   50    HD1  PHE  23           HD1      PHE  23  -7.154  22.383  20.645
   51    HD2  PHE  23           HD2      PHE  23  -3.665  24.317  22.127
   52    HE1  PHE  23           HE1      PHE  23  -6.287  20.215  21.420
   53    HE2  PHE  23           HE2      PHE  23  -2.791  22.153  22.904
   54    HZ   PHE  23           HZ       PHE  23  -4.102  20.098  22.551
   55    H    ASN  24           H        ASN  24  -7.184  27.198  19.317
   56    HA   ASN  24           HA       ASN  24  -9.200  27.988  18.620
   57    HB2  ASN  24           HB1      ASN  24  -8.273  26.249  16.568
   58    HB3  ASN  24           HB2      ASN  24 -10.012  25.990  16.742
   59   HD21  ASN  24          HD21      ASN  24  -7.592  28.532  16.372
   60   HD22  ASN  24          HD22      ASN  24  -8.608  29.616  15.489
   61    H    ASN  25           H        ASN  25 -11.593  27.252  18.234
   62    HA   ASN  25           HA       ASN  25 -12.462  24.827  19.416
   63    HB2  ASN  25           HB1      ASN  25 -12.081  27.176  21.170
   64    HB3  ASN  25           HB2      ASN  25 -13.648  26.372  21.319
   65   HD21  ASN  25          HD21      ASN  25 -10.557  26.414  22.442
   66   HD22  ASN  25          HD22      ASN  25 -10.473  24.823  23.108
   67    H    ILE  26           H        ILE  26 -13.816  24.724  17.649
   68    HA   ILE  26           HA       ILE  26 -15.730  26.881  17.210
   69    HB   ILE  26           HB       ILE  26 -14.587  25.847  15.268
   70   HG12  ILE  26          HG11      ILE  26 -17.141  25.023  14.406
   71   HG13  ILE  26          HG12      ILE  26 -17.416  26.284  15.621
   72   HG21  ILE  26          HG21      ILE  26 -14.781  23.639  14.679
   73   HG22  ILE  26          HG22      ILE  26 -14.792  23.508  16.437
   74   HG23  ILE  26          HG23      ILE  26 -16.307  23.431  15.538
   75   HD11  ILE  26          HD11      ILE  26 -16.736  26.626  12.925
   76   HD12  ILE  26          HD12      ILE  26 -16.887  27.864  14.172
   77   HD13  ILE  26          HD13      ILE  26 -15.323  27.112  13.862
   78    H    ARG  27           H        ARG  27 -15.575  23.604  18.406
   79    HA   ARG  27           HA       ARG  27 -17.123  22.214  19.335
   80    HB2  ARG  27           HB1      ARG  27 -17.150  24.167  20.912
   81    HB3  ARG  27           HB2      ARG  27 -18.561  24.777  20.035
   82    HG2  ARG  27           HG1      ARG  27 -19.352  22.231  20.587
   83    HG3  ARG  27           HG2      ARG  27 -18.360  22.620  22.003
   84    HD2  ARG  27           HD1      ARG  27 -19.740  24.886  21.912
   85    HD3  ARG  27           HD2      ARG  27 -20.899  23.852  21.066
   86    HE   ARG  27           HE       ARG  27 -20.044  22.585  23.438
   87   HH11  ARG  27          HH11      ARG  27 -22.025  25.221  22.322
   88   HH12  ARG  27          HH12      ARG  27 -23.088  25.173  23.688
   89   HH21  ARG  27          HH21      ARG  27 -21.437  22.512  25.243
   90   HH22  ARG  27          HH22      ARG  27 -22.752  23.632  25.349
   91    H    SER  28           H        SER  28 -17.603  21.721  16.983
   92    HA   SER  28           HA       SER  28 -20.437  21.601  16.645
   93    HB2  SER  28           HB1      SER  28 -19.659  23.948  15.792
   94    HB3  SER  28           HB2      SER  28 -19.048  23.034  14.400
   95    HG   SER  28           HG       SER  28 -21.077  23.479  13.812
   96    H    SER  29           H        SER  29 -19.529  19.389  16.793
   97    HA   SER  29           HA       SER  29 -18.914  18.395  14.105
   98    HB2  SER  29           HB1      SER  29 -17.271  16.784  15.076
   99    HB3  SER  29           HB2      SER  29 -16.762  18.476  15.216
  100    HG   SER  29           HG       SER  29 -17.900  16.860  17.250
  101    H    ALA  30           H        ALA  30 -21.140  17.790  14.083
  102    HA   ALA  30           HA       ALA  30 -21.687  15.373  15.678
  103    HB1  ALA  30           HB1      ALA  30 -24.167  16.451  15.007
  104    HB2  ALA  30           HB2      ALA  30 -23.407  16.434  16.599
  105    HB3  ALA  30           HB3      ALA  30 -23.195  17.825  15.535
  106    H    ASP  31           H        ASP  31 -22.640  13.662  14.632
  107    HA   ASP  31           HA       ASP  31 -22.440  13.676  11.749
  108    HB2  ASP  31           HB1      ASP  31 -21.688  11.769  13.247
  109    HB3  ASP  31           HB2      ASP  31 -23.402  11.413  13.498
  110    HD2  ASP  31           HD       ASP  31 -23.425   9.563  10.636
  111    H    LEU  32           H        LEU  32 -24.291  15.434  12.037
  112    HA   LEU  32           HA       LEU  32 -26.919  14.145  12.024
  113    HB2  LEU  32           HB1      LEU  32 -26.079  17.046  12.082
  114    HB3  LEU  32           HB2      LEU  32 -27.763  16.502  11.965
  115    HG   LEU  32           HG       LEU  32 -26.009  15.693  14.265
  116   HD11  LEU  32          HD11      LEU  32 -27.809  18.105  14.201
  117   HD12  LEU  32          HD12      LEU  32 -26.055  18.179  14.040
  118   HD13  LEU  32          HD13      LEU  32 -26.779  17.565  15.526
  119   HD21  LEU  32          HD21      LEU  32 -27.893  14.875  15.199
  120   HD22  LEU  32          HD22      LEU  32 -28.424  14.778  13.520
  121   HD23  LEU  32          HD23      LEU  32 -28.911  16.146  14.523
  122    H    HIS  33           H        HIS  33 -24.780  16.081   9.988
  123    HA   HIS  33           HA       HIS  33 -26.124  15.054   7.627
  124    HB2  HIS  33           HB1      HIS  33 -26.476  17.234   6.613
  125    HB3  HIS  33           HB2      HIS  33 -27.353  17.132   8.144
  126    HD1  HIS  33           HD1      HIS  33 -24.208  18.672   6.714
  127    HD2  HIS  33           HD2      HIS  33 -26.736  19.059   9.989
  128    HE1  HIS  33           HE1      HIS  33 -23.446  20.748   7.909
  129    HE2  HIS  33           HE2      HIS  33 -24.991  20.987   9.910
  130    H    GLY  34           H        GLY  34 -24.932  15.648   5.612
  131    HA2  GLY  34           HA2      GLY  34 -22.442  16.838   5.501
  132    HA3  GLY  34           HA3      GLY  34 -22.144  15.176   5.986
  133    HA1  GLY  34           HA1      GLY  34 -23.222  16.776   5.092
  134    H    ALA  35           H        ALA  35 -23.585  17.194   3.471
  135    HA   ALA  35           HA       ALA  35 -24.069  15.102   1.628
  136    HB1  ALA  35           HB1      ALA  35 -23.521  17.627   0.340
  137    HB2  ALA  35           HB2      ALA  35 -25.032  16.725   0.452
  138    HB3  ALA  35           HB3      ALA  35 -24.572  17.837   1.741
  139    H    ARG  36           H        ARG  36 -21.341  17.317   2.087
  140    HA   ARG  36           HA       ARG  36 -19.210  17.307   1.292
  141    HB2  ARG  36           HB1      ARG  36 -19.881  14.369   1.227
  142    HB3  ARG  36           HB2      ARG  36 -18.290  14.972   0.745
  143    HG2  ARG  36           HG1      ARG  36 -18.564  16.209   3.135
  144    HG3  ARG  36           HG2      ARG  36 -19.478  14.716   3.419
  145    HD2  ARG  36           HD1      ARG  36 -17.477  13.814   3.912
  146    HD3  ARG  36           HD2      ARG  36 -17.264  13.760   2.156
  147    HE   ARG  36           HE       ARG  36 -15.633  15.337   2.362
  148   HH11  ARG  36          HH11      ARG  36 -17.660  15.461   5.190
  149   HH12  ARG  36          HH12      ARG  36 -16.675  16.633   6.004
  150   HH21  ARG  36          HH21      ARG  36 -14.329  16.880   3.423
  151   HH22  ARG  36          HH22      ARG  36 -14.782  17.440   4.997
  152    H    LYS  37           H        LYS  37 -17.831  16.256  -0.676
  153    HA   LYS  37           HA       LYS  37 -19.466  16.747  -3.077
  154    HB2  LYS  37           HB1      LYS  37 -17.557  18.353  -2.429
  155    HB3  LYS  37           HB2      LYS  37 -16.475  17.052  -2.950
  156    HG2  LYS  37           HG1      LYS  37 -18.636  17.920  -4.810
  157    HG3  LYS  37           HG2      LYS  37 -17.218  18.962  -4.598
  158    HD2  LYS  37           HD1      LYS  37 -15.749  17.044  -5.140
  159    HD3  LYS  37           HD2      LYS  37 -17.193  16.062  -5.432
  160    HE2  LYS  37           HE1      LYS  37 -17.196  16.772  -7.545
  161    HE3  LYS  37           HE2      LYS  37 -17.551  18.396  -6.940
  162    HZ1  LYS  37           HZ1      LYS  37 -15.499  18.053  -8.414
  163    HZ2  LYS  37           HZ2      LYS  37 -14.772  17.417  -7.026
  164    HZ3  LYS  37           HZ3      LYS  37 -15.338  19.011  -7.029
  165    H    GLY  38           H        GLY  38 -16.688  14.881  -1.866
  166    HA2  GLY  38           HA2      GLY  38 -17.270  12.389  -2.556
  167    HA3  GLY  38           HA3      GLY  38 -16.895  13.059  -4.137
  168    HA1  GLY  38           HA1      GLY  38 -16.814  12.914  -2.018
  169    H    SER  39           H        SER  39 -15.612  12.194  -1.000
  170    HA   SER  39           HA       SER  39 -12.897  12.869  -1.758
  171    HB2  SER  39           HB1      SER  39 -14.041  11.540   0.718
  172    HB3  SER  39           HB2      SER  39 -12.325  11.925   0.490
  173    HG   SER  39           HG       SER  39 -13.275  13.610   1.606
  174    H    GLN  40           H        GLN  40 -11.712  11.566  -2.972
  175    HA   GLN  40           HA       GLN  40 -12.429   8.954  -3.689
  176    HB2  GLN  40           HB1      GLN  40 -10.889  10.538  -4.934
  177    HB3  GLN  40           HB2      GLN  40  -9.629  10.069  -3.783
  178    HG2  GLN  40           HG1      GLN  40  -9.186   8.657  -5.534
  179    HG3  GLN  40           HG2      GLN  40 -10.222   7.650  -4.512
  180   HE21  GLN  40          HE21      GLN  40  -9.818   9.083  -7.559
  181   HE22  GLN  40          HE22      GLN  40 -11.326   8.605  -8.252
  182    H    CYS  41           H        CYS  41  -9.648   9.957  -1.688
  183    HA   CYS  41           HA       CYS  41 -10.077   7.626   0.018
  184    HB2  CYS  41           HB1      CYS  41  -7.619   7.103  -0.071
  185    HB3  CYS  41           HB2      CYS  41  -8.508   6.743  -1.551
  186    H    LEU  42           H        LEU  42  -9.448   7.912   2.121
  187    HA   LEU  42           HA       LEU  42  -8.658  10.634   2.844
  188    HB2  LEU  42           HB1      LEU  42 -10.676   9.312   3.817
  189    HB3  LEU  42           HB2      LEU  42  -9.440   8.510   4.801
  190    HG   LEU  42           HG       LEU  42  -9.542  11.489   4.797
  191   HD11  LEU  42          HD11      LEU  42 -11.892  10.379   5.120
  192   HD12  LEU  42          HD12      LEU  42 -11.353  11.672   6.191
  193   HD13  LEU  42          HD13      LEU  42 -11.258   9.992   6.719
  194   HD21  LEU  42          HD21      LEU  42  -9.123   9.626   7.108
  195   HD22  LEU  42          HD22      LEU  42  -8.561  11.284   6.901
  196   HD23  LEU  42          HD23      LEU  42  -7.822   9.979   5.972
  197    H    SER  43           H        SER  43  -7.632   7.288   3.176
  198    HA   SER  43           HA       SER  43  -5.037   8.258   4.171
  199    HB2  SER  43           HB1      SER  43  -6.767   6.857   5.740
  200    HB3  SER  43           HB2      SER  43  -5.831   5.538   5.012
  201    HG   SER  43           HG       SER  43  -4.713   7.787   6.339
  202    H    ASP  44           H        ASP  44  -3.397   6.306   4.006
  203    HA   ASP  44           HA       ASP  44  -3.196   5.708   1.216
  204    HB2  ASP  44           HB1      ASP  44  -1.477   4.456   3.350
  205    HB3  ASP  44           HB2      ASP  44  -1.046   4.888   1.690
  206    HD2  ASP  44           HD       ASP  44  -0.267   8.134   2.563
  207    H    THR  45           H        THR  45  -4.301   4.011   4.037
  208    HA   THR  45           HA       THR  45  -4.283   1.424   2.724
  209    HB   THR  45           HB       THR  45  -5.292   0.576   4.798
  210    HG1  THR  45           HG1      THR  45  -6.439   2.025   5.844
  211   HG21  THR  45          HG21      THR  45  -2.867   2.340   5.046
  212   HG22  THR  45          HG22      THR  45  -2.934   0.590   4.839
  213   HG23  THR  45          HG23      THR  45  -3.423   1.317   6.369
  214    H    ASP  46           H        ASP  46  -6.145   4.030   2.333
  215    HA   ASP  46           HA       ASP  46  -8.770   2.885   2.514
  216    HB2  ASP  46           HB1      ASP  46  -7.785   5.451   2.366
  217    HB3  ASP  46           HB2      ASP  46  -8.456   5.208   0.748
  218    HD2  ASP  46           HD       ASP  46 -11.625   5.673   1.916
  219    H    CYS  47           H        CYS  47  -6.283   3.063   0.107
  220    HA   CYS  47           HA       CYS  47  -8.032   2.388  -2.091
  221    HB2  CYS  47           HB1      CYS  47  -5.414   3.435  -1.804
  222    HB3  CYS  47           HB2      CYS  47  -5.259   1.907  -2.675
  223    H    ASN  48           H        ASN  48  -5.319   0.752  -0.449
  224    HA   ASN  48           HA       ASN  48  -4.797  -1.448  -0.196
  225    HB2  ASN  48           HB1      ASN  48  -7.478  -1.156   0.500
  226    HB3  ASN  48           HB2      ASN  48  -7.465  -2.550  -0.588
  227   HD21  ASN  48          HD21      ASN  48  -6.418  -4.422   0.010
  228   HD22  ASN  48          HD22      ASN  48  -5.868  -4.709   1.623
  229    H    THR  49           H        THR  49  -5.037  -0.247  -2.922
  230    HA   THR  49           HA       THR  49  -5.327  -2.757  -4.442
  231    HB   THR  49           HB       THR  49  -5.634  -0.037  -5.688
  232    HG1  THR  49           HG1      THR  49  -7.765  -1.655  -4.710
  233   HG21  THR  49          HG21      THR  49  -5.435  -2.549  -6.770
  234   HG22  THR  49          HG22      THR  49  -6.174  -1.156  -7.558
  235   HG23  THR  49          HG23      THR  49  -7.179  -2.311  -6.684
  236    H    ARG  50           H        ARG  50  -2.932  -1.920  -3.137
  237    HA   ARG  50           HA       ARG  50  -0.698  -1.783  -3.536
  238    HB2  ARG  50           HB1      ARG  50  -1.317  -2.177  -6.464
  239    HB3  ARG  50           HB2      ARG  50   0.159  -2.612  -5.590
  240    HG2  ARG  50           HG1      ARG  50  -0.637  -4.665  -5.361
  241    HG3  ARG  50           HG2      ARG  50  -1.895  -4.002  -4.305
  242    HD2  ARG  50           HD1      ARG  50  -3.435  -3.773  -6.091
  243    HD3  ARG  50           HD2      ARG  50  -2.167  -4.023  -7.298
  244    HE   ARG  50           HE       ARG  50  -2.488  -6.270  -7.095
  245   HH11  ARG  50          HH11      ARG  50  -3.740  -4.707  -4.247
  246   HH12  ARG  50          HH12      ARG  50  -4.403  -6.161  -3.580
  247   HH21  ARG  50          HH21      ARG  50  -3.358  -8.192  -6.228
  248   HH22  ARG  50          HH22      ARG  50  -4.183  -8.144  -4.708
  249    H    LYS  51           H        LYS  51  -2.249   0.600  -3.516
  250    HA   LYS  51           HA       LYS  51  -0.407   2.344  -4.942
  251    HB2  LYS  51           HB1      LYS  51  -3.405   2.388  -5.333
  252    HB3  LYS  51           HB2      LYS  51  -2.352   3.750  -5.752
  253    HG2  LYS  51           HG1      LYS  51  -1.075   2.183  -7.251
  254    HG3  LYS  51           HG2      LYS  51  -2.362   0.998  -6.963
  255    HD2  LYS  51           HD1      LYS  51  -3.272   3.693  -7.769
  256    HD3  LYS  51           HD2      LYS  51  -2.378   2.780  -8.996
  257    HE2  LYS  51           HE1      LYS  51  -3.968   1.109  -9.125
  258    HE3  LYS  51           HE2      LYS  51  -4.552   1.411  -7.482
  259    HZ1  LYS  51           HZ1      LYS  51  -6.002   2.945  -8.188
  260    HZ2  LYS  51           HZ2      LYS  51  -5.809   2.219  -9.704
  261    HZ3  LYS  51           HZ3      LYS  51  -4.932   3.613  -9.316
  262    H    PHE  52           H        PHE  52  -0.127   4.340  -3.981
  263    HA   PHE  52           HA       PHE  52  -1.208   4.560  -1.279
  264    HB2  PHE  52           HB1      PHE  52   0.510   6.293  -0.950
  265    HB3  PHE  52           HB2      PHE  52   1.208   4.780  -1.531
  266    HD1  PHE  52           HD1      PHE  52   0.404   8.238  -2.434
  267    HD2  PHE  52           HD2      PHE  52   2.215   4.600  -3.700
  268    HE1  PHE  52           HE1      PHE  52   1.477   9.426  -4.301
  269    HE2  PHE  52           HE2      PHE  52   3.291   5.783  -5.570
  270    HZ   PHE  52           HZ       PHE  52   2.925   8.200  -5.871
  271    H    CYS  53           H        CYS  53  -2.289   6.376  -0.508
  272    HA   CYS  53           HA       CYS  53  -3.824   7.797  -2.505
  273    HB2  CYS  53           HB1      CYS  53  -4.935   6.914  -0.509
  274    HB3  CYS  53           HB2      CYS  53  -3.911   7.922   0.516
  275    H    LEU  54           H        LEU  54  -2.841   9.458  -3.475
  276    HA   LEU  54           HA       LEU  54  -1.044  11.185  -1.963
  277    HB2  LEU  54           HB1      LEU  54  -0.294  10.432  -4.139
  278    HB3  LEU  54           HB2      LEU  54  -1.755  11.098  -4.891
  279    HG   LEU  54           HG       LEU  54  -0.685  13.314  -3.708
  280   HD11  LEU  54          HD11      LEU  54   1.692  12.022  -4.957
  281   HD12  LEU  54          HD12      LEU  54   1.331  11.711  -3.260
  282   HD13  LEU  54          HD13      LEU  54   1.606  13.362  -3.813
  283   HD21  LEU  54          HD21      LEU  54  -0.427  12.161  -6.466
  284   HD22  LEU  54          HD22      LEU  54   0.224  13.750  -6.062
  285   HD23  LEU  54          HD23      LEU  54  -1.503  13.435  -5.894
  286    H    GLN  55           H        GLN  55  -1.449  13.277  -1.450
  287    HA   GLN  55           HA       GLN  55  -4.023  14.415  -2.312
  288    HB2  GLN  55           HB1      GLN  55  -4.070  15.521  -0.006
  289    HB3  GLN  55           HB2      GLN  55  -4.450  13.794  -0.085
  290    HG2  GLN  55           HG1      GLN  55  -2.192  13.235   0.641
  291    HG3  GLN  55           HG2      GLN  55  -1.783  14.954   0.690
  292   HE21  GLN  55          HE21      GLN  55  -2.153  16.061   2.496
  293   HE22  GLN  55          HE22      GLN  55  -3.031  15.476   3.864
  294    HA   PRO  56           HA       PRO  56  -0.730  17.385  -3.457
  295    HB2  PRO  56           HB1      PRO  56  -2.040  18.307  -5.678
  296    HB3  PRO  56           HB2      PRO  56  -1.048  16.852  -5.669
  297    HG2  PRO  56           HG1      PRO  56  -4.023  17.128  -5.403
  298    HG3  PRO  56           HG2      PRO  56  -3.070  15.977  -6.413
  299    HD2  PRO  56           HD1      PRO  56  -4.206  15.262  -4.052
  300    HD3  PRO  56           HD2      PRO  56  -2.670  14.583  -4.620
  301    H    ARG  57           H        ARG  57  -0.671  19.621  -3.244
  302    HA   ARG  57           HA       ARG  57  -2.881  20.775  -1.780
  303    HB2  ARG  57           HB1      ARG  57  -0.322  21.058  -1.356
  304    HB3  ARG  57           HB2      ARG  57  -0.437  22.301  -2.611
  305    HG2  ARG  57           HG1      ARG  57  -2.485  23.076  -1.065
  306    HG3  ARG  57           HG2      ARG  57  -1.459  22.306   0.157
  307    HD2  ARG  57           HD1      ARG  57   0.464  23.691  -0.769
  308    HD3  ARG  57           HD2      ARG  57  -0.762  24.589  -1.672
  309    HE   ARG  57           HE       ARG  57  -1.577  24.573   0.979
  310   HH11  ARG  57          HH11      ARG  57   1.099  25.771  -0.899
  311   HH12  ARG  57          HH12      ARG  57   1.403  27.115   0.152
  312   HH21  ARG  57          HH21      ARG  57  -1.187  26.338   2.370
  313   HH22  ARG  57          HH22      ARG  57   0.103  27.436   2.012
  314    H    ASP  58           H        ASP  58  -1.566  20.903  -4.986
  315    HA   ASP  58           HA       ASP  58  -3.097  23.276  -5.691
  316    HB2  ASP  58           HB1      ASP  58  -0.980  21.631  -6.998
  317    HB3  ASP  58           HB2      ASP  58  -2.097  22.513  -8.046
  318    HD2  ASP  58           HD       ASP  58   0.416  24.632  -5.824
  319    H    GLU  59           H        GLU  59  -3.345  19.842  -5.850
  320    HA   GLU  59           HA       GLU  59  -5.793  20.112  -7.468
  321    HB2  GLU  59           HB1      GLU  59  -3.474  18.434  -7.868
  322    HB3  GLU  59           HB2      GLU  59  -4.930  17.447  -7.660
  323    HG2  GLU  59           HG1      GLU  59  -5.253  17.752  -9.842
  324    HG3  GLU  59           HG2      GLU  59  -5.795  19.374  -9.388
  325    HE2  GLU  59           HE       GLU  59  -2.213  20.219 -10.150
  326    H    LYS  60           H        LYS  60  -7.051  17.840  -7.167
  327    HA   LYS  60           HA       LYS  60  -7.745  17.809  -4.351
  328    HB2  LYS  60           HB1      LYS  60  -9.017  16.998  -6.890
  329    HB3  LYS  60           HB2      LYS  60  -9.388  15.966  -5.499
  330    HG2  LYS  60           HG1      LYS  60 -10.796  17.459  -4.651
  331    HG3  LYS  60           HG2      LYS  60  -9.599  18.757  -4.803
  332    HD2  LYS  60           HD1      LYS  60 -10.298  19.351  -6.938
  333    HD3  LYS  60           HD2      LYS  60 -11.049  17.772  -7.228
  334    HE2  LYS  60           HE1      LYS  60 -13.019  18.470  -6.442
  335    HE3  LYS  60           HE2      LYS  60 -12.264  19.075  -4.961
  336    HZ1  LYS  60           HZ1      LYS  60 -12.399  20.539  -7.542
  337    HZ2  LYS  60           HZ2      LYS  60 -11.688  21.115  -6.121
  338    HZ3  LYS  60           HZ3      LYS  60 -13.357  20.848  -6.182
  339    HA   PRO  61           HA       PRO  61  -5.790  14.054  -3.200
  340    HB2  PRO  61           HB1      PRO  61  -7.669  12.871  -1.598
  341    HB3  PRO  61           HB2      PRO  61  -6.748  14.298  -1.126
  342    HG2  PRO  61           HG1      PRO  61  -9.511  14.114  -2.279
  343    HG3  PRO  61           HG2      PRO  61  -8.917  15.104  -0.894
  344    HD2  PRO  61           HD1      PRO  61  -9.333  16.144  -3.367
  345    HD3  PRO  61           HD2      PRO  61  -8.042  16.714  -2.294
  346    H    PHE  62           H        PHE  62  -5.443  12.133  -4.137
  347    HA   PHE  62           HA       PHE  62  -7.592  10.405  -4.944
  348    HB2  PHE  62           HB1      PHE  62  -7.220  10.392  -7.295
  349    HB3  PHE  62           HB2      PHE  62  -7.402  12.083  -6.825
  350    HD1  PHE  62           HD1      PHE  62  -5.382   9.775  -8.568
  351    HD2  PHE  62           HD2      PHE  62  -5.218  13.394  -6.334
  352    HE1  PHE  62           HE1      PHE  62  -3.221  10.318  -9.613
  353    HE2  PHE  62           HE2      PHE  62  -3.058  13.943  -7.375
  354    HZ   PHE  62           HZ       PHE  62  -2.056  12.405  -9.017
  355    H    CYS  63           H        CYS  63  -6.744   8.378  -5.957
  356    HA   CYS  63           HA       CYS  63  -4.382   7.536  -4.524
  357    HB2  CYS  63           HB1      CYS  63  -6.675   6.265  -5.078
  358    HB3  CYS  63           HB2      CYS  63  -5.723   5.721  -6.461
  359    H    ALA  64           H        ALA  64  -2.393   7.303  -5.324
  360    HA   ALA  64           HA       ALA  64  -2.036   7.625  -8.232
  361    HB1  ALA  64           HB1      ALA  64   0.330   8.325  -7.531
  362    HB2  ALA  64           HB2      ALA  64  -0.990   9.456  -7.227
  363    HB3  ALA  64           HB3      ALA  64  -0.343   8.481  -5.908
  364    H    THR  65           H        THR  65  -0.509   6.337  -9.309
  365    HA   THR  65           HA       THR  65  -0.332   3.659  -8.373
  366    HB   THR  65           HB       THR  65   1.532   4.335 -10.522
  367    HG1  THR  65           HG1      THR  65  -0.043   5.026 -11.979
  368   HG21  THR  65          HG21      THR  65   0.294   2.108  -9.761
  369   HG22  THR  65          HG22      THR  65   0.747   2.395 -11.442
  370   HG23  THR  65          HG23      THR  65  -0.910   2.685 -10.914
  371    H    CYS  66           H        CYS  66   1.780   2.450  -8.348
  372    HA   CYS  66           HA       CYS  66   3.442   3.456  -6.324
  373    HB2  CYS  66           HB1      CYS  66   3.048   1.008  -7.546
  374    HB3  CYS  66           HB2      CYS  66   4.696   1.427  -8.019
  375    H    ARG  67           H        ARG  67   5.686   4.015  -6.391
  376    HA   ARG  67           HA       ARG  67   6.420   5.387  -8.886
  377    HB2  ARG  67           HB1      ARG  67   6.554   6.112  -6.079
  378    HB3  ARG  67           HB2      ARG  67   8.131   6.268  -6.865
  379    HG2  ARG  67           HG1      ARG  67   7.395   8.320  -7.402
  380    HG3  ARG  67           HG2      ARG  67   6.558   7.460  -8.704
  381    HD2  ARG  67           HD1      ARG  67   4.652   8.311  -7.908
  382    HD3  ARG  67           HD2      ARG  67   4.850   7.208  -6.539
  383    HE   ARG  67           HE       ARG  67   5.374   8.998  -5.216
  384   HH11  ARG  67          HH11      ARG  67   5.665   9.932  -8.557
  385   HH12  ARG  67          HH12      ARG  67   5.916  11.609  -8.202
  386   HH21  ARG  67          HH21      ARG  67   5.703  11.204  -4.736
  387   HH22  ARG  67          HH22      ARG  67   5.938  12.331  -6.028
  388    H    GLY  68           H        GLY  68   8.208   4.818  -9.976
  389    HA2  GLY  68           HA2      GLY  68   9.557   2.411  -9.357
  390    HA3  GLY  68           HA3      GLY  68  10.024   3.560 -10.603
  391    HA1  GLY  68           HA1      GLY  68   9.446   2.932  -8.655
  392    H    LEU  69           H        LEU  69  12.024   2.319  -9.361
  393    HA   LEU  69           HA       LEU  69  12.959   3.524  -6.985
  394    HB2  LEU  69           HB1      LEU  69  14.100   1.803  -9.119
  395    HB3  LEU  69           HB2      LEU  69  15.242   2.708  -8.113
  396    HG   LEU  69           HG       LEU  69  13.190   0.743  -7.099
  397   HD11  LEU  69          HD11      LEU  69  15.599   0.224  -8.350
  398   HD12  LEU  69          HD12      LEU  69  14.705  -0.872  -7.295
  399   HD13  LEU  69          HD13      LEU  69  15.985   0.143  -6.630
  400   HD21  LEU  69          HD21      LEU  69  14.772   2.791  -5.795
  401   HD22  LEU  69          HD22      LEU  69  15.116   1.183  -5.158
  402   HD23  LEU  69          HD23      LEU  69  13.463   1.798  -5.156
  403    H    ARG  70           H        ARG  70  13.054   4.493 -10.308
  404    HA   ARG  70           HA       ARG  70  15.010   6.595  -9.740
  405    HB2  ARG  70           HB1      ARG  70  13.812   5.519 -12.291
  406    HB3  ARG  70           HB2      ARG  70  14.762   7.012 -12.252
  407    HG2  ARG  70           HG1      ARG  70  16.474   5.395 -10.977
  408    HG3  ARG  70           HG2      ARG  70  15.635   4.206 -11.987
  409    HD2  ARG  70           HD1      ARG  70  16.261   5.282 -13.989
  410    HD3  ARG  70           HD2      ARG  70  16.717   6.761 -13.132
  411    HE   ARG  70           HE       ARG  70  18.370   4.501 -13.614
  412   HH11  ARG  70          HH11      ARG  70  17.703   7.005 -11.289
  413   HH12  ARG  70          HH12      ARG  70  19.303   6.996 -10.625
  414   HH21  ARG  70          HH21      ARG  70  20.481   4.480 -12.748
  415   HH22  ARG  70          HH22      ARG  70  20.883   5.560 -11.457
  416    H    ARG  71           H        ARG  71  11.964   6.351  -9.056
  417    HA   ARG  71           HA       ARG  71  11.027   8.834 -10.281
  418    HB2  ARG  71           HB1      ARG  71   9.776   6.426  -9.299
  419    HB3  ARG  71           HB2      ARG  71   9.072   7.850  -8.519
  420    HG2  ARG  71           HG1      ARG  71   9.389   7.638 -11.506
  421    HG3  ARG  71           HG2      ARG  71   7.955   7.056 -10.643
  422    HD2  ARG  71           HD1      ARG  71   8.303   9.594  -9.610
  423    HD3  ARG  71           HD2      ARG  71   8.760   9.778 -11.309
  424    HE   ARG  71           HE       ARG  71   6.283   8.362 -10.906
  425   HH11  ARG  71          HH11      ARG  71   7.793  11.472 -11.319
  426   HH12  ARG  71          HH12      ARG  71   6.353  12.239 -11.902
  427   HH21  ARG  71          HH21      ARG  71   4.381   9.361 -11.671
  428   HH22  ARG  71          HH22      ARG  71   4.412  11.037 -12.100
  429    H    ARG  72           H        ARG  72  10.678  10.693  -9.168
  430    HA   ARG  72           HA       ARG  72  12.044  11.063  -6.704
  431    HB2  ARG  72           HB1      ARG  72  10.036  12.955  -7.936
  432    HB3  ARG  72           HB2      ARG  72  11.383  13.351  -6.857
  433    HG2  ARG  72           HG1      ARG  72  12.503  12.047  -9.096
  434    HG3  ARG  72           HG2      ARG  72  11.340  13.235  -9.706
  435    HD2  ARG  72           HD1      ARG  72  12.595  14.669  -7.749
  436    HD3  ARG  72           HD2      ARG  72  13.905  13.637  -8.339
  437    HE   ARG  72           HE       ARG  72  12.660  14.705 -10.575
  438   HH11  ARG  72          HH11      ARG  72  14.423  15.853  -7.801
  439   HH12  ARG  72          HH12      ARG  72  15.059  17.243  -8.618
  440   HH21  ARG  72          HH21      ARG  72  13.492  16.530 -11.661
  441   HH22  ARG  72          HH22      ARG  72  14.528  17.627 -10.813
  442    H    CYS  73           H        CYS  73  11.129  11.822  -4.701
  443    HA   CYS  73           HA       CYS  73   8.299  11.299  -4.255
  444    HB2  CYS  73           HB1      CYS  73   8.883   9.908  -2.213
  445    HB3  CYS  73           HB2      CYS  73   9.122   9.129  -3.779
  446    H    GLN  74           H        GLN  74   7.600  11.988  -2.075
  447    HA   GLN  74           HA       GLN  74   9.295  14.181  -1.076
  448    HB2  GLN  74           HB1      GLN  74   6.647  14.234  -2.068
  449    HB3  GLN  74           HB2      GLN  74   6.542  14.495  -0.319
  450    HG2  GLN  74           HG1      GLN  74   7.011  16.627  -0.678
  451    HG3  GLN  74           HG2      GLN  74   8.642  16.116  -1.138
  452   HE21  GLN  74          HE21      GLN  74   8.851  15.386  -3.453
  453   HE22  GLN  74          HE22      GLN  74   8.025  16.327  -4.642
  454    H    ARG  75           H        ARG  75   7.392  11.394  -0.271
  455    HA   ARG  75           HA       ARG  75   8.310  11.623   2.509
  456    HB2  ARG  75           HB1      ARG  75   5.518  11.004   1.545
  457    HB3  ARG  75           HB2      ARG  75   6.083  10.545   3.158
  458    HG2  ARG  75           HG1      ARG  75   6.439  12.833   3.773
  459    HG3  ARG  75           HG2      ARG  75   6.108  13.368   2.118
  460    HD2  ARG  75           HD1      ARG  75   3.851  11.903   2.766
  461    HD3  ARG  75           HD2      ARG  75   4.261  12.728   4.275
  462    HE   ARG  75           HE       ARG  75   3.247  13.926   1.877
  463   HH11  ARG  75          HH11      ARG  75   5.135  14.476   4.750
  464   HH12  ARG  75          HH12      ARG  75   4.840  16.183   4.774
  465   HH21  ARG  75          HH21      ARG  75   2.852  16.172   1.899
  466   HH22  ARG  75          HH22      ARG  75   3.540  17.146   3.153
  467    H    ASP  76           H        ASP  76   8.146   9.498   3.675
  468    HA   ASP  76           HA       ASP  76   9.448   7.485   2.150
  469    HB2  ASP  76           HB1      ASP  76   9.146   6.116   4.284
  470    HB3  ASP  76           HB2      ASP  76  10.065   7.619   4.427
  471    HD2  ASP  76           HD       ASP  76   6.844   7.220   6.569
  472    H    ALA  77           H        ALA  77   6.260   7.582   3.738
  473    HA   ALA  77           HA       ALA  77   5.377   5.085   2.799
  474    HB1  ALA  77           HB1      ALA  77   4.413   6.826   4.586
  475    HB2  ALA  77           HB2      ALA  77   3.350   7.192   3.226
  476    HB3  ALA  77           HB3      ALA  77   3.434   5.550   3.862
  477    H    MET  78           H        MET  78   5.305   8.290   1.380
  478    HA   MET  78           HA       MET  78   3.441   7.899  -0.646
  479    HB2  MET  78           HB1      MET  78   5.798   9.685  -0.262
  480    HB3  MET  78           HB2      MET  78   5.109   9.565  -1.889
  481    HG2  MET  78           HG1      MET  78   2.896  10.189  -0.973
  482    HG3  MET  78           HG2      MET  78   3.652  10.394   0.609
  483    HE1  MET  78           HE1      MET  78   5.449  12.245  -2.940
  484    HE2  MET  78           HE2      MET  78   4.186  11.015  -2.971
  485    HE3  MET  78           HE3      MET  78   3.762  12.720  -3.135
  486    H    CYS  79           H        CYS  79   6.682   6.712  -0.323
  487    HA   CYS  79           HA       CYS  79   7.030   6.047  -3.094
  488    HB2  CYS  79           HB1      CYS  79   8.608   5.978  -0.670
  489    HB3  CYS  79           HB2      CYS  79   8.764   4.457  -1.552
  490    H    CYS  80           H        CYS  80   7.863   3.559  -3.323
  491    HA   CYS  80           HA       CYS  80   5.465   2.024  -3.212
  492    HB2  CYS  80           HB1      CYS  80   8.272   1.556  -4.136
  493    HB3  CYS  80           HB2      CYS  80   7.221   0.159  -3.894
  494    HA   PRO  81           HA       PRO  81   5.813  -0.129   0.593
  495    HB2  PRO  81           HB1      PRO  81   4.969  -2.648  -0.074
  496    HB3  PRO  81           HB2      PRO  81   3.894  -1.255   0.022
  497    HG2  PRO  81           HG1      PRO  81   5.213  -2.475  -2.378
  498    HG3  PRO  81           HG2      PRO  81   3.508  -1.933  -2.168
  499    HD2  PRO  81           HD1      PRO  81   5.363  -0.453  -3.485
  500    HD3  PRO  81           HD2      PRO  81   4.063   0.275  -2.528
  501    H    GLY  82           H        GLY  82   7.703  -0.595   1.526
  502    HA2  GLY  82           HA2      GLY  82   9.370  -2.179   2.124
  503    HA3  GLY  82           HA3      GLY  82   9.227  -2.892   0.525
  504    HA1  GLY  82           HA1      GLY  82   9.294  -1.317   1.950
  505    H    THR  83           H        THR  83   9.385   0.533   0.675
  506    HA   THR  83           HA       THR  83  12.271   0.508   0.135
  507    HB   THR  83           HB       THR  83  11.381   2.474  -1.567
  508    HG1  THR  83           HG1      THR  83   9.352   2.004  -1.964
  509   HG21  THR  83          HG21      THR  83  11.627   0.325  -3.236
  510   HG22  THR  83          HG22      THR  83  12.477  -0.237  -1.796
  511   HG23  THR  83          HG23      THR  83  12.976   1.258  -2.587
  512    H    LEU  84           H        LEU  84  13.073   2.877  -0.040
  513    HA   LEU  84           HA       LEU  84  11.652   4.565   1.903
  514    HB2  LEU  84           HB1      LEU  84  14.338   3.404   2.083
  515    HB3  LEU  84           HB2      LEU  84  14.292   5.155   2.347
  516    HG   LEU  84           HG       LEU  84  12.269   4.327   3.968
  517   HD11  LEU  84          HD11      LEU  84  14.286   2.120   3.772
  518   HD12  LEU  84          HD12      LEU  84  12.526   2.020   3.795
  519   HD13  LEU  84          HD13      LEU  84  13.405   2.426   5.269
  520   HD21  LEU  84          HD21      LEU  84  15.191   4.532   4.687
  521   HD22  LEU  84          HD22      LEU  84  13.831   4.695   5.797
  522   HD23  LEU  84          HD23      LEU  84  14.075   5.887   4.520
  523    H    CYS  85           H        CYS  85  12.132   6.835   1.759
  524    HA   CYS  85           HA       CYS  85  12.736   7.637  -0.982
  525    HB2  CYS  85           HB1      CYS  85  10.661   8.418   0.224
  526    HB3  CYS  85           HB2      CYS  85  11.715   9.362   1.279
  527    H    VAL  86           H        VAL  86  14.832   7.957  -1.371
  528    HA   VAL  86           HA       VAL  86  16.392   9.491   0.606
  529    HB   VAL  86           HB       VAL  86  17.462   7.480  -1.379
  530   HG11  VAL  86          HG11      VAL  86  18.835   8.954   0.868
  531   HG12  VAL  86          HG12      VAL  86  19.572   7.749  -0.189
  532   HG13  VAL  86          HG13      VAL  86  19.027   9.289  -0.853
  533   HG21  VAL  86          HG21      VAL  86  16.975   7.265   1.587
  534   HG22  VAL  86          HG22      VAL  86  16.234   6.304   0.308
  535   HG23  VAL  86          HG23      VAL  86  17.953   6.127   0.660
  536    H    ASN  87           H        ASN  87  17.335  11.331  -0.051
  537    HA   ASN  87           HA       ASN  87  17.800  13.140  -1.353
  538    HB2  ASN  87           HB1      ASN  87  19.429  11.333  -2.200
  539    HB3  ASN  87           HB2      ASN  87  18.354  11.210  -3.598
  540   HD21  ASN  87          HD21      ASN  87  20.676  13.163  -1.944
  541   HD22  ASN  87          HD22      ASN  87  20.879  14.345  -3.187
  542    H    ASP  88           H        ASP  88  15.095  12.477  -1.244
  543    HA   ASP  88           HA       ASP  88  13.103  12.973  -2.224
  544    HB2  ASP  88           HB1      ASP  88  14.638  14.397  -4.398
  545    HB3  ASP  88           HB2      ASP  88  13.027  14.765  -3.767
  546    HD2  ASP  88           HD       ASP  88  14.802  15.911  -0.742
  547    H    VAL  89           H        VAL  89  14.680  10.598  -3.058
  548    HA   VAL  89           HA       VAL  89  13.073   9.938  -5.399
  549    HB   VAL  89           HB       VAL  89  16.068   9.534  -5.356
  550   HG11  VAL  89          HG11      VAL  89  15.765   8.633  -7.615
  551   HG12  VAL  89          HG12      VAL  89  14.906   7.672  -6.410
  552   HG13  VAL  89          HG13      VAL  89  14.017   8.793  -7.442
  553   HG21  VAL  89          HG21      VAL  89  14.284  11.462  -6.798
  554   HG22  VAL  89          HG22      VAL  89  15.771  11.778  -5.906
  555   HG23  VAL  89          HG23      VAL  89  15.839  10.982  -7.478
  556    H    CYS  90           H        CYS  90  12.454   7.825  -5.477
  557    HA   CYS  90           HA       CYS  90  12.486   6.288  -3.156
  558    HB2  CYS  90           HB1      CYS  90  11.327   6.127  -5.719
  559    HB3  CYS  90           HB2      CYS  90  12.202   4.612  -5.489
  560    H    THR  91           H        THR  91  13.714   4.618  -2.413
  561    HA   THR  91           HA       THR  91  15.911   3.609  -4.044
  562    HB   THR  91           HB       THR  91  16.416   4.782  -1.304
  563    HG1  THR  91           HG1      THR  91  16.252   6.510  -2.653
  564   HG21  THR  91          HG21      THR  91  17.843   2.860  -1.890
  565   HG22  THR  91          HG22      THR  91  18.762   4.362  -1.799
  566   HG23  THR  91          HG23      THR  91  18.329   3.687  -3.369
  567    H    THR  92           H        THR  92  16.523   1.546  -3.539
  568    HA   THR  92           HA       THR  92  14.720  -0.032  -2.023
  569    HB   THR  92           HB       THR  92  16.780  -1.729  -2.334
  570    HG1  THR  92           HG1      THR  92  18.115  -1.125  -3.929
  571   HG21  THR  92          HG21      THR  92  15.635  -1.482  -4.923
  572   HG22  THR  92          HG22      THR  92  14.390  -1.087  -3.739
  573   HG23  THR  92          HG23      THR  92  15.232  -2.635  -3.652
  574    H    MET  93           H        MET  93  15.050  -1.175  -0.098
  575    HA   MET  93           HA       MET  93  16.324   0.198   1.970
  576    HB2  MET  93           HB1      MET  93  15.354  -2.653   1.743
  577    HB3  MET  93           HB2      MET  93  16.025  -1.991   3.242
  578    HG2  MET  93           HG1      MET  93  14.277  -0.317   3.346
  579    HG3  MET  93           HG2      MET  93  13.642  -0.866   1.793
  580    HE1  MET  93           HE1      MET  93  13.452  -2.795   5.860
  581    HE2  MET  93           HE2      MET  93  14.245  -1.312   5.330
  582    HE3  MET  93           HE3      MET  93  12.501  -1.335   5.593
  583    H    GLU  94           H        GLU  94  17.533  -2.159  -0.263
  584    HA   GLU  94           HA       GLU  94  19.854  -2.855   1.279
  585    HB2  GLU  94           HB1      GLU  94  18.986  -3.363  -1.560
  586    HB3  GLU  94           HB2      GLU  94  20.601  -3.814  -0.991
  587    HG2  GLU  94           HG1      GLU  94  18.213  -4.720   0.555
  588    HG3  GLU  94           HG2      GLU  94  18.641  -5.539  -0.954
  589    HE2  GLU  94           HE       GLU  94  20.954  -7.393   0.739
  590    H    ASP  95           H        ASP  95  19.057  -0.518  -1.198
  591    HA   ASP  95           HA       ASP  95  21.769   0.247  -1.724
  592    HB2  ASP  95           HB1      ASP  95  19.076   1.396  -2.444
  593    HB3  ASP  95           HB2      ASP  95  20.570   2.273  -2.798
  594    HD2  ASP  95           HD       ASP  95  20.946  -1.105  -4.654
  595    H    ALA  96           H        ALA  96  19.207   1.342   0.406
  596    HA   ALA  96           HA       ALA  96  20.465   3.771   1.192
  597    HB1  ALA  96           HB1      ALA  96  18.030   2.367   1.788
  598    HB2  ALA  96           HB2      ALA  96  18.778   2.957   3.273
  599    HB3  ALA  96           HB3      ALA  96  18.406   4.081   1.965
  600    H    THR  97           H        THR  97  21.045   4.170   3.541
  601    HA   THR  97           HA       THR  97  22.443   3.822   5.302
  602    HB   THR  97           HB       THR  97  21.788   0.892   4.942
  603    HG1  THR  97           HG1      THR  97  19.869   1.466   5.602
  604   HG21  THR  97          HG21      THR  97  23.559   0.933   6.438
  605   HG22  THR  97          HG22      THR  97  22.167   1.045   7.517
  606   HG23  THR  97          HG23      THR  97  23.088   2.493   7.110
  607    H    GLU  98           H        GLU  98  24.413   4.405   4.530
  608    HA   GLU  98           HA       GLU  98  26.093   2.240   3.450
  609    HB2  GLU  98           HB1      GLU  98  25.417   3.933   1.721
  610    HB3  GLU  98           HB2      GLU  98  26.296   5.148   2.661
  611    HG2  GLU  98           HG1      GLU  98  28.126   3.080   2.343
  612    HG3  GLU  98           HG2      GLU  98  27.294   3.193   0.785
  613    HE2  GLU  98           HE       GLU  98  29.163   6.515   1.919
  614    H    ASN  99           H        ASN  99  27.966   1.909   4.476
  615    HA   ASN  99           HA       ASN  99  28.644   3.687   6.691
  616    HB2  ASN  99           HB1      ASN  99  28.476   1.316   7.208
  617    HB3  ASN  99           HB2      ASN  99  29.665   0.935   5.957
  618   HD21  ASN  99          HD21      ASN  99  29.179   2.278   9.121
  619   HD22  ASN  99          HD22      ASN  99  30.840   2.284   9.595
  620    H    LEU 100           H        LEU 100  29.860   5.367   6.062
  621    HA   LEU 100           HA       LEU 100  31.764   5.195   3.930
  622    HB2  LEU 100           HB1      LEU 100  30.507   7.245   5.483
  623    HB3  LEU 100           HB2      LEU 100  32.261   7.489   5.503
  624    HG   LEU 100           HG       LEU 100  30.833   7.070   2.904
  625   HD11  LEU 100          HD11      LEU 100  30.240   9.308   2.702
  626   HD12  LEU 100          HD12      LEU 100  31.248   9.802   4.062
  627   HD13  LEU 100          HD13      LEU 100  29.756   8.907   4.350
  628   HD21  LEU 100          HD21      LEU 100  32.784   8.902   2.515
  629   HD22  LEU 100          HD22      LEU 100  33.009   7.162   2.341
  630   HD23  LEU 100          HD23      LEU 100  33.472   7.966   3.841
  631    H    TYR 101           H        TYR 101  34.016   5.339   4.060
  632    HA   TYR 101           HA       TYR 101  36.077   4.816   4.864
  633    HB2  TYR 101           HB1      TYR 101  34.935   6.662   6.664
  634    HB3  TYR 101           HB2      TYR 101  35.701   5.423   7.660
  635    HD1  TYR 101           HD1      TYR 101  37.914   5.719   8.234
  636    HD2  TYR 101           HD2      TYR 101  36.492   7.448   4.615
  637    HE1  TYR 101           HE1      TYR 101  40.119   6.744   7.864
  638    HE2  TYR 101           HE2      TYR 101  38.694   8.477   4.235
  639    HH   TYR 101           HH       TYR 101  40.992   8.200   4.884
  640    H    PHE 102           H        PHE 102  37.159   3.662   6.944
  641    HA   PHE 102           HA       PHE 102  35.471   1.421   7.782
  642    HB2  PHE 102           HB1      PHE 102  37.219  -0.208   7.204
  643    HB3  PHE 102           HB2      PHE 102  36.624   0.639   5.776
  644    HD1  PHE 102           HD1      PHE 102  39.484   0.118   7.963
  645    HD2  PHE 102           HD2      PHE 102  37.998   2.277   4.609
  646    HE1  PHE 102           HE1      PHE 102  41.782   0.772   7.372
  647    HE2  PHE 102           HE2      PHE 102  40.293   2.934   4.012
  648    HZ   PHE 102           HZ       PHE 102  42.189   2.181   5.392
  649    H    GLN 103           H        GLN 103  36.638   3.792   9.099
  650    HA   GLN 103           HA       GLN 103  37.703   4.366  11.028
  651    HB2  GLN 103           HB1      GLN 103  36.173   2.174  11.561
  652    HB3  GLN 103           HB2      GLN 103  37.768   1.623  12.100
  653    HG2  GLN 103           HG1      GLN 103  37.774   4.002  13.286
  654    HG3  GLN 103           HG2      GLN 103  36.025   3.751  13.196
  655   HE21  GLN 103          HE21      GLN 103  38.301   3.606  15.322
  656   HE22  GLN 103          HE22      GLN 103  37.880   2.194  16.223
  657    H    SER 104           H        SER 104  39.488   3.180  12.690
  658    HA   SER 104           HA       SER 104  41.783   2.747  10.906
  659    HB2  SER 104           HB1      SER 104  43.125   3.847  12.413
  660    HB3  SER 104           HB2      SER 104  41.579   4.634  12.772
  661    HG   SER 104           HG       SER 104  41.552   3.725  14.671
  662    H    LEU 105           H        LEU 105  42.993   0.937  11.010
  663    HA   LEU 105           HA       LEU 105  42.348  -1.022  13.114
  664    HB2  LEU 105           HB1      LEU 105  42.587  -2.818  11.489
  665    HB3  LEU 105           HB2      LEU 105  41.306  -1.687  11.019
  666    HG   LEU 105           HG       LEU 105  43.278  -0.641   9.576
  667   HD11  LEU 105          HD11      LEU 105  45.095  -1.887   9.347
  668   HD12  LEU 105          HD12      LEU 105  44.126  -3.292   8.903
  669   HD13  LEU 105          HD13      LEU 105  44.477  -2.964  10.599
  670   HD21  LEU 105          HD21      LEU 105  42.145  -1.444   7.793
  671   HD22  LEU 105          HD22      LEU 105  41.003  -1.958   9.035
  672   HD23  LEU 105          HD23      LEU 105  42.173  -3.105   8.382
  673    H    GLU 106           H        GLU 106  44.040  -2.432  13.741
  674    HA   GLU 106           HA       GLU 106  46.718  -1.393  13.096
  675    HB2  GLU 106           HB1      GLU 106  47.449  -2.197  15.265
  676    HB3  GLU 106           HB2      GLU 106  46.038  -1.144  15.455
  677    HG2  GLU 106           HG1      GLU 106  44.696  -3.382  15.392
  678    HG3  GLU 106           HG2      GLU 106  46.257  -4.093  15.828
  679    HE2  GLU 106           HE       GLU 106  45.194  -3.431  19.054
  680    H    HIS 107           H        HIS 107  44.719  -4.241  13.283
  681    HA   HIS 107           HA       HIS 107  45.021  -6.396  12.614
  682    HB2  HIS 107           HB1      HIS 107  46.280  -4.706  10.678
  683    HB3  HIS 107           HB2      HIS 107  47.241  -6.180  10.848
  684    HD1  HIS 107           HD1      HIS 107  43.624  -5.214  10.194
  685    HD2  HIS 107           HD2      HIS 107  46.297  -8.306   9.451
  686    HE1  HIS 107           HE1      HIS 107  42.398  -6.817   8.694
  687    HE2  HIS 107           HE2      HIS 107  44.032  -8.708   8.237
  688    H    HIS 108           H        HIS 108  47.031  -8.030  12.055
  689    HA   HIS 108           HA       HIS 108  48.497  -8.125  14.552
  690    HB2  HIS 108           HB1      HIS 108  47.796 -10.019  12.396
  691    HB3  HIS 108           HB2      HIS 108  49.367 -10.294  13.156
  692    HD1  HIS 108           HD1      HIS 108  48.330 -12.535  14.110
  693    HD2  HIS 108           HD2      HIS 108  46.659  -9.028  15.583
  694    HE1  HIS 108           HE1      HIS 108  47.044 -13.214  16.161
  695    HE2  HIS 108           HE2      HIS 108  46.022 -11.071  17.062
  696    H    HIS 109           H        HIS 109  50.849  -9.005  14.330
  697    HA   HIS 109           HA       HIS 109  52.274  -7.097  12.626
  698    HB2  HIS 109           HB1      HIS 109  54.207  -7.516  14.064
  699    HB3  HIS 109           HB2      HIS 109  52.798  -7.055  15.024
  700    HD1  HIS 109           HD1      HIS 109  55.110  -9.905  14.397
  701    HD2  HIS 109           HD2      HIS 109  51.725  -9.084  16.661
  702    HE1  HIS 109           HE1      HIS 109  54.922 -11.801  16.038
  703    HE2  HIS 109           HE2      HIS 109  52.853 -11.300  17.423
  704    H    HIS 110           H        HIS 110  54.232  -7.785  11.520
  705    HA   HIS 110           HA       HIS 110  54.598 -10.613  11.036
  706    HB2  HIS 110           HB1      HIS 110  52.731  -9.811   9.494
  707    HB3  HIS 110           HB2      HIS 110  53.962  -8.845   8.676
  708    HD1  HIS 110           HD1      HIS 110  53.657 -12.509   9.693
  709    HD2  HIS 110           HD2      HIS 110  54.966 -10.140   6.540
  710    HE1  HIS 110           HE1      HIS 110  54.444 -14.116   7.926
  711    HE2  HIS 110           HE2      HIS 110  55.245 -12.671   5.999
  712    H    HIS 111           H        HIS 111  56.466 -11.031   9.604
  713    HA   HIS 111           HA       HIS 111  58.577  -9.132  10.181
  714    HB2  HIS 111           HB1      HIS 111  58.464 -11.887  10.039
  715    HB3  HIS 111           HB2      HIS 111  59.287 -11.451   8.538
  716    HD1  HIS 111           HD1      HIS 111  60.088 -12.312  11.856
  717    HD2  HIS 111           HD2      HIS 111  61.495  -9.430   9.216
  718    HE1  HIS 111           HE1      HIS 111  62.354 -11.655  12.724
  719    HE2  HIS 111           HE2      HIS 111  63.216  -9.894  11.110
  720    H    HIS 112           H        HIS 112  58.594  -7.410   8.855
  721    HA   HIS 112           HA       HIS 112  59.046  -7.905   6.017
  722    HB2  HIS 112           HB1      HIS 112  56.538  -7.131   6.905
  723    HB3  HIS 112           HB2      HIS 112  57.285  -5.608   6.416
  724    HD1  HIS 112           HD1      HIS 112  55.178  -8.002   5.031
  725    HD2  HIS 112           HD2      HIS 112  58.644  -6.162   3.664
  726    HE1  HIS 112           HE1      HIS 112  55.131  -8.253   2.529
  727    HE2  HIS 112           HE2      HIS 112  57.247  -7.129   1.692
  Start of MODEL   22
    1    H1   MET  18           H        MET  18 -31.130 -43.271 -40.431
    2    HA   MET  18           HA       MET  18 -32.700 -41.826 -39.533
    3    HB2  MET  18           HB1      MET  18 -32.828 -42.131 -37.057
    4    HB3  MET  18           HB2      MET  18 -32.675 -43.643 -37.965
    5    HG2  MET  18           HG1      MET  18 -30.176 -43.508 -37.500
    6    HG3  MET  18           HG2      MET  18 -30.582 -42.241 -36.338
    7    HE1  MET  18           HE1      MET  18 -29.504 -44.567 -34.088
    8    HE2  MET  18           HE2      MET  18 -29.602 -45.951 -35.176
    9    HE3  MET  18           HE3      MET  18 -28.959 -44.414 -35.759
   10    H    LEU  19           H        LEU  19 -33.045 -39.731 -39.039
   11    HA   LEU  19           HA       LEU  19 -30.704 -38.149 -38.232
   12    HB2  LEU  19           HB1      LEU  19 -32.004 -37.756 -40.438
   13    HB3  LEU  19           HB2      LEU  19 -33.220 -37.009 -39.389
   14    HG   LEU  19           HG       LEU  19 -30.976 -35.703 -38.589
   15   HD11  LEU  19          HD11      LEU  19 -30.544 -35.429 -41.455
   16   HD12  LEU  19          HD12      LEU  19 -30.104 -37.020 -40.836
   17   HD13  LEU  19          HD13      LEU  19 -29.378 -35.573 -40.139
   18   HD21  LEU  19          HD21      LEU  19 -33.250 -35.167 -40.360
   19   HD22  LEU  19          HD22      LEU  19 -31.870 -34.094 -40.595
   20   HD23  LEU  19          HD23      LEU  19 -32.618 -34.232 -39.003
   21    H    VAL  20           H        VAL  20 -30.858 -36.602 -36.605
   22    HA   VAL  20           HA       VAL  20 -33.197 -36.905 -34.836
   23    HB   VAL  20           HB       VAL  20 -31.742 -36.308 -32.966
   24   HG11  VAL  20          HG11      VAL  20 -30.703 -38.379 -32.732
   25   HG12  VAL  20          HG12      VAL  20 -31.989 -38.698 -33.897
   26   HG13  VAL  20          HG13      VAL  20 -30.327 -38.493 -34.451
   27   HG21  VAL  20          HG21      VAL  20 -30.085 -34.915 -33.773
   28   HG22  VAL  20          HG22      VAL  20 -29.202 -36.420 -33.522
   29   HG23  VAL  20          HG23      VAL  20 -29.723 -35.964 -35.143
   30    H    LEU  21           H        LEU  21 -34.173 -35.101 -33.984
   31    HA   LEU  21           HA       LEU  21 -33.931 -32.685 -35.472
   32    HB2  LEU  21           HB1      LEU  21 -35.800 -33.866 -33.706
   33    HB3  LEU  21           HB2      LEU  21 -35.358 -32.292 -33.025
   34    HG   LEU  21           HG       LEU  21 -37.323 -32.016 -34.359
   35   HD11  LEU  21          HD11      LEU  21 -36.590 -30.333 -35.924
   36   HD12  LEU  21          HD12      LEU  21 -34.954 -30.989 -35.915
   37   HD13  LEU  21          HD13      LEU  21 -35.613 -30.241 -34.459
   38   HD21  LEU  21          HD21      LEU  21 -35.759 -33.279 -36.608
   39   HD22  LEU  21          HD22      LEU  21 -37.366 -32.567 -36.747
   40   HD23  LEU  21          HD23      LEU  21 -37.119 -34.002 -35.751
   41    H    ASP  22           H        ASP  22 -33.099 -30.712 -34.887
   42    HA   ASP  22           HA       ASP  22 -32.168 -30.044 -32.313
   43    HB2  ASP  22           HB1      ASP  22 -30.481 -31.847 -33.384
   44    HB3  ASP  22           HB2      ASP  22 -29.800 -30.368 -34.075
   45    HD2  ASP  22           HD       ASP  22 -28.881 -31.182 -30.438
   46    H    PHE  23           H        PHE  23 -31.726 -27.894 -32.172
   47    HA   PHE  23           HA       PHE  23 -30.801 -26.287 -34.300
   48    HB2  PHE  23           HB1      PHE  23 -33.174 -26.862 -35.050
   49    HB3  PHE  23           HB2      PHE  23 -33.728 -25.867 -33.703
   50    HD1  PHE  23           HD1      PHE  23 -33.331 -23.452 -33.669
   51    HD2  PHE  23           HD2      PHE  23 -32.242 -25.846 -37.016
   52    HE1  PHE  23           HE1      PHE  23 -33.132 -21.426 -35.050
   53    HE2  PHE  23           HE2      PHE  23 -32.040 -23.823 -38.401
   54    HZ   PHE  23           HZ       PHE  23 -32.484 -21.609 -37.419
   55    H    ASN  24           H        ASN  24 -30.450 -24.130 -33.678
   56    HA   ASN  24           HA       ASN  24 -31.461 -23.052 -31.243
   57    HB2  ASN  24           HB1      ASN  24 -29.170 -22.903 -30.136
   58    HB3  ASN  24           HB2      ASN  24 -29.955 -24.486 -30.108
   59   HD21  ASN  24          HD21      ASN  24 -27.419 -22.584 -31.554
   60   HD22  ASN  24          HD22      ASN  24 -26.513 -23.913 -32.187
   61    H    ASN  25           H        ASN  25 -31.320 -20.885 -31.290
   62    HA   ASN  25           HA       ASN  25 -29.176 -19.512 -32.625
   63    HB2  ASN  25           HB1      ASN  25 -31.001 -20.279 -34.377
   64    HB3  ASN  25           HB2      ASN  25 -31.874 -18.875 -33.750
   65   HD21  ASN  25          HD21      ASN  25 -30.514 -16.841 -33.610
   66   HD22  ASN  25          HD22      ASN  25 -29.505 -16.501 -34.970
   67    H    ILE  26           H        ILE  26 -29.719 -19.308 -30.047
   68    HA   ILE  26           HA       ILE  26 -30.938 -16.645 -29.808
   69    HB   ILE  26           HB       ILE  26 -31.320 -18.881 -27.812
   70   HG12  ILE  26          HG11      ILE  26 -33.383 -17.532 -29.567
   71   HG13  ILE  26          HG12      ILE  26 -32.627 -19.087 -29.957
   72   HG21  ILE  26          HG21      ILE  26 -33.117 -16.901 -27.215
   73   HG22  ILE  26          HG22      ILE  26 -31.584 -17.177 -26.389
   74   HG23  ILE  26          HG23      ILE  26 -31.684 -15.989 -27.688
   75   HD11  ILE  26          HD11      ILE  26 -34.497 -19.864 -28.953
   76   HD12  ILE  26          HD12      ILE  26 -33.487 -19.683 -27.518
   77   HD13  ILE  26          HD13      ILE  26 -34.672 -18.442 -27.925
   78    H    ARG  27           H        ARG  27 -29.684 -15.212 -28.798
   79    HA   ARG  27           HA       ARG  27 -28.018 -15.783 -26.599
   80    HB2  ARG  27           HB1      ARG  27 -26.783 -16.863 -28.592
   81    HB3  ARG  27           HB2      ARG  27 -26.421 -15.200 -29.079
   82    HG2  ARG  27           HG1      ARG  27 -25.428 -14.854 -26.782
   83    HG3  ARG  27           HG2      ARG  27 -25.570 -16.607 -26.564
   84    HD2  ARG  27           HD1      ARG  27 -24.203 -16.944 -28.609
   85    HD3  ARG  27           HD2      ARG  27 -24.002 -15.189 -28.715
   86    HE   ARG  27           HE       ARG  27 -22.467 -15.281 -27.008
   87   HH11  ARG  27          HH11      ARG  27 -24.162 -18.314 -27.219
   88   HH12  ARG  27          HH12      ARG  27 -23.110 -19.129 -26.110
   89   HH21  ARG  27          HH21      ARG  27 -21.075 -16.342 -25.546
   90   HH22  ARG  27          HH22      ARG  27 -21.355 -18.006 -25.158
   91    H    SER  28           H        SER  28 -29.966 -13.842 -27.497
   92    HA   SER  28           HA       SER  28 -28.584 -11.380 -28.031
   93    HB2  SER  28           HB1      SER  28 -31.443 -12.144 -27.485
   94    HB3  SER  28           HB2      SER  28 -30.952 -10.440 -27.446
   95    HG   SER  28           HG       SER  28 -31.351 -10.628 -29.524
   96    H    SER  29           H        SER  29 -28.517  -9.546 -26.638
   97    HA   SER  29           HA       SER  29 -29.223  -9.720 -23.881
   98    HB2  SER  29           HB1      SER  29 -26.631 -10.728 -24.670
   99    HB3  SER  29           HB2      SER  29 -26.449  -9.309 -23.622
  100    HG   SER  29           HG       SER  29 -28.161 -11.474 -22.986
  101    H    ALA  30           H        ALA  30 -28.860  -7.760 -22.746
  102    HA   ALA  30           HA       ALA  30 -27.441  -5.560 -23.776
  103    HB1  ALA  30           HB1      ALA  30 -30.154  -4.645 -24.046
  104    HB2  ALA  30           HB2      ALA  30 -28.824  -4.568 -25.203
  105    HB3  ALA  30           HB3      ALA  30 -29.848  -6.002 -25.130
  106    H    ASP  31           H        ASP  31 -27.247  -3.999 -22.253
  107    HA   ASP  31           HA       ASP  31 -29.183  -3.330 -20.329
  108    HB2  ASP  31           HB1      ASP  31 -28.141  -5.748 -19.700
  109    HB3  ASP  31           HB2      ASP  31 -26.987  -4.690 -18.881
  110    HD2  ASP  31           HD       ASP  31 -30.714  -4.776 -17.527
  111    H    LEU  32           H        LEU  32 -28.099  -2.082 -18.433
  112    HA   LEU  32           HA       LEU  32 -25.716  -0.682 -19.453
  113    HB2  LEU  32           HB1      LEU  32 -28.315   0.356 -19.141
  114    HB3  LEU  32           HB2      LEU  32 -27.350   1.018 -17.811
  115    HG   LEU  32           HG       LEU  32 -25.664   1.596 -19.752
  116   HD11  LEU  32          HD11      LEU  32 -27.530   0.413 -21.286
  117   HD12  LEU  32          HD12      LEU  32 -26.449   1.681 -21.862
  118   HD13  LEU  32          HD13      LEU  32 -28.089   2.084 -21.353
  119   HD21  LEU  32          HD21      LEU  32 -26.810   3.791 -19.982
  120   HD22  LEU  32          HD22      LEU  32 -26.634   3.252 -18.312
  121   HD23  LEU  32          HD23      LEU  32 -28.193   3.112 -19.125
  122    H    HIS  33           H        HIS  33 -25.047   0.933 -17.476
  123    HA   HIS  33           HA       HIS  33 -25.047  -0.609 -14.984
  124    HB2  HIS  33           HB1      HIS  33 -22.737  -0.062 -16.732
  125    HB3  HIS  33           HB2      HIS  33 -22.478   0.326 -15.027
  126    HD1  HIS  33           HD1      HIS  33 -23.354  -2.607 -17.236
  127    HD2  HIS  33           HD2      HIS  33 -22.067  -1.821 -13.364
  128    HE1  HIS  33           HE1      HIS  33 -22.768  -4.848 -16.255
  129    HE2  HIS  33           HE2      HIS  33 -21.983  -4.369 -13.889
  130    H    GLY  34           H        GLY  34 -23.322   2.276 -16.172
  131    HA2  GLY  34           HA2      GLY  34 -23.490   4.487 -15.527
  132    HA3  GLY  34           HA3      GLY  34 -24.966   4.077 -14.665
  133    HA1  GLY  34           HA1      GLY  34 -22.944   3.841 -15.279
  134    H    ALA  35           H        ALA  35 -23.115   5.870 -13.637
  135    HA   ALA  35           HA       ALA  35 -22.316   4.445 -11.211
  136    HB1  ALA  35           HB1      ALA  35 -20.122   4.755 -11.433
  137    HB2  ALA  35           HB2      ALA  35 -20.445   5.135 -13.125
  138    HB3  ALA  35           HB3      ALA  35 -20.331   6.432 -11.937
  139    H    ARG  36           H        ARG  36 -22.442   5.651  -9.350
  140    HA   ARG  36           HA       ARG  36 -23.175   8.483  -9.615
  141    HB2  ARG  36           HB1      ARG  36 -24.597   6.504  -7.818
  142    HB3  ARG  36           HB2      ARG  36 -24.967   8.227  -7.991
  143    HG2  ARG  36           HG1      ARG  36 -25.420   7.727 -10.452
  144    HG3  ARG  36           HG2      ARG  36 -25.415   6.021  -9.970
  145    HD2  ARG  36           HD1      ARG  36 -27.150   6.607  -8.230
  146    HD3  ARG  36           HD2      ARG  36 -27.253   8.197  -8.999
  147    HE   ARG  36           HE       ARG  36 -27.622   6.403 -11.037
  148   HH11  ARG  36          HH11      ARG  36 -29.164   7.065  -7.987
  149   HH12  ARG  36          HH12      ARG  36 -30.729   6.541  -8.514
  150   HH21  ARG  36          HH21      ARG  36 -29.678   5.710 -11.744
  151   HH22  ARG  36          HH22      ARG  36 -31.019   5.769 -10.652
  152    H    LYS  37           H        LYS  37 -21.408   9.386  -8.720
  153    HA   LYS  37           HA       LYS  37 -21.012   9.109  -5.894
  154    HB2  LYS  37           HB1      LYS  37 -19.437   7.498  -7.655
  155    HB3  LYS  37           HB2      LYS  37 -18.390   8.723  -6.922
  156    HG2  LYS  37           HG1      LYS  37 -18.826   7.975  -4.742
  157    HG3  LYS  37           HG2      LYS  37 -20.236   7.036  -5.266
  158    HD2  LYS  37           HD1      LYS  37 -18.877   5.412  -6.352
  159    HD3  LYS  37           HD2      LYS  37 -17.435   6.429  -6.191
  160    HE2  LYS  37           HE1      LYS  37 -18.923   5.525  -3.744
  161    HE3  LYS  37           HE2      LYS  37 -17.787   4.438  -4.558
  162    HZ1  LYS  37           HZ1      LYS  37 -16.064   5.528  -3.711
  163    HZ2  LYS  37           HZ2      LYS  37 -17.152   6.340  -2.703
  164    HZ3  LYS  37           HZ3      LYS  37 -16.673   7.038  -4.167
  165    H    GLY  38           H        GLY  38 -19.629  10.737  -5.019
  166    HA2  GLY  38           HA2      GLY  38 -19.322  13.020  -6.849
  167    HA3  GLY  38           HA3      GLY  38 -19.452  13.122  -5.099
  168    HA1  GLY  38           HA1      GLY  38 -18.844  12.285  -6.956
  169    H    SER  39           H        SER  39 -17.608  12.010  -3.897
  170    HA   SER  39           HA       SER  39 -15.133  13.054  -4.987
  171    HB2  SER  39           HB1      SER  39 -15.232  11.581  -2.382
  172    HB3  SER  39           HB2      SER  39 -14.315  13.031  -2.828
  173    HG   SER  39           HG       SER  39 -15.901  13.824  -1.586
  174    H    GLN  40           H        GLN  40 -13.131  11.576  -4.267
  175    HA   GLN  40           HA       GLN  40 -13.554   9.027  -5.660
  176    HB2  GLN  40           HB1      GLN  40 -11.081  10.693  -5.176
  177    HB3  GLN  40           HB2      GLN  40 -11.028   9.057  -5.852
  178    HG2  GLN  40           HG1      GLN  40 -12.712  11.196  -7.114
  179    HG3  GLN  40           HG2      GLN  40 -10.983  11.054  -7.461
  180   HE21  GLN  40          HE21      GLN  40 -13.405  10.643  -9.135
  181   HE22  GLN  40          HE22      GLN  40 -13.217   9.066  -9.813
  182    H    CYS  41           H        CYS  41 -11.220  10.110  -3.196
  183    HA   CYS  41           HA       CYS  41 -12.026   7.855  -1.503
  184    HB2  CYS  41           HB1      CYS  41  -9.785   7.120  -1.152
  185    HB3  CYS  41           HB2      CYS  41 -10.024   7.230  -2.897
  186    H    LEU  42           H        LEU  42 -11.829   8.195   0.685
  187    HA   LEU  42           HA       LEU  42 -11.253  10.962   1.470
  188    HB2  LEU  42           HB1      LEU  42 -13.267   9.060   2.178
  189    HB3  LEU  42           HB2      LEU  42 -12.332   9.477   3.626
  190    HG   LEU  42           HG       LEU  42 -12.785  11.930   2.923
  191   HD11  LEU  42          HD11      LEU  42 -15.103  12.022   1.817
  192   HD12  LEU  42          HD12      LEU  42 -14.729  10.400   1.233
  193   HD13  LEU  42          HD13      LEU  42 -13.694  11.758   0.789
  194   HD21  LEU  42          HD21      LEU  42 -15.059  11.794   4.031
  195   HD22  LEU  42          HD22      LEU  42 -13.706  11.107   4.931
  196   HD23  LEU  42          HD23      LEU  42 -14.826  10.045   4.074
  197    H    SER  43           H        SER  43 -10.198   7.690   1.895
  198    HA   SER  43           HA       SER  43  -7.966   8.654   3.527
  199    HB2  SER  43           HB1      SER  43  -8.778   5.998   4.381
  200    HB3  SER  43           HB2      SER  43  -8.495   7.455   5.351
  201    HG   SER  43           HG       SER  43 -10.801   6.336   4.852
  202    H    ASP  44           H        ASP  44  -6.261   6.875   3.737
  203    HA   ASP  44           HA       ASP  44  -5.494   6.071   1.133
  204    HB2  ASP  44           HB1      ASP  44  -4.037   6.593   3.229
  205    HB3  ASP  44           HB2      ASP  44  -4.302   4.888   3.623
  206    HD2  ASP  44           HD       ASP  44  -2.576   4.024   0.558
  207    H    THR  45           H        THR  45  -7.205   4.490   3.714
  208    HA   THR  45           HA       THR  45  -6.844   1.812   2.982
  209    HB   THR  45           HB       THR  45  -9.300   1.659   4.000
  210    HG1  THR  45           HG1      THR  45  -9.935   3.680   4.328
  211   HG21  THR  45          HG21      THR  45  -7.850   0.661   5.408
  212   HG22  THR  45          HG22      THR  45  -7.946   2.175   6.305
  213   HG23  THR  45          HG23      THR  45  -6.619   1.902   5.177
  214    H    ASP  46           H        ASP  46  -8.768   4.320   1.572
  215    HA   ASP  46           HA       ASP  46 -10.623   2.682   0.185
  216    HB2  ASP  46           HB1      ASP  46 -10.113   5.458   0.480
  217    HB3  ASP  46           HB2      ASP  46 -10.101   5.107  -1.254
  218    HD2  ASP  46           HD       ASP  46 -13.502   4.788  -1.332
  219    H    CYS  47           H        CYS  47  -7.357   3.704  -0.460
  220    HA   CYS  47           HA       CYS  47  -7.470   2.697  -3.198
  221    HB2  CYS  47           HB1      CYS  47  -6.125   4.807  -2.065
  222    HB3  CYS  47           HB2      CYS  47  -4.866   3.574  -2.161
  223    H    ASN  48           H        ASN  48  -5.467   1.392  -3.881
  224    HA   ASN  48           HA       ASN  48  -5.535  -1.105  -2.697
  225    HB2  ASN  48           HB1      ASN  48  -4.410  -0.086  -4.952
  226    HB3  ASN  48           HB2      ASN  48  -2.968  -0.387  -3.974
  227   HD21  ASN  48          HD21      ASN  48  -2.072  -2.229  -4.517
  228   HD22  ASN  48          HD22      ASN  48  -2.900  -3.706  -4.863
  229    H    THR  49           H        THR  49  -3.518  -2.256  -1.814
  230    HA   THR  49           HA       THR  49  -2.830  -1.001   0.659
  231    HB   THR  49           HB       THR  49  -1.719  -3.549  -0.534
  232    HG1  THR  49           HG1      THR  49  -3.822  -3.246   1.363
  233   HG21  THR  49          HG21      THR  49  -1.830  -2.676   2.352
  234   HG22  THR  49          HG22      THR  49  -0.400  -2.530   1.330
  235   HG23  THR  49          HG23      THR  49  -1.061  -4.122   1.702
  236    H    ARG  50           H        ARG  50  -1.252  -1.437  -2.424
  237    HA   ARG  50           HA       ARG  50   1.244  -0.331  -1.352
  238    HB2  ARG  50           HB1      ARG  50   0.542  -1.869  -3.833
  239    HB3  ARG  50           HB2      ARG  50   2.018  -0.895  -3.776
  240    HG2  ARG  50           HG1      ARG  50   3.026  -2.675  -2.910
  241    HG3  ARG  50           HG2      ARG  50   2.113  -2.343  -1.428
  242    HD2  ARG  50           HD1      ARG  50   0.317  -3.813  -2.152
  243    HD3  ARG  50           HD2      ARG  50   1.146  -4.087  -3.691
  244    HE   ARG  50           HE       ARG  50   2.547  -5.577  -2.647
  245   HH11  ARG  50          HH11      ARG  50   0.794  -3.756  -0.254
  246   HH12  ARG  50          HH12      ARG  50   1.314  -4.745   1.069
  247   HH21  ARG  50          HH21      ARG  50   3.239  -6.887  -0.913
  248   HH22  ARG  50          HH22      ARG  50   2.706  -6.525   0.694
  249    H    LYS  51           H        LYS  51  -1.242   1.213  -1.846
  250    HA   LYS  51           HA       LYS  51  -0.055   3.245  -3.604
  251    HB2  LYS  51           HB1      LYS  51  -2.966   2.408  -3.602
  252    HB3  LYS  51           HB2      LYS  51  -2.282   3.755  -4.526
  253    HG2  LYS  51           HG1      LYS  51  -0.846   2.155  -5.752
  254    HG3  LYS  51           HG2      LYS  51  -1.645   0.834  -4.882
  255    HD2  LYS  51           HD1      LYS  51  -3.846   1.883  -5.784
  256    HD3  LYS  51           HD2      LYS  51  -2.776   2.688  -6.945
  257    HE2  LYS  51           HE1      LYS  51  -1.864   0.462  -7.592
  258    HE3  LYS  51           HE2      LYS  51  -3.054  -0.284  -6.515
  259    HZ1  LYS  51           HZ1      LYS  51  -4.801   0.330  -7.871
  260    HZ2  LYS  51           HZ2      LYS  51  -3.601  -0.050  -9.001
  261    HZ3  LYS  51           HZ3      LYS  51  -3.933   1.567  -8.633
  262    H    PHE  52           H        PHE  52  -0.955   5.421  -3.245
  263    HA   PHE  52           HA       PHE  52  -2.057   5.767  -0.539
  264    HB2  PHE  52           HB1      PHE  52  -0.600   7.777  -0.278
  265    HB3  PHE  52           HB2      PHE  52   0.294   6.258  -0.357
  266    HD1  PHE  52           HD1      PHE  52  -0.732   9.172  -2.402
  267    HD2  PHE  52           HD2      PHE  52   1.963   5.909  -1.952
  268    HE1  PHE  52           HE1      PHE  52   0.634  10.049  -4.251
  269    HE2  PHE  52           HE2      PHE  52   3.334   6.782  -3.799
  270    HZ   PHE  52           HZ       PHE  52   2.671   8.855  -4.951
  271    H    CYS  53           H        CYS  53  -3.470   7.473  -0.253
  272    HA   CYS  53           HA       CYS  53  -4.711   8.460  -2.673
  273    HB2  CYS  53           HB1      CYS  53  -5.409   8.325   0.209
  274    HB3  CYS  53           HB2      CYS  53  -6.112   9.660  -0.705
  275    H    LEU  54           H        LEU  54  -3.568  10.053  -3.628
  276    HA   LEU  54           HA       LEU  54  -2.381  12.176  -2.038
  277    HB2  LEU  54           HB1      LEU  54  -1.139  11.228  -3.924
  278    HB3  LEU  54           HB2      LEU  54  -2.435  11.735  -5.020
  279    HG   LEU  54           HG       LEU  54  -1.600  14.059  -3.672
  280   HD11  LEU  54          HD11      LEU  54   0.429  12.695  -3.086
  281   HD12  LEU  54          HD12      LEU  54   0.744  14.170  -3.998
  282   HD13  LEU  54          HD13      LEU  54   0.775  12.607  -4.813
  283   HD21  LEU  54          HD21      LEU  54  -0.728  13.275  -6.430
  284   HD22  LEU  54          HD22      LEU  54  -1.201  14.861  -5.824
  285   HD23  LEU  54          HD23      LEU  54  -2.421  13.609  -6.065
  286    H    GLN  55           H        GLN  55  -3.134  14.215  -1.856
  287    HA   GLN  55           HA       GLN  55  -5.489  14.966  -3.449
  288    HB2  GLN  55           HB1      GLN  55  -6.281  16.194  -1.349
  289    HB3  GLN  55           HB2      GLN  55  -6.450  14.431  -1.371
  290    HG2  GLN  55           HG1      GLN  55  -5.096  14.152   0.375
  291    HG3  GLN  55           HG2      GLN  55  -3.909  15.299  -0.261
  292   HE21  GLN  55          HE21      GLN  55  -3.949  17.410   0.395
  293   HE22  GLN  55          HE22      GLN  55  -4.956  17.988   1.674
  294    HA   PRO  56           HA       PRO  56  -2.322  18.241  -3.931
  295    HB2  PRO  56           HB1      PRO  56  -3.052  18.866  -6.494
  296    HB3  PRO  56           HB2      PRO  56  -1.961  17.543  -6.090
  297    HG2  PRO  56           HG1      PRO  56  -4.904  17.472  -6.657
  298    HG3  PRO  56           HG2      PRO  56  -3.600  16.387  -7.267
  299    HD2  PRO  56           HD1      PRO  56  -5.266  15.682  -5.244
  300    HD3  PRO  56           HD2      PRO  56  -3.573  15.160  -5.315
  301    H    ARG  57           H        ARG  57  -2.556  20.530  -4.235
  302    HA   ARG  57           HA       ARG  57  -5.104  21.509  -3.284
  303    HB2  ARG  57           HB1      ARG  57  -2.674  22.262  -2.622
  304    HB3  ARG  57           HB2      ARG  57  -2.837  23.309  -4.039
  305    HG2  ARG  57           HG1      ARG  57  -4.525  24.575  -3.097
  306    HG3  ARG  57           HG2      ARG  57  -4.976  23.295  -1.958
  307    HD2  ARG  57           HD1      ARG  57  -2.218  24.283  -1.656
  308    HD3  ARG  57           HD2      ARG  57  -3.479  25.478  -1.325
  309    HE   ARG  57           HE       ARG  57  -2.801  23.210   0.279
  310   HH11  ARG  57          HH11      ARG  57  -5.389  25.353  -0.631
  311   HH12  ARG  57          HH12      ARG  57  -6.283  25.105   0.830
  312   HH21  ARG  57          HH21      ARG  57  -3.970  22.875   2.209
  313   HH22  ARG  57          HH22      ARG  57  -5.475  23.697   2.447
  314    H    ASP  58           H        ASP  58  -3.049  21.977  -6.142
  315    HA   ASP  58           HA       ASP  58  -4.934  23.698  -7.444
  316    HB2  ASP  58           HB1      ASP  58  -2.235  22.982  -7.811
  317    HB3  ASP  58           HB2      ASP  58  -3.080  22.450  -9.271
  318    HD2  ASP  58           HD       ASP  58  -2.644  26.313  -8.643
  319    H    GLU  59           H        GLU  59  -4.462  20.292  -7.214
  320    HA   GLU  59           HA       GLU  59  -6.442  19.865  -9.355
  321    HB2  GLU  59           HB1      GLU  59  -3.906  18.618  -8.832
  322    HB3  GLU  59           HB2      GLU  59  -5.196  17.411  -8.707
  323    HG2  GLU  59           HG1      GLU  59  -4.886  19.264 -11.065
  324    HG3  GLU  59           HG2      GLU  59  -4.155  17.656 -10.973
  325    HE2  GLU  59           HE       GLU  59  -7.061  16.296 -12.143
  326    H    LYS  60           H        LYS  60  -7.432  17.483  -8.914
  327    HA   LYS  60           HA       LYS  60  -8.686  17.711  -6.270
  328    HB2  LYS  60           HB1      LYS  60 -10.408  16.145  -7.285
  329    HB3  LYS  60           HB2      LYS  60 -10.327  17.774  -7.975
  330    HG2  LYS  60           HG1      LYS  60  -9.880  16.992 -10.003
  331    HG3  LYS  60           HG2      LYS  60  -8.572  15.969  -9.382
  332    HD2  LYS  60           HD1      LYS  60  -9.953  14.320 -10.127
  333    HD3  LYS  60           HD2      LYS  60 -10.639  14.534  -8.507
  334    HE2  LYS  60           HE1      LYS  60 -12.448  15.822  -9.312
  335    HE3  LYS  60           HE2      LYS  60 -11.658  16.077 -10.874
  336    HZ1  LYS  60           HZ1      LYS  60 -12.400  13.364  -9.979
  337    HZ2  LYS  60           HZ2      LYS  60 -12.113  13.918 -11.551
  338    HZ3  LYS  60           HZ3      LYS  60 -13.528  14.367 -10.742
  339    HA   PRO  61           HA       PRO  61  -6.905  13.990  -4.769
  340    HB2  PRO  61           HB1      PRO  61  -8.945  12.980  -3.247
  341    HB3  PRO  61           HB2      PRO  61  -8.000  14.396  -2.791
  342    HG2  PRO  61           HG1      PRO  61 -10.677  14.249  -4.135
  343    HG3  PRO  61           HG2      PRO  61 -10.144  15.298  -2.769
  344    HD2  PRO  61           HD1      PRO  61 -10.332  16.200  -5.324
  345    HD3  PRO  61           HD2      PRO  61  -9.102  16.785  -4.189
  346    H    PHE  62           H        PHE  62  -6.723  11.830  -5.229
  347    HA   PHE  62           HA       PHE  62  -8.840  10.224  -6.218
  348    HB2  PHE  62           HB1      PHE  62  -8.261   9.988  -8.513
  349    HB3  PHE  62           HB2      PHE  62  -8.374  11.722  -8.200
  350    HD1  PHE  62           HD1      PHE  62  -6.067  12.819  -7.411
  351    HD2  PHE  62           HD2      PHE  62  -6.454   9.286  -9.753
  352    HE1  PHE  62           HE1      PHE  62  -3.790  13.151  -8.282
  353    HE2  PHE  62           HE2      PHE  62  -4.178   9.612 -10.628
  354    HZ   PHE  62           HZ       PHE  62  -2.842  11.546  -9.892
  355    H    CYS  63           H        CYS  63  -7.993   8.087  -7.058
  356    HA   CYS  63           HA       CYS  63  -6.049   7.096  -5.232
  357    HB2  CYS  63           HB1      CYS  63  -7.994   6.021  -7.052
  358    HB3  CYS  63           HB2      CYS  63  -6.449   5.209  -7.310
  359    H    ALA  64           H        ALA  64  -3.960   7.569  -5.444
  360    HA   ALA  64           HA       ALA  64  -2.781   7.649  -8.134
  361    HB1  ALA  64           HB1      ALA  64  -1.107   8.496  -5.883
  362    HB2  ALA  64           HB2      ALA  64  -1.415   9.283  -7.431
  363    HB3  ALA  64           HB3      ALA  64  -2.570   9.454  -6.110
  364    H    THR  65           H        THR  65  -1.368   6.148  -8.782
  365    HA   THR  65           HA       THR  65  -0.930   3.811  -7.231
  366    HB   THR  65           HB       THR  65   0.782   3.323  -9.126
  367    HG1  THR  65           HG1      THR  65   0.491   4.628 -10.956
  368   HG21  THR  65          HG21      THR  65  -1.419   3.282 -10.736
  369   HG22  THR  65          HG22      THR  65  -2.153   3.377  -9.135
  370   HG23  THR  65          HG23      THR  65  -1.042   2.063  -9.520
  371    H    CYS  66           H        CYS  66   1.373   2.896  -7.036
  372    HA   CYS  66           HA       CYS  66   2.820   4.543  -5.248
  373    HB2  CYS  66           HB1      CYS  66   2.693   1.870  -5.684
  374    HB3  CYS  66           HB2      CYS  66   4.230   2.243  -6.462
  375    H    ARG  67           H        ARG  67   5.320   4.706  -5.552
  376    HA   ARG  67           HA       ARG  67   5.795   5.894  -8.207
  377    HB2  ARG  67           HB1      ARG  67   7.163   6.617  -5.606
  378    HB3  ARG  67           HB2      ARG  67   7.307   7.456  -7.158
  379    HG2  ARG  67           HG1      ARG  67   4.753   7.243  -5.561
  380    HG3  ARG  67           HG2      ARG  67   5.858   8.628  -5.537
  381    HD2  ARG  67           HD1      ARG  67   5.507   8.406  -8.194
  382    HD3  ARG  67           HD2      ARG  67   3.966   7.744  -7.633
  383    HE   ARG  67           HE       ARG  67   4.548  10.180  -6.304
  384   HH11  ARG  67          HH11      ARG  67   3.471   8.892  -9.354
  385   HH12  ARG  67          HH12      ARG  67   2.578  10.312  -9.787
  386   HH21  ARG  67          HH21      ARG  67   3.375  12.055  -6.861
  387   HH22  ARG  67          HH22      ARG  67   2.524  12.110  -8.368
  388    H    GLY  68           H        GLY  68   7.688   5.446  -9.289
  389    HA2  GLY  68           HA2      GLY  68   8.941   2.956  -8.685
  390    HA3  GLY  68           HA3      GLY  68   9.387   4.055  -9.982
  391    HA1  GLY  68           HA1      GLY  68   8.875   3.501  -7.995
  392    H    LEU  69           H        LEU  69  11.553   3.178  -9.236
  393    HA   LEU  69           HA       LEU  69  12.629   4.117  -6.767
  394    HB2  LEU  69           HB1      LEU  69  13.923   3.043  -9.274
  395    HB3  LEU  69           HB2      LEU  69  14.820   3.467  -7.806
  396    HG   LEU  69           HG       LEU  69  12.744   1.294  -8.071
  397   HD11  LEU  69          HD11      LEU  69  14.440  -0.001  -8.667
  398   HD12  LEU  69          HD12      LEU  69  15.233   0.357  -7.133
  399   HD13  LEU  69          HD13      LEU  69  15.555   1.360  -8.547
  400   HD21  LEU  69          HD21      LEU  69  13.559   0.733  -5.734
  401   HD22  LEU  69          HD22      LEU  69  12.501   2.137  -5.887
  402   HD23  LEU  69          HD23      LEU  69  14.241   2.360  -5.694
  403    H    ARG  70           H        ARG  70  13.241   5.063 -10.153
  404    HA   ARG  70           HA       ARG  70  14.900   7.230  -9.645
  405    HB2  ARG  70           HB1      ARG  70  12.925   6.771 -11.890
  406    HB3  ARG  70           HB2      ARG  70  14.114   8.083 -11.876
  407    HG2  ARG  70           HG1      ARG  70  15.170   5.355 -11.430
  408    HG3  ARG  70           HG2      ARG  70  14.553   5.723 -13.048
  409    HD2  ARG  70           HD1      ARG  70  15.988   7.841 -12.943
  410    HD3  ARG  70           HD2      ARG  70  16.768   7.086 -11.545
  411    HE   ARG  70           HE       ARG  70  17.118   6.385 -14.306
  412   HH11  ARG  70          HH11      ARG  70  17.279   5.222 -11.028
  413   HH12  ARG  70          HH12      ARG  70  18.418   3.968 -11.391
  414   HH21  ARG  70          HH21      ARG  70  18.617   4.738 -14.796
  415   HH22  ARG  70          HH22      ARG  70  19.179   3.694 -13.534
  416    H    ARG  71           H        ARG  71  11.462   6.933  -9.314
  417    HA   ARG  71           HA       ARG  71  10.698   9.620  -9.434
  418    HB2  ARG  71           HB1      ARG  71   9.545   7.112  -8.572
  419    HB3  ARG  71           HB2      ARG  71   9.095   8.420  -7.469
  420    HG2  ARG  71           HG1      ARG  71   7.447   8.103  -9.262
  421    HG3  ARG  71           HG2      ARG  71   8.190   9.712  -9.297
  422    HD2  ARG  71           HD1      ARG  71   8.955   9.396 -11.368
  423    HD3  ARG  71           HD2      ARG  71   9.724   7.875 -10.890
  424    HE   ARG  71           HE       ARG  71   7.094   7.223 -11.142
  425   HH11  ARG  71          HH11      ARG  71   9.445   8.733 -13.220
  426   HH12  ARG  71          HH12      ARG  71   8.727   8.138 -14.681
  427   HH21  ARG  71          HH21      ARG  71   6.140   6.435 -13.058
  428   HH22  ARG  71          HH22      ARG  71   6.847   6.833 -14.588
  429    H    ARG  72           H        ARG  72  10.415  11.204  -7.853
  430    HA   ARG  72           HA       ARG  72  12.348  11.094  -5.702
  431    HB2  ARG  72           HB1      ARG  72  10.425  13.312  -6.446
  432    HB3  ARG  72           HB2      ARG  72  11.825  13.445  -5.370
  433    HG2  ARG  72           HG1      ARG  72  12.644  12.403  -7.923
  434    HG3  ARG  72           HG2      ARG  72  11.740  13.912  -8.125
  435    HD2  ARG  72           HD1      ARG  72  14.013  13.595  -6.160
  436    HD3  ARG  72           HD2      ARG  72  14.229  14.164  -7.820
  437    HE   ARG  72           HE       ARG  72  12.308  15.808  -6.835
  438   HH11  ARG  72          HH11      ARG  72  15.493  14.892  -5.766
  439   HH12  ARG  72          HH12      ARG  72  15.806  16.405  -4.981
  440   HH21  ARG  72          HH21      ARG  72  12.708  17.803  -5.804
  441   HH22  ARG  72          HH22      ARG  72  14.221  18.059  -5.002
  442    H    CYS  73           H        CYS  73  11.850  11.529  -3.492
  443    HA   CYS  73           HA       CYS  73   9.062  11.210  -2.681
  444    HB2  CYS  73           HB1      CYS  73   9.757   9.489  -0.979
  445    HB3  CYS  73           HB2      CYS  73   9.785   8.936  -2.654
  446    H    GLN  74           H        GLN  74   8.661  11.810  -0.472
  447    HA   GLN  74           HA       GLN  74  10.762  13.559   0.627
  448    HB2  GLN  74           HB1      GLN  74   8.774  14.759  -0.251
  449    HB3  GLN  74           HB2      GLN  74   7.769  13.873   0.906
  450    HG2  GLN  74           HG1      GLN  74   8.547  15.039   2.720
  451    HG3  GLN  74           HG2      GLN  74  10.084  15.428   1.935
  452   HE21  GLN  74          HE21      GLN  74  10.095  17.057   0.289
  453   HE22  GLN  74          HE22      GLN  74   8.916  18.319   0.312
  454    H    ARG  75           H        ARG  75   8.425  11.068   1.278
  455    HA   ARG  75           HA       ARG  75   9.402  10.931   4.056
  456    HB2  ARG  75           HB1      ARG  75   6.825  11.436   3.330
  457    HB3  ARG  75           HB2      ARG  75   6.802   9.672   3.473
  458    HG2  ARG  75           HG1      ARG  75   8.163  10.539   5.746
  459    HG3  ARG  75           HG2      ARG  75   6.823  11.679   5.540
  460    HD2  ARG  75           HD1      ARG  75   5.454   9.445   5.107
  461    HD3  ARG  75           HD2      ARG  75   6.763   8.756   6.077
  462    HE   ARG  75           HE       ARG  75   4.628  10.416   7.008
  463   HH11  ARG  75          HH11      ARG  75   7.930   9.471   7.580
  464   HH12  ARG  75          HH12      ARG  75   7.881   9.844   9.270
  465   HH21  ARG  75          HH21      ARG  75   4.552  10.911   9.234
  466   HH22  ARG  75          HH22      ARG  75   5.959  10.663  10.211
  467    H    ASP  76           H        ASP  76   9.376   8.750   5.000
  468    HA   ASP  76           HA       ASP  76  10.629   6.878   3.266
  469    HB2  ASP  76           HB1      ASP  76  10.456   5.351   5.305
  470    HB3  ASP  76           HB2      ASP  76  11.360   6.857   5.514
  471    HD2  ASP  76           HD       ASP  76   8.209   6.256   7.735
  472    H    ALA  77           H        ALA  77   7.527   6.798   5.021
  473    HA   ALA  77           HA       ALA  77   6.643   4.366   3.888
  474    HB1  ALA  77           HB1      ALA  77   5.639   5.073   5.914
  475    HB2  ALA  77           HB2      ALA  77   5.164   6.623   5.219
  476    HB3  ALA  77           HB3      ALA  77   4.380   5.138   4.681
  477    H    MET  78           H        MET  78   6.584   7.651   2.769
  478    HA   MET  78           HA       MET  78   4.495   7.626   0.957
  479    HB2  MET  78           HB1      MET  78   7.071   9.085   1.186
  480    HB3  MET  78           HB2      MET  78   6.271   9.130  -0.391
  481    HG2  MET  78           HG1      MET  78   4.759   9.793   2.114
  482    HG3  MET  78           HG2      MET  78   5.772  10.993   1.308
  483    HE1  MET  78           HE1      MET  78   4.579  12.104  -1.549
  484    HE2  MET  78           HE2      MET  78   5.840  10.913  -1.230
  485    HE3  MET  78           HE3      MET  78   4.491  10.506  -2.292
  486    H    CYS  79           H        CYS  79   7.662   6.163   0.719
  487    HA   CYS  79           HA       CYS  79   7.251   5.445  -2.073
  488    HB2  CYS  79           HB1      CYS  79   9.485   6.197  -1.082
  489    HB3  CYS  79           HB2      CYS  79   9.557   4.607  -0.322
  490    H    CYS  80           H        CYS  80   7.332   3.253  -2.809
  491    HA   CYS  80           HA       CYS  80   5.620   1.512  -1.497
  492    HB2  CYS  80           HB1      CYS  80   7.411   1.396  -3.819
  493    HB3  CYS  80           HB2      CYS  80   7.160  -0.170  -3.044
  494    HA   PRO  81           HA       PRO  81   7.924  -0.642   1.550
  495    HB2  PRO  81           HB1      PRO  81   6.997  -3.205   1.297
  496    HB3  PRO  81           HB2      PRO  81   6.038  -1.885   1.965
  497    HG2  PRO  81           HG1      PRO  81   6.052  -3.005  -0.818
  498    HG3  PRO  81           HG2      PRO  81   4.650  -2.573   0.232
  499    HD2  PRO  81           HD1      PRO  81   5.525  -0.970  -1.778
  500    HD3  PRO  81           HD2      PRO  81   4.836  -0.332  -0.275
  501    H    GLY  82           H        GLY  82   9.768  -1.864   1.882
  502    HA2  GLY  82           HA2      GLY  82  11.411  -3.468   1.293
  503    HA3  GLY  82           HA3      GLY  82  10.820  -3.427  -0.363
  504    HA1  GLY  82           HA1      GLY  82  11.362  -2.620   1.528
  505    H    THR  83           H        THR  83  10.827  -0.373  -0.085
  506    HA   THR  83           HA       THR  83  13.720  -0.031  -0.543
  507    HB   THR  83           HB       THR  83  13.146   1.794  -2.110
  508    HG1  THR  83           HG1      THR  83  10.475   0.876  -2.115
  509   HG21  THR  83          HG21      THR  83  13.155   0.313  -3.786
  510   HG22  THR  83          HG22      THR  83  11.564  -0.305  -3.344
  511   HG23  THR  83          HG23      THR  83  13.007  -0.940  -2.555
  512    H    LEU  84           H        LEU  84  14.329   2.395  -0.393
  513    HA   LEU  84           HA       LEU  84  12.920   3.668   1.847
  514    HB2  LEU  84           HB1      LEU  84  15.473   2.448   1.962
  515    HB3  LEU  84           HB2      LEU  84  15.722   4.201   2.024
  516    HG   LEU  84           HG       LEU  84  13.698   3.803   3.851
  517   HD11  LEU  84          HD11      LEU  84  13.917   1.408   3.780
  518   HD12  LEU  84          HD12      LEU  84  14.551   2.001   5.314
  519   HD13  LEU  84          HD13      LEU  84  15.659   1.522   4.029
  520   HD21  LEU  84          HD21      LEU  84  15.226   4.595   5.392
  521   HD22  LEU  84          HD22      LEU  84  15.924   5.141   3.866
  522   HD23  LEU  84          HD23      LEU  84  16.571   3.711   4.672
  523    H    CYS  85           H        CYS  85  13.486   5.976   2.107
  524    HA   CYS  85           HA       CYS  85  13.705   7.230  -0.515
  525    HB2  CYS  85           HB1      CYS  85  11.903   7.780   1.229
  526    HB3  CYS  85           HB2      CYS  85  13.178   8.636   2.097
  527    H    VAL  86           H        VAL  86  15.772   7.456  -1.143
  528    HA   VAL  86           HA       VAL  86  17.657   8.684   0.762
  529    HB   VAL  86           HB       VAL  86  18.325   6.946  -1.618
  530   HG11  VAL  86          HG11      VAL  86  20.603   7.029  -0.817
  531   HG12  VAL  86          HG12      VAL  86  20.012   8.670  -1.080
  532   HG13  VAL  86          HG13      VAL  86  20.117   8.022   0.557
  533   HG21  VAL  86          HG21      VAL  86  18.137   6.364   1.319
  534   HG22  VAL  86          HG22      VAL  86  17.418   5.485  -0.030
  535   HG23  VAL  86          HG23      VAL  86  19.158   5.402   0.250
  536    H    ASN  87           H        ASN  87  18.456  10.625   0.269
  537    HA   ASN  87           HA       ASN  87  18.789  12.595  -0.820
  538    HB2  ASN  87           HB1      ASN  87  20.243  10.828  -2.116
  539    HB3  ASN  87           HB2      ASN  87  19.072  11.111  -3.408
  540   HD21  ASN  87          HD21      ASN  87  21.181  12.864  -1.171
  541   HD22  ASN  87          HD22      ASN  87  21.588  14.130  -2.274
  542    H    ASP  88           H        ASP  88  16.097  11.811  -0.543
  543    HA   ASP  88           HA       ASP  88  14.017  12.436  -1.220
  544    HB2  ASP  88           HB1      ASP  88  15.614  14.539  -1.867
  545    HB3  ASP  88           HB2      ASP  88  14.944  14.133  -3.453
  546    HD2  ASP  88           HD       ASP  88  12.465  15.535  -0.694
  547    H    VAL  89           H        VAL  89  15.483  10.206  -2.510
  548    HA   VAL  89           HA       VAL  89  13.697   9.908  -4.813
  549    HB   VAL  89           HB       VAL  89  16.649   9.268  -4.913
  550   HG11  VAL  89          HG11      VAL  89  16.089   8.834  -7.352
  551   HG12  VAL  89          HG12      VAL  89  15.536   7.628  -6.189
  552   HG13  VAL  89          HG13      VAL  89  14.399   8.802  -6.852
  553   HG21  VAL  89          HG21      VAL  89  16.337  10.968  -6.917
  554   HG22  VAL  89          HG22      VAL  89  15.020  11.550  -5.900
  555   HG23  VAL  89          HG23      VAL  89  16.670  11.523  -5.277
  556    H    CYS  90           H        CYS  90  12.945   7.855  -5.138
  557    HA   CYS  90           HA       CYS  90  13.040   6.051  -2.962
  558    HB2  CYS  90           HB1      CYS  90  11.889   5.995  -5.726
  559    HB3  CYS  90           HB2      CYS  90  11.974   4.490  -4.807
  560    H    THR  91           H        THR  91  14.858   5.015  -2.438
  561    HA   THR  91           HA       THR  91  16.356   3.670  -4.593
  562    HB   THR  91           HB       THR  91  17.492   4.607  -1.953
  563    HG1  THR  91           HG1      THR  91  17.249   5.848  -4.453
  564   HG21  THR  91          HG21      THR  91  18.727   3.416  -4.432
  565   HG22  THR  91          HG22      THR  91  18.751   2.764  -2.794
  566   HG23  THR  91          HG23      THR  91  19.660   4.226  -3.175
  567    H    THR  92           H        THR  92  16.684   1.528  -4.427
  568    HA   THR  92           HA       THR  92  15.200  -0.001  -2.581
  569    HB   THR  92           HB       THR  92  17.374  -1.527  -3.712
  570    HG1  THR  92           HG1      THR  92  17.199  -0.978  -5.821
  571   HG21  THR  92          HG21      THR  92  15.703  -2.975  -4.206
  572   HG22  THR  92          HG22      THR  92  14.653  -1.709  -4.844
  573   HG23  THR  92          HG23      THR  92  14.783  -1.953  -3.102
  574    H    MET  93           H        MET  93  15.887  -1.359  -0.891
  575    HA   MET  93           HA       MET  93  17.776  -0.263   0.864
  576    HB2  MET  93           HB1      MET  93  16.221  -2.810   0.739
  577    HB3  MET  93           HB2      MET  93  17.562  -2.702   1.890
  578    HG2  MET  93           HG1      MET  93  16.552  -0.714   2.905
  579    HG3  MET  93           HG2      MET  93  15.217  -0.822   1.757
  580    HE1  MET  93           HE1      MET  93  15.641  -2.436   5.734
  581    HE2  MET  93           HE2      MET  93  16.115  -0.961   4.893
  582    HE3  MET  93           HE3      MET  93  14.424  -1.229   5.320
  583    H    GLU  94           H        GLU  94  18.011  -2.904  -1.461
  584    HA   GLU  94           HA       GLU  94  20.577  -3.803  -0.664
  585    HB2  GLU  94           HB1      GLU  94  19.091  -4.068  -3.285
  586    HB3  GLU  94           HB2      GLU  94  20.616  -4.890  -2.922
  587    HG2  GLU  94           HG1      GLU  94  19.595  -6.132  -1.132
  588    HG3  GLU  94           HG2      GLU  94  18.086  -5.231  -1.330
  589    HE2  GLU  94           HE       GLU  94  18.853  -8.203  -3.813
  590    H    ASP  95           H        ASP  95  19.469  -1.227  -2.717
  591    HA   ASP  95           HA       ASP  95  22.052  -0.790  -3.937
  592    HB2  ASP  95           HB1      ASP  95  19.497  -0.181  -4.693
  593    HB3  ASP  95           HB2      ASP  95  20.060   1.377  -4.075
  594    HD2  ASP  95           HD       ASP  95  21.100   0.562  -7.625
  595    H    ALA  96           H        ALA  96  20.093   0.668  -1.391
  596    HA   ALA  96           HA       ALA  96  21.734   2.911  -0.914
  597    HB1  ALA  96           HB1      ALA  96  20.602   2.547   1.489
  598    HB2  ALA  96           HB2      ALA  96  19.747   3.245   0.112
  599    HB3  ALA  96           HB3      ALA  96  19.538   1.539   0.506
  600    H    THR  97           H        THR  97  23.821   2.780  -0.411
  601    HA   THR  97           HA       THR  97  24.665   0.743   1.547
  602    HB   THR  97           HB       THR  97  25.658   0.468  -0.725
  603    HG1  THR  97           HG1      THR  97  26.763  -0.009   1.388
  604   HG21  THR  97          HG21      THR  97  27.482   2.752  -0.305
  605   HG22  THR  97          HG22      THR  97  25.839   3.157  -0.804
  606   HG23  THR  97          HG23      THR  97  26.824   2.085  -1.799
  607    H    GLU  98           H        GLU  98  24.699   4.107   0.662
  608    HA   GLU  98           HA       GLU  98  25.315   5.989   1.781
  609    HB2  GLU  98           HB1      GLU  98  23.946   4.871   3.569
  610    HB3  GLU  98           HB2      GLU  98  25.458   4.231   4.231
  611    HG2  GLU  98           HG1      GLU  98  26.193   6.291   4.955
  612    HG3  GLU  98           HG2      GLU  98  25.180   7.165   3.798
  613    HE2  GLU  98           HE       GLU  98  22.807   5.729   6.549
  614    H    ASN  99           H        ASN  99  27.305   6.091   0.655
  615    HA   ASN  99           HA       ASN  99  29.562   6.311   0.481
  616    HB2  ASN  99           HB1      ASN  99  28.899   6.960   3.149
  617    HB3  ASN  99           HB2      ASN  99  30.352   5.954   3.229
  618   HD21  ASN  99          HD21      ASN  99  29.025   8.708   1.438
  619   HD22  ASN  99          HD22      ASN  99  30.518   9.568   1.314
  620    H    LEU 100           H        LEU 100  31.724   5.206   1.594
  621    HA   LEU 100           HA       LEU 100  31.243   2.318   1.749
  622    HB2  LEU 100           HB1      LEU 100  32.479   3.742  -0.434
  623    HB3  LEU 100           HB2      LEU 100  33.637   2.634   0.326
  624    HG   LEU 100           HG       LEU 100  31.615   0.932   0.052
  625   HD11  LEU 100          HD11      LEU 100  30.439   3.062  -1.089
  626   HD12  LEU 100          HD12      LEU 100  30.079   1.393  -1.531
  627   HD13  LEU 100          HD13      LEU 100  31.206   2.340  -2.504
  628   HD21  LEU 100          HD21      LEU 100  34.029   1.482  -1.285
  629   HD22  LEU 100          HD22      LEU 100  32.829   1.135  -2.531
  630   HD23  LEU 100          HD23      LEU 100  33.131  -0.036  -1.246
  631    H    TYR 101           H        TYR 101  33.320   1.146   2.374
  632    HA   TYR 101           HA       TYR 101  34.452   2.544   4.655
  633    HB2  TYR 101           HB1      TYR 101  34.451  -0.317   3.717
  634    HB3  TYR 101           HB2      TYR 101  35.555   0.216   4.988
  635    HD1  TYR 101           HD1      TYR 101  31.953  -0.002   4.116
  636    HD2  TYR 101           HD2      TYR 101  34.833   0.453   7.215
  637    HE1  TYR 101           HE1      TYR 101  30.179  -0.280   5.798
  638    HE2  TYR 101           HE2      TYR 101  33.068   0.176   8.904
  639    HH   TYR 101           HH       TYR 101  29.716  -0.505   7.966
  640    H    PHE 102           H        PHE 102  36.628   2.932   4.988
  641    HA   PHE 102           HA       PHE 102  38.295   2.808   2.567
  642    HB2  PHE 102           HB1      PHE 102  38.008   4.797   4.763
  643    HB3  PHE 102           HB2      PHE 102  39.625   4.569   4.094
  644    HD1  PHE 102           HD1      PHE 102  40.163   6.281   2.669
  645    HD2  PHE 102           HD2      PHE 102  36.231   4.655   2.544
  646    HE1  PHE 102           HE1      PHE 102  39.617   7.756   0.777
  647    HE2  PHE 102           HE2      PHE 102  35.679   6.127   0.652
  648    HZ   PHE 102           HZ       PHE 102  37.373   7.680  -0.234
  649    H    GLN 103           H        GLN 103  39.843   1.331   2.578
  650    HA   GLN 103           HA       GLN 103  40.762   0.232   5.125
  651    HB2  GLN 103           HB1      GLN 103  40.169  -0.905   2.631
  652    HB3  GLN 103           HB2      GLN 103  41.929  -1.006   2.789
  653    HG2  GLN 103           HG1      GLN 103  41.816  -2.327   4.712
  654    HG3  GLN 103           HG2      GLN 103  40.122  -1.906   4.998
  655   HE21  GLN 103          HE21      GLN 103  39.705  -4.164   5.158
  656   HE22  GLN 103          HE22      GLN 103  39.531  -5.127   3.735
  657    H    SER 104           H        SER 104  43.195  -0.527   4.948
  658    HA   SER 104           HA       SER 104  44.795   1.716   3.915
  659    HB2  SER 104           HB1      SER 104  44.296   1.293   6.597
  660    HB3  SER 104           HB2      SER 104  45.857   0.487   6.355
  661    HG   SER 104           HG       SER 104  45.983   2.771   6.877
  662    H    LEU 105           H        LEU 105  47.276   0.998   4.321
  663    HA   LEU 105           HA       LEU 105  47.716  -1.798   3.721
  664    HB2  LEU 105           HB1      LEU 105  47.710   0.295   1.668
  665    HB3  LEU 105           HB2      LEU 105  49.193  -0.676   1.705
  666    HG   LEU 105           HG       LEU 105  46.839  -2.357   1.791
  667   HD11  LEU 105          HD11      LEU 105  46.955  -0.190  -0.237
  668   HD12  LEU 105          HD12      LEU 105  45.562  -0.974   0.506
  669   HD13  LEU 105          HD13      LEU 105  46.465  -1.801  -0.763
  670   HD21  LEU 105          HD21      LEU 105  49.389  -2.106   0.299
  671   HD22  LEU 105          HD22      LEU 105  48.092  -3.033  -0.456
  672   HD23  LEU 105          HD23      LEU 105  48.694  -3.494   1.136
  673    H    GLU 106           H        GLU 106  49.210   1.433   3.712
  674    HA   GLU 106           HA       GLU 106  51.513   0.262   5.131
  675    HB2  GLU 106           HB1      GLU 106  52.893   2.069   4.136
  676    HB3  GLU 106           HB2      GLU 106  52.211   0.965   2.930
  677    HG2  GLU 106           HG1      GLU 106  50.409   2.611   2.489
  678    HG3  GLU 106           HG2      GLU 106  51.216   3.724   3.604
  679    HE2  GLU 106           HE       GLU 106  53.777   3.106   0.753
  680    H    HIS 107           H        HIS 107  52.409   1.432   6.836
  681    HA   HIS 107           HA       HIS 107  50.885   3.783   7.734
  682    HB2  HIS 107           HB1      HIS 107  51.379   1.217   9.126
  683    HB3  HIS 107           HB2      HIS 107  51.611   2.673  10.098
  684    HD1  HIS 107           HD1      HIS 107  49.580   3.039  11.447
  685    HD2  HIS 107           HD2      HIS 107  48.662   1.777   7.597
  686    HE1  HIS 107           HE1      HIS 107  47.068   3.046  11.318
  687    HE2  HIS 107           HE2      HIS 107  46.506   2.276   8.965
  688    H    HIS 108           H        HIS 108  52.124   4.831   9.672
  689    HA   HIS 108           HA       HIS 108  55.019   4.694   9.292
  690    HB2  HIS 108           HB1      HIS 108  53.344   6.795   8.273
  691    HB3  HIS 108           HB2      HIS 108  54.398   7.446   9.532
  692    HD1  HIS 108           HD1      HIS 108  57.042   6.301   9.126
  693    HD2  HIS 108           HD2      HIS 108  54.577   7.151   5.892
  694    HE1  HIS 108           HE1      HIS 108  58.579   6.509   7.146
  695    HE2  HIS 108           HE2      HIS 108  57.073   7.029   5.168
  696    H    HIS 109           H        HIS 109  55.997   6.496  10.887
  697    HA   HIS 109           HA       HIS 109  54.581   6.991  13.292
  698    HB2  HIS 109           HB1      HIS 109  55.504   4.379  13.082
  699    HB3  HIS 109           HB2      HIS 109  56.743   5.184  14.050
  700    HD1  HIS 109           HD1      HIS 109  54.363   3.066  14.914
  701    HD2  HIS 109           HD2      HIS 109  54.733   7.097  15.847
  702    HE1  HIS 109           HE1      HIS 109  53.013   3.398  17.009
  703    HE2  HIS 109           HE2      HIS 109  53.239   5.862  17.581
  704    H    HIS 110           H        HIS 110  57.765   6.448  11.838
  705    HA   HIS 110           HA       HIS 110  58.627   9.046  12.836
  706    HB2  HIS 110           HB1      HIS 110  59.331   6.769  14.229
  707    HB3  HIS 110           HB2      HIS 110  60.723   7.030  13.173
  708    HD1  HIS 110           HD1      HIS 110  62.446   8.073  14.620
  709    HD2  HIS 110           HD2      HIS 110  58.704   9.795  15.165
  710    HE1  HIS 110           HE1      HIS 110  62.816  10.002  16.190
  711    HE2  HIS 110           HE2      HIS 110  60.529  11.055  16.524
  712    H    HIS 111           H        HIS 111  60.953   9.479  11.970
  713    HA   HIS 111           HA       HIS 111  60.850   8.969   9.114
  714    HB2  HIS 111           HB1      HIS 111  61.988  11.001  10.867
  715    HB3  HIS 111           HB2      HIS 111  63.131  10.478   9.626
  716    HD1  HIS 111           HD1      HIS 111  59.941  12.341  10.068
  717    HD2  HIS 111           HD2      HIS 111  62.407  11.088   6.968
  718    HE1  HIS 111           HE1      HIS 111  59.157  13.597   8.035
  719    HE2  HIS 111           HE2      HIS 111  60.664  12.834   6.140
  720    H    HIS 112           H        HIS 112  61.611   7.006   8.570
  721    HA   HIS 112           HA       HIS 112  64.020   5.974   9.851
  722    HB2  HIS 112           HB1      HIS 112  61.903   4.593   9.386
  723    HB3  HIS 112           HB2      HIS 112  62.425   4.594   7.698
  724    HD1  HIS 112           HD1      HIS 112  63.819   2.665   7.053
  725    HD2  HIS 112           HD2      HIS 112  64.135   3.501  11.110
  726    HE1  HIS 112           HE1      HIS 112  65.315   0.875   7.994
  727    HE2  HIS 112           HE2      HIS 112  65.509   1.386  10.473
  Start of MODEL   23
    1    H1   MET  18           H        MET  18  24.172   0.734 -14.247
    2    HA   MET  18           HA       MET  18  24.043  -1.167 -15.507
    3    HB2  MET  18           HB1      MET  18  26.103  -2.471 -15.620
    4    HB3  MET  18           HB2      MET  18  26.459  -0.740 -15.551
    5    HG2  MET  18           HG1      MET  18  26.473  -1.498 -12.891
    6    HG3  MET  18           HG2      MET  18  27.211  -2.866 -13.729
    7    HE1  MET  18           HE1      MET  18  30.417  -1.111 -12.471
    8    HE2  MET  18           HE2      MET  18  28.900  -1.447 -11.635
    9    HE3  MET  18           HE3      MET  18  29.601  -2.657 -12.712
   10    H    LEU  19           H        LEU  19  24.590  -1.640 -12.096
   11    HA   LEU  19           HA       LEU  19  22.754  -3.871 -12.089
   12    HB2  LEU  19           HB1      LEU  19  25.288  -4.602 -12.459
   13    HB3  LEU  19           HB2      LEU  19  25.319  -4.419 -10.697
   14    HG   LEU  19           HG       LEU  19  24.930  -6.721 -11.219
   15   HD11  LEU  19          HD11      LEU  19  22.213  -5.705 -10.474
   16   HD12  LEU  19          HD12      LEU  19  23.588  -5.508  -9.388
   17   HD13  LEU  19          HD13      LEU  19  23.077  -7.123  -9.878
   18   HD21  LEU  19          HD21      LEU  19  22.761  -7.304 -12.446
   19   HD22  LEU  19          HD22      LEU  19  24.121  -6.735 -13.412
   20   HD23  LEU  19          HD23      LEU  19  22.793  -5.640 -13.027
   21    H    VAL  20           H        VAL  20  21.414  -2.747 -10.743
   22    HA   VAL  20           HA       VAL  20  22.479  -1.643  -8.259
   23    HB   VAL  20           HB       VAL  20  19.667  -1.549  -9.362
   24   HG11  VAL  20          HG11      VAL  20  20.946  -0.206  -6.988
   25   HG12  VAL  20          HG12      VAL  20  19.398   0.287  -7.678
   26   HG13  VAL  20          HG13      VAL  20  19.584  -1.327  -6.989
   27   HG21  VAL  20          HG21      VAL  20  20.375   0.939  -9.612
   28   HG22  VAL  20          HG22      VAL  20  22.015   0.290  -9.588
   29   HG23  VAL  20          HG23      VAL  20  20.878  -0.232 -10.831
   30    H    LEU  21           H        LEU  21  21.867  -2.323  -6.220
   31    HA   LEU  21           HA       LEU  21  21.273  -5.085  -5.934
   32    HB2  LEU  21           HB1      LEU  21  21.412  -2.822  -3.940
   33    HB3  LEU  21           HB2      LEU  21  21.141  -4.514  -3.490
   34    HG   LEU  21           HG       LEU  21  23.526  -4.081  -5.141
   35   HD11  LEU  21          HD11      LEU  21  24.630  -3.358  -2.811
   36   HD12  LEU  21          HD12      LEU  21  23.079  -2.532  -2.668
   37   HD13  LEU  21          HD13      LEU  21  24.130  -2.201  -4.045
   38   HD21  LEU  21          HD21      LEU  21  23.343  -6.208  -4.256
   39   HD22  LEU  21          HD22      LEU  21  22.728  -5.626  -2.709
   40   HD23  LEU  21          HD23      LEU  21  24.434  -5.424  -3.113
   41    H    ASP  22           H        ASP  22  19.386  -6.102  -5.711
   42    HA   ASP  22           HA       ASP  22  17.048  -4.716  -4.703
   43    HB2  ASP  22           HB1      ASP  22  17.291  -5.685  -7.547
   44    HB3  ASP  22           HB2      ASP  22  15.718  -5.589  -6.744
   45    HD2  ASP  22           HD       ASP  22  16.979  -2.371  -8.336
   46    H    PHE  23           H        PHE  23  15.079  -6.389  -5.007
   47    HA   PHE  23           HA       PHE  23  15.591  -9.137  -4.990
   48    HB2  PHE  23           HB1      PHE  23  16.463  -7.860  -2.621
   49    HB3  PHE  23           HB2      PHE  23  14.981  -8.725  -2.208
   50    HD1  PHE  23           HD1      PHE  23  18.438  -9.032  -2.443
   51    HD2  PHE  23           HD2      PHE  23  14.848 -11.190  -3.199
   52    HE1  PHE  23           HE1      PHE  23  19.686 -11.147  -2.311
   53    HE2  PHE  23           HE2      PHE  23  16.091 -13.310  -3.067
   54    HZ   PHE  23           HZ       PHE  23  18.513 -13.291  -2.622
   55    H    ASN  24           H        ASN  24  13.675  -6.668  -3.291
   56    HA   ASN  24           HA       ASN  24  11.431  -6.359  -3.086
   57    HB2  ASN  24           HB1      ASN  24  11.770  -7.685  -5.681
   58    HB3  ASN  24           HB2      ASN  24  10.174  -7.936  -4.965
   59   HD21  ASN  24          HD21      ASN  24  11.826  -6.016  -6.989
   60   HD22  ASN  24          HD22      ASN  24  10.918  -4.554  -6.837
   61    H    ASN  25           H        ASN  25  11.296  -7.368  -1.071
   62    HA   ASN  25           HA       ASN  25  10.420 -10.176  -1.088
   63    HB2  ASN  25           HB1      ASN  25  12.250  -8.723   0.571
   64    HB3  ASN  25           HB2      ASN  25  10.898  -9.273   1.567
   65   HD21  ASN  25          HD21      ASN  25  13.697 -10.139   1.513
   66   HD22  ASN  25          HD22      ASN  25  13.654 -11.844   1.240
   67    H    ILE  26           H        ILE  26   8.475 -10.759  -0.252
   68    HA   ILE  26           HA       ILE  26   6.386  -8.907  -0.172
   69    HB   ILE  26           HB       ILE  26   5.021 -10.696   0.806
   70   HG12  ILE  26          HG11      ILE  26   6.562 -12.950   0.858
   71   HG13  ILE  26          HG12      ILE  26   7.682 -11.745   1.514
   72   HG21  ILE  26          HG21      ILE  26   6.744 -11.087  -1.554
   73   HG22  ILE  26          HG22      ILE  26   5.893 -12.517  -0.971
   74   HG23  ILE  26          HG23      ILE  26   4.985 -11.073  -1.420
   75   HD11  ILE  26          HD11      ILE  26   5.237 -12.877   2.691
   76   HD12  ILE  26          HD12      ILE  26   6.719 -12.314   3.461
   77   HD13  ILE  26          HD13      ILE  26   5.495 -11.152   2.950
   78    H    ARG  27           H        ARG  27   5.140  -8.082   1.540
   79    HA   ARG  27           HA       ARG  27   6.085  -8.382   4.263
   80    HB2  ARG  27           HB1      ARG  27   7.520  -6.592   3.295
   81    HB3  ARG  27           HB2      ARG  27   6.057  -5.654   2.961
   82    HG2  ARG  27           HG1      ARG  27   6.348  -4.719   4.957
   83    HG3  ARG  27           HG2      ARG  27   5.817  -6.266   5.637
   84    HD2  ARG  27           HD1      ARG  27   7.842  -5.859   6.730
   85    HD3  ARG  27           HD2      ARG  27   8.274  -6.980   5.432
   86    HE   ARG  27           HE       ARG  27   8.583  -4.315   4.549
   87   HH11  ARG  27          HH11      ARG  27  10.046  -6.689   6.634
   88   HH12  ARG  27          HH12      ARG  27  11.641  -6.029   6.483
   89   HH21  ARG  27          HH21      ARG  27  10.679  -3.436   4.344
   90   HH22  ARG  27          HH22      ARG  27  11.999  -4.177   5.181
   91    H    SER  28           H        SER  28   4.039  -9.211   4.697
   92    HA   SER  28           HA       SER  28   2.064  -7.330   5.435
   93    HB2  SER  28           HB1      SER  28   0.255  -8.297   3.876
   94    HB3  SER  28           HB2      SER  28   1.403  -7.141   3.178
   95    HG   SER  28           HG       SER  28   2.369  -8.720   2.073
   96    H    SER  29           H        SER  29   1.700  -8.271   7.345
   97    HA   SER  29           HA       SER  29   0.830 -11.084   7.342
   98    HB2  SER  29           HB1      SER  29   3.182 -10.564   8.328
   99    HB3  SER  29           HB2      SER  29   2.276  -9.881   9.689
  100    HG   SER  29           HG       SER  29   2.493 -11.953  10.260
  101    H    ALA  30           H        ALA  30  -0.696  -8.575   7.228
  102    HA   ALA  30           HA       ALA  30  -2.730  -9.216   9.059
  103    HB1  ALA  30           HB1      ALA  30  -2.450  -6.838  10.238
  104    HB2  ALA  30           HB2      ALA  30  -1.751  -8.318  10.895
  105    HB3  ALA  30           HB3      ALA  30  -0.749  -7.210   9.957
  106    H    ASP  31           H        ASP  31  -4.560  -8.536   8.158
  107    HA   ASP  31           HA       ASP  31  -4.545  -6.039   6.611
  108    HB2  ASP  31           HB1      ASP  31  -5.865  -7.049   4.840
  109    HB3  ASP  31           HB2      ASP  31  -4.357  -7.949   5.049
  110    HD2  ASP  31           HD       ASP  31  -6.014 -10.814   6.037
  111    H    LEU  32           H        LEU  32  -6.221  -4.731   7.021
  112    HA   LEU  32           HA       LEU  32  -8.533  -5.854   8.459
  113    HB2  LEU  32           HB1      LEU  32  -7.535  -3.051   8.884
  114    HB3  LEU  32           HB2      LEU  32  -8.626  -4.011   9.898
  115    HG   LEU  32           HG       LEU  32  -5.649  -4.399   9.599
  116   HD11  LEU  32          HD11      LEU  32  -5.437  -3.553  11.762
  117   HD12  LEU  32          HD12      LEU  32  -7.161  -3.710  12.095
  118   HD13  LEU  32          HD13      LEU  32  -6.587  -2.463  10.989
  119   HD21  LEU  32          HD21      LEU  32  -7.737  -6.205  10.467
  120   HD22  LEU  32          HD22      LEU  32  -6.569  -5.890  11.751
  121   HD23  LEU  32          HD23      LEU  32  -6.022  -6.511  10.192
  122    H    HIS  33           H        HIS  33 -10.483  -4.407   8.334
  123    HA   HIS  33           HA       HIS  33 -10.603  -2.750   5.938
  124    HB2  HIS  33           HB1      HIS  33 -11.335  -5.384   5.754
  125    HB3  HIS  33           HB2      HIS  33 -12.875  -4.608   6.139
  126    HD1  HIS  33           HD1      HIS  33 -10.100  -3.368   3.852
  127    HD2  HIS  33           HD2      HIS  33 -14.123  -4.400   3.745
  128    HE1  HIS  33           HE1      HIS  33 -10.872  -2.823   1.522
  129    HE2  HIS  33           HE2      HIS  33 -13.331  -3.452   1.456
  130    H    GLY  34           H        GLY  34 -12.382  -1.312   5.888
  131    HA2  GLY  34           HA2      GLY  34 -14.463  -0.515   6.835
  132    HA3  GLY  34           HA3      GLY  34 -13.963  -1.197   8.374
  133    HA1  GLY  34           HA1      GLY  34 -13.696  -0.240   6.496
  134    H    ALA  35           H        ALA  35 -14.403   1.622   6.808
  135    HA   ALA  35           HA       ALA  35 -12.899   3.102   8.759
  136    HB1  ALA  35           HB1      ALA  35 -11.130   2.676   7.147
  137    HB2  ALA  35           HB2      ALA  35 -12.127   3.346   5.854
  138    HB3  ALA  35           HB3      ALA  35 -11.559   4.387   7.159
  139    H    ARG  36           H        ARG  36 -15.668   2.754   7.764
  140    HA   ARG  36           HA       ARG  36 -17.529   4.013   7.411
  141    HB2  ARG  36           HB1      ARG  36 -15.888   5.492   9.085
  142    HB3  ARG  36           HB2      ARG  36 -16.326   6.638   7.809
  143    HG2  ARG  36           HG1      ARG  36 -18.221   7.014   8.897
  144    HG3  ARG  36           HG2      ARG  36 -18.712   5.368   8.461
  145    HD2  ARG  36           HD1      ARG  36 -17.937   4.473  10.512
  146    HD3  ARG  36           HD2      ARG  36 -17.039   5.949  10.889
  147    HE   ARG  36           HE       ARG  36 -19.871   6.365  10.643
  148   HH11  ARG  36          HH11      ARG  36 -17.289   5.441  12.786
  149   HH12  ARG  36          HH12      ARG  36 -18.148   5.884  14.225
  150   HH21  ARG  36          HH21      ARG  36 -21.013   6.952  12.528
  151   HH22  ARG  36          HH22      ARG  36 -20.267   6.742  14.076
  152    H    LYS  37           H        LYS  37 -18.288   6.136   6.185
  153    HA   LYS  37           HA       LYS  37 -16.895   6.106   3.593
  154    HB2  LYS  37           HB1      LYS  37 -19.138   6.936   2.711
  155    HB3  LYS  37           HB2      LYS  37 -19.070   5.256   3.267
  156    HG2  LYS  37           HG1      LYS  37 -20.522   5.601   4.947
  157    HG3  LYS  37           HG2      LYS  37 -19.858   7.202   5.319
  158    HD2  LYS  37           HD1      LYS  37 -20.981   7.731   2.926
  159    HD3  LYS  37           HD2      LYS  37 -22.051   6.436   3.491
  160    HE2  LYS  37           HE1      LYS  37 -21.346   8.766   5.264
  161    HE3  LYS  37           HE2      LYS  37 -22.660   8.863   4.082
  162    HZ1  LYS  37           HZ1      LYS  37 -23.436   8.202   6.292
  163    HZ2  LYS  37           HZ2      LYS  37 -22.465   6.819   6.228
  164    HZ3  LYS  37           HZ3      LYS  37 -23.745   7.004   5.138
  165    H    GLY  38           H        GLY  38 -15.570   7.824   3.518
  166    HA2  GLY  38           HA2      GLY  38 -16.763  10.466   3.672
  167    HA3  GLY  38           HA3      GLY  38 -15.517  10.141   4.868
  168    HA1  GLY  38           HA1      GLY  38 -16.551   9.905   3.024
  169    H    SER  39           H        SER  39 -16.014  11.592   2.016
  170    HA   SER  39           HA       SER  39 -14.707  12.280   0.282
  171    HB2  SER  39           HB1      SER  39 -12.181  11.643   1.717
  172    HB3  SER  39           HB2      SER  39 -12.691  13.143   0.922
  173    HG   SER  39           HG       SER  39 -12.605  12.854   3.427
  174    H    GLN  40           H        GLN  40 -12.351  11.568  -0.797
  175    HA   GLN  40           HA       GLN  40 -12.947   9.001  -1.926
  176    HB2  GLN  40           HB1      GLN  40 -11.202  11.264  -2.523
  177    HB3  GLN  40           HB2      GLN  40 -10.421   9.703  -2.826
  178    HG2  GLN  40           HG1      GLN  40 -11.455  10.437  -4.851
  179    HG3  GLN  40           HG2      GLN  40 -12.358   9.053  -4.221
  180   HE21  GLN  40          HE21      GLN  40 -14.432   9.297  -4.606
  181   HE22  GLN  40          HE22      GLN  40 -15.339  10.757  -4.434
  182    H    CYS  41           H        CYS  41  -9.915  10.220  -0.492
  183    HA   CYS  41           HA       CYS  41  -9.653   7.821   1.111
  184    HB2  CYS  41           HB1      CYS  41  -7.360   7.345   0.200
  185    HB3  CYS  41           HB2      CYS  41  -8.686   6.980  -0.905
  186    H    LEU  42           H        LEU  42  -8.347   8.097   2.880
  187    HA   LEU  42           HA       LEU  42  -7.360  10.825   3.303
  188    HB2  LEU  42           HB1      LEU  42  -8.325   8.633   5.081
  189    HB3  LEU  42           HB2      LEU  42  -7.153   9.793   5.728
  190    HG   LEU  42           HG       LEU  42  -9.442  10.403   6.317
  191   HD11  LEU  42          HD11      LEU  42  -8.946  12.553   4.429
  192   HD12  LEU  42          HD12      LEU  42  -7.490  12.055   5.290
  193   HD13  LEU  42          HD13      LEU  42  -8.918  12.564   6.192
  194   HD21  LEU  42          HD21      LEU  42 -10.628   9.442   4.441
  195   HD22  LEU  42          HD22      LEU  42  -9.858  10.581   3.334
  196   HD23  LEU  42          HD23      LEU  42 -10.990  11.165   4.555
  197    H    SER  43           H        SER  43  -6.323   7.534   3.014
  198    HA   SER  43           HA       SER  43  -3.551   8.398   3.059
  199    HB2  SER  43           HB1      SER  43  -4.748   7.095   5.312
  200    HB3  SER  43           HB2      SER  43  -3.587   5.984   4.564
  201    HG   SER  43           HG       SER  43  -2.702   7.470   6.169
  202    H    ASP  44           H        ASP  44  -2.183   6.165   2.813
  203    HA   ASP  44           HA       ASP  44  -2.868   5.211   0.233
  204    HB2  ASP  44           HB1      ASP  44  -0.911   3.775   0.432
  205    HB3  ASP  44           HB2      ASP  44  -0.537   5.394   1.037
  206    HD2  ASP  44           HD       ASP  44  -0.354   4.211   4.354
  207    H    THR  45           H        THR  45  -3.299   3.945   3.475
  208    HA   THR  45           HA       THR  45  -3.912   1.291   2.880
  209    HB   THR  45           HB       THR  45  -5.593   1.908   4.997
  210    HG1  THR  45           HG1      THR  45  -3.223   3.414   5.380
  211   HG21  THR  45          HG21      THR  45  -2.743   1.407   5.625
  212   HG22  THR  45          HG22      THR  45  -3.537   0.244   4.563
  213   HG23  THR  45          HG23      THR  45  -4.190   0.560   6.170
  214    H    ASP  46           H        ASP  46  -5.753   4.182   2.411
  215    HA   ASP  46           HA       ASP  46  -8.332   3.008   2.273
  216    HB2  ASP  46           HB1      ASP  46  -7.235   5.602   2.084
  217    HB3  ASP  46           HB2      ASP  46  -8.098   5.320   0.567
  218    HD2  ASP  46           HD       ASP  46 -10.203   5.617   3.901
  219    H    CYS  47           H        CYS  47  -5.694   3.275   0.032
  220    HA   CYS  47           HA       CYS  47  -7.385   2.320  -2.167
  221    HB2  CYS  47           HB1      CYS  47  -4.698   3.654  -2.027
  222    HB3  CYS  47           HB2      CYS  47  -5.136   2.712  -3.452
  223    H    ASN  48           H        ASN  48  -7.556   0.178  -2.252
  224    HA   ASN  48           HA       ASN  48  -5.859  -1.670  -1.040
  225    HB2  ASN  48           HB1      ASN  48  -8.039  -1.773  -3.050
  226    HB3  ASN  48           HB2      ASN  48  -6.944  -3.160  -3.024
  227   HD21  ASN  48          HD21      ASN  48  -9.751  -2.027  -1.822
  228   HD22  ASN  48          HD22      ASN  48  -9.849  -2.949  -0.364
  229    H    THR  49           H        THR  49  -4.911  -3.550  -2.542
  230    HA   THR  49           HA       THR  49  -3.151  -4.197  -3.832
  231    HB   THR  49           HB       THR  49  -3.230  -2.029  -5.779
  232    HG1  THR  49           HG1      THR  49  -5.329  -1.791  -5.807
  233   HG21  THR  49          HG21      THR  49  -3.475  -5.011  -5.749
  234   HG22  THR  49          HG22      THR  49  -2.273  -3.995  -6.544
  235   HG23  THR  49          HG23      THR  49  -3.904  -4.110  -7.202
  236    H    ARG  50           H        ARG  50  -1.196  -2.997  -5.215
  237    HA   ARG  50           HA       ARG  50   0.289  -1.650  -3.142
  238    HB2  ARG  50           HB1      ARG  50   0.984  -2.552  -5.941
  239    HB3  ARG  50           HB2      ARG  50   2.122  -1.679  -4.902
  240    HG2  ARG  50           HG1      ARG  50   2.405  -3.442  -3.462
  241    HG3  ARG  50           HG2      ARG  50   0.823  -4.138  -3.845
  242    HD2  ARG  50           HD1      ARG  50   1.716  -5.474  -5.389
  243    HD3  ARG  50           HD2      ARG  50   2.430  -4.080  -6.213
  244    HE   ARG  50           HE       ARG  50   4.038  -4.618  -4.020
  245   HH11  ARG  50          HH11      ARG  50   3.040  -6.218  -6.945
  246   HH12  ARG  50          HH12      ARG  50   4.499  -7.142  -7.093
  247   HH21  ARG  50          HH21      ARG  50   5.964  -5.827  -4.203
  248   HH22  ARG  50          HH22      ARG  50   6.161  -6.919  -5.532
  249    H    LYS  51           H        LYS  51  -1.304   0.195  -3.213
  250    HA   LYS  51           HA       LYS  51  -0.174   2.308  -4.870
  251    HB2  LYS  51           HB1      LYS  51  -3.026   1.379  -4.981
  252    HB3  LYS  51           HB2      LYS  51  -2.638   3.084  -5.262
  253    HG2  LYS  51           HG1      LYS  51  -2.365   2.526  -7.400
  254    HG3  LYS  51           HG2      LYS  51  -0.843   1.777  -6.879
  255    HD2  LYS  51           HD1      LYS  51  -2.550  -0.224  -6.288
  256    HD3  LYS  51           HD2      LYS  51  -3.409   0.524  -7.644
  257    HE2  LYS  51           HE1      LYS  51  -1.705   0.081  -9.158
  258    HE3  LYS  51           HE2      LYS  51  -0.484  -0.045  -7.883
  259    HZ1  LYS  51           HZ1      LYS  51  -0.877  -2.209  -7.626
  260    HZ2  LYS  51           HZ2      LYS  51  -1.689  -2.135  -9.109
  261    HZ3  LYS  51           HZ3      LYS  51  -2.558  -2.021  -7.662
  262    H    PHE  52           H        PHE  52  -0.726   4.454  -4.116
  263    HA   PHE  52           HA       PHE  52  -1.653   4.490  -1.320
  264    HB2  PHE  52           HB1      PHE  52  -0.026   6.200  -0.798
  265    HB3  PHE  52           HB2      PHE  52   0.804   4.810  -1.501
  266    HD1  PHE  52           HD1      PHE  52   1.320   4.890  -4.020
  267    HD2  PHE  52           HD2      PHE  52   0.331   8.316  -1.697
  268    HE1  PHE  52           HE1      PHE  52   2.360   6.337  -5.717
  269    HE2  PHE  52           HE2      PHE  52   1.368   9.768  -3.391
  270    HZ   PHE  52           HZ       PHE  52   2.383   8.779  -5.405
  271    H    CYS  53           H        CYS  53  -2.114   6.895  -0.667
  272    HA   CYS  53           HA       CYS  53  -3.829   8.021  -2.780
  273    HB2  CYS  53           HB1      CYS  53  -5.080   7.227  -0.847
  274    HB3  CYS  53           HB2      CYS  53  -4.078   8.201   0.230
  275    H    LEU  54           H        LEU  54  -2.737   9.619  -3.750
  276    HA   LEU  54           HA       LEU  54  -0.987  11.363  -2.225
  277    HB2  LEU  54           HB1      LEU  54  -0.163  10.650  -4.350
  278    HB3  LEU  54           HB2      LEU  54  -1.655  11.169  -5.153
  279    HG   LEU  54           HG       LEU  54  -0.604  13.472  -3.943
  280   HD11  LEU  54          HD11      LEU  54   1.514  11.760  -5.210
  281   HD12  LEU  54          HD12      LEU  54   1.543  12.559  -3.639
  282   HD13  LEU  54          HD13      LEU  54   1.642  13.516  -5.117
  283   HD21  LEU  54          HD21      LEU  54  -0.324  14.207  -6.256
  284   HD22  LEU  54          HD22      LEU  54  -1.857  13.365  -6.033
  285   HD23  LEU  54          HD23      LEU  54  -0.504  12.543  -6.812
  286    H    GLN  55           H        GLN  55  -1.602  13.235  -1.380
  287    HA   GLN  55           HA       GLN  55  -4.056  14.498  -2.412
  288    HB2  GLN  55           HB1      GLN  55  -4.186  15.527  -0.077
  289    HB3  GLN  55           HB2      GLN  55  -4.556  13.801  -0.221
  290    HG2  GLN  55           HG1      GLN  55  -2.906  13.221   1.149
  291    HG3  GLN  55           HG2      GLN  55  -1.746  14.246   0.294
  292   HE21  GLN  55          HE21      GLN  55  -4.090  14.108   2.865
  293   HE22  GLN  55          HE22      GLN  55  -3.575  15.540   3.682
  294    HA   PRO  56           HA       PRO  56  -0.710  17.485  -3.345
  295    HB2  PRO  56           HB1      PRO  56  -1.939  18.488  -5.577
  296    HB3  PRO  56           HB2      PRO  56  -0.954  17.026  -5.583
  297    HG2  PRO  56           HG1      PRO  56  -3.936  17.309  -5.412
  298    HG3  PRO  56           HG2      PRO  56  -2.952  16.187  -6.424
  299    HD2  PRO  56           HD1      PRO  56  -4.172  15.401  -4.130
  300    HD3  PRO  56           HD2      PRO  56  -2.621  14.733  -4.666
  301    H    ARG  57           H        ARG  57  -0.728  19.808  -3.369
  302    HA   ARG  57           HA       ARG  57  -2.838  20.906  -1.727
  303    HB2  ARG  57           HB1      ARG  57  -0.077  21.539  -2.338
  304    HB3  ARG  57           HB2      ARG  57  -1.103  22.975  -2.462
  305    HG2  ARG  57           HG1      ARG  57  -1.865  22.732  -0.206
  306    HG3  ARG  57           HG2      ARG  57  -1.059  21.161  -0.064
  307    HD2  ARG  57           HD1      ARG  57   1.025  22.755  -0.813
  308    HD3  ARG  57           HD2      ARG  57   0.045  23.873   0.145
  309    HE   ARG  57           HE       ARG  57   0.576  22.686   2.039
  310   HH11  ARG  57          HH11      ARG  57   1.488  20.859  -0.781
  311   HH12  ARG  57          HH12      ARG  57   2.366  19.664   0.117
  312   HH21  ARG  57          HH21      ARG  57   1.728  21.121   3.232
  313   HH22  ARG  57          HH22      ARG  57   2.500  19.814   2.399
  314    H    ASP  58           H        ASP  58  -1.478  21.516  -4.949
  315    HA   ASP  58           HA       ASP  58  -3.389  23.555  -5.575
  316    HB2  ASP  58           HB1      ASP  58  -0.955  22.747  -6.625
  317    HB3  ASP  58           HB2      ASP  58  -2.117  22.265  -7.866
  318    HD2  ASP  58           HD       ASP  58  -2.427  25.487  -8.943
  319    H    GLU  59           H        GLU  59  -3.306  20.116  -5.784
  320    HA   GLU  59           HA       GLU  59  -5.781  20.148  -7.384
  321    HB2  GLU  59           HB1      GLU  59  -3.369  18.559  -7.587
  322    HB3  GLU  59           HB2      GLU  59  -4.791  17.529  -7.366
  323    HG2  GLU  59           HG1      GLU  59  -5.530  17.893  -9.434
  324    HG3  GLU  59           HG2      GLU  59  -5.231  19.633  -9.318
  325    HE2  GLU  59           HE       GLU  59  -2.521  17.357 -11.057
  326    H    LYS  60           H        LYS  60  -6.920  17.834  -6.937
  327    HA   LYS  60           HA       LYS  60  -7.463  17.854  -4.053
  328    HB2  LYS  60           HB1      LYS  60  -9.548  16.583  -4.740
  329    HB3  LYS  60           HB2      LYS  60  -9.443  18.265  -5.286
  330    HG2  LYS  60           HG1      LYS  60  -9.592  17.675  -7.421
  331    HG3  LYS  60           HG2      LYS  60  -8.300  16.476  -7.237
  332    HD2  LYS  60           HD1      LYS  60  -9.871  14.830  -6.405
  333    HD3  LYS  60           HD2      LYS  60 -11.177  16.028  -6.441
  334    HE2  LYS  60           HE1      LYS  60  -9.761  15.710  -9.002
  335    HE3  LYS  60           HE2      LYS  60 -10.613  14.262  -8.445
  336    HZ1  LYS  60           HZ1      LYS  60 -12.402  15.202  -9.348
  337    HZ2  LYS  60           HZ2      LYS  60 -11.680  16.727  -9.454
  338    HZ3  LYS  60           HZ3      LYS  60 -12.416  16.239  -8.011
  339    HA   PRO  61           HA       PRO  61  -5.813  13.840  -3.395
  340    HB2  PRO  61           HB1      PRO  61  -7.529  12.845  -1.506
  341    HB3  PRO  61           HB2      PRO  61  -6.344  14.108  -1.176
  342    HG2  PRO  61           HG1      PRO  61  -9.265  14.358  -1.812
  343    HG3  PRO  61           HG2      PRO  61  -8.301  15.189  -0.534
  344    HD2  PRO  61           HD1      PRO  61  -8.995  16.398  -2.863
  345    HD3  PRO  61           HD2      PRO  61  -7.468  16.733  -2.028
  346    H    PHE  62           H        PHE  62  -5.985  11.761  -4.121
  347    HA   PHE  62           HA       PHE  62  -8.443  10.455  -4.662
  348    HB2  PHE  62           HB1      PHE  62  -8.504  10.466  -7.039
  349    HB3  PHE  62           HB2      PHE  62  -8.345  12.149  -6.536
  350    HD1  PHE  62           HD1      PHE  62  -5.786  12.926  -6.262
  351    HD2  PHE  62           HD2      PHE  62  -7.186   9.816  -8.809
  352    HE1  PHE  62           HE1      PHE  62  -3.788  13.188  -7.674
  353    HE2  PHE  62           HE2      PHE  62  -5.190  10.072 -10.224
  354    HZ   PHE  62           HZ       PHE  62  -3.487  11.760  -9.658
  355    H    CYS  63           H        CYS  63  -8.064   8.389  -5.934
  356    HA   CYS  63           HA       CYS  63  -5.845   7.024  -4.791
  357    HB2  CYS  63           HB1      CYS  63  -8.250   6.196  -5.578
  358    HB3  CYS  63           HB2      CYS  63  -7.368   5.829  -7.061
  359    H    ALA  64           H        ALA  64  -3.827   7.092  -5.497
  360    HA   ALA  64           HA       ALA  64  -3.354   7.459  -8.384
  361    HB1  ALA  64           HB1      ALA  64  -2.414   9.349  -7.483
  362    HB2  ALA  64           HB2      ALA  64  -1.946   8.538  -5.988
  363    HB3  ALA  64           HB3      ALA  64  -1.032   8.254  -7.470
  364    H    THR  65           H        THR  65  -1.180   6.567  -9.092
  365    HA   THR  65           HA       THR  65  -0.962   3.830  -8.081
  366    HB   THR  65           HB       THR  65   0.704   4.477 -10.387
  367    HG1  THR  65           HG1      THR  65  -1.112   4.760 -11.803
  368   HG21  THR  65          HG21      THR  65  -1.024   2.600 -11.231
  369   HG22  THR  65          HG22      THR  65  -1.196   2.396  -9.487
  370   HG23  THR  65          HG23      THR  65   0.389   2.234 -10.243
  371    H    CYS  66           H        CYS  66   1.179   2.852  -7.865
  372    HA   CYS  66           HA       CYS  66   2.904   4.481  -6.284
  373    HB2  CYS  66           HB1      CYS  66   2.642   1.650  -6.980
  374    HB3  CYS  66           HB2      CYS  66   4.323   2.169  -6.837
  375    H    ARG  67           H        ARG  67   5.367   4.314  -6.707
  376    HA   ARG  67           HA       ARG  67   5.887   4.885  -9.551
  377    HB2  ARG  67           HB1      ARG  67   7.052   6.303  -7.141
  378    HB3  ARG  67           HB2      ARG  67   7.505   6.602  -8.827
  379    HG2  ARG  67           HG1      ARG  67   4.624   6.826  -8.251
  380    HG3  ARG  67           HG2      ARG  67   5.661   8.033  -7.471
  381    HD2  ARG  67           HD1      ARG  67   6.724   8.169  -9.902
  382    HD3  ARG  67           HD2      ARG  67   5.124   7.568 -10.360
  383    HE   ARG  67           HE       ARG  67   5.767  10.202  -9.492
  384   HH11  ARG  67          HH11      ARG  67   3.267   7.780  -9.433
  385   HH12  ARG  67          HH12      ARG  67   1.979   8.926  -9.269
  386   HH21  ARG  67          HH21      ARG  67   4.081  11.721  -9.276
  387   HH22  ARG  67          HH22      ARG  67   2.443  11.168  -9.180
  388    H    GLY  68           H        GLY  68   8.313   4.822 -10.029
  389    HA2  GLY  68           HA2      GLY  68   9.292   2.255  -9.128
  390    HA3  GLY  68           HA3      GLY  68  10.018   3.278 -10.359
  391    HA1  GLY  68           HA1      GLY  68   9.093   2.836  -8.498
  392    H    LEU  69           H        LEU  69  12.061   2.733  -9.368
  393    HA   LEU  69           HA       LEU  69  12.588   3.716  -6.699
  394    HB2  LEU  69           HB1      LEU  69  14.266   2.381  -8.813
  395    HB3  LEU  69           HB2      LEU  69  14.971   3.041  -7.328
  396    HG   LEU  69           HG       LEU  69  12.921   0.833  -7.487
  397   HD11  LEU  69          HD11      LEU  69  15.468   0.528  -8.122
  398   HD12  LEU  69          HD12      LEU  69  14.597  -0.679  -7.178
  399   HD13  LEU  69          HD13      LEU  69  15.650   0.481  -6.368
  400   HD21  LEU  69          HD21      LEU  69  12.477   1.913  -5.470
  401   HD22  LEU  69          HD22      LEU  69  14.176   2.291  -5.186
  402   HD23  LEU  69          HD23      LEU  69  13.601   0.632  -5.017
  403    H    ARG  70           H        ARG  70  13.992   4.382  -9.913
  404    HA   ARG  70           HA       ARG  70  15.473   6.618  -9.208
  405    HB2  ARG  70           HB1      ARG  70  14.138   5.874 -11.815
  406    HB3  ARG  70           HB2      ARG  70  15.221   7.264 -11.647
  407    HG2  ARG  70           HG1      ARG  70  16.068   4.474 -10.903
  408    HG3  ARG  70           HG2      ARG  70  16.234   5.121 -12.544
  409    HD2  ARG  70           HD1      ARG  70  17.286   6.740 -10.264
  410    HD3  ARG  70           HD2      ARG  70  18.192   5.311 -10.785
  411    HE   ARG  70           HE       ARG  70  17.557   6.868 -13.038
  412   HH11  ARG  70          HH11      ARG  70  19.584   6.929 -10.208
  413   HH12  ARG  70          HH12      ARG  70  20.801   7.920 -10.941
  414   HH21  ARG  70          HH21      ARG  70  19.153   8.173 -14.014
  415   HH22  ARG  70          HH22      ARG  70  20.554   8.628 -13.105
  416    H    ARG  71           H        ARG  71  12.060   6.287  -9.731
  417    HA   ARG  71           HA       ARG  71  11.297   8.878 -10.328
  418    HB2  ARG  71           HB1      ARG  71   9.998   6.623  -8.844
  419    HB3  ARG  71           HB2      ARG  71   9.215   8.212  -8.864
  420    HG2  ARG  71           HG1      ARG  71  10.009   6.668 -11.334
  421    HG3  ARG  71           HG2      ARG  71   8.388   6.682 -10.620
  422    HD2  ARG  71           HD1      ARG  71   8.629   9.287 -10.815
  423    HD3  ARG  71           HD2      ARG  71   9.861   8.873 -12.016
  424    HE   ARG  71           HE       ARG  71   7.583   7.401 -12.633
  425   HH11  ARG  71          HH11      ARG  71   8.569  10.736 -12.471
  426   HH12  ARG  71          HH12      ARG  71   7.471  11.256 -13.707
  427   HH21  ARG  71          HH21      ARG  71   6.133   8.074 -14.260
  428   HH22  ARG  71          HH22      ARG  71   6.086   9.741 -14.722
  429    H    ARG  72           H        ARG  72  10.877  10.715  -9.160
  430    HA   ARG  72           HA       ARG  72  12.330  11.023  -6.703
  431    HB2  ARG  72           HB1      ARG  72  10.565  12.929  -8.259
  432    HB3  ARG  72           HB2      ARG  72  11.500  13.378  -6.824
  433    HG2  ARG  72           HG1      ARG  72  13.084  12.066  -8.914
  434    HG3  ARG  72           HG2      ARG  72  12.364  13.613  -9.393
  435    HD2  ARG  72           HD1      ARG  72  13.294  14.276  -6.943
  436    HD3  ARG  72           HD2      ARG  72  14.467  13.035  -7.406
  437    HE   ARG  72           HE       ARG  72  15.327  14.466  -8.979
  438   HH11  ARG  72          HH11      ARG  72  12.265  15.682  -7.855
  439   HH12  ARG  72          HH12      ARG  72  12.430  17.210  -8.654
  440   HH21  ARG  72          HH21      ARG  72  15.556  16.474 -10.037
  441   HH22  ARG  72          HH22      ARG  72  14.302  17.659  -9.896
  442    H    CYS  73           H        CYS  73  11.493  11.619  -4.678
  443    HA   CYS  73           HA       CYS  73   8.613  11.460  -4.269
  444    HB2  CYS  73           HB1      CYS  73   8.690   9.715  -2.648
  445    HB3  CYS  73           HB2      CYS  73   9.537   9.123  -4.078
  446    H    GLN  74           H        GLN  74   7.984  12.089  -2.065
  447    HA   GLN  74           HA       GLN  74   9.956  13.936  -0.894
  448    HB2  GLN  74           HB1      GLN  74   7.691  14.734  -1.988
  449    HB3  GLN  74           HB2      GLN  74   7.022  14.249  -0.423
  450    HG2  GLN  74           HG1      GLN  74   7.462  16.424   0.045
  451    HG3  GLN  74           HG2      GLN  74   9.021  15.714   0.488
  452   HE21  GLN  74          HE21      GLN  74  10.812  16.337  -0.560
  453   HE22  GLN  74          HE22      GLN  74  10.842  17.438  -1.890
  454    H    ARG  75           H        ARG  75   7.373  11.637  -0.171
  455    HA   ARG  75           HA       ARG  75   8.517  11.327   2.523
  456    HB2  ARG  75           HB1      ARG  75   6.147  10.764   3.265
  457    HB3  ARG  75           HB2      ARG  75   6.491  12.467   2.924
  458    HG2  ARG  75           HG1      ARG  75   5.260  12.473   0.954
  459    HG3  ARG  75           HG2      ARG  75   5.319  10.707   0.811
  460    HD2  ARG  75           HD1      ARG  75   3.348  10.559   1.836
  461    HD3  ARG  75           HD2      ARG  75   4.065  11.302   3.273
  462    HE   ARG  75           HE       ARG  75   3.441  13.344   1.475
  463   HH11  ARG  75          HH11      ARG  75   1.820  10.958   3.422
  464   HH12  ARG  75          HH12      ARG  75   0.386  11.910   3.627
  465   HH21  ARG  75          HH21      ARG  75   1.559  14.606   1.736
  466   HH22  ARG  75          HH22      ARG  75   0.239  13.984   2.666
  467    H    ASP  76           H        ASP  76   8.594   9.248   3.348
  468    HA   ASP  76           HA       ASP  76   9.010   7.147   1.602
  469    HB2  ASP  76           HB1      ASP  76   8.189   7.033   4.517
  470    HB3  ASP  76           HB2      ASP  76   8.847   5.673   3.598
  471    HD2  ASP  76           HD       ASP  76  11.368   8.621   4.471
  472    H    ALA  77           H        ALA  77   6.043   8.279   3.027
  473    HA   ALA  77           HA       ALA  77   4.450   5.996   2.617
  474    HB1  ALA  77           HB1      ALA  77   4.057   8.424   3.776
  475    HB2  ALA  77           HB2      ALA  77   3.083   8.571   2.312
  476    HB3  ALA  77           HB3      ALA  77   2.784   7.250   3.442
  477    H    MET  78           H        MET  78   5.212   8.750   0.535
  478    HA   MET  78           HA       MET  78   3.416   8.236  -1.535
  479    HB2  MET  78           HB1      MET  78   6.041   9.644  -1.326
  480    HB3  MET  78           HB2      MET  78   5.384   9.322  -2.937
  481    HG2  MET  78           HG1      MET  78   3.285  10.478  -2.265
  482    HG3  MET  78           HG2      MET  78   4.065  10.894  -0.737
  483    HE1  MET  78           HE1      MET  78   5.851  11.098  -4.492
  484    HE2  MET  78           HE2      MET  78   4.088  11.066  -4.474
  485    HE3  MET  78           HE3      MET  78   4.937  12.553  -4.893
  486    H    CYS  79           H        CYS  79   6.425   6.699  -0.703
  487    HA   CYS  79           HA       CYS  79   6.525   5.246  -3.229
  488    HB2  CYS  79           HB1      CYS  79   8.530   6.223  -1.793
  489    HB3  CYS  79           HB2      CYS  79   8.391   4.668  -0.969
  490    H    CYS  80           H        CYS  80   6.199   3.061  -3.444
  491    HA   CYS  80           HA       CYS  80   4.295   1.804  -1.892
  492    HB2  CYS  80           HB1      CYS  80   6.171   1.010  -4.006
  493    HB3  CYS  80           HB2      CYS  80   5.710  -0.314  -2.934
  494    HA   PRO  81           HA       PRO  81   6.233   0.180   1.692
  495    HB2  PRO  81           HB1      PRO  81   5.056  -2.281   1.940
  496    HB3  PRO  81           HB2      PRO  81   4.212  -0.764   2.242
  497    HG2  PRO  81           HG1      PRO  81   4.232  -2.469  -0.224
  498    HG3  PRO  81           HG2      PRO  81   2.837  -1.691   0.613
  499    HD2  PRO  81           HD1      PRO  81   3.959  -0.659  -1.635
  500    HD3  PRO  81           HD2      PRO  81   3.274   0.355  -0.353
  501    H    GLY  82           H        GLY  82   8.315  -0.386   1.766
  502    HA2  GLY  82           HA2      GLY  82   9.625  -2.582   1.811
  503    HA3  GLY  82           HA3      GLY  82   9.217  -2.649   0.103
  504    HA1  GLY  82           HA1      GLY  82   9.638  -1.714   1.966
  505    H    THR  83           H        THR  83   9.505   0.412   0.136
  506    HA   THR  83           HA       THR  83  12.447   0.429  -0.062
  507    HB   THR  83           HB       THR  83  11.689   2.537  -1.615
  508    HG1  THR  83           HG1      THR  83   9.457   1.813  -1.393
  509   HG21  THR  83          HG21      THR  83  12.771  -0.093  -1.980
  510   HG22  THR  83          HG22      THR  83  13.061   1.367  -2.925
  511   HG23  THR  83          HG23      THR  83  11.715   0.305  -3.335
  512    H    LEU  84           H        LEU  84  13.292   2.794  -0.021
  513    HA   LEU  84           HA       LEU  84  11.873   4.314   2.060
  514    HB2  LEU  84           HB1      LEU  84  14.409   2.998   2.254
  515    HB3  LEU  84           HB2      LEU  84  14.649   4.751   2.356
  516    HG   LEU  84           HG       LEU  84  12.480   3.797   4.060
  517   HD11  LEU  84          HD11      LEU  84  14.226   2.918   5.741
  518   HD12  LEU  84          HD12      LEU  84  15.226   2.634   4.317
  519   HD13  LEU  84          HD13      LEU  84  13.659   1.839   4.465
  520   HD21  LEU  84          HD21      LEU  84  15.007   5.326   4.668
  521   HD22  LEU  84          HD22      LEU  84  13.556   5.230   5.667
  522   HD23  LEU  84          HD23      LEU  84  13.501   6.053   4.108
  523    H    CYS  85           H        CYS  85  11.980   6.533   1.916
  524    HA   CYS  85           HA       CYS  85  12.672   7.587  -0.677
  525    HB2  CYS  85           HB1      CYS  85  11.185   8.518   1.710
  526    HB3  CYS  85           HB2      CYS  85  11.972   9.777   0.757
  527    H    VAL  86           H        VAL  86  14.776   7.898  -1.069
  528    HA   VAL  86           HA       VAL  86  16.282   9.561   0.830
  529    HB   VAL  86           HB       VAL  86  17.471   7.205  -0.637
  530   HG11  VAL  86          HG11      VAL  86  19.393   8.244  -0.215
  531   HG12  VAL  86          HG12      VAL  86  18.589   9.472   0.767
  532   HG13  VAL  86          HG13      VAL  86  19.092   7.946   1.496
  533   HG21  VAL  86          HG21      VAL  86  16.340   7.475   2.112
  534   HG22  VAL  86          HG22      VAL  86  16.211   6.138   0.969
  535   HG23  VAL  86          HG23      VAL  86  17.719   6.409   1.842
  536    H    ASN  87           H        ASN  87  17.678  11.039  -0.071
  537    HA   ASN  87           HA       ASN  87  18.466  12.495  -1.631
  538    HB2  ASN  87           HB1      ASN  87  19.557  10.238  -2.315
  539    HB3  ASN  87           HB2      ASN  87  18.410  10.278  -3.660
  540   HD21  ASN  87          HD21      ASN  87  21.215  10.348  -3.921
  541   HD22  ASN  87          HD22      ASN  87  21.645  11.861  -4.636
  542    H    ASP  88           H        ASP  88  15.597  12.169  -1.339
  543    HA   ASP  88           HA       ASP  88  13.680  12.963  -2.273
  544    HB2  ASP  88           HB1      ASP  88  15.396  14.053  -4.513
  545    HB3  ASP  88           HB2      ASP  88  13.826  14.650  -3.957
  546    HD2  ASP  88           HD       ASP  88  17.041  15.992  -2.212
  547    H    VAL  89           H        VAL  89  14.894  10.351  -3.074
  548    HA   VAL  89           HA       VAL  89  13.079   9.826  -5.289
  549    HB   VAL  89           HB       VAL  89  14.851   8.461  -6.458
  550   HG11  VAL  89          HG11      VAL  89  14.127  10.519  -7.431
  551   HG12  VAL  89          HG12      VAL  89  15.121  11.459  -6.317
  552   HG13  VAL  89          HG13      VAL  89  15.886  10.457  -7.552
  553   HG21  VAL  89          HG21      VAL  89  16.436   8.387  -4.571
  554   HG22  VAL  89          HG22      VAL  89  17.180   8.996  -6.050
  555   HG23  VAL  89          HG23      VAL  89  16.723  10.116  -4.767
  556    H    CYS  90           H        CYS  90  12.590   7.575  -5.564
  557    HA   CYS  90           HA       CYS  90  12.403   6.169  -3.110
  558    HB2  CYS  90           HB1      CYS  90  11.713   5.565  -5.964
  559    HB3  CYS  90           HB2      CYS  90  11.681   4.263  -4.773
  560    H    THR  91           H        THR  91  14.174   5.376  -2.161
  561    HA   THR  91           HA       THR  91  16.116   3.912  -3.822
  562    HB   THR  91           HB       THR  91  16.535   5.097  -1.070
  563    HG1  THR  91           HG1      THR  91  17.586   5.973  -3.569
  564   HG21  THR  91          HG21      THR  91  18.129   3.461  -1.114
  565   HG22  THR  91          HG22      THR  91  19.001   4.718  -1.992
  566   HG23  THR  91          HG23      THR  91  18.197   3.421  -2.875
  567    H    THR  92           H        THR  92  16.611   1.821  -3.375
  568    HA   THR  92           HA       THR  92  14.775   0.314  -1.793
  569    HB   THR  92           HB       THR  92  16.998  -1.321  -2.374
  570    HG1  THR  92           HG1      THR  92  17.537  -0.803  -4.441
  571   HG21  THR  92          HG21      THR  92  14.615  -1.075  -4.175
  572   HG22  THR  92          HG22      THR  92  14.432  -1.668  -2.523
  573   HG23  THR  92          HG23      THR  92  15.476  -2.524  -3.657
  574    H    MET  93           H        MET  93  15.322  -1.099  -0.026
  575    HA   MET  93           HA       MET  93  16.698   0.166   2.052
  576    HB2  MET  93           HB1      MET  93  15.232  -2.292   1.654
  577    HB3  MET  93           HB2      MET  93  16.662  -2.579   2.657
  578    HG2  MET  93           HG1      MET  93  15.939  -1.188   4.355
  579    HG3  MET  93           HG2      MET  93  14.873  -0.280   3.280
  580    HE1  MET  93           HE1      MET  93  12.233  -0.664   3.375
  581    HE2  MET  93           HE2      MET  93  11.771  -1.473   4.872
  582    HE3  MET  93           HE3      MET  93  13.021  -0.229   4.893
  583    H    GLU  94           H        GLU  94  17.707  -2.405  -0.158
  584    HA   GLU  94           HA       GLU  94  20.192  -2.940   1.075
  585    HB2  GLU  94           HB1      GLU  94  19.147  -3.381  -1.722
  586    HB3  GLU  94           HB2      GLU  94  20.781  -3.862  -1.236
  587    HG2  GLU  94           HG1      GLU  94  18.447  -4.779   0.387
  588    HG3  GLU  94           HG2      GLU  94  18.812  -5.571  -1.153
  589    HE2  GLU  94           HE       GLU  94  22.082  -6.360   0.355
  590    H    ASP  95           H        ASP  95  19.148  -0.546  -1.247
  591    HA   ASP  95           HA       ASP  95  21.733   0.269  -2.096
  592    HB2  ASP  95           HB1      ASP  95  18.956   1.210  -2.415
  593    HB3  ASP  95           HB2      ASP  95  20.180   2.485  -2.473
  594    HD2  ASP  95           HD       ASP  95  21.121  -0.175  -5.180
  595    H    ALA  96           H        ALA  96  19.435   1.678   0.234
  596    HA   ALA  96           HA       ALA  96  21.046   3.795   1.086
  597    HB1  ALA  96           HB1      ALA  96  18.678   2.381   2.152
  598    HB2  ALA  96           HB2      ALA  96  19.613   3.342   3.298
  599    HB3  ALA  96           HB3      ALA  96  18.938   4.100   1.855
  600    H    THR  97           H        THR  97  22.299   4.070   2.991
  601    HA   THR  97           HA       THR  97  23.706   1.621   3.782
  602    HB   THR  97           HB       THR  97  24.664   4.354   4.539
  603    HG1  THR  97           HG1      THR  97  25.147   3.151   2.001
  604   HG21  THR  97          HG21      THR  97  26.653   2.573   3.523
  605   HG22  THR  97          HG22      THR  97  25.652   1.707   4.689
  606   HG23  THR  97          HG23      THR  97  26.463   3.201   5.160
  607    H    GLU  98           H        GLU  98  22.293   0.828   5.348
  608    HA   GLU  98           HA       GLU  98  21.352   2.454   7.508
  609    HB2  GLU  98           HB1      GLU  98  21.433  -0.560   7.224
  610    HB3  GLU  98           HB2      GLU  98  20.529   0.337   8.454
  611    HG2  GLU  98           HG1      GLU  98  19.957   1.115   5.673
  612    HG3  GLU  98           HG2      GLU  98  19.487  -0.531   6.120
  613    HE2  GLU  98           HE       GLU  98  17.520   2.498   7.734
  614    H    ASN  99           H        ASN  99  21.712   1.304   9.818
  615    HA   ASN  99           HA       ASN  99  24.396   1.900  10.511
  616    HB2  ASN  99           HB1      ASN  99  21.917   1.206  11.890
  617    HB3  ASN  99           HB2      ASN  99  23.341   0.494  12.661
  618   HD21  ASN  99          HD21      ASN  99  22.284   3.576  11.259
  619   HD22  ASN  99          HD22      ASN  99  23.023   4.572  12.463
  620    H    LEU 100           H        LEU 100  26.092   0.584  11.068
  621    HA   LEU 100           HA       LEU 100  25.814  -2.238  10.293
  622    HB2  LEU 100           HB1      LEU 100  28.370  -2.104  10.174
  623    HB3  LEU 100           HB2      LEU 100  27.425  -1.298   8.911
  624    HG   LEU 100           HG       LEU 100  28.272   0.343  11.237
  625   HD11  LEU 100          HD11      LEU 100  30.128  -0.956   9.322
  626   HD12  LEU 100          HD12      LEU 100  30.378  -0.486  11.003
  627   HD13  LEU 100          HD13      LEU 100  30.412   0.735   9.732
  628   HD21  LEU 100          HD21      LEU 100  26.994   0.859   8.897
  629   HD22  LEU 100          HD22      LEU 100  28.663   1.241   8.471
  630   HD23  LEU 100          HD23      LEU 100  27.892   2.053   9.834
  631    H    TYR 101           H        TYR 101  26.454  -3.862  11.647
  632    HA   TYR 101           HA       TYR 101  26.714  -3.163  14.445
  633    HB2  TYR 101           HB1      TYR 101  26.387  -5.772  12.962
  634    HB3  TYR 101           HB2      TYR 101  26.707  -5.717  14.698
  635    HD1  TYR 101           HD1      TYR 101  24.277  -4.640  12.110
  636    HD2  TYR 101           HD2      TYR 101  24.984  -5.303  16.253
  637    HE1  TYR 101           HE1      TYR 101  21.878  -4.342  12.561
  638    HE2  TYR 101           HE2      TYR 101  22.587  -5.009  16.715
  639    HH   TYR 101           HH       TYR 101  20.275  -5.296  14.692
  640    H    PHE 102           H        PHE 102  28.305  -4.541  15.760
  641    HA   PHE 102           HA       PHE 102  30.918  -4.495  14.401
  642    HB2  PHE 102           HB1      PHE 102  30.030  -3.554  17.078
  643    HB3  PHE 102           HB2      PHE 102  31.624  -4.309  16.989
  644    HD1  PHE 102           HD1      PHE 102  33.416  -3.326  15.645
  645    HD2  PHE 102           HD2      PHE 102  29.644  -1.401  16.085
  646    HE1  PHE 102           HE1      PHE 102  34.397  -1.223  14.826
  647    HE2  PHE 102           HE2      PHE 102  30.620   0.703  15.265
  648    HZ   PHE 102           HZ       PHE 102  32.998   0.794  14.633
  649    H    GLN 103           H        GLN 103  32.364  -6.167  14.766
  650    HA   GLN 103           HA       GLN 103  33.048  -8.297  15.179
  651    HB2  GLN 103           HB1      GLN 103  32.604  -7.475  17.556
  652    HB3  GLN 103           HB2      GLN 103  31.078  -8.368  17.458
  653    HG2  GLN 103           HG1      GLN 103  33.415  -9.945  16.672
  654    HG3  GLN 103           HG2      GLN 103  33.447  -9.381  18.349
  655   HE21  GLN 103          HE21      GLN 103  30.999  -9.515  19.254
  656   HE22  GLN 103          HE22      GLN 103  30.340 -11.108  19.134
  657    H    SER 104           H        SER 104  32.203  -9.170  13.291
  658    HA   SER 104           HA       SER 104  29.881 -10.904  13.699
  659    HB2  SER 104           HB1      SER 104  29.221  -8.720  12.527
  660    HB3  SER 104           HB2      SER 104  30.175  -9.308  11.156
  661    HG   SER 104           HG       SER 104  28.765 -10.915  10.824
  662    H    LEU 105           H        LEU 105  32.568 -11.629  13.748
  663    HA   LEU 105           HA       LEU 105  32.609 -13.741  11.882
  664    HB2  LEU 105           HB1      LEU 105  33.337 -11.477  10.642
  665    HB3  LEU 105           HB2      LEU 105  34.903 -11.955  11.321
  666    HG   LEU 105           HG       LEU 105  33.782 -14.239  10.062
  667   HD11  LEU 105          HD11      LEU 105  33.293 -13.576   7.884
  668   HD12  LEU 105          HD12      LEU 105  33.976 -11.966   8.117
  669   HD13  LEU 105          HD13      LEU 105  32.444 -12.393   8.880
  670   HD21  LEU 105          HD21      LEU 105  35.795 -13.493   8.448
  671   HD22  LEU 105          HD22      LEU 105  36.040 -14.268  10.013
  672   HD23  LEU 105          HD23      LEU 105  36.169 -12.515   9.867
  673    H    GLU 106           H        GLU 106  34.402 -15.167  12.183
  674    HA   GLU 106           HA       GLU 106  35.256 -15.473  14.790
  675    HB2  GLU 106           HB1      GLU 106  35.854 -16.680  12.210
  676    HB3  GLU 106           HB2      GLU 106  37.263 -16.667  13.281
  677    HG2  GLU 106           HG1      GLU 106  35.883 -17.742  15.044
  678    HG3  GLU 106           HG2      GLU 106  34.567 -17.865  13.868
  679    HE2  GLU 106           HE       GLU 106  37.710 -20.246  13.368
  680    H    HIS 107           H        HIS 107  37.581 -15.513  15.539
  681    HA   HIS 107           HA       HIS 107  38.656 -12.873  15.303
  682    HB2  HIS 107           HB1      HIS 107  39.480 -15.354  16.798
  683    HB3  HIS 107           HB2      HIS 107  40.513 -13.922  16.767
  684    HD1  HIS 107           HD1      HIS 107  39.516 -14.711  19.462
  685    HD2  HIS 107           HD2      HIS 107  37.362 -12.193  16.954
  686    HE1  HIS 107           HE1      HIS 107  37.978 -13.413  20.970
  687    HE2  HIS 107           HE2      HIS 107  36.661 -11.876  19.439
  688    H    HIS 108           H        HIS 108  40.149 -16.064  14.725
  689    HA   HIS 108           HA       HIS 108  41.215 -15.333  12.202
  690    HB2  HIS 108           HB1      HIS 108  42.635 -14.135  14.130
  691    HB3  HIS 108           HB2      HIS 108  43.443 -15.706  14.139
  692    HD1  HIS 108           HD1      HIS 108  42.349 -13.322  11.366
  693    HD2  HIS 108           HD2      HIS 108  45.592 -15.649  12.521
  694    HE1  HIS 108           HE1      HIS 108  44.096 -12.967   9.593
  695    HE2  HIS 108           HE2      HIS 108  46.079 -14.388  10.298
  696    H    HIS 109           H        HIS 109  42.740 -17.013  11.367
  697    HA   HIS 109           HA       HIS 109  42.044 -19.625  12.525
  698    HB2  HIS 109           HB1      HIS 109  42.493 -18.659   9.732
  699    HB3  HIS 109           HB2      HIS 109  42.874 -20.342  10.110
  700    HD1  HIS 109           HD1      HIS 109  40.917 -21.934  10.642
  701    HD2  HIS 109           HD2      HIS 109  39.743 -18.047   9.759
  702    HE1  HIS 109           HE1      HIS 109  38.430 -22.047  10.287
  703    HE2  HIS 109           HE2      HIS 109  37.711 -19.672   9.747
  704    H    HIS 110           H        HIS 110  43.667 -21.341  12.351
  705    HA   HIS 110           HA       HIS 110  46.324 -20.287  12.968
  706    HB2  HIS 110           HB1      HIS 110  44.722 -22.478  13.923
  707    HB3  HIS 110           HB2      HIS 110  46.264 -23.094  13.322
  708    HD1  HIS 110           HD1      HIS 110  45.161 -20.244  15.601
  709    HD2  HIS 110           HD2      HIS 110  48.185 -23.065  15.212
  710    HE1  HIS 110           HE1      HIS 110  46.643 -19.922  17.606
  711    HE2  HIS 110           HE2      HIS 110  48.490 -21.646  17.371
  712    H    HIS 111           H        HIS 111  48.172 -21.832  12.286
  713    HA   HIS 111           HA       HIS 111  47.865 -23.271   9.842
  714    HB2  HIS 111           HB1      HIS 111  47.817 -20.717   9.266
  715    HB3  HIS 111           HB2      HIS 111  49.559 -20.815   9.537
  716    HD1  HIS 111           HD1      HIS 111  49.714 -23.791   8.260
  717    HD2  HIS 111           HD2      HIS 111  48.192 -20.348   6.501
  718    HE1  HIS 111           HE1      HIS 111  49.848 -24.187   5.780
  719    HE2  HIS 111           HE2      HIS 111  48.917 -22.083   4.704
  720    H    HIS 112           H        HIS 112  48.861 -24.378  11.927
  721    HA   HIS 112           HA       HIS 112  50.642 -25.504  12.783
  722    HB2  HIS 112           HB1      HIS 112  51.089 -25.420  10.102
  723    HB3  HIS 112           HB2      HIS 112  52.550 -24.631  10.704
  724    HD1  HIS 112           HD1      HIS 112  50.841 -27.938  10.599
  725    HD2  HIS 112           HD2      HIS 112  54.297 -26.268  12.187
  726    HE1  HIS 112           HE1      HIS 112  52.261 -29.885  11.316
  727    HE2  HIS 112           HE2      HIS 112  54.373 -28.866  12.286
  Start of MODEL   24
    1    H1   MET  18           H        MET  18 -18.885  54.116   5.243
    2    HA   MET  18           HA       MET  18 -18.724  54.386   7.820
    3    HB2  MET  18           HB1      MET  18 -19.862  56.568   8.463
    4    HB3  MET  18           HB2      MET  18 -18.192  56.686   7.889
    5    HG2  MET  18           HG1      MET  18 -18.763  57.753   5.955
    6    HG3  MET  18           HG2      MET  18 -20.353  56.991   5.887
    7    HE1  MET  18           HE1      MET  18 -20.640  61.031   6.135
    8    HE2  MET  18           HE2      MET  18 -19.451  60.004   5.333
    9    HE3  MET  18           HE3      MET  18 -21.174  59.683   5.131
   10    H    LEU  19           H        LEU  19 -20.910  55.194   5.203
   11    HA   LEU  19           HA       LEU  19 -23.215  54.288   6.754
   12    HB2  LEU  19           HB1      LEU  19 -22.792  55.922   4.331
   13    HB3  LEU  19           HB2      LEU  19 -24.219  54.872   4.314
   14    HG   LEU  19           HG       LEU  19 -24.162  56.262   6.801
   15   HD11  LEU  19          HD11      LEU  19 -22.997  58.094   6.122
   16   HD12  LEU  19          HD12      LEU  19 -24.597  58.551   5.539
   17   HD13  LEU  19          HD13      LEU  19 -23.413  57.870   4.423
   18   HD21  LEU  19          HD21      LEU  19 -26.235  55.586   6.075
   19   HD22  LEU  19          HD22      LEU  19 -25.929  56.066   4.406
   20   HD23  LEU  19          HD23      LEU  19 -26.263  57.291   5.629
   21    H    VAL  20           H        VAL  20 -24.158  52.359   6.483
   22    HA   VAL  20           HA       VAL  20 -23.086  50.602   4.382
   23    HB   VAL  20           HB       VAL  20 -23.760  48.718   5.743
   24   HG11  VAL  20          HG11      VAL  20 -21.611  50.101   6.192
   25   HG12  VAL  20          HG12      VAL  20 -22.425  50.554   7.690
   26   HG13  VAL  20          HG13      VAL  20 -22.094  48.856   7.344
   27   HG21  VAL  20          HG21      VAL  20 -24.634  49.164   8.071
   28   HG22  VAL  20          HG22      VAL  20 -24.953  50.817   7.542
   29   HG23  VAL  20          HG23      VAL  20 -25.768  49.465   6.754
   30    H    LEU  21           H        LEU  21 -24.424  49.541   2.983
   31    HA   LEU  21           HA       LEU  21 -27.000  50.668   2.520
   32    HB2  LEU  21           HB1      LEU  21 -25.133  48.999   1.128
   33    HB3  LEU  21           HB2      LEU  21 -26.740  48.257   1.074
   34    HG   LEU  21           HG       LEU  21 -27.054  51.000   0.435
   35   HD11  LEU  21          HD11      LEU  21 -25.200  49.848  -1.566
   36   HD12  LEU  21          HD12      LEU  21 -24.493  50.511  -0.093
   37   HD13  LEU  21          HD13      LEU  21 -25.496  51.530  -1.125
   38   HD21  LEU  21          HD21      LEU  21 -27.711  50.001  -1.781
   39   HD22  LEU  21          HD22      LEU  21 -28.546  49.344  -0.373
   40   HD23  LEU  21          HD23      LEU  21 -27.236  48.432  -1.126
   41    H    ASP  22           H        ASP  22 -28.782  50.171   3.595
   42    HA   ASP  22           HA       ASP  22 -28.998  47.552   4.890
   43    HB2  ASP  22           HB1      ASP  22 -30.195  50.244   5.361
   44    HB3  ASP  22           HB2      ASP  22 -31.155  48.829   5.814
   45    HD2  ASP  22           HD       ASP  22 -28.604  47.899   8.166
   46    H    PHE  23           H        PHE  23 -29.446  46.402   2.937
   47    HA   PHE  23           HA       PHE  23 -32.182  46.836   1.931
   48    HB2  PHE  23           HB1      PHE  23 -29.966  47.048   0.414
   49    HB3  PHE  23           HB2      PHE  23 -30.250  45.313   0.267
   50    HD1  PHE  23           HD1      PHE  23 -31.797  44.482  -1.249
   51    HD2  PHE  23           HD2      PHE  23 -31.950  48.589  -0.140
   52    HE1  PHE  23           HE1      PHE  23 -33.502  44.882  -2.979
   53    HE2  PHE  23           HE2      PHE  23 -33.655  48.996  -1.867
   54    HZ   PHE  23           HZ       PHE  23 -34.434  47.141  -3.288
   55    H    ASN  24           H        ASN  24 -33.580  45.257   2.326
   56    HA   ASN  24           HA       ASN  24 -32.778  42.488   2.326
   57    HB2  ASN  24           HB1      ASN  24 -32.354  43.548   4.689
   58    HB3  ASN  24           HB2      ASN  24 -34.109  43.407   4.850
   59   HD21  ASN  24          HD21      ASN  24 -31.605  41.335   3.426
   60   HD22  ASN  24          HD22      ASN  24 -32.037  39.916   4.312
   61    H    ASN  25           H        ASN  25 -34.432  41.170   1.765
   62    HA   ASN  25           HA       ASN  25 -37.067  42.431   1.440
   63    HB2  ASN  25           HB1      ASN  25 -35.893  40.011   0.041
   64    HB3  ASN  25           HB2      ASN  25 -37.486  40.708  -0.273
   65   HD21  ASN  25          HD21      ASN  25 -35.794  40.439  -2.339
   66   HD22  ASN  25          HD22      ASN  25 -35.199  41.979  -2.847
   67    H    ILE  26           H        ILE  26 -38.896  40.707   1.438
   68    HA   ILE  26           HA       ILE  26 -38.475  38.794   3.631
   69    HB   ILE  26           HB       ILE  26 -39.563  40.753   4.592
   70   HG12  ILE  26          HG11      ILE  26 -41.584  38.529   4.247
   71   HG13  ILE  26          HG12      ILE  26 -40.177  38.422   5.318
   72   HG21  ILE  26          HG21      ILE  26 -40.603  41.442   2.379
   73   HG22  ILE  26          HG22      ILE  26 -41.885  40.287   2.742
   74   HG23  ILE  26          HG23      ILE  26 -41.597  41.653   3.820
   75   HD11  ILE  26          HD11      ILE  26 -42.147  38.999   6.587
   76   HD12  ILE  26          HD12      ILE  26 -41.006  40.344   6.593
   77   HD13  ILE  26          HD13      ILE  26 -42.431  40.400   5.556
   78    H    ARG  27           H        ARG  27 -39.480  36.856   3.412
   79    HA   ARG  27           HA       ARG  27 -41.367  36.529   1.182
   80    HB2  ARG  27           HB1      ARG  27 -38.807  35.085   1.700
   81    HB3  ARG  27           HB2      ARG  27 -40.165  34.165   1.034
   82    HG2  ARG  27           HG1      ARG  27 -40.252  35.484  -0.920
   83    HG3  ARG  27           HG2      ARG  27 -39.193  36.716  -0.215
   84    HD2  ARG  27           HD1      ARG  27 -37.644  34.454  -0.032
   85    HD3  ARG  27           HD2      ARG  27 -38.519  34.201  -1.547
   86    HE   ARG  27           HE       ARG  27 -37.232  35.822  -2.498
   87   HH11  ARG  27          HH11      ARG  27 -37.164  36.238   0.957
   88   HH12  ARG  27          HH12      ARG  27 -35.995  37.515   0.911
   89   HH21  ARG  27          HH21      ARG  27 -35.691  37.503  -2.572
   90   HH22  ARG  27          HH22      ARG  27 -35.158  38.235  -1.095
   91    H    SER  28           H        SER  28 -42.560  34.417   1.323
   92    HA   SER  28           HA       SER  28 -43.302  33.945   4.121
   93    HB2  SER  28           HB1      SER  28 -45.450  33.667   3.441
   94    HB3  SER  28           HB2      SER  28 -44.894  34.535   1.998
   95    HG   SER  28           HG       SER  28 -45.123  32.780   0.867
   96    H    SER  29           H        SER  29 -42.989  32.037   5.089
   97    HA   SER  29           HA       SER  29 -42.237  29.923   5.465
   98    HB2  SER  29           HB1      SER  29 -43.527  29.599   2.750
   99    HB3  SER  29           HB2      SER  29 -42.806  28.234   3.622
  100    HG   SER  29           HG       SER  29 -45.213  29.042   3.915
  101    H    ALA  30           H        ALA  30 -40.901  28.043   4.262
  102    HA   ALA  30           HA       ALA  30 -38.899  29.118   2.459
  103    HB1  ALA  30           HB1      ALA  30 -37.012  28.601   3.903
  104    HB2  ALA  30           HB2      ALA  30 -38.067  29.793   4.663
  105    HB3  ALA  30           HB3      ALA  30 -38.112  28.110   5.190
  106    H    ASP  31           H        ASP  31 -38.910  26.388   4.742
  107    HA   ASP  31           HA       ASP  31 -38.644  24.149   4.422
  108    HB2  ASP  31           HB1      ASP  31 -40.313  24.766   1.967
  109    HB3  ASP  31           HB2      ASP  31 -40.012  23.145   2.608
  110    HD2  ASP  31           HD       ASP  31 -43.142  24.200   4.012
  111    H    LEU  32           H        LEU  32 -36.339  24.635   4.051
  112    HA   LEU  32           HA       LEU  32 -35.532  24.084   1.272
  113    HB2  LEU  32           HB1      LEU  32 -34.734  26.233   1.951
  114    HB3  LEU  32           HB2      LEU  32 -34.117  25.568   3.476
  115    HG   LEU  32           HG       LEU  32 -32.951  24.394   1.040
  116   HD11  LEU  32          HD11      LEU  32 -31.440  26.321   0.705
  117   HD12  LEU  32          HD12      LEU  32 -32.454  27.270   1.792
  118   HD13  LEU  32          HD13      LEU  32 -33.113  26.670   0.270
  119   HD21  LEU  32          HD21      LEU  32 -30.874  24.836   2.417
  120   HD22  LEU  32          HD22      LEU  32 -32.053  23.727   3.118
  121   HD23  LEU  32          HD23      LEU  32 -31.955  25.391   3.697
  122    H    HIS  33           H        HIS  33 -34.591  22.195   0.880
  123    HA   HIS  33           HA       HIS  33 -32.733  20.947   2.606
  124    HB2  HIS  33           HB1      HIS  33 -35.387  20.478   3.332
  125    HB3  HIS  33           HB2      HIS  33 -34.914  19.032   2.434
  126    HD1  HIS  33           HD1      HIS  33 -34.553  17.367   4.258
  127    HD2  HIS  33           HD2      HIS  33 -32.600  20.959   4.992
  128    HE1  HIS  33           HE1      HIS  33 -33.148  16.963   6.304
  129    HE2  HIS  33           HE2      HIS  33 -31.954  19.159   6.753
  130    H    GLY  34           H        GLY  34 -31.395  19.923   1.277
  131    HA2  GLY  34           HA2      GLY  34 -31.801  17.885  -0.421
  132    HA3  GLY  34           HA3      GLY  34 -32.267  19.260  -1.411
  133    HA1  GLY  34           HA1      GLY  34 -31.253  18.255   0.163
  134    H    ALA  35           H        ALA  35 -29.718  17.322  -0.386
  135    HA   ALA  35           HA       ALA  35 -27.840  18.567  -2.071
  136    HB1  ALA  35           HB1      ALA  35 -27.641  20.324  -0.505
  137    HB2  ALA  35           HB2      ALA  35 -27.586  19.204   0.857
  138    HB3  ALA  35           HB3      ALA  35 -26.228  19.294  -0.265
  139    H    ARG  36           H        ARG  36 -25.805  17.458  -2.124
  140    HA   ARG  36           HA       ARG  36 -25.307  15.243  -0.372
  141    HB2  ARG  36           HB1      ARG  36 -27.112  14.478  -2.045
  142    HB3  ARG  36           HB2      ARG  36 -25.814  14.514  -3.246
  143    HG2  ARG  36           HG1      ARG  36 -25.673  12.332  -2.629
  144    HG3  ARG  36           HG2      ARG  36 -24.573  13.044  -1.438
  145    HD2  ARG  36           HD1      ARG  36 -26.476  13.186   0.169
  146    HD3  ARG  36           HD2      ARG  36 -27.471  12.330  -1.016
  147    HE   ARG  36           HE       ARG  36 -25.351  10.682  -0.703
  148   HH11  ARG  36          HH11      ARG  36 -27.533  12.219   1.533
  149   HH12  ARG  36          HH12      ARG  36 -27.422  10.955   2.712
  150   HH21  ARG  36          HH21      ARG  36 -25.196   9.012   0.842
  151   HH22  ARG  36          HH22      ARG  36 -26.092   9.131   2.319
  152    H    LYS  37           H        LYS  37 -23.186  15.355  -0.112
  153    HA   LYS  37           HA       LYS  37 -21.504  15.917  -2.468
  154    HB2  LYS  37           HB1      LYS  37 -21.295  16.914   0.364
  155    HB3  LYS  37           HB2      LYS  37 -19.872  16.850  -0.688
  156    HG2  LYS  37           HG1      LYS  37 -21.751  18.110  -2.267
  157    HG3  LYS  37           HG2      LYS  37 -22.070  18.748  -0.644
  158    HD2  LYS  37           HD1      LYS  37 -20.439  20.217  -1.183
  159    HD3  LYS  37           HD2      LYS  37 -19.377  18.889  -0.682
  160    HE2  LYS  37           HE1      LYS  37 -20.331  19.019  -3.521
  161    HE3  LYS  37           HE2      LYS  37 -19.018  20.079  -2.986
  162    HZ1  LYS  37           HZ1      LYS  37 -17.615  18.325  -2.623
  163    HZ2  LYS  37           HZ2      LYS  37 -18.498  17.734  -3.939
  164    HZ3  LYS  37           HZ3      LYS  37 -18.863  17.211  -2.372
  165    H    GLY  38           H        GLY  38 -19.072  15.328  -1.747
  166    HA2  GLY  38           HA2      GLY  38 -18.524  13.241  -0.020
  167    HA3  GLY  38           HA3      GLY  38 -19.064  12.489  -1.515
  168    HA1  GLY  38           HA1      GLY  38 -18.241  14.027  -0.299
  169    H    SER  39           H        SER  39 -16.533  12.026  -0.549
  170    HA   SER  39           HA       SER  39 -14.844  13.551  -2.422
  171    HB2  SER  39           HB1      SER  39 -12.973  13.287  -0.943
  172    HB3  SER  39           HB2      SER  39 -14.332  13.882   0.027
  173    HG   SER  39           HG       SER  39 -13.207  12.116   1.013
  174    H    GLN  40           H        GLN  40 -12.673  12.135  -2.710
  175    HA   GLN  40           HA       GLN  40 -13.577   9.759  -4.084
  176    HB2  GLN  40           HB1      GLN  40 -11.879  11.438  -4.980
  177    HB3  GLN  40           HB2      GLN  40 -10.732  10.721  -3.838
  178    HG2  GLN  40           HG1      GLN  40 -10.230   9.181  -5.341
  179    HG3  GLN  40           HG2      GLN  40 -11.887   8.575  -5.222
  180   HE21  GLN  40          HE21      GLN  40 -10.164  11.292  -6.726
  181   HE22  GLN  40          HE22      GLN  40 -10.970  11.181  -8.250
  182    H    CYS  41           H        CYS  41 -10.796  10.303  -1.916
  183    HA   CYS  41           HA       CYS  41 -11.405   7.722  -0.636
  184    HB2  CYS  41           HB1      CYS  41  -9.098   7.123  -0.580
  185    HB3  CYS  41           HB2      CYS  41  -9.469   7.591  -2.241
  186    H    LEU  42           H        LEU  42 -10.970   7.562   1.561
  187    HA   LEU  42           HA       LEU  42 -10.850  10.109   2.954
  188    HB2  LEU  42           HB1      LEU  42 -11.492   7.285   3.752
  189    HB3  LEU  42           HB2      LEU  42 -11.163   8.525   4.976
  190    HG   LEU  42           HG       LEU  42 -13.103   9.579   3.195
  191   HD11  LEU  42          HD11      LEU  42 -14.794   8.015   3.073
  192   HD12  LEU  42          HD12      LEU  42 -14.117   7.023   4.362
  193   HD13  LEU  42          HD13      LEU  42 -13.364   7.030   2.768
  194   HD21  LEU  42          HD21      LEU  42 -14.493   9.177   5.401
  195   HD22  LEU  42          HD22      LEU  42 -13.215  10.390   5.328
  196   HD23  LEU  42          HD23      LEU  42 -12.898   8.819   6.063
  197    H    SER  43           H        SER  43  -8.839   7.362   2.312
  198    HA   SER  43           HA       SER  43  -6.565   8.699   3.474
  199    HB2  SER  43           HB1      SER  43  -7.689   6.167   4.680
  200    HB3  SER  43           HB2      SER  43  -5.977   6.597   4.838
  201    HG   SER  43           HG       SER  43  -8.235   7.888   5.896
  202    H    ASP  44           H        ASP  44  -4.579   7.138   3.297
  203    HA   ASP  44           HA       ASP  44  -4.367   6.416   0.555
  204    HB2  ASP  44           HB1      ASP  44  -2.516   5.979   2.911
  205    HB3  ASP  44           HB2      ASP  44  -2.098   5.562   1.244
  206    HD2  ASP  44           HD       ASP  44  -2.671   9.451   1.652
  207    H    THR  45           H        THR  45  -5.149   4.686   3.452
  208    HA   THR  45           HA       THR  45  -4.534   2.069   2.576
  209    HB   THR  45           HB       THR  45  -6.676   1.763   4.305
  210    HG1  THR  45           HG1      THR  45  -6.457   3.354   5.851
  211   HG21  THR  45          HG21      THR  45  -5.115   0.832   5.675
  212   HG22  THR  45          HG22      THR  45  -3.999   2.188   5.504
  213   HG23  THR  45          HG23      THR  45  -4.121   0.978   4.228
  214    H    ASP  46           H        ASP  46  -7.173   4.211   1.925
  215    HA   ASP  46           HA       ASP  46  -9.085   2.272   1.129
  216    HB2  ASP  46           HB1      ASP  46  -9.180   4.946   1.579
  217    HB3  ASP  46           HB2      ASP  46  -9.167   4.918  -0.189
  218    HD2  ASP  46           HD       ASP  46 -12.575   4.474   1.273
  219    H    CYS  47           H        CYS  47  -6.345   3.712  -0.429
  220    HA   CYS  47           HA       CYS  47  -7.090   3.184  -3.114
  221    HB2  CYS  47           HB1      CYS  47  -5.099   4.605  -1.949
  222    HB3  CYS  47           HB2      CYS  47  -4.211   3.159  -2.431
  223    H    ASN  48           H        ASN  48  -6.143   1.590  -4.539
  224    HA   ASN  48           HA       ASN  48  -6.462  -1.025  -3.689
  225    HB2  ASN  48           HB1      ASN  48  -5.176   0.260  -6.062
  226    HB3  ASN  48           HB2      ASN  48  -4.909  -1.468  -5.800
  227   HD21  ASN  48          HD21      ASN  48  -6.701  -2.884  -5.793
  228   HD22  ASN  48          HD22      ASN  48  -8.173  -2.454  -6.590
  229    H    THR  49           H        THR  49  -4.677  -2.749  -3.927
  230    HA   THR  49           HA       THR  49  -2.834  -2.404  -1.837
  231    HB   THR  49           HB       THR  49  -1.758  -4.497  -3.187
  232    HG1  THR  49           HG1      THR  49  -4.496  -4.803  -3.761
  233   HG21  THR  49          HG21      THR  49  -2.460  -4.777  -0.960
  234   HG22  THR  49          HG22      THR  49  -3.459  -5.899  -1.884
  235   HG23  THR  49          HG23      THR  49  -4.129  -4.360  -1.344
  236    H    ARG  50           H        ARG  50  -0.577  -2.211  -1.835
  237    HA   ARG  50           HA       ARG  50   1.395  -1.259  -2.456
  238    HB2  ARG  50           HB1      ARG  50   0.656  -2.452  -5.139
  239    HB3  ARG  50           HB2      ARG  50   2.271  -1.908  -4.661
  240    HG2  ARG  50           HG1      ARG  50   2.724  -3.890  -3.787
  241    HG3  ARG  50           HG2      ARG  50   1.325  -3.749  -2.708
  242    HD2  ARG  50           HD1      ARG  50   0.809  -5.677  -3.874
  243    HD3  ARG  50           HD2      ARG  50  -0.034  -4.442  -4.818
  244    HE   ARG  50           HE       ARG  50   2.561  -4.796  -5.851
  245   HH11  ARG  50          HH11      ARG  50  -0.511  -6.419  -5.637
  246   HH12  ARG  50          HH12      ARG  50  -0.290  -7.311  -7.107
  247   HH21  ARG  50          HH21      ARG  50   2.864  -5.964  -7.787
  248   HH22  ARG  50          HH22      ARG  50   1.632  -7.052  -8.328
  249    H    LYS  51           H        LYS  51  -1.076   0.316  -2.727
  250    HA   LYS  51           HA       LYS  51   0.024   2.418  -4.432
  251    HB2  LYS  51           HB1      LYS  51  -2.793   1.333  -4.634
  252    HB3  LYS  51           HB2      LYS  51  -2.285   2.881  -5.326
  253    HG2  LYS  51           HG1      LYS  51  -0.557   1.625  -6.650
  254    HG3  LYS  51           HG2      LYS  51  -1.334   0.133  -6.091
  255    HD2  LYS  51           HD1      LYS  51  -3.514   1.377  -6.987
  256    HD3  LYS  51           HD2      LYS  51  -2.312   2.180  -8.010
  257    HE2  LYS  51           HE1      LYS  51  -1.734   0.237  -9.115
  258    HE3  LYS  51           HE2      LYS  51  -2.225  -0.789  -7.761
  259    HZ1  LYS  51           HZ1      LYS  51  -3.664  -0.518  -9.965
  260    HZ2  LYS  51           HZ2      LYS  51  -4.343   0.731  -9.050
  261    HZ3  LYS  51           HZ3      LYS  51  -4.355  -0.852  -8.457
  262    H    PHE  52           H        PHE  52  -0.499   4.505  -3.790
  263    HA   PHE  52           HA       PHE  52  -2.002   4.718  -1.264
  264    HB2  PHE  52           HB1      PHE  52  -0.472   6.357  -0.451
  265    HB3  PHE  52           HB2      PHE  52   0.490   4.994  -1.023
  266    HD1  PHE  52           HD1      PHE  52  -0.386   8.481  -1.599
  267    HD2  PHE  52           HD2      PHE  52   1.830   5.148  -3.046
  268    HE1  PHE  52           HE1      PHE  52   0.909   9.980  -3.057
  269    HE2  PHE  52           HE2      PHE  52   3.129   6.643  -4.507
  270    HZ   PHE  52           HZ       PHE  52   2.669   9.062  -4.513
  271    H    CYS  53           H        CYS  53  -3.025   6.786  -0.872
  272    HA   CYS  53           HA       CYS  53  -4.061   7.928  -3.348
  273    HB2  CYS  53           HB1      CYS  53  -5.297   7.195  -1.027
  274    HB3  CYS  53           HB2      CYS  53  -5.101   8.930  -0.777
  275    H    LEU  54           H        LEU  54  -2.684   9.429  -4.130
  276    HA   LEU  54           HA       LEU  54  -1.180  11.203  -2.483
  277    HB2  LEU  54           HB1      LEU  54  -0.672  10.380  -4.868
  278    HB3  LEU  54           HB2      LEU  54  -1.786  11.657  -5.386
  279    HG   LEU  54           HG       LEU  54   0.285  12.623  -3.573
  280   HD11  LEU  54          HD11      LEU  54   1.997  12.552  -5.479
  281   HD12  LEU  54          HD12      LEU  54   1.040  11.212  -6.107
  282   HD13  LEU  54          HD13      LEU  54   1.777  11.095  -4.510
  283   HD21  LEU  54          HD21      LEU  54  -1.053  13.400  -6.105
  284   HD22  LEU  54          HD22      LEU  54   0.535  14.091  -5.771
  285   HD23  LEU  54          HD23      LEU  54  -0.790  14.329  -4.630
  286    H    GLN  55           H        GLN  55  -1.734  13.109  -1.647
  287    HA   GLN  55           HA       GLN  55  -4.204  14.386  -2.621
  288    HB2  GLN  55           HB1      GLN  55  -3.077  14.438   0.189
  289    HB3  GLN  55           HB2      GLN  55  -4.573  15.216  -0.351
  290    HG2  GLN  55           HG1      GLN  55  -5.762  13.327  -0.223
  291    HG3  GLN  55           HG2      GLN  55  -4.461  12.358  -0.929
  292   HE21  GLN  55          HE21      GLN  55  -5.133  14.156   2.058
  293   HE22  GLN  55          HE22      GLN  55  -4.497  12.956   3.125
  294    HA   PRO  56           HA       PRO  56  -0.858  17.394  -3.477
  295    HB2  PRO  56           HB1      PRO  56  -2.090  18.460  -5.678
  296    HB3  PRO  56           HB2      PRO  56  -1.106  16.997  -5.726
  297    HG2  PRO  56           HG1      PRO  56  -4.087  17.279  -5.541
  298    HG3  PRO  56           HG2      PRO  56  -3.107  16.184  -6.587
  299    HD2  PRO  56           HD1      PRO  56  -4.323  15.337  -4.313
  300    HD3  PRO  56           HD2      PRO  56  -2.775  14.682  -4.869
  301    H    ARG  57           H        ARG  57  -0.809  19.642  -3.207
  302    HA   ARG  57           HA       ARG  57  -3.025  20.714  -1.693
  303    HB2  ARG  57           HB1      ARG  57  -0.572  21.021  -1.114
  304    HB3  ARG  57           HB2      ARG  57  -0.493  22.153  -2.472
  305    HG2  ARG  57           HG1      ARG  57  -0.969  23.705  -0.931
  306    HG3  ARG  57           HG2      ARG  57  -2.632  23.124  -1.122
  307    HD2  ARG  57           HD1      ARG  57  -2.237  21.506   0.731
  308    HD3  ARG  57           HD2      ARG  57  -0.640  22.231   0.958
  309    HE   ARG  57           HE       ARG  57  -3.152  23.301   1.821
  310   HH11  ARG  57          HH11      ARG  57   0.090  24.113   0.847
  311   HH12  ARG  57          HH12      ARG  57   0.115  25.613   1.713
  312   HH21  ARG  57          HH21      ARG  57  -3.133  25.274   2.965
  313   HH22  ARG  57          HH22      ARG  57  -1.719  26.272   2.918
  314    H    ASP  58           H        ASP  58  -1.323  21.502  -4.707
  315    HA   ASP  58           HA       ASP  58  -3.057  23.686  -5.345
  316    HB2  ASP  58           HB1      ASP  58  -0.592  23.116  -6.142
  317    HB3  ASP  58           HB2      ASP  58  -1.458  22.296  -7.449
  318    HD2  ASP  58           HD       ASP  58  -1.072  26.125  -7.690
  319    H    GLU  59           H        GLU  59  -3.141  20.274  -5.815
  320    HA   GLU  59           HA       GLU  59  -5.477  20.579  -7.586
  321    HB2  GLU  59           HB1      GLU  59  -3.138  18.814  -7.720
  322    HB3  GLU  59           HB2      GLU  59  -4.682  17.964  -7.893
  323    HG2  GLU  59           HG1      GLU  59  -5.203  19.881  -9.608
  324    HG3  GLU  59           HG2      GLU  59  -3.439  20.009  -9.660
  325    HE2  GLU  59           HE       GLU  59  -4.722  17.486 -12.053
  326    H    LYS  60           H        LYS  60  -6.775  18.342  -7.469
  327    HA   LYS  60           HA       LYS  60  -7.648  18.167  -4.703
  328    HB2  LYS  60           HB1      LYS  60  -8.796  17.570  -7.358
  329    HB3  LYS  60           HB2      LYS  60  -9.286  16.471  -6.059
  330    HG2  LYS  60           HG1      LYS  60  -9.527  19.016  -4.949
  331    HG3  LYS  60           HG2      LYS  60 -10.139  19.172  -6.604
  332    HD2  LYS  60           HD1      LYS  60 -11.250  16.789  -5.784
  333    HD3  LYS  60           HD2      LYS  60 -11.286  17.774  -4.310
  334    HE2  LYS  60           HE1      LYS  60 -12.225  18.920  -6.925
  335    HE3  LYS  60           HE2      LYS  60 -13.285  17.883  -5.960
  336    HZ1  LYS  60           HZ1      LYS  60 -11.985  20.366  -4.977
  337    HZ2  LYS  60           HZ2      LYS  60 -13.058  19.392  -4.105
  338    HZ3  LYS  60           HZ3      LYS  60 -13.600  20.240  -5.466
  339    HA   PRO  61           HA       PRO  61  -5.888  14.272  -3.714
  340    HB2  PRO  61           HB1      PRO  61  -7.895  13.053  -2.303
  341    HB3  PRO  61           HB2      PRO  61  -6.954  14.409  -1.683
  342    HG2  PRO  61           HG1      PRO  61  -9.651  14.408  -2.996
  343    HG3  PRO  61           HG2      PRO  61  -9.105  15.278  -1.514
  344    HD2  PRO  61           HD1      PRO  61  -9.343  16.499  -3.927
  345    HD3  PRO  61           HD2      PRO  61  -8.099  16.945  -2.746
  346    H    PHE  62           H        PHE  62  -5.584  12.343  -4.674
  347    HA   PHE  62           HA       PHE  62  -7.784  10.883  -5.851
  348    HB2  PHE  62           HB1      PHE  62  -6.558  10.733  -8.081
  349    HB3  PHE  62           HB2      PHE  62  -7.380  12.254  -7.733
  350    HD1  PHE  62           HD1      PHE  62  -6.261  14.215  -8.131
  351    HD2  PHE  62           HD2      PHE  62  -4.020  10.703  -7.262
  352    HE1  PHE  62           HE1      PHE  62  -4.171  15.460  -8.504
  353    HE2  PHE  62           HE2      PHE  62  -1.927  11.941  -7.632
  354    HZ   PHE  62           HZ       PHE  62  -2.000  14.324  -8.254
  355    H    CYS  63           H        CYS  63  -6.975   8.807  -6.871
  356    HA   CYS  63           HA       CYS  63  -5.046   7.623  -5.063
  357    HB2  CYS  63           HB1      CYS  63  -7.267   6.709  -6.668
  358    HB3  CYS  63           HB2      CYS  63  -5.843   5.716  -6.975
  359    H    ALA  64           H        ALA  64  -3.040   6.906  -5.566
  360    HA   ALA  64           HA       ALA  64  -2.137   7.263  -8.349
  361    HB1  ALA  64           HB1      ALA  64  -0.097   8.184  -7.641
  362    HB2  ALA  64           HB2      ALA  64  -1.325   8.997  -6.672
  363    HB3  ALA  64           HB3      ALA  64  -0.362   7.700  -5.966
  364    H    THR  65           H        THR  65  -0.077   6.030  -8.799
  365    HA   THR  65           HA       THR  65  -0.357   3.331  -7.688
  366    HB   THR  65           HB       THR  65   1.467   3.717  -9.970
  367    HG1  THR  65           HG1      THR  65   0.046   4.553 -11.305
  368   HG21  THR  65          HG21      THR  65  -0.420   1.858 -10.659
  369   HG22  THR  65          HG22      THR  65  -0.403   1.730  -8.900
  370   HG23  THR  65          HG23      THR  65   1.088   1.506  -9.816
  371    H    CYS  66           H        CYS  66   1.731   2.053  -7.571
  372    HA   CYS  66           HA       CYS  66   3.414   3.090  -5.644
  373    HB2  CYS  66           HB1      CYS  66   3.119   0.660  -6.908
  374    HB3  CYS  66           HB2      CYS  66   4.733   1.161  -7.418
  375    H    ARG  67           H        ARG  67   5.617   3.771  -5.692
  376    HA   ARG  67           HA       ARG  67   6.283   5.247  -8.145
  377    HB2  ARG  67           HB1      ARG  67   7.226   5.663  -5.297
  378    HB3  ARG  67           HB2      ARG  67   7.709   6.645  -6.689
  379    HG2  ARG  67           HG1      ARG  67   4.815   6.460  -6.415
  380    HG3  ARG  67           HG2      ARG  67   5.606   7.156  -4.990
  381    HD2  ARG  67           HD1      ARG  67   5.401   9.073  -6.194
  382    HD3  ARG  67           HD2      ARG  67   6.925   8.496  -6.885
  383    HE   ARG  67           HE       ARG  67   5.858   8.240  -8.882
  384   HH11  ARG  67          HH11      ARG  67   3.472   8.278  -6.346
  385   HH12  ARG  67          HH12      ARG  67   2.125   8.247  -7.436
  386   HH21  ARG  67          HH21      ARG  67   4.092   8.198 -10.326
  387   HH22  ARG  67          HH22      ARG  67   2.479   8.200  -9.698
  388    H    GLY  68           H        GLY  68   7.922   4.563  -9.351
  389    HA2  GLY  68           HA2      GLY  68   9.468   2.295  -8.671
  390    HA3  GLY  68           HA3      GLY  68   9.756   3.363 -10.037
  391    HA1  GLY  68           HA1      GLY  68   9.385   2.866  -8.004
  392    H    LEU  69           H        LEU  69  11.974   2.462  -9.067
  393    HA   LEU  69           HA       LEU  69  13.031   3.830  -6.815
  394    HB2  LEU  69           HB1      LEU  69  14.391   2.429  -9.122
  395    HB3  LEU  69           HB2      LEU  69  15.228   3.043  -7.687
  396    HG   LEU  69           HG       LEU  69  13.205   0.809  -7.787
  397   HD11  LEU  69          HD11      LEU  69  16.117   0.961  -7.838
  398   HD12  LEU  69          HD12      LEU  69  15.041  -0.369  -8.262
  399   HD13  LEU  69          HD13      LEU  69  15.488  -0.100  -6.577
  400   HD21  LEU  69          HD21      LEU  69  12.709   1.672  -5.733
  401   HD22  LEU  69          HD22      LEU  69  14.303   2.399  -5.527
  402   HD23  LEU  69          HD23      LEU  69  14.090   0.662  -5.304
  403    H    ARG  70           H        ARG  70  12.583   4.691 -10.111
  404    HA   ARG  70           HA       ARG  70  14.502   6.889  -9.951
  405    HB2  ARG  70           HB1      ARG  70  12.813   5.802 -12.209
  406    HB3  ARG  70           HB2      ARG  70  13.799   7.264 -12.352
  407    HG2  ARG  70           HG1      ARG  70  15.677   5.584 -11.438
  408    HG3  ARG  70           HG2      ARG  70  14.621   4.432 -12.269
  409    HD2  ARG  70           HD1      ARG  70  14.925   6.710 -13.955
  410    HD3  ARG  70           HD2      ARG  70  16.528   6.218 -13.388
  411    HE   ARG  70           HE       ARG  70  15.183   3.919 -14.212
  412   HH11  ARG  70          HH11      ARG  70  16.438   6.864 -15.583
  413   HH12  ARG  70          HH12      ARG  70  16.745   6.163 -17.137
  414   HH21  ARG  70          HH21      ARG  70  15.582   2.986 -16.256
  415   HH22  ARG  70          HH22      ARG  70  16.256   3.958 -17.519
  416    H    ARG  71           H        ARG  71  11.216   6.273  -9.420
  417    HA   ARG  71           HA       ARG  71  10.152   8.807 -10.182
  418    HB2  ARG  71           HB1      ARG  71   9.191   6.351  -8.937
  419    HB3  ARG  71           HB2      ARG  71   8.468   7.800  -8.221
  420    HG2  ARG  71           HG1      ARG  71   7.111   6.885 -10.053
  421    HG3  ARG  71           HG2      ARG  71   7.681   8.530 -10.383
  422    HD2  ARG  71           HD1      ARG  71   9.384   7.738 -11.866
  423    HD3  ARG  71           HD2      ARG  71   9.083   6.062 -11.386
  424    HE   ARG  71           HE       ARG  71   6.697   6.823 -12.384
  425   HH11  ARG  71          HH11      ARG  71   9.951   7.032 -13.604
  426   HH12  ARG  71          HH12      ARG  71   9.474   6.912 -15.267
  427   HH21  ARG  71          HH21      ARG  71   6.057   6.665 -14.567
  428   HH22  ARG  71          HH22      ARG  71   7.259   6.704 -15.813
  429    H    ARG  72           H        ARG  72  10.018  10.669  -9.074
  430    HA   ARG  72           HA       ARG  72  11.627  11.044  -6.762
  431    HB2  ARG  72           HB1      ARG  72   9.575  12.885  -8.017
  432    HB3  ARG  72           HB2      ARG  72  10.782  13.356  -6.810
  433    HG2  ARG  72           HG1      ARG  72  11.689  12.103  -9.367
  434    HG3  ARG  72           HG2      ARG  72  11.201  13.806  -9.344
  435    HD2  ARG  72           HD1      ARG  72  13.183  12.700  -7.361
  436    HD3  ARG  72           HD2      ARG  72  13.675  13.275  -8.961
  437    HE   ARG  72           HE       ARG  72  12.093  15.164  -7.468
  438   HH11  ARG  72          HH11      ARG  72  15.297  13.980  -8.140
  439   HH12  ARG  72          HH12      ARG  72  16.081  15.450  -7.667
  440   HH21  ARG  72          HH21      ARG  72  13.114  17.105  -6.843
  441   HH22  ARG  72          HH22      ARG  72  14.839  17.227  -6.927
  442    H    CYS  73           H        CYS  73  10.950  11.769  -4.674
  443    HA   CYS  73           HA       CYS  73   8.173  11.483  -3.923
  444    HB2  CYS  73           HB1      CYS  73   8.543   9.756  -2.248
  445    HB3  CYS  73           HB2      CYS  73   8.973   9.155  -3.851
  446    H    GLN  74           H        GLN  74   8.029  11.710  -1.406
  447    HA   GLN  74           HA       GLN  74  10.029  13.688  -0.534
  448    HB2  GLN  74           HB1      GLN  74   7.630  14.490  -1.258
  449    HB3  GLN  74           HB2      GLN  74   7.180  13.899   0.349
  450    HG2  GLN  74           HG1      GLN  74   7.835  15.823   1.218
  451    HG3  GLN  74           HG2      GLN  74   9.488  15.451   0.709
  452   HE21  GLN  74          HE21      GLN  74   6.449  16.684  -0.640
  453   HE22  GLN  74          HE22      GLN  74   7.180  17.896  -1.631
  454    H    ARG  75           H        ARG  75   7.705  11.214   0.394
  455    HA   ARG  75           HA       ARG  75   9.111  10.962   2.972
  456    HB2  ARG  75           HB1      ARG  75   6.353  11.456   2.482
  457    HB3  ARG  75           HB2      ARG  75   6.499   9.815   3.127
  458    HG2  ARG  75           HG1      ARG  75   8.122  11.117   4.838
  459    HG3  ARG  75           HG2      ARG  75   6.976  12.406   4.436
  460    HD2  ARG  75           HD1      ARG  75   5.480  10.020   4.860
  461    HD3  ARG  75           HD2      ARG  75   6.625  10.201   6.198
  462    HE   ARG  75           HE       ARG  75   5.176  12.608   5.568
  463   HH11  ARG  75          HH11      ARG  75   5.178   9.644   7.396
  464   HH12  ARG  75          HH12      ARG  75   4.078  10.232   8.597
  465   HH21  ARG  75          HH21      ARG  75   3.726  13.393   7.145
  466   HH22  ARG  75          HH22      ARG  75   3.252  12.364   8.454
  467    H    ASP  76           H        ASP  76   9.259   8.818   3.845
  468    HA   ASP  76           HA       ASP  76   9.724   6.843   1.799
  469    HB2  ASP  76           HB1      ASP  76   9.877   6.247   4.739
  470    HB3  ASP  76           HB2      ASP  76  10.877   5.630   3.418
  471    HD2  ASP  76           HD       ASP  76  13.180   8.122   3.832
  472    H    ALA  77           H        ALA  77   7.227   7.592   4.062
  473    HA   ALA  77           HA       ALA  77   6.029   5.005   4.166
  474    HB1  ALA  77           HB1      ALA  77   5.127   7.757   4.929
  475    HB2  ALA  77           HB2      ALA  77   4.012   6.390   4.970
  476    HB3  ALA  77           HB3      ALA  77   5.470   6.370   5.963
  477    H    MET  78           H        MET  78   5.725   7.790   2.065
  478    HA   MET  78           HA       MET  78   3.362   6.815   0.742
  479    HB2  MET  78           HB1      MET  78   3.686   8.701  -0.790
  480    HB3  MET  78           HB2      MET  78   3.786   9.217   0.901
  481    HG2  MET  78           HG1      MET  78   5.950   9.827   0.748
  482    HG3  MET  78           HG2      MET  78   6.347   8.496  -0.343
  483    HE1  MET  78           HE1      MET  78   6.267   9.869  -3.763
  484    HE2  MET  78           HE2      MET  78   6.811   8.657  -2.603
  485    HE3  MET  78           HE3      MET  78   5.123   8.694  -3.113
  486    H    CYS  79           H        CYS  79   6.756   6.372   0.431
  487    HA   CYS  79           HA       CYS  79   6.895   5.720  -2.315
  488    HB2  CYS  79           HB1      CYS  79   8.655   5.748  -0.051
  489    HB3  CYS  79           HB2      CYS  79   8.836   4.210  -0.895
  490    H    CYS  80           H        CYS  80   7.854   3.340  -2.781
  491    HA   CYS  80           HA       CYS  80   5.618   1.612  -2.594
  492    HB2  CYS  80           HB1      CYS  80   8.413   1.383  -3.642
  493    HB3  CYS  80           HB2      CYS  80   7.465  -0.090  -3.429
  494    HA   PRO  81           HA       PRO  81   6.286  -0.653   1.103
  495    HB2  PRO  81           HB1      PRO  81   5.598  -3.199   0.367
  496    HB3  PRO  81           HB2      PRO  81   4.429  -1.894   0.564
  497    HG2  PRO  81           HG1      PRO  81   5.727  -2.921  -1.936
  498    HG3  PRO  81           HG2      PRO  81   3.997  -2.515  -1.634
  499    HD2  PRO  81           HD1      PRO  81   5.683  -0.853  -2.964
  500    HD3  PRO  81           HD2      PRO  81   4.376  -0.259  -1.925
  501    H    GLY  82           H        GLY  82   8.245  -1.012   1.936
  502    HA2  GLY  82           HA2      GLY  82  10.042  -2.499   2.398
  503    HA3  GLY  82           HA3      GLY  82   9.887  -3.147   0.772
  504    HA1  GLY  82           HA1      GLY  82   9.896  -1.638   2.269
  505    H    THR  83           H        THR  83   9.666   0.109   0.451
  506    HA   THR  83           HA       THR  83  12.567   0.371  -0.008
  507    HB   THR  83           HB       THR  83  11.550   2.304  -1.599
  508    HG1  THR  83           HG1      THR  83   9.679   0.153  -1.702
  509   HG21  THR  83          HG21      THR  83  12.514  -0.431  -1.968
  510   HG22  THR  83          HG22      THR  83  12.948   1.047  -2.826
  511   HG23  THR  83          HG23      THR  83  11.509   0.145  -3.297
  512    H    LEU  84           H        LEU  84  13.190   2.801  -0.153
  513    HA   LEU  84           HA       LEU  84  11.811   4.311   1.960
  514    HB2  LEU  84           HB1      LEU  84  14.712   3.612   1.719
  515    HB3  LEU  84           HB2      LEU  84  14.238   5.143   2.475
  516    HG   LEU  84           HG       LEU  84  12.669   3.380   3.828
  517   HD11  LEU  84          HD11      LEU  84  14.103   1.614   2.503
  518   HD12  LEU  84          HD12      LEU  84  13.666   1.358   4.192
  519   HD13  LEU  84          HD13      LEU  84  15.275   1.949   3.778
  520   HD21  LEU  84          HD21      LEU  84  14.939   3.455   5.358
  521   HD22  LEU  84          HD22      LEU  84  13.704   4.713   5.295
  522   HD23  LEU  84          HD23      LEU  84  15.150   4.846   4.294
  523    H    CYS  85           H        CYS  85  12.348   6.645   1.937
  524    HA   CYS  85           HA       CYS  85  12.631   7.574  -0.835
  525    HB2  CYS  85           HB1      CYS  85  10.550   8.113   0.522
  526    HB3  CYS  85           HB2      CYS  85  11.575   9.158   1.508
  527    H    VAL  86           H        VAL  86  14.621   8.203  -1.335
  528    HA   VAL  86           HA       VAL  86  16.045   9.957   0.543
  529    HB   VAL  86           HB       VAL  86  17.417   7.779  -1.034
  530   HG11  VAL  86          HG11      VAL  86  19.240   8.371   0.696
  531   HG12  VAL  86          HG12      VAL  86  18.989   9.454  -0.674
  532   HG13  VAL  86          HG13      VAL  86  18.331   9.866   0.909
  533   HG21  VAL  86          HG21      VAL  86  17.779   6.749   1.239
  534   HG22  VAL  86          HG22      VAL  86  16.543   7.851   1.846
  535   HG23  VAL  86          HG23      VAL  86  16.132   6.657   0.615
  536    H    ASN  87           H        ASN  87  17.221  11.597  -0.380
  537    HA   ASN  87           HA       ASN  87  17.791  13.152  -1.939
  538    HB2  ASN  87           HB1      ASN  87  18.880  10.801  -2.782
  539    HB3  ASN  87           HB2      ASN  87  17.901  11.241  -4.187
  540   HD21  ASN  87          HD21      ASN  87  20.578  12.157  -2.170
  541   HD22  ASN  87          HD22      ASN  87  21.239  13.341  -3.239
  542    H    ASP  88           H        ASP  88  14.984  12.496  -1.551
  543    HA   ASP  88           HA       ASP  88  12.962  13.112  -2.395
  544    HB2  ASP  88           HB1      ASP  88  14.847  14.855  -3.601
  545    HB3  ASP  88           HB2      ASP  88  13.708  14.368  -4.865
  546    HD2  ASP  88           HD       ASP  88  11.511  16.691  -3.674
  547    H    VAL  89           H        VAL  89  14.398  10.639  -3.263
  548    HA   VAL  89           HA       VAL  89  12.553   9.938  -5.402
  549    HB   VAL  89           HB       VAL  89  14.502  10.607  -6.668
  550   HG11  VAL  89          HG11      VAL  89  16.661   9.381  -6.354
  551   HG12  VAL  89          HG12      VAL  89  16.232  10.464  -5.029
  552   HG13  VAL  89          HG13      VAL  89  16.002   8.724  -4.857
  553   HG21  VAL  89          HG21      VAL  89  14.250   7.605  -6.503
  554   HG22  VAL  89          HG22      VAL  89  13.269   8.684  -7.494
  555   HG23  VAL  89          HG23      VAL  89  14.989   8.494  -7.835
  556    H    CYS  90           H        CYS  90  12.006   7.775  -5.450
  557    HA   CYS  90           HA       CYS  90  12.241   6.323  -3.061
  558    HB2  CYS  90           HB1      CYS  90  10.732   6.138  -5.383
  559    HB3  CYS  90           HB2      CYS  90  11.698   4.663  -5.400
  560    H    THR  91           H        THR  91  13.462   4.555  -2.469
  561    HA   THR  91           HA       THR  91  15.495   3.543  -4.289
  562    HB   THR  91           HB       THR  91  16.544   5.502  -3.152
  563    HG1  THR  91           HG1      THR  91  18.346   4.392  -3.239
  564   HG21  THR  91          HG21      THR  91  15.385   5.368  -1.011
  565   HG22  THR  91          HG22      THR  91  17.131   5.290  -0.772
  566   HG23  THR  91          HG23      THR  91  16.160   3.821  -0.672
  567    H    THR  92           H        THR  92  16.406   1.552  -3.636
  568    HA   THR  92           HA       THR  92  14.644  -0.057  -2.047
  569    HB   THR  92           HB       THR  92  16.896  -1.604  -2.504
  570    HG1  THR  92           HG1      THR  92  17.668  -1.066  -4.486
  571   HG21  THR  92          HG21      THR  92  15.515  -2.405  -4.519
  572   HG22  THR  92          HG22      THR  92  14.333  -1.195  -4.018
  573   HG23  THR  92          HG23      THR  92  14.773  -2.505  -2.922
  574    H    MET  93           H        MET  93  15.275  -1.342  -0.217
  575    HA   MET  93           HA       MET  93  16.528   0.114   1.816
  576    HB2  MET  93           HB1      MET  93  14.990  -2.157   1.685
  577    HB3  MET  93           HB2      MET  93  16.564  -2.797   2.183
  578    HG2  MET  93           HG1      MET  93  16.563  -1.012   3.998
  579    HG3  MET  93           HG2      MET  93  14.862  -0.771   3.594
  580    HE1  MET  93           HE1      MET  93  16.235  -1.542   6.346
  581    HE2  MET  93           HE2      MET  93  15.961  -3.195   6.893
  582    HE3  MET  93           HE3      MET  93  17.302  -2.839   5.802
  583    H    GLU  94           H        GLU  94  17.814  -2.051  -0.567
  584    HA   GLU  94           HA       GLU  94  20.352  -2.346   0.817
  585    HB2  GLU  94           HB1      GLU  94  19.514  -3.277  -1.941
  586    HB3  GLU  94           HB2      GLU  94  20.999  -3.734  -1.092
  587    HG2  GLU  94           HG1      GLU  94  19.953  -5.205   0.275
  588    HG3  GLU  94           HG2      GLU  94  18.457  -4.262   0.314
  589    HE2  GLU  94           HE       GLU  94  17.779  -5.724  -2.999
  590    H    ASP  95           H        ASP  95  18.916  -0.400  -1.662
  591    HA   ASP  95           HA       ASP  95  21.345   0.498  -2.857
  592    HB2  ASP  95           HB1      ASP  95  18.475   1.057  -3.116
  593    HB3  ASP  95           HB2      ASP  95  19.500   2.476  -3.373
  594    HD2  ASP  95           HD       ASP  95  20.560   1.339  -6.428
  595    H    ALA  96           H        ALA  96  19.297   1.637  -0.237
  596    HA   ALA  96           HA       ALA  96  20.383   4.188   0.111
  597    HB1  ALA  96           HB1      ALA  96  18.386   2.839   1.290
  598    HB2  ALA  96           HB2      ALA  96  19.612   2.722   2.553
  599    HB3  ALA  96           HB3      ALA  96  19.099   4.304   1.966
  600    H    THR  97           H        THR  97  21.434   4.564   2.507
  601    HA   THR  97           HA       THR  97  23.351   4.506   3.734
  602    HB   THR  97           HB       THR  97  24.097   1.756   2.915
  603    HG1  THR  97           HG1      THR  97  21.885   2.096   4.647
  604   HG21  THR  97          HG21      THR  97  25.109   3.175   4.790
  605   HG22  THR  97          HG22      THR  97  24.666   1.514   5.183
  606   HG23  THR  97          HG23      THR  97  23.620   2.845   5.677
  607    H    GLU  98           H        GLU  98  23.342   5.158   0.832
  608    HA   GLU  98           HA       GLU  98  24.809   5.683  -0.828
  609    HB2  GLU  98           HB1      GLU  98  25.981   6.373   1.573
  610    HB3  GLU  98           HB2      GLU  98  27.241   5.418   0.776
  611    HG2  GLU  98           HG1      GLU  98  27.306   6.873  -1.095
  612    HG3  GLU  98           HG2      GLU  98  25.837   7.707  -0.568
  613    HE2  GLU  98           HE       GLU  98  29.138   8.531   1.494
  614    H    ASN  99           H        ASN  99  24.245   2.832  -0.225
  615    HA   ASN  99           HA       ASN  99  24.918   0.747  -0.851
  616    HB2  ASN  99           HB1      ASN  99  25.926   2.608  -2.923
  617    HB3  ASN  99           HB2      ASN  99  26.639   0.991  -2.930
  618   HD21  ASN  99          HD21      ASN  99  24.881  -0.780  -2.572
  619   HD22  ASN  99          HD22      ASN  99  23.503  -0.640  -3.604
  620    H    LEU 100           H        LEU 100  26.056   0.333   1.100
  621    HA   LEU 100           HA       LEU 100  28.719   1.007   1.604
  622    HB2  LEU 100           HB1      LEU 100  27.174  -1.427   2.512
  623    HB3  LEU 100           HB2      LEU 100  28.699  -0.855   3.210
  624    HG   LEU 100           HG       LEU 100  26.180   0.796   3.214
  625   HD11  LEU 100          HD11      LEU 100  25.382  -0.758   4.623
  626   HD12  LEU 100          HD12      LEU 100  26.488  -0.015   5.778
  627   HD13  LEU 100          HD13      LEU 100  26.971  -1.470   4.906
  628   HD21  LEU 100          HD21      LEU 100  27.355   2.335   4.339
  629   HD22  LEU 100          HD22      LEU 100  28.773   1.514   3.684
  630   HD23  LEU 100          HD23      LEU 100  28.197   1.125   5.306
  631    H    TYR 101           H        TYR 101  30.604  -0.415   1.634
  632    HA   TYR 101           HA       TYR 101  30.618  -2.712  -0.111
  633    HB2  TYR 101           HB1      TYR 101  32.105  -1.882  -1.776
  634    HB3  TYR 101           HB2      TYR 101  30.783  -0.720  -1.651
  635    HD1  TYR 101           HD1      TYR 101  34.347  -1.264  -1.055
  636    HD2  TYR 101           HD2      TYR 101  31.128   1.493  -0.682
  637    HE1  TYR 101           HE1      TYR 101  35.958   0.554  -0.668
  638    HE2  TYR 101           HE2      TYR 101  32.730   3.319  -0.295
  639    HH   TYR 101           HH       TYR 101  34.874   3.905  -0.232
  640    H    PHE 102           H        PHE 102  33.087  -3.342  -0.464
  641    HA   PHE 102           HA       PHE 102  34.429  -3.006   2.138
  642    HB2  PHE 102           HB1      PHE 102  33.838  -5.422   0.515
  643    HB3  PHE 102           HB2      PHE 102  35.427  -5.363   1.282
  644    HD1  PHE 102           HD1      PHE 102  35.704  -5.880   3.536
  645    HD2  PHE 102           HD2      PHE 102  31.803  -5.099   2.023
  646    HE1  PHE 102           HE1      PHE 102  34.732  -6.619   5.672
  647    HE2  PHE 102           HE2      PHE 102  30.825  -5.835   4.157
  648    HZ   PHE 102           HZ       PHE 102  32.290  -6.596   5.985
  649    H    GLN 103           H        GLN 103  36.379  -2.118   2.060
  650    HA   GLN 103           HA       GLN 103  37.580  -1.202  -0.279
  651    HB2  GLN 103           HB1      GLN 103  37.988  -0.822   2.397
  652    HB3  GLN 103           HB2      GLN 103  39.434  -1.736   1.939
  653    HG2  GLN 103           HG1      GLN 103  40.207  -0.089   0.514
  654    HG3  GLN 103           HG2      GLN 103  38.601   0.625   0.318
  655   HE21  GLN 103          HE21      GLN 103  38.074   2.324   1.521
  656   HE22  GLN 103          HE22      GLN 103  38.983   2.920   2.863
  657    H    SER 104           H        SER 104  39.946  -1.769  -0.846
  658    HA   SER 104           HA       SER 104  40.053  -4.675  -1.264
  659    HB2  SER 104           HB1      SER 104  41.965  -3.115  -2.820
  660    HB3  SER 104           HB2      SER 104  40.725  -4.256  -3.369
  661    HG   SER 104           HG       SER 104  40.513  -1.484  -2.936
  662    H    LEU 105           H        LEU 105  42.396  -5.489  -1.555
  663    HA   LEU 105           HA       LEU 105  43.996  -4.448   0.688
  664    HB2  LEU 105           HB1      LEU 105  43.465  -7.213  -0.320
  665    HB3  LEU 105           HB2      LEU 105  44.998  -6.863   0.498
  666    HG   LEU 105           HG       LEU 105  43.500  -5.941   2.401
  667   HD11  LEU 105          HD11      LEU 105  41.318  -6.937   2.574
  668   HD12  LEU 105          HD12      LEU 105  41.540  -7.783   1.042
  669   HD13  LEU 105          HD13      LEU 105  41.418  -6.024   1.068
  670   HD21  LEU 105          HD21      LEU 105  43.059  -8.773   2.524
  671   HD22  LEU 105          HD22      LEU 105  44.210  -7.781   3.420
  672   HD23  LEU 105          HD23      LEU 105  44.651  -8.438   1.843
  673    H    GLU 106           H        GLU 106  45.966  -3.689   0.263
  674    HA   GLU 106           HA       GLU 106  47.129  -4.270  -2.381
  675    HB2  GLU 106           HB1      GLU 106  48.267  -2.099  -2.232
  676    HB3  GLU 106           HB2      GLU 106  46.508  -1.925  -2.141
  677    HG2  GLU 106           HG1      GLU 106  46.985  -2.037   0.462
  678    HG3  GLU 106           HG2      GLU 106  48.569  -1.450  -0.065
  679    HE2  GLU 106           HE       GLU 106  47.358   1.716  -0.525
  680    H    HIS 107           H        HIS 107  49.125  -5.118  -2.488
  681    HA   HIS 107           HA       HIS 107  50.383  -5.968  -0.035
  682    HB2  HIS 107           HB1      HIS 107  51.265  -6.341  -2.910
  683    HB3  HIS 107           HB2      HIS 107  51.943  -7.169  -1.503
  684    HD1  HIS 107           HD1      HIS 107  50.809  -9.270  -0.729
  685    HD2  HIS 107           HD2      HIS 107  48.537  -7.153  -3.488
  686    HE1  HIS 107           HE1      HIS 107  48.878 -10.774  -1.304
  687    HE2  HIS 107           HE2      HIS 107  47.488  -9.481  -2.992
  688    H    HIS 108           H        HIS 108  52.804  -5.746   0.181
  689    HA   HIS 108           HA       HIS 108  53.612  -3.009  -0.555
  690    HB2  HIS 108           HB1      HIS 108  53.189  -3.783   1.951
  691    HB3  HIS 108           HB2      HIS 108  54.838  -4.394   1.787
  692    HD1  HIS 108           HD1      HIS 108  53.582  -1.773   3.409
  693    HD2  HIS 108           HD2      HIS 108  56.165  -1.881   0.156
  694    HE1  HIS 108           HE1      HIS 108  54.799   0.427   3.444
  695    HE2  HIS 108           HE2      HIS 108  56.377   0.364   1.455
  696    H    HIS 109           H        HIS 109  55.103  -6.081   0.489
  697    HA   HIS 109           HA       HIS 109  56.926  -7.217  -0.260
  698    HB2  HIS 109           HB1      HIS 109  55.801  -5.943  -2.652
  699    HB3  HIS 109           HB2      HIS 109  57.525  -6.305  -2.790
  700    HD1  HIS 109           HD1      HIS 109  54.847  -7.775  -4.089
  701    HD2  HIS 109           HD2      HIS 109  57.542  -9.222  -1.277
  702    HE1  HIS 109           HE1      HIS 109  54.684 -10.281  -4.228
  703    HE2  HIS 109           HE2      HIS 109  56.332 -11.166  -2.512
  704    H    HIS 110           H        HIS 110  59.224  -6.955  -0.915
  705    HA   HIS 110           HA       HIS 110  60.463  -4.460  -1.202
  706    HB2  HIS 110           HB1      HIS 110  59.586  -4.937   1.436
  707    HB3  HIS 110           HB2      HIS 110  61.334  -5.187   1.449
  708    HD1  HIS 110           HD1      HIS 110  62.848  -3.150   1.064
  709    HD2  HIS 110           HD2      HIS 110  58.790  -2.276   0.895
  710    HE1  HIS 110           HE1      HIS 110  62.698  -0.640   1.113
  711    HE2  HIS 110           HE2      HIS 110  60.218  -0.106   1.009
  712    H    HIS 111           H        HIS 111  62.649  -4.661  -1.583
  713    HA   HIS 111           HA       HIS 111  64.601  -5.693  -2.126
  714    HB2  HIS 111           HB1      HIS 111  63.875  -6.662   0.462
  715    HB3  HIS 111           HB2      HIS 111  64.580  -7.999  -0.450
  716    HD1  HIS 111           HD1      HIS 111  67.070  -8.060  -0.659
  717    HD2  HIS 111           HD2      HIS 111  65.680  -4.368   0.647
  718    HE1  HIS 111           HE1      HIS 111  69.125  -6.745  -0.049
  719    HE2  HIS 111           HE2      HIS 111  68.276  -4.488   0.749
  720    H    HIS 112           H        HIS 112  65.509  -8.084  -2.596
  721    HA   HIS 112           HA       HIS 112  64.098  -9.012  -4.824
  722    HB2  HIS 112           HB1      HIS 112  66.330 -10.172  -3.170
  723    HB3  HIS 112           HB2      HIS 112  65.644 -11.070  -4.528
  724    HD1  HIS 112           HD1      HIS 112  67.224 -10.885  -6.416
  725    HD2  HIS 112           HD2      HIS 112  66.791  -7.274  -4.408
  726    HE1  HIS 112           HE1      HIS 112  68.605  -9.228  -7.708
  727    HE2  HIS 112           HE2      HIS 112  68.340  -7.020  -6.483
  Start of MODEL   25
    1    H1   MET  18           H        MET  18 -60.794  34.919  -9.836
    2    HA   MET  18           HA       MET  18 -61.897  33.930 -12.377
    3    HB2  MET  18           HB1      MET  18 -59.902  35.008 -13.506
    4    HB3  MET  18           HB2      MET  18 -61.155  36.114 -12.925
    5    HG2  MET  18           HG1      MET  18 -59.781  37.128 -11.477
    6    HG3  MET  18           HG2      MET  18 -59.058  35.602 -10.966
    7    HE1  MET  18           HE1      MET  18 -57.158  38.578 -11.735
    8    HE2  MET  18           HE2      MET  18 -57.333  38.778 -13.478
    9    HE3  MET  18           HE3      MET  18 -58.764  38.740 -12.446
   10    H    LEU  19           H        LEU  19 -61.272  31.910 -12.712
   11    HA   LEU  19           HA       LEU  19 -58.549  31.090 -12.451
   12    HB2  LEU  19           HB1      LEU  19 -59.213  29.168 -10.852
   13    HB3  LEU  19           HB2      LEU  19 -58.860  30.773 -10.189
   14    HG   LEU  19           HG       LEU  19 -61.694  30.329 -10.787
   15   HD11  LEU  19          HD11      LEU  19 -62.006  28.941  -8.730
   16   HD12  LEU  19          HD12      LEU  19 -60.269  28.639  -8.743
   17   HD13  LEU  19          HD13      LEU  19 -61.269  28.092 -10.089
   18   HD21  LEU  19          HD21      LEU  19 -60.018  31.474  -8.589
   19   HD22  LEU  19          HD22      LEU  19 -61.729  31.137  -8.324
   20   HD23  LEU  19          HD23      LEU  19 -61.237  32.260  -9.593
   21    H    VAL  20           H        VAL  20 -58.132  29.439 -13.804
   22    HA   VAL  20           HA       VAL  20 -60.442  28.121 -15.063
   23    HB   VAL  20           HB       VAL  20 -59.045  27.717 -16.997
   24   HG11  VAL  20          HG11      VAL  20 -60.216  29.893 -16.770
   25   HG12  VAL  20          HG12      VAL  20 -58.726  30.587 -16.126
   26   HG13  VAL  20          HG13      VAL  20 -58.773  29.975 -17.781
   27   HG21  VAL  20          HG21      VAL  20 -56.903  27.325 -16.114
   28   HG22  VAL  20          HG22      VAL  20 -56.745  28.819 -17.037
   29   HG23  VAL  20          HG23      VAL  20 -56.870  28.879 -15.279
   30    H    LEU  21           H        LEU  21 -60.510  25.908 -15.292
   31    HA   LEU  21           HA       LEU  21 -58.982  24.398 -13.381
   32    HB2  LEU  21           HB1      LEU  21 -61.442  24.108 -14.800
   33    HB3  LEU  21           HB2      LEU  21 -60.434  22.685 -15.114
   34    HG   LEU  21           HG       LEU  21 -60.286  23.079 -12.352
   35   HD11  LEU  21          HD11      LEU  21 -62.696  23.022 -11.727
   36   HD12  LEU  21          HD12      LEU  21 -63.086  23.492 -13.382
   37   HD13  LEU  21          HD13      LEU  21 -62.148  24.578 -12.356
   38   HD21  LEU  21          HD21      LEU  21 -60.323  20.950 -13.611
   39   HD22  LEU  21          HD22      LEU  21 -62.051  21.178 -13.890
   40   HD23  LEU  21          HD23      LEU  21 -61.443  20.965 -12.249
   41    H    ASP  22           H        ASP  22 -57.256  23.137 -13.729
   42    HA   ASP  22           HA       ASP  22 -56.625  21.875 -16.168
   43    HB2  ASP  22           HB1      ASP  22 -55.924  24.609 -16.101
   44    HB3  ASP  22           HB2      ASP  22 -54.419  23.706 -15.883
   45    HD2  ASP  22           HD       ASP  22 -55.201  22.060 -19.060
   46    H    PHE  23           H        PHE  23 -55.377  20.189 -15.691
   47    HA   PHE  23           HA       PHE  23 -53.242  20.361 -13.769
   48    HB2  PHE  23           HB1      PHE  23 -55.853  19.113 -13.094
   49    HB3  PHE  23           HB2      PHE  23 -54.406  18.220 -12.624
   50    HD1  PHE  23           HD1      PHE  23 -56.670  20.716 -11.641
   51    HD2  PHE  23           HD2      PHE  23 -52.569  19.607 -11.376
   52    HE1  PHE  23           HE1      PHE  23 -56.418  22.136  -9.647
   53    HE2  PHE  23           HE2      PHE  23 -52.311  21.024  -9.382
   54    HZ   PHE  23           HZ       PHE  23 -54.237  22.291  -8.514
   55    H    ASN  24           H        ASN  24 -55.361  18.067 -15.480
   56    HA   ASN  24           HA       ASN  24 -54.909  16.284 -16.817
   57    HB2  ASN  24           HB1      ASN  24 -52.843  18.218 -17.360
   58    HB3  ASN  24           HB2      ASN  24 -52.182  16.583 -17.491
   59   HD21  ASN  24          HD21      ASN  24 -52.238  15.828 -19.467
   60   HD22  ASN  24          HD22      ASN  24 -53.465  16.128 -20.645
   61    H    ASN  25           H        ASN  25 -53.153  14.450 -17.143
   62    HA   ASN  25           HA       ASN  25 -51.779  13.848 -14.638
   63    HB2  ASN  25           HB1      ASN  25 -52.793  11.457 -14.850
   64    HB3  ASN  25           HB2      ASN  25 -53.751  12.739 -14.098
   65   HD21  ASN  25          HD21      ASN  25 -53.210  11.054 -17.145
   66   HD22  ASN  25          HD22      ASN  25 -54.815  11.260 -17.751
   67    H    ILE  26           H        ILE  26 -50.375  11.915 -14.833
   68    HA   ILE  26           HA       ILE  26 -49.611  11.308 -17.602
   69    HB   ILE  26           HB       ILE  26 -47.232  11.497 -17.034
   70   HG12  ILE  26          HG11      ILE  26 -48.186  12.758 -14.452
   71   HG13  ILE  26          HG12      ILE  26 -47.527  11.119 -14.580
   72   HG21  ILE  26          HG21      ILE  26 -47.082  13.900 -17.080
   73   HG22  ILE  26          HG22      ILE  26 -48.463  13.390 -18.049
   74   HG23  ILE  26          HG23      ILE  26 -48.716  14.051 -16.433
   75   HD11  ILE  26          HD11      ILE  26 -45.386  11.935 -15.216
   76   HD12  ILE  26          HD12      ILE  26 -46.000  13.582 -15.372
   77   HD13  ILE  26          HD13      ILE  26 -45.901  12.823 -13.783
   78    H    ARG  27           H        ARG  27 -47.902   9.489 -17.595
   79    HA   ARG  27           HA       ARG  27 -48.313   7.605 -15.396
   80    HB2  ARG  27           HB1      ARG  27 -50.034   7.121 -17.110
   81    HB3  ARG  27           HB2      ARG  27 -48.746   6.881 -18.299
   82    HG2  ARG  27           HG1      ARG  27 -47.909   4.965 -17.127
   83    HG3  ARG  27           HG2      ARG  27 -49.027   5.254 -15.784
   84    HD2  ARG  27           HD1      ARG  27 -50.393   3.807 -16.820
   85    HD3  ARG  27           HD2      ARG  27 -50.720   5.142 -17.933
   86    HE   ARG  27           HE       ARG  27 -49.646   3.965 -19.559
   87   HH11  ARG  27          HH11      ARG  27 -48.559   2.809 -16.461
   88   HH12  ARG  27          HH12      ARG  27 -47.586   1.540 -17.130
   89   HH21  ARG  27          HH21      ARG  27 -48.370   2.299 -20.451
   90   HH22  ARG  27          HH22      ARG  27 -47.479   1.251 -19.400
   91    H    SER  28           H        SER  28 -46.523   6.497 -14.880
   92    HA   SER  28           HA       SER  28 -44.533   5.637 -16.648
   93    HB2  SER  28           HB1      SER  28 -44.351   8.411 -16.061
   94    HB3  SER  28           HB2      SER  28 -43.037   7.603 -15.189
   95    HG   SER  28           HG       SER  28 -43.599   7.314 -17.958
   96    H    SER  29           H        SER  29 -42.803   4.551 -15.589
   97    HA   SER  29           HA       SER  29 -42.318   4.574 -12.835
   98    HB2  SER  29           HB1      SER  29 -43.366   2.200 -12.436
   99    HB3  SER  29           HB2      SER  29 -44.376   3.649 -12.282
  100    HG   SER  29           HG       SER  29 -45.302   1.934 -13.581
  101    H    ALA  30           H        ALA  30 -40.215   4.161 -13.105
  102    HA   ALA  30           HA       ALA  30 -39.410   1.528 -13.978
  103    HB1  ALA  30           HB1      ALA  30 -38.189   2.063 -15.850
  104    HB2  ALA  30           HB2      ALA  30 -39.564   3.156 -16.019
  105    HB3  ALA  30           HB3      ALA  30 -38.029   3.759 -15.394
  106    H    ASP  31           H        ASP  31 -37.891   4.734 -13.577
  107    HA   ASP  31           HA       ASP  31 -36.145   5.436 -12.297
  108    HB2  ASP  31           HB1      ASP  31 -37.713   3.617 -10.570
  109    HB3  ASP  31           HB2      ASP  31 -36.063   3.945 -10.027
  110    HD2  ASP  31           HD       ASP  31 -38.182   7.266 -10.404
  111    H    LEU  32           H        LEU  32 -34.478   4.797 -13.663
  112    HA   LEU  32           HA       LEU  32 -32.824   2.651 -12.620
  113    HB2  LEU  32           HB1      LEU  32 -32.478   1.641 -14.840
  114    HB3  LEU  32           HB2      LEU  32 -34.141   1.473 -14.253
  115    HG   LEU  32           HG       LEU  32 -33.932   3.830 -15.875
  116   HD11  LEU  32          HD11      LEU  32 -33.172   3.034 -17.920
  117   HD12  LEU  32          HD12      LEU  32 -33.257   1.349 -17.409
  118   HD13  LEU  32          HD13      LEU  32 -31.990   2.398 -16.775
  119   HD21  LEU  32          HD21      LEU  32 -35.384   1.208 -16.214
  120   HD22  LEU  32          HD22      LEU  32 -35.692   2.673 -17.147
  121   HD23  LEU  32          HD23      LEU  32 -35.997   2.653 -15.410
  122    H    HIS  33           H        HIS  33 -32.447   5.394 -12.475
  123    HA   HIS  33           HA       HIS  33 -29.873   5.636 -13.711
  124    HB2  HIS  33           HB1      HIS  33 -32.231   7.007 -14.860
  125    HB3  HIS  33           HB2      HIS  33 -30.803   8.021 -14.616
  126    HD1  HIS  33           HD1      HIS  33 -28.508   6.368 -15.472
  127    HD2  HIS  33           HD2      HIS  33 -32.159   6.223 -17.450
  128    HE1  HIS  33           HE1      HIS  33 -27.992   5.498 -17.774
  129    HE2  HIS  33           HE2      HIS  33 -30.223   5.409 -18.984
  130    H    GLY  34           H        GLY  34 -28.562   6.964 -12.559
  131    HA2  GLY  34           HA2      GLY  34 -28.906   9.259 -11.263
  132    HA3  GLY  34           HA3      GLY  34 -29.709   8.153 -10.157
  133    HA1  GLY  34           HA1      GLY  34 -28.338   8.725 -11.679
  134    H    ALA  35           H        ALA  35 -27.348   9.780  -9.690
  135    HA   ALA  35           HA       ALA  35 -25.690   7.737  -8.531
  136    HB1  ALA  35           HB1      ALA  35 -24.416   9.557 -10.566
  137    HB2  ALA  35           HB2      ALA  35 -23.638   8.271  -9.644
  138    HB3  ALA  35           HB3      ALA  35 -24.842   7.873 -10.868
  139    H    ARG  36           H        ARG  36 -23.927   8.677  -7.206
  140    HA   ARG  36           HA       ARG  36 -24.864  11.130  -5.953
  141    HB2  ARG  36           HB1      ARG  36 -22.723   9.146  -5.155
  142    HB3  ARG  36           HB2      ARG  36 -23.177  10.568  -4.205
  143    HG2  ARG  36           HG1      ARG  36 -25.542   9.622  -4.181
  144    HG3  ARG  36           HG2      ARG  36 -24.815   8.123  -4.784
  145    HD2  ARG  36           HD1      ARG  36 -23.153   8.688  -2.704
  146    HD3  ARG  36           HD2      ARG  36 -24.685   9.345  -2.111
  147    HE   ARG  36           HE       ARG  36 -25.427   7.210  -1.817
  148   HH11  ARG  36          HH11      ARG  36 -22.779   7.164  -4.076
  149   HH12  ARG  36          HH12      ARG  36 -22.719   5.435  -4.171
  150   HH21  ARG  36          HH21      ARG  36 -25.358   4.933  -1.932
  151   HH22  ARG  36          HH22      ARG  36 -24.186   4.167  -2.951
  152    H    LYS  37           H        LYS  37 -21.753   9.842  -7.129
  153    HA   LYS  37           HA       LYS  37 -19.896  10.863  -7.954
  154    HB2  LYS  37           HB1      LYS  37 -21.943  11.859  -9.374
  155    HB3  LYS  37           HB2      LYS  37 -21.363  13.356  -8.630
  156    HG2  LYS  37           HG1      LYS  37 -19.020  12.427  -9.481
  157    HG3  LYS  37           HG2      LYS  37 -20.076  11.626 -10.657
  158    HD2  LYS  37           HD1      LYS  37 -19.626  13.616 -11.739
  159    HD3  LYS  37           HD2      LYS  37 -21.140  13.998 -10.901
  160    HE2  LYS  37           HE1      LYS  37 -19.916  15.836 -10.299
  161    HE3  LYS  37           HE2      LYS  37 -19.480  14.739  -8.980
  162    HZ1  LYS  37           HZ1      LYS  37 -17.430  14.237  -9.999
  163    HZ2  LYS  37           HZ2      LYS  37 -17.584  15.920 -10.082
  164    HZ3  LYS  37           HZ3      LYS  37 -17.871  14.975 -11.456
  165    H    GLY  38           H        GLY  38 -18.737  11.169  -6.080
  166    HA2  GLY  38           HA2      GLY  38 -17.843  13.636  -5.362
  167    HA3  GLY  38           HA3      GLY  38 -19.251  13.402  -4.337
  168    HA1  GLY  38           HA1      GLY  38 -17.609  12.807  -5.548
  169    H    SER  39           H        SER  39 -16.778  13.756  -3.213
  170    HA   SER  39           HA       SER  39 -15.292  12.866  -1.736
  171    HB2  SER  39           HB1      SER  39 -17.136  10.518  -1.363
  172    HB3  SER  39           HB2      SER  39 -16.175  11.390  -0.156
  173    HG   SER  39           HG       SER  39 -18.608  12.141  -1.358
  174    H    GLN  40           H        GLN  40 -13.745  12.412  -3.377
  175    HA   GLN  40           HA       GLN  40 -13.632  10.033  -4.858
  176    HB2  GLN  40           HB1      GLN  40 -11.581  12.066  -4.025
  177    HB3  GLN  40           HB2      GLN  40 -11.097  10.604  -4.899
  178    HG2  GLN  40           HG1      GLN  40 -13.350  12.065  -6.096
  179    HG3  GLN  40           HG2      GLN  40 -11.811  12.936  -6.072
  180   HE21  GLN  40          HE21      GLN  40 -11.903  12.783  -8.388
  181   HE22  GLN  40          HE22      GLN  40 -11.374  11.340  -9.176
  182    H    CYS  41           H        CYS  41 -11.665  10.911  -2.011
  183    HA   CYS  41           HA       CYS  41 -11.997   8.311  -0.844
  184    HB2  CYS  41           HB1      CYS  41  -9.716   7.562  -0.952
  185    HB3  CYS  41           HB2      CYS  41 -10.273   7.881  -2.597
  186    H    LEU  42           H        LEU  42 -11.533   8.307   1.313
  187    HA   LEU  42           HA       LEU  42 -10.899  10.892   2.485
  188    HB2  LEU  42           HB1      LEU  42 -12.627   8.835   3.165
  189    HB3  LEU  42           HB2      LEU  42 -11.311   8.695   4.343
  190    HG   LEU  42           HG       LEU  42 -11.753  11.294   4.609
  191   HD11  LEU  42          HD11      LEU  42 -14.448  11.251   4.590
  192   HD12  LEU  42          HD12      LEU  42 -14.104  10.264   3.169
  193   HD13  LEU  42          HD13      LEU  42 -13.464  11.903   3.279
  194   HD21  LEU  42          HD21      LEU  42 -13.145   8.955   5.850
  195   HD22  LEU  42          HD22      LEU  42 -13.529  10.599   6.361
  196   HD23  LEU  42          HD23      LEU  42 -11.881   9.990   6.517
  197    H    SER  43           H        SER  43  -9.446   7.789   1.988
  198    HA   SER  43           HA       SER  43  -6.910   8.769   2.933
  199    HB2  SER  43           HB1      SER  43  -8.531   7.400   4.779
  200    HB3  SER  43           HB2      SER  43  -7.321   6.221   4.244
  201    HG   SER  43           HG       SER  43  -6.685   8.839   5.131
  202    H    ASP  44           H        ASP  44  -5.344   6.669   2.959
  203    HA   ASP  44           HA       ASP  44  -5.260   5.817   0.253
  204    HB2  ASP  44           HB1      ASP  44  -3.248   4.678   0.817
  205    HB3  ASP  44           HB2      ASP  44  -3.272   6.163   1.777
  206    HD2  ASP  44           HD       ASP  44  -3.538   2.701   3.668
  207    H    THR  45           H        THR  45  -6.588   4.464   3.154
  208    HA   THR  45           HA       THR  45  -6.672   1.755   2.507
  209    HB   THR  45           HB       THR  45  -8.570   1.575   4.047
  210    HG1  THR  45           HG1      THR  45  -9.675   3.332   4.714
  211   HG21  THR  45          HG21      THR  45  -6.020   2.532   4.656
  212   HG22  THR  45          HG22      THR  45  -7.161   1.773   5.766
  213   HG23  THR  45          HG23      THR  45  -7.121   3.529   5.606
  214    H    ASP  46           H        ASP  46  -8.497   4.417   1.258
  215    HA   ASP  46           HA       ASP  46 -10.710   2.960   0.246
  216    HB2  ASP  46           HB1      ASP  46 -10.035   5.628   0.450
  217    HB3  ASP  46           HB2      ASP  46  -9.954   5.334  -1.292
  218    HD2  ASP  46           HD       ASP  46 -13.349   5.591  -1.470
  219    H    CYS  47           H        CYS  47  -7.486   3.564  -0.921
  220    HA   CYS  47           HA       CYS  47  -8.006   2.776  -3.626
  221    HB2  CYS  47           HB1      CYS  47  -5.968   4.111  -2.362
  222    HB3  CYS  47           HB2      CYS  47  -5.240   2.531  -2.663
  223    H    ASN  48           H        ASN  48  -6.195   1.003  -4.394
  224    HA   ASN  48           HA       ASN  48  -7.270  -1.471  -3.812
  225    HB2  ASN  48           HB1      ASN  48  -4.757  -0.513  -5.075
  226    HB3  ASN  48           HB2      ASN  48  -4.787  -2.204  -4.558
  227   HD21  ASN  48          HD21      ASN  48  -6.606   0.171  -6.435
  228   HD22  ASN  48          HD22      ASN  48  -7.238  -0.958  -7.580
  229    H    THR  49           H        THR  49  -3.935  -0.675  -2.875
  230    HA   THR  49           HA       THR  49  -4.199  -1.082  -0.127
  231    HB   THR  49           HB       THR  49  -4.784  -3.357  -0.485
  232    HG1  THR  49           HG1      THR  49  -1.981  -3.384   0.018
  233   HG21  THR  49          HG21      THR  49  -4.013  -3.491  -2.837
  234   HG22  THR  49          HG22      THR  49  -3.522  -4.886  -1.877
  235   HG23  THR  49          HG23      THR  49  -2.353  -3.622  -2.258
  236    H    ARG  50           H        ARG  50  -2.116  -1.665  -2.928
  237    HA   ARG  50           HA       ARG  50   0.223  -0.853  -1.365
  238    HB2  ARG  50           HB1      ARG  50   0.047  -1.973  -4.174
  239    HB3  ARG  50           HB2      ARG  50   1.539  -1.653  -3.277
  240    HG2  ARG  50           HG1      ARG  50  -0.386  -3.411  -1.905
  241    HG3  ARG  50           HG2      ARG  50   0.323  -4.059  -3.394
  242    HD2  ARG  50           HD1      ARG  50   2.555  -3.760  -2.558
  243    HD3  ARG  50           HD2      ARG  50   1.948  -2.877  -1.150
  244    HE   ARG  50           HE       ARG  50   2.059  -5.723  -1.480
  245   HH11  ARG  50          HH11      ARG  50   0.416  -3.107   0.126
  246   HH12  ARG  50          HH12      ARG  50  -0.115  -4.084   1.455
  247   HH21  ARG  50          HH21      ARG  50   1.365  -7.019   0.263
  248   HH22  ARG  50          HH22      ARG  50   0.426  -6.309   1.532
  249    H    LYS  51           H        LYS  51  -1.769   1.091  -2.063
  250    HA   LYS  51           HA       LYS  51  -0.049   2.974  -3.466
  251    HB2  LYS  51           HB1      LYS  51  -2.906   2.439  -4.322
  252    HB3  LYS  51           HB2      LYS  51  -1.866   3.730  -4.945
  253    HG2  LYS  51           HG1      LYS  51  -0.359   2.130  -5.930
  254    HG3  LYS  51           HG2      LYS  51  -1.266   0.791  -5.204
  255    HD2  LYS  51           HD1      LYS  51  -3.286   1.601  -6.498
  256    HD3  LYS  51           HD2      LYS  51  -2.181   2.686  -7.362
  257    HE2  LYS  51           HE1      LYS  51  -1.780   1.013  -8.785
  258    HE3  LYS  51           HE2      LYS  51  -0.935   0.199  -7.460
  259    HZ1  LYS  51           HZ1      LYS  51  -2.813  -1.051  -6.926
  260    HZ2  LYS  51           HZ2      LYS  51  -2.780  -1.073  -8.617
  261    HZ3  LYS  51           HZ3      LYS  51  -3.860  -0.055  -7.807
  262    H    PHE  52           H        PHE  52  -0.553   5.170  -3.050
  263    HA   PHE  52           HA       PHE  52  -2.292   5.538  -0.703
  264    HB2  PHE  52           HB1      PHE  52  -0.889   7.566  -0.245
  265    HB3  PHE  52           HB2      PHE  52  -0.017   6.036  -0.135
  266    HD1  PHE  52           HD1      PHE  52  -0.706   8.816  -2.506
  267    HD2  PHE  52           HD2      PHE  52   1.957   5.722  -1.302
  268    HE1  PHE  52           HE1      PHE  52   0.966   9.632  -4.117
  269    HE2  PHE  52           HE2      PHE  52   3.633   6.533  -2.909
  270    HZ   PHE  52           HZ       PHE  52   3.139   8.490  -4.319
  271    H    CYS  53           H        CYS  53  -3.438   7.574  -0.529
  272    HA   CYS  53           HA       CYS  53  -4.442   8.435  -3.131
  273    HB2  CYS  53           HB1      CYS  53  -5.576   8.058  -0.529
  274    HB3  CYS  53           HB2      CYS  53  -5.810   9.739  -1.009
  275    H    LEU  54           H        LEU  54  -2.863   9.824  -3.883
  276    HA   LEU  54           HA       LEU  54  -1.779  11.932  -2.285
  277    HB2  LEU  54           HB1      LEU  54  -0.427  11.083  -4.046
  278    HB3  LEU  54           HB2      LEU  54  -1.718  11.338  -5.231
  279    HG   LEU  54           HG       LEU  54  -1.099  13.863  -4.111
  280   HD11  LEU  54          HD11      LEU  54   1.048  12.603  -3.493
  281   HD12  LEU  54          HD12      LEU  54   1.202  14.129  -4.364
  282   HD13  LEU  54          HD13      LEU  54   1.380  12.600  -5.225
  283   HD21  LEU  54          HD21      LEU  54  -0.790  14.482  -6.336
  284   HD22  LEU  54          HD22      LEU  54  -1.911  13.124  -6.434
  285   HD23  LEU  54          HD23      LEU  54  -0.201  12.885  -6.799
  286    H    GLN  55           H        GLN  55  -2.589  13.888  -1.900
  287    HA   GLN  55           HA       GLN  55  -4.834  14.814  -3.568
  288    HB2  GLN  55           HB1      GLN  55  -5.515  16.129  -1.506
  289    HB3  GLN  55           HB2      GLN  55  -5.714  14.371  -1.415
  290    HG2  GLN  55           HG1      GLN  55  -4.391  14.226   0.354
  291    HG3  GLN  55           HG2      GLN  55  -3.111  15.130  -0.467
  292   HE21  GLN  55          HE21      GLN  55  -2.589  17.030   0.343
  293   HE22  GLN  55          HE22      GLN  55  -3.560  17.982   1.407
  294    HA   PRO  56           HA       PRO  56  -1.494  17.871  -4.267
  295    HB2  PRO  56           HB1      PRO  56  -2.282  18.462  -6.823
  296    HB3  PRO  56           HB2      PRO  56  -1.255  17.086  -6.414
  297    HG2  PRO  56           HG1      PRO  56  -4.218  17.180  -6.875
  298    HG3  PRO  56           HG2      PRO  56  -3.004  15.998  -7.494
  299    HD2  PRO  56           HD1      PRO  56  -4.634  15.459  -5.392
  300    HD3  PRO  56           HD2      PRO  56  -2.980  14.832  -5.506
  301    H    ARG  57           H        ARG  57  -1.602  20.161  -4.652
  302    HA   ARG  57           HA       ARG  57  -4.044  21.325  -3.635
  303    HB2  ARG  57           HB1      ARG  57  -1.381  21.944  -3.368
  304    HB3  ARG  57           HB2      ARG  57  -1.939  23.164  -4.521
  305    HG2  ARG  57           HG1      ARG  57  -2.149  24.126  -2.371
  306    HG3  ARG  57           HG2      ARG  57  -3.784  23.706  -2.908
  307    HD2  ARG  57           HD1      ARG  57  -3.816  21.733  -1.537
  308    HD3  ARG  57           HD2      ARG  57  -2.105  21.940  -1.137
  309    HE   ARG  57           HE       ARG  57  -3.569  24.224  -0.345
  310   HH11  ARG  57          HH11      ARG  57  -3.016  20.898   0.520
  311   HH12  ARG  57          HH12      ARG  57  -3.354  21.142   2.200
  312   HH21  ARG  57          HH21      ARG  57  -4.016  24.559   1.867
  313   HH22  ARG  57          HH22      ARG  57  -3.924  23.225   2.967
  314    H    ASP  58           H        ASP  58  -2.092  21.568  -6.591
  315    HA   ASP  58           HA       ASP  58  -3.919  23.358  -7.878
  316    HB2  ASP  58           HB1      ASP  58  -1.338  22.121  -8.472
  317    HB3  ASP  58           HB2      ASP  58  -2.398  22.199  -9.886
  318    HD2  ASP  58           HD       ASP  58  -2.499  25.793  -9.495
  319    H    GLU  59           H        GLU  59  -3.661  19.938  -7.535
  320    HA   GLU  59           HA       GLU  59  -5.774  19.572  -9.556
  321    HB2  GLU  59           HB1      GLU  59  -3.304  18.137  -9.059
  322    HB3  GLU  59           HB2      GLU  59  -4.703  17.056  -8.978
  323    HG2  GLU  59           HG1      GLU  59  -4.721  18.899 -11.264
  324    HG3  GLU  59           HG2      GLU  59  -3.390  17.733 -11.254
  325    HE2  GLU  59           HE       GLU  59  -7.021  16.450 -12.028
  326    H    LYS  60           H        LYS  60  -6.876  17.267  -8.990
  327    HA   LYS  60           HA       LYS  60  -7.971  17.649  -6.296
  328    HB2  LYS  60           HB1      LYS  60  -9.819  16.141  -7.157
  329    HB3  LYS  60           HB2      LYS  60  -9.688  17.729  -7.928
  330    HG2  LYS  60           HG1      LYS  60  -9.359  16.839  -9.938
  331    HG3  LYS  60           HG2      LYS  60  -8.106  15.748  -9.317
  332    HD2  LYS  60           HD1      LYS  60 -10.291  14.552  -8.286
  333    HD3  LYS  60           HD2      LYS  60 -10.993  15.274  -9.744
  334    HE2  LYS  60           HE1      LYS  60  -8.527  13.515  -9.703
  335    HE3  LYS  60           HE2      LYS  60 -10.163  12.968 -10.101
  336    HZ1  LYS  60           HZ1      LYS  60 -10.080  14.819 -11.857
  337    HZ2  LYS  60           HZ2      LYS  60  -9.225  13.391 -12.156
  338    HZ3  LYS  60           HZ3      LYS  60  -8.404  14.774 -11.630
  339    HA   PRO  61           HA       PRO  61  -6.296  13.905  -4.733
  340    HB2  PRO  61           HB1      PRO  61  -8.302  13.058  -3.070
  341    HB3  PRO  61           HB2      PRO  61  -7.266  14.442  -2.721
  342    HG2  PRO  61           HG1      PRO  61 -10.014  14.379  -3.922
  343    HG3  PRO  61           HG2      PRO  61  -9.359  15.451  -2.630
  344    HD2  PRO  61           HD1      PRO  61  -9.637  16.263  -5.205
  345    HD3  PRO  61           HD2      PRO  61  -8.322  16.827  -4.160
  346    H    PHE  62           H        PHE  62  -6.180  11.777  -5.248
  347    HA   PHE  62           HA       PHE  62  -8.413  10.183  -5.970
  348    HB2  PHE  62           HB1      PHE  62  -8.083   9.900  -8.309
  349    HB3  PHE  62           HB2      PHE  62  -8.136  11.641  -8.018
  350    HD1  PHE  62           HD1      PHE  62  -5.722  12.683  -7.458
  351    HD2  PHE  62           HD2      PHE  62  -6.451   9.175  -9.757
  352    HE1  PHE  62           HE1      PHE  62  -3.544  12.963  -8.570
  353    HE2  PHE  62           HE2      PHE  62  -4.275   9.450 -10.871
  354    HZ   PHE  62           HZ       PHE  62  -2.818  11.345 -10.278
  355    H    CYS  63           H        CYS  63  -7.541   8.085  -7.137
  356    HA   CYS  63           HA       CYS  63  -5.556   7.004  -5.390
  357    HB2  CYS  63           HB1      CYS  63  -7.413   6.003  -7.440
  358    HB3  CYS  63           HB2      CYS  63  -5.892   5.112  -7.350
  359    H    ALA  64           H        ALA  64  -3.430   7.033  -5.647
  360    HA   ALA  64           HA       ALA  64  -2.339   7.281  -8.373
  361    HB1  ALA  64           HB1      ALA  64  -1.554   8.753  -5.880
  362    HB2  ALA  64           HB2      ALA  64  -0.432   8.555  -7.227
  363    HB3  ALA  64           HB3      ALA  64  -1.960   9.400  -7.470
  364    H    THR  65           H        THR  65  -0.913   5.766  -8.928
  365    HA   THR  65           HA       THR  65  -0.368   3.530  -7.378
  366    HB   THR  65           HB       THR  65  -0.081   3.343  -9.730
  367    HG1  THR  65           HG1      THR  65   2.227   2.685  -9.806
  368   HG21  THR  65          HG21      THR  65   0.448   5.615 -10.317
  369   HG22  THR  65          HG22      THR  65   1.735   4.574 -10.924
  370   HG23  THR  65          HG23      THR  65   1.987   5.525  -9.461
  371    H    CYS  66           H        CYS  66   1.710   2.753  -6.558
  372    HA   CYS  66           HA       CYS  66   2.817   4.419  -4.634
  373    HB2  CYS  66           HB1      CYS  66   3.182   1.735  -5.549
  374    HB3  CYS  66           HB2      CYS  66   4.772   2.476  -5.352
  375    H    ARG  67           H        ARG  67   5.316   4.767  -4.517
  376    HA   ARG  67           HA       ARG  67   6.025   6.331  -6.891
  377    HB2  ARG  67           HB1      ARG  67   7.166   6.369  -4.086
  378    HB3  ARG  67           HB2      ARG  67   7.670   7.432  -5.409
  379    HG2  ARG  67           HG1      ARG  67   4.781   7.446  -4.854
  380    HG3  ARG  67           HG2      ARG  67   5.809   8.068  -3.551
  381    HD2  ARG  67           HD1      ARG  67   6.964   9.479  -5.350
  382    HD3  ARG  67           HD2      ARG  67   5.595   9.044  -6.384
  383    HE   ARG  67           HE       ARG  67   4.453  10.010  -4.093
  384   HH11  ARG  67          HH11      ARG  67   6.725  11.222  -6.436
  385   HH12  ARG  67          HH12      ARG  67   6.254  12.876  -6.231
  386   HH21  ARG  67          HH21      ARG  67   3.823  12.185  -3.816
  387   HH22  ARG  67          HH22      ARG  67   4.603  13.423  -4.740
  388    H    GLY  68           H        GLY  68   7.228   5.274  -8.330
  389    HA2  GLY  68           HA2      GLY  68   8.786   2.983  -7.731
  390    HA3  GLY  68           HA3      GLY  68   8.828   3.895  -9.234
  391    HA1  GLY  68           HA1      GLY  68   8.861   3.623  -7.126
  392    H    LEU  69           H        LEU  69  11.163   2.956  -8.611
  393    HA   LEU  69           HA       LEU  69  12.751   4.312  -6.756
  394    HB2  LEU  69           HB1      LEU  69  13.498   3.055  -9.402
  395    HB3  LEU  69           HB2      LEU  69  14.661   3.592  -8.177
  396    HG   LEU  69           HG       LEU  69  12.668   1.344  -7.925
  397   HD11  LEU  69          HD11      LEU  69  14.854   1.073  -9.239
  398   HD12  LEU  69          HD12      LEU  69  14.490  -0.106  -7.978
  399   HD13  LEU  69          HD13      LEU  69  15.649   1.186  -7.669
  400   HD21  LEU  69          HD21      LEU  69  13.867   0.985  -5.716
  401   HD22  LEU  69          HD22      LEU  69  12.727   2.329  -5.787
  402   HD23  LEU  69          HD23      LEU  69  14.460   2.636  -5.889
  403    H    ARG  70           H        ARG  70  11.547   5.294  -9.839
  404    HA   ARG  70           HA       ARG  70  13.443   7.486 -10.085
  405    HB2  ARG  70           HB1      ARG  70  11.020   6.938 -11.807
  406    HB3  ARG  70           HB2      ARG  70  12.431   7.928 -12.207
  407    HG2  ARG  70           HG1      ARG  70  13.066   6.098 -13.348
  408    HG3  ARG  70           HG2      ARG  70  13.643   5.574 -11.756
  409    HD2  ARG  70           HD1      ARG  70  11.991   4.026 -11.498
  410    HD3  ARG  70           HD2      ARG  70  10.812   4.998 -12.390
  411    HE   ARG  70           HE       ARG  70  12.499   2.957 -13.453
  412   HH11  ARG  70          HH11      ARG  70  10.902   5.956 -14.214
  413   HH12  ARG  70          HH12      ARG  70  10.806   5.624 -15.913
  414   HH21  ARG  70          HH21      ARG  70  12.379   2.509 -15.685
  415   HH22  ARG  70          HH22      ARG  70  11.646   3.663 -16.749
  416    H    ARG  71           H        ARG  71  10.289   6.883  -8.848
  417    HA   ARG  71           HA       ARG  71   9.271   9.534  -9.020
  418    HB2  ARG  71           HB1      ARG  71   8.533   7.114  -7.384
  419    HB3  ARG  71           HB2      ARG  71   7.712   8.666  -7.164
  420    HG2  ARG  71           HG1      ARG  71   7.854   7.113  -9.750
  421    HG3  ARG  71           HG2      ARG  71   6.469   7.175  -8.648
  422    HD2  ARG  71           HD1      ARG  71   6.576   9.730  -8.954
  423    HD3  ARG  71           HD2      ARG  71   7.615   9.371 -10.340
  424    HE   ARG  71           HE       ARG  71   5.303   7.820 -10.574
  425   HH11  ARG  71          HH11      ARG  71   6.259  11.167 -10.648
  426   HH12  ARG  71          HH12      ARG  71   4.980  11.644 -11.714
  427   HH21  ARG  71          HH21      ARG  71   3.615   8.436 -11.978
  428   HH22  ARG  71          HH22      ARG  71   3.476  10.089 -12.469
  429    H    ARG  72           H        ARG  72   9.411  11.222  -7.634
  430    HA   ARG  72           HA       ARG  72  11.529  11.195  -5.702
  431    HB2  ARG  72           HB1      ARG  72   9.487  13.381  -6.124
  432    HB3  ARG  72           HB2      ARG  72  11.117  13.533  -5.452
  433    HG2  ARG  72           HG1      ARG  72  10.510  12.750  -8.304
  434    HG3  ARG  72           HG2      ARG  72  10.919  14.387  -7.762
  435    HD2  ARG  72           HD1      ARG  72  12.998  13.116  -6.689
  436    HD3  ARG  72           HD2      ARG  72  12.639  11.975  -7.992
  437    HE   ARG  72           HE       ARG  72  12.686  14.508  -9.126
  438   HH11  ARG  72          HH11      ARG  72  14.882  12.352  -7.499
  439   HH12  ARG  72          HH12      ARG  72  16.283  12.946  -8.325
  440   HH21  ARG  72          HH21      ARG  72  14.524  15.299 -10.221
  441   HH22  ARG  72          HH22      ARG  72  16.079  14.622  -9.873
  442    H    CYS  73           H        CYS  73  11.362  11.575  -3.466
  443    HA   CYS  73           HA       CYS  73   8.763  11.535  -2.195
  444    HB2  CYS  73           HB1      CYS  73   9.025   9.504  -0.983
  445    HB3  CYS  73           HB2      CYS  73   9.318   9.123  -2.681
  446    H    GLN  74           H        GLN  74   9.131  11.353   0.303
  447    HA   GLN  74           HA       GLN  74  11.603  12.758   1.044
  448    HB2  GLN  74           HB1      GLN  74   9.627  14.323   0.737
  449    HB3  GLN  74           HB2      GLN  74   8.896  13.519   2.135
  450    HG2  GLN  74           HG1      GLN  74   9.896  15.106   3.341
  451    HG3  GLN  74           HG2      GLN  74  11.358  14.138   3.103
  452   HE21  GLN  74          HE21      GLN  74  12.746  14.693   1.303
  453   HE22  GLN  74          HE22      GLN  74  12.837  16.336   0.779
  454    H    ARG  75           H        ARG  75   8.786  10.915   2.119
  455    HA   ARG  75           HA       ARG  75  10.359  10.004   4.439
  456    HB2  ARG  75           HB1      ARG  75   7.345  10.118   4.174
  457    HB3  ARG  75           HB2      ARG  75   8.258   9.624   5.611
  458    HG2  ARG  75           HG1      ARG  75   8.555  11.724   6.293
  459    HG3  ARG  75           HG2      ARG  75   9.007  12.269   4.668
  460    HD2  ARG  75           HD1      ARG  75   6.602  12.288   4.039
  461    HD3  ARG  75           HD2      ARG  75   6.206  11.860   5.710
  462    HE   ARG  75           HE       ARG  75   6.958  14.444   4.724
  463   HH11  ARG  75          HH11      ARG  75   6.928  12.367   7.517
  464   HH12  ARG  75          HH12      ARG  75   6.959  13.676   8.653
  465   HH21  ARG  75          HH21      ARG  75   6.998  16.176   6.209
  466   HH22  ARG  75          HH22      ARG  75   6.998  15.842   7.907
  467    H    ASP  76           H        ASP  76  10.667   7.864   4.718
  468    HA   ASP  76           HA       ASP  76  10.409   6.078   2.611
  469    HB2  ASP  76           HB1      ASP  76  11.978   5.647   4.384
  470    HB3  ASP  76           HB2      ASP  76  10.675   5.557   5.576
  471    HD2  ASP  76           HD       ASP  76   9.770   2.337   4.518
  472    H    ALA  77           H        ALA  77   8.165   6.862   5.175
  473    HA   ALA  77           HA       ALA  77   6.428   4.660   4.896
  474    HB1  ALA  77           HB1      ALA  77   6.400   7.241   6.253
  475    HB2  ALA  77           HB2      ALA  77   4.803   6.710   5.721
  476    HB3  ALA  77           HB3      ALA  77   5.771   5.677   6.773
  477    H    MET  78           H        MET  78   6.875   7.529   3.011
  478    HA   MET  78           HA       MET  78   4.317   7.424   1.709
  479    HB2  MET  78           HB1      MET  78   6.862   8.942   1.109
  480    HB3  MET  78           HB2      MET  78   5.383   9.098   0.149
  481    HG2  MET  78           HG1      MET  78   4.178   9.806   2.216
  482    HG3  MET  78           HG2      MET  78   5.734   9.800   3.052
  483    HE1  MET  78           HE1      MET  78   3.890  10.921  -0.009
  484    HE2  MET  78           HE2      MET  78   4.364  12.598  -0.276
  485    HE3  MET  78           HE3      MET  78   5.408  11.289  -0.829
  486    H    CYS  79           H        CYS  79   7.451   6.029   1.213
  487    HA   CYS  79           HA       CYS  79   6.796   5.196  -1.505
  488    HB2  CYS  79           HB1      CYS  79   9.244   5.443   0.110
  489    HB3  CYS  79           HB2      CYS  79   9.195   4.007  -0.913
  490    H    CYS  80           H        CYS  80   6.596   3.054  -2.146
  491    HA   CYS  80           HA       CYS  80   5.217   1.319  -0.501
  492    HB2  CYS  80           HB1      CYS  80   6.521   1.171  -3.125
  493    HB3  CYS  80           HB2      CYS  80   6.442  -0.383  -2.294
  494    HA   PRO  81           HA       PRO  81   8.082  -0.778   2.073
  495    HB2  PRO  81           HB1      PRO  81   7.142  -3.350   2.040
  496    HB3  PRO  81           HB2      PRO  81   6.321  -2.024   2.862
  497    HG2  PRO  81           HG1      PRO  81   5.806  -3.187   0.145
  498    HG3  PRO  81           HG2      PRO  81   4.629  -2.746   1.439
  499    HD2  PRO  81           HD1      PRO  81   5.089  -1.169  -0.724
  500    HD3  PRO  81           HD2      PRO  81   4.696  -0.512   0.874
  501    H    GLY  82           H        GLY  82  10.094  -1.560   1.853
  502    HA2  GLY  82           HA2      GLY  82  11.530  -3.366   1.025
  503    HA3  GLY  82           HA3      GLY  82  10.673  -3.243  -0.506
  504    HA1  GLY  82           HA1      GLY  82  11.527  -2.531   1.306
  505    H    THR  83           H        THR  83  10.792  -0.183   0.050
  506    HA   THR  83           HA       THR  83  13.525   0.162  -1.001
  507    HB   THR  83           HB       THR  83  12.528   2.320  -2.009
  508    HG1  THR  83           HG1      THR  83  10.151   0.797  -1.584
  509   HG21  THR  83          HG21      THR  83  11.370   0.768  -3.850
  510   HG22  THR  83          HG22      THR  83  12.221  -0.481  -2.941
  511   HG23  THR  83          HG23      THR  83  13.120   0.857  -3.654
  512    H    LEU  84           H        LEU  84  14.245   2.554  -0.737
  513    HA   LEU  84           HA       LEU  84  13.431   3.589   1.887
  514    HB2  LEU  84           HB1      LEU  84  15.629   2.143   1.768
  515    HB3  LEU  84           HB2      LEU  84  16.311   3.644   1.122
  516    HG   LEU  84           HG       LEU  84  15.081   4.559   3.366
  517   HD11  LEU  84          HD11      LEU  84  15.803   2.958   5.164
  518   HD12  LEU  84          HD12      LEU  84  15.994   1.742   3.902
  519   HD13  LEU  84          HD13      LEU  84  14.408   2.448   4.212
  520   HD21  LEU  84          HD21      LEU  84  17.875   3.431   3.278
  521   HD22  LEU  84          HD22      LEU  84  17.281   4.740   4.299
  522   HD23  LEU  84          HD23      LEU  84  17.399   4.966   2.554
  523    H    CYS  85           H        CYS  85  13.224   5.750   1.982
  524    HA   CYS  85           HA       CYS  85  13.434   7.265  -0.438
  525    HB2  CYS  85           HB1      CYS  85  12.474   7.756   2.340
  526    HB3  CYS  85           HB2      CYS  85  12.911   9.164   1.372
  527    H    VAL  86           H        VAL  86  15.429   7.735  -1.147
  528    HA   VAL  86           HA       VAL  86  17.239   9.116   0.722
  529    HB   VAL  86           HB       VAL  86  18.077   7.198  -1.457
  530   HG11  VAL  86          HG11      VAL  86  19.564   9.091   0.294
  531   HG12  VAL  86          HG12      VAL  86  20.313   7.546  -0.114
  532   HG13  VAL  86          HG13      VAL  86  19.837   8.662  -1.394
  533   HG21  VAL  86          HG21      VAL  86  19.081   6.189   0.843
  534   HG22  VAL  86          HG22      VAL  86  17.564   6.876   1.422
  535   HG23  VAL  86          HG23      VAL  86  17.553   5.681   0.124
  536    H    ASN  87           H        ASN  87  18.332  10.882  -0.063
  537    HA   ASN  87           HA       ASN  87  18.698  12.720  -1.352
  538    HB2  ASN  87           HB1      ASN  87  18.401  10.714  -3.606
  539    HB3  ASN  87           HB2      ASN  87  19.082  12.337  -3.766
  540   HD21  ASN  87          HD21      ASN  87  20.340   9.794  -4.313
  541   HD22  ASN  87          HD22      ASN  87  21.739   9.711  -3.303
  542    H    ASP  88           H        ASP  88  15.983  12.091  -0.565
  543    HA   ASP  88           HA       ASP  88  13.882  12.910  -0.868
  544    HB2  ASP  88           HB1      ASP  88  14.871  14.577  -3.172
  545    HB3  ASP  88           HB2      ASP  88  13.612  14.952  -1.987
  546    HD2  ASP  88           HD       ASP  88  17.304  15.951  -1.171
  547    H    VAL  89           H        VAL  89  14.967  10.629  -2.461
  548    HA   VAL  89           HA       VAL  89  12.721  10.433  -4.304
  549    HB   VAL  89           HB       VAL  89  14.565  11.312  -5.688
  550   HG11  VAL  89          HG11      VAL  89  15.975   8.809  -4.780
  551   HG12  VAL  89          HG12      VAL  89  16.487   9.777  -6.163
  552   HG13  VAL  89          HG13      VAL  89  16.487  10.480  -4.545
  553   HG21  VAL  89          HG21      VAL  89  14.416   9.658  -7.460
  554   HG22  VAL  89          HG22      VAL  89  13.881   8.438  -6.303
  555   HG23  VAL  89          HG23      VAL  89  12.856   9.830  -6.654
  556    H    CYS  90           H        CYS  90  12.120   8.303  -4.797
  557    HA   CYS  90           HA       CYS  90  12.579   6.401  -2.784
  558    HB2  CYS  90           HB1      CYS  90  10.779   6.704  -4.851
  559    HB3  CYS  90           HB2      CYS  90  11.710   5.291  -5.355
  560    H    THR  91           H        THR  91  14.385   5.312  -2.417
  561    HA   THR  91           HA       THR  91  15.917   4.310  -4.726
  562    HB   THR  91           HB       THR  91  17.123   5.248  -2.117
  563    HG1  THR  91           HG1      THR  91  16.476   7.058  -3.252
  564   HG21  THR  91          HG21      THR  91  18.324   3.432  -3.357
  565   HG22  THR  91          HG22      THR  91  19.247   4.924  -3.179
  566   HG23  THR  91          HG23      THR  91  18.477   4.542  -4.718
  567    H    THR  92           H        THR  92  15.987   2.170  -4.770
  568    HA   THR  92           HA       THR  92  14.924   0.462  -2.884
  569    HB   THR  92           HB       THR  92  17.055  -0.931  -4.171
  570    HG1  THR  92           HG1      THR  92  16.773  -0.289  -6.293
  571   HG21  THR  92          HG21      THR  92  15.156  -1.967  -5.416
  572   HG22  THR  92          HG22      THR  92  14.083  -0.775  -4.680
  573   HG23  THR  92          HG23      THR  92  14.931  -1.942  -3.667
  574    H    MET  93           H        MET  93  15.731  -0.783  -1.215
  575    HA   MET  93           HA       MET  93  17.690   0.315   0.423
  576    HB2  MET  93           HB1      MET  93  15.807  -1.496   0.844
  577    HB3  MET  93           HB2      MET  93  17.148  -2.617   0.563
  578    HG2  MET  93           HG1      MET  93  18.135  -0.681   2.344
  579    HG3  MET  93           HG2      MET  93  16.514  -1.098   2.907
  580    HE1  MET  93           HE1      MET  93  17.205  -2.056   5.092
  581    HE2  MET  93           HE2      MET  93  18.360  -3.362   5.351
  582    HE3  MET  93           HE3      MET  93  18.929  -1.765   4.862
  583    H    GLU  94           H        GLU  94  17.919  -2.555  -1.676
  584    HA   GLU  94           HA       GLU  94  20.565  -3.213  -1.169
  585    HB2  GLU  94           HB1      GLU  94  18.879  -3.531  -3.652
  586    HB3  GLU  94           HB2      GLU  94  20.516  -4.191  -3.518
  587    HG2  GLU  94           HG1      GLU  94  19.769  -5.457  -1.496
  588    HG3  GLU  94           HG2      GLU  94  18.121  -4.917  -1.852
  589    HE2  GLU  94           HE       GLU  94  18.717  -8.152  -3.444
  590    H    ASP  95           H        ASP  95  19.221  -0.787  -3.321
  591    HA   ASP  95           HA       ASP  95  21.713  -0.174  -4.594
  592    HB2  ASP  95           HB1      ASP  95  18.955   0.558  -4.901
  593    HB3  ASP  95           HB2      ASP  95  19.938   2.027  -4.814
  594    HD2  ASP  95           HD       ASP  95  20.881  -0.428  -7.793
  595    H    ALA  96           H        ALA  96  20.003   0.937  -1.770
  596    HA   ALA  96           HA       ALA  96  21.756   3.228  -1.416
  597    HB1  ALA  96           HB1      ALA  96  20.414   3.651   0.608
  598    HB2  ALA  96           HB2      ALA  96  19.423   3.506  -0.845
  599    HB3  ALA  96           HB3      ALA  96  19.515   2.166   0.298
  600    H    THR  97           H        THR  97  23.684   1.808  -1.328
  601    HA   THR  97           HA       THR  97  24.623   1.524   1.301
  602    HB   THR  97           HB       THR  97  24.923  -1.165   0.687
  603    HG1  THR  97           HG1      THR  97  23.209  -1.764  -0.384
  604   HG21  THR  97          HG21      THR  97  22.652  -0.430   2.435
  605   HG22  THR  97          HG22      THR  97  24.212   0.290   2.834
  606   HG23  THR  97          HG23      THR  97  24.043  -1.464   2.758
  607    H    GLU  98           H        GLU  98  26.753   1.787   1.173
  608    HA   GLU  98           HA       GLU  98  28.078   1.290  -1.385
  609    HB2  GLU  98           HB1      GLU  98  28.516   3.097   0.915
  610    HB3  GLU  98           HB2      GLU  98  29.981   2.464   0.148
  611    HG2  GLU  98           HG1      GLU  98  29.408   3.402  -1.956
  612    HG3  GLU  98           HG2      GLU  98  27.780   3.804  -1.394
  613    HE2  GLU  98           HE       GLU  98  29.425   6.900  -1.072
  614    H    ASN  99           H        ASN  99  29.829  -0.050  -1.633
  615    HA   ASN  99           HA       ASN  99  31.279  -1.253   0.450
  616    HB2  ASN  99           HB1      ASN  99  30.362  -3.634   0.014
  617    HB3  ASN  99           HB2      ASN  99  29.449  -2.564   1.086
  618   HD21  ASN  99          HD21      ASN  99  27.437  -1.892   0.521
  619   HD22  ASN  99          HD22      ASN  99  26.602  -2.446  -0.886
  620    H    LEU 100           H        LEU 100  33.157  -1.346  -0.587
  621    HA   LEU 100           HA       LEU 100  33.433  -1.624  -3.383
  622    HB2  LEU 100           HB1      LEU 100  35.290  -1.662  -1.043
  623    HB3  LEU 100           HB2      LEU 100  35.883  -2.213  -2.620
  624    HG   LEU 100           HG       LEU 100  36.442   0.139  -2.154
  625   HD11  LEU 100          HD11      LEU 100  35.813  -0.898  -4.484
  626   HD12  LEU 100          HD12      LEU 100  36.119   0.830  -4.311
  627   HD13  LEU 100          HD13      LEU 100  34.462   0.230  -4.374
  628   HD21  LEU 100          HD21      LEU 100  34.427   0.659  -0.820
  629   HD22  LEU 100          HD22      LEU 100  33.467   0.614  -2.300
  630   HD23  LEU 100          HD23      LEU 100  34.727   1.834  -2.101
  631    H    TYR 101           H        TYR 101  35.129  -3.388  -4.170
  632    HA   TYR 101           HA       TYR 101  34.570  -6.011  -3.044
  633    HB2  TYR 101           HB1      TYR 101  33.508  -5.027  -5.651
  634    HB3  TYR 101           HB2      TYR 101  34.098  -6.690  -5.583
  635    HD1  TYR 101           HD1      TYR 101  31.253  -4.727  -5.218
  636    HD2  TYR 101           HD2      TYR 101  33.232  -8.038  -3.423
  637    HE1  TYR 101           HE1      TYR 101  29.120  -5.463  -4.239
  638    HE2  TYR 101           HE2      TYR 101  31.104  -8.784  -2.440
  639    HH   TYR 101           HH       TYR 101  28.890  -7.662  -1.778
  640    H    PHE 102           H        PHE 102  35.989  -7.656  -3.798
  641    HA   PHE 102           HA       PHE 102  38.130  -6.930  -5.611
  642    HB2  PHE 102           HB1      PHE 102  39.937  -7.278  -4.065
  643    HB3  PHE 102           HB2      PHE 102  38.856  -6.059  -3.385
  644    HD1  PHE 102           HD1      PHE 102  40.153  -9.442  -3.017
  645    HD2  PHE 102           HD2      PHE 102  37.451  -6.546  -1.458
  646    HE1  PHE 102           HE1      PHE 102  39.942 -10.757  -0.948
  647    HE2  PHE 102           HE2      PHE 102  37.237  -7.855   0.613
  648    HZ   PHE 102           HZ       PHE 102  38.483  -9.964   0.870
  649    H    GLN 103           H        GLN 103  39.220  -8.700  -6.458
  650    HA   GLN 103           HA       GLN 103  38.012 -11.302  -5.815
  651    HB2  GLN 103           HB1      GLN 103  38.677 -12.008  -8.063
  652    HB3  GLN 103           HB2      GLN 103  37.659 -10.560  -8.117
  653    HG2  GLN 103           HG1      GLN 103  39.708  -9.176  -8.356
  654    HG3  GLN 103           HG2      GLN 103  40.647 -10.673  -8.449
  655   HE21  GLN 103          HE21      GLN 103  38.265  -8.690 -10.049
  656   HE22  GLN 103          HE22      GLN 103  38.440  -9.397 -11.615
  657    H    SER 104           H        SER 104  39.733 -13.076  -6.800
  658    HA   SER 104           HA       SER 104  42.285 -12.539  -5.429
  659    HB2  SER 104           HB1      SER 104  40.294 -14.510  -4.794
  660    HB3  SER 104           HB2      SER 104  41.768 -15.328  -5.341
  661    HG   SER 104           HG       SER 104  42.407 -14.968  -3.368
  662    H    LEU 105           H        LEU 105  44.120 -13.688  -6.227
  663    HA   LEU 105           HA       LEU 105  43.880 -14.315  -9.080
  664    HB2  LEU 105           HB1      LEU 105  45.767 -12.874  -7.518
  665    HB3  LEU 105           HB2      LEU 105  46.586 -14.294  -8.191
  666    HG   LEU 105           HG       LEU 105  46.824 -12.252  -9.576
  667   HD11  LEU 105          HD11      LEU 105  47.216 -13.960 -10.981
  668   HD12  LEU 105          HD12      LEU 105  45.652 -13.516 -11.663
  669   HD13  LEU 105          HD13      LEU 105  45.763 -14.832 -10.494
  670   HD21  LEU 105          HD21      LEU 105  43.986 -12.557 -10.439
  671   HD22  LEU 105          HD22      LEU 105  45.058 -11.162 -10.563
  672   HD23  LEU 105          HD23      LEU 105  44.355 -11.598  -9.004
  673    H    GLU 106           H        GLU 106  45.197 -15.603  -6.058
  674    HA   GLU 106           HA       GLU 106  45.730 -17.716  -5.406
  675    HB2  GLU 106           HB1      GLU 106  43.579 -18.012  -7.325
  676    HB3  GLU 106           HB2      GLU 106  44.672 -19.405  -7.368
  677    HG2  GLU 106           HG1      GLU 106  44.384 -19.751  -4.978
  678    HG3  GLU 106           HG2      GLU 106  43.333 -18.330  -4.898
  679    HE2  GLU 106           HE       GLU 106  41.117 -21.123  -5.190
  680    H    HIS 107           H        HIS 107  46.641 -19.921  -6.420
  681    HA   HIS 107           HA       HIS 107  48.548 -19.230  -8.547
  682    HB2  HIS 107           HB1      HIS 107  50.357 -20.322  -7.360
  683    HB3  HIS 107           HB2      HIS 107  49.670 -19.049  -6.345
  684    HD1  HIS 107           HD1      HIS 107  48.053 -19.874  -4.377
  685    HD2  HIS 107           HD2      HIS 107  50.339 -22.819  -6.212
  686    HE1  HIS 107           HE1      HIS 107  47.997 -21.841  -2.812
  687    HE2  HIS 107           HE2      HIS 107  49.393 -23.641  -3.932
  688    H    HIS 108           H        HIS 108  49.569 -21.165  -9.534
  689    HA   HIS 108           HA       HIS 108  47.659 -23.407  -9.589
  690    HB2  HIS 108           HB1      HIS 108  49.411 -22.211 -11.733
  691    HB3  HIS 108           HB2      HIS 108  48.699 -23.818 -11.900
  692    HD1  HIS 108           HD1      HIS 108  47.726 -20.193 -11.741
  693    HD2  HIS 108           HD2      HIS 108  45.998 -23.888 -12.521
  694    HE1  HIS 108           HE1      HIS 108  45.446 -19.685 -12.673
  695    HE2  HIS 108           HE2      HIS 108  44.389 -21.945 -13.151
  696    H    HIS 109           H        HIS 109  48.456 -25.533  -9.724
  697    HA   HIS 109           HA       HIS 109  51.121 -25.845  -8.556
  698    HB2  HIS 109           HB1      HIS 109  48.690 -27.617  -8.708
  699    HB3  HIS 109           HB2      HIS 109  50.271 -28.274  -8.277
  700    HD1  HIS 109           HD1      HIS 109  51.455 -26.832  -6.184
  701    HD2  HIS 109           HD2      HIS 109  47.314 -26.817  -6.515
  702    HE1  HIS 109           HE1      HIS 109  50.603 -26.161  -3.916
  703    HE2  HIS 109           HE2      HIS 109  48.071 -26.150  -4.117
  704    H    HIS 110           H        HIS 110  49.175 -27.736 -10.874
  705    HA   HIS 110           HA       HIS 110  51.144 -27.599 -12.926
  706    HB2  HIS 110           HB1      HIS 110  51.906 -29.891 -12.930
  707    HB3  HIS 110           HB2      HIS 110  52.269 -29.168 -11.361
  708    HD1  HIS 110           HD1      HIS 110  51.531 -32.291 -12.331
  709    HD2  HIS 110           HD2      HIS 110  49.466 -29.717  -9.807
  710    HE1  HIS 110           HE1      HIS 110  50.100 -33.770 -10.886
  711    HE2  HIS 110           HE2      HIS 110  48.837 -32.197  -9.342
  712    H    HIS 111           H        HIS 111  50.629 -29.592 -14.542
  713    HA   HIS 111           HA       HIS 111  47.707 -29.884 -14.682
  714    HB2  HIS 111           HB1      HIS 111  49.585 -28.827 -16.777
  715    HB3  HIS 111           HB2      HIS 111  48.098 -29.651 -17.254
  716    HD1  HIS 111           HD1      HIS 111  45.822 -28.522 -16.488
  717    HD2  HIS 111           HD2      HIS 111  49.236 -26.218 -15.941
  718    HE1  HIS 111           HE1      HIS 111  44.998 -26.175 -16.116
  719    HE2  HIS 111           HE2      HIS 111  47.083 -24.765 -15.784
  720    H    HIS 112           H        HIS 112  50.712 -30.915 -16.309
  721    HA   HIS 112           HA       HIS 112  49.560 -33.601 -16.592
  722    HB2  HIS 112           HB1      HIS 112  50.742 -32.083 -18.480
  723    HB3  HIS 112           HB2      HIS 112  52.158 -32.943 -17.867
  724    HD1  HIS 112           HD1      HIS 112  48.938 -33.528 -19.687
  725    HD2  HIS 112           HD2      HIS 112  52.291 -35.661 -18.477
  726    HE1  HIS 112           HE1      HIS 112  48.796 -35.737 -20.881
  727    HE2  HIS 112           HE2      HIS 112  50.846 -37.040 -20.144
  Start of MODEL   26
    1    H1   MET  18           H        MET  18 -77.040  14.740 -11.147
    2    HA   MET  18           HA       MET  18 -78.452  16.084  -9.377
    3    HB2  MET  18           HB1      MET  18 -79.095  13.171  -8.858
    4    HB3  MET  18           HB2      MET  18 -79.533  14.527  -7.809
    5    HG2  MET  18           HG1      MET  18 -80.662  15.399 -10.065
    6    HG3  MET  18           HG2      MET  18 -80.714  13.662 -10.377
    7    HE1  MET  18           HE1      MET  18 -83.467  15.406 -10.146
    8    HE2  MET  18           HE2      MET  18 -83.952  15.778  -8.492
    9    HE3  MET  18           HE3      MET  18 -82.508  16.525  -9.176
   10    H    LEU  19           H        LEU  19 -76.387  13.288  -9.706
   11    HA   LEU  19           HA       LEU  19 -74.863  14.182  -7.348
   12    HB2  LEU  19           HB1      LEU  19 -75.771  11.551  -8.207
   13    HB3  LEU  19           HB2      LEU  19 -74.024  11.606  -7.911
   14    HG   LEU  19           HG       LEU  19 -76.050  12.527  -5.882
   15   HD11  LEU  19          HD11      LEU  19 -76.263  10.083  -6.610
   16   HD12  LEU  19          HD12      LEU  19 -76.063  10.414  -4.890
   17   HD13  LEU  19          HD13      LEU  19 -74.691   9.853  -5.845
   18   HD21  LEU  19          HD21      LEU  19 -73.698  13.320  -5.690
   19   HD22  LEU  19          HD22      LEU  19 -73.187  11.637  -5.564
   20   HD23  LEU  19          HD23      LEU  19 -74.235  12.336  -4.329
   21    H    VAL  20           H        VAL  20 -73.498  15.588  -8.420
   22    HA   VAL  20           HA       VAL  20 -72.157  14.996 -10.836
   23    HB   VAL  20           HB       VAL  20 -70.729  16.907 -10.338
   24   HG11  VAL  20          HG11      VAL  20 -73.019  17.275 -11.182
   25   HG12  VAL  20          HG12      VAL  20 -73.580  17.455  -9.519
   26   HG13  VAL  20          HG13      VAL  20 -72.435  18.614 -10.195
   27   HG21  VAL  20          HG21      VAL  20 -70.142  16.896  -8.129
   28   HG22  VAL  20          HG22      VAL  20 -71.412  18.120  -8.095
   29   HG23  VAL  20          HG23      VAL  20 -71.765  16.469  -7.584
   30    H    LEU  21           H        LEU  21 -70.135  14.194 -11.253
   31    HA   LEU  21           HA       LEU  21 -69.078  12.250  -9.554
   32    HB2  LEU  21           HB1      LEU  21 -68.053  13.686 -11.976
   33    HB3  LEU  21           HB2      LEU  21 -66.985  12.600 -11.071
   34    HG   LEU  21           HG       LEU  21 -69.633  11.730 -12.215
   35   HD11  LEU  21          HD11      LEU  21 -66.879  11.502 -13.422
   36   HD12  LEU  21          HD12      LEU  21 -68.219  12.467 -14.042
   37   HD13  LEU  21          HD13      LEU  21 -68.332  10.707 -14.028
   38   HD21  LEU  21          HD21      LEU  21 -67.873  10.546 -10.390
   39   HD22  LEU  21          HD22      LEU  21 -67.597   9.720 -11.923
   40   HD23  LEU  21          HD23      LEU  21 -69.220   9.781 -11.235
   41    H    ASP  22           H        ASP  22 -67.633  12.270  -7.939
   42    HA   ASP  22           HA       ASP  22 -66.835  14.762  -6.798
   43    HB2  ASP  22           HB1      ASP  22 -65.763  13.422  -5.070
   44    HB3  ASP  22           HB2      ASP  22 -67.374  12.781  -5.423
   45    HD2  ASP  22           HD       ASP  22 -66.094   9.810  -6.662
   46    H    PHE  23           H        PHE  23 -65.117  15.935  -7.302
   47    HA   PHE  23           HA       PHE  23 -63.057  14.825  -9.014
   48    HB2  PHE  23           HB1      PHE  23 -64.236  17.310  -8.829
   49    HB3  PHE  23           HB2      PHE  23 -62.674  17.568  -8.050
   50    HD1  PHE  23           HD1      PHE  23 -60.611  17.448  -9.276
   51    HD2  PHE  23           HD2      PHE  23 -64.338  16.700 -11.191
   52    HE1  PHE  23           HE1      PHE  23 -59.517  17.641 -11.471
   53    HE2  PHE  23           HE2      PHE  23 -63.250  16.892 -13.391
   54    HZ   PHE  23           HZ       PHE  23 -60.836  17.362 -13.532
   55    H    ASN  24           H        ASN  24 -60.802  14.955  -8.545
   56    HA   ASN  24           HA       ASN  24 -60.168  15.112  -5.675
   57    HB2  ASN  24           HB1      ASN  24 -60.247  12.762  -7.000
   58    HB3  ASN  24           HB2      ASN  24 -58.579  13.242  -7.340
   59   HD21  ASN  24          HD21      ASN  24 -60.607  11.757  -5.149
   60   HD22  ASN  24          HD22      ASN  24 -59.541  11.712  -3.789
   61    H    ASN  25           H        ASN  25 -57.620  15.083  -5.463
   62    HA   ASN  25           HA       ASN  25 -56.606  17.110  -7.345
   63    HB2  ASN  25           HB1      ASN  25 -55.061  17.727  -5.401
   64    HB3  ASN  25           HB2      ASN  25 -56.768  18.155  -5.235
   65   HD21  ASN  25          HD21      ASN  25 -57.571  17.772  -3.315
   66   HD22  ASN  25          HD22      ASN  25 -57.098  16.505  -2.240
   67    H    ILE  26           H        ILE  26 -54.486  16.958  -8.085
   68    HA   ILE  26           HA       ILE  26 -53.296  14.285  -7.807
   69    HB   ILE  26           HB       ILE  26 -52.834  16.359  -9.954
   70   HG12  ILE  26          HG11      ILE  26 -53.898  14.027 -11.070
   71   HG13  ILE  26          HG12      ILE  26 -54.849  14.299  -9.601
   72   HG21  ILE  26          HG21      ILE  26 -51.680  14.482 -11.121
   73   HG22  ILE  26          HG22      ILE  26 -50.856  15.044  -9.668
   74   HG23  ILE  26          HG23      ILE  26 -51.794  13.551  -9.627
   75   HD11  ILE  26          HD11      ILE  26 -55.412  15.416 -11.983
   76   HD12  ILE  26          HD12      ILE  26 -55.869  16.115 -10.430
   77   HD13  ILE  26          HD13      ILE  26 -54.420  16.682 -11.261
   78    H    ARG  27           H        ARG  27 -51.869  14.330  -6.171
   79    HA   ARG  27           HA       ARG  27 -50.286  16.631  -5.544
   80    HB2  ARG  27           HB1      ARG  27 -49.357  15.337  -3.779
   81    HB3  ARG  27           HB2      ARG  27 -51.067  14.888  -3.892
   82    HG2  ARG  27           HG1      ARG  27 -49.957  13.035  -5.533
   83    HG3  ARG  27           HG2      ARG  27 -48.660  13.275  -4.349
   84    HD2  ARG  27           HD1      ARG  27 -49.746  11.980  -2.901
   85    HD3  ARG  27           HD2      ARG  27 -51.082  13.140  -2.903
   86    HE   ARG  27           HE       ARG  27 -51.457  11.614  -5.153
   87   HH11  ARG  27          HH11      ARG  27 -51.192  11.017  -1.733
   88   HH12  ARG  27          HH12      ARG  27 -52.219   9.622  -1.765
   89   HH21  ARG  27          HH21      ARG  27 -52.811   9.779  -5.208
   90   HH22  ARG  27          HH22      ARG  27 -53.139   8.919  -3.742
   91    H    SER  28           H        SER  28 -48.073  16.925  -5.803
   92    HA   SER  28           HA       SER  28 -46.504  14.979  -7.259
   93    HB2  SER  28           HB1      SER  28 -45.882  16.662  -9.040
   94    HB3  SER  28           HB2      SER  28 -47.537  16.036  -9.145
   95    HG   SER  28           HG       SER  28 -47.714  18.218  -9.350
   96    H    SER  29           H        SER  29 -44.552  14.980  -6.381
   97    HA   SER  29           HA       SER  29 -43.296  17.497  -5.610
   98    HB2  SER  29           HB1      SER  29 -43.166  17.116  -3.378
   99    HB3  SER  29           HB2      SER  29 -44.578  16.084  -3.672
  100    HG   SER  29           HG       SER  29 -43.219  14.300  -3.799
  101    H    ALA  30           H        ALA  30 -41.246  17.535  -6.247
  102    HA   ALA  30           HA       ALA  30 -40.004  15.039  -7.128
  103    HB1  ALA  30           HB1      ALA  30 -39.338  17.928  -7.641
  104    HB2  ALA  30           HB2      ALA  30 -38.314  16.590  -8.162
  105    HB3  ALA  30           HB3      ALA  30 -39.958  16.735  -8.785
  106    H    ASP  31           H        ASP  31 -38.265  14.146  -6.177
  107    HA   ASP  31           HA       ASP  31 -37.462  15.119  -3.595
  108    HB2  ASP  31           HB1      ASP  31 -35.887  13.125  -3.686
  109    HB3  ASP  31           HB2      ASP  31 -37.614  12.761  -3.792
  110    HD2  ASP  31           HD       ASP  31 -36.685  10.871  -6.523
  111    H    LEU  32           H        LEU  32 -35.080  15.204  -3.039
  112    HA   LEU  32           HA       LEU  32 -33.586  16.546  -5.196
  113    HB2  LEU  32           HB1      LEU  32 -34.384  17.508  -2.598
  114    HB3  LEU  32           HB2      LEU  32 -32.618  17.487  -2.740
  115    HG   LEU  32           HG       LEU  32 -33.260  18.698  -5.063
  116   HD11  LEU  32          HD11      LEU  32 -35.163  19.928  -5.018
  117   HD12  LEU  32          HD12      LEU  32 -35.165  20.070  -3.260
  118   HD13  LEU  32          HD13      LEU  32 -35.709  18.576  -4.025
  119   HD21  LEU  32          HD21      LEU  32 -33.062  20.858  -3.508
  120   HD22  LEU  32          HD22      LEU  32 -31.686  19.820  -3.879
  121   HD23  LEU  32          HD23      LEU  32 -32.543  19.634  -2.349
  122    H    HIS  33           H        HIS  33 -31.395  16.150  -5.347
  123    HA   HIS  33           HA       HIS  33 -30.467  13.790  -3.880
  124    HB2  HIS  33           HB1      HIS  33 -29.681  15.085  -6.476
  125    HB3  HIS  33           HB2      HIS  33 -28.572  13.977  -5.664
  126    HD1  HIS  33           HD1      HIS  33 -30.577  11.843  -4.700
  127    HD2  HIS  33           HD2      HIS  33 -30.555  13.482  -8.518
  128    HE1  HIS  33           HE1      HIS  33 -31.722  10.150  -6.166
  129    HE2  HIS  33           HE2      HIS  33 -31.708  11.151  -8.500
  130    H    GLY  34           H        GLY  34 -28.924  16.763  -5.127
  131    HA2  GLY  34           HA2      GLY  34 -27.889  18.348  -3.614
  132    HA3  GLY  34           HA3      GLY  34 -27.546  17.008  -2.530
  133    HA1  GLY  34           HA1      GLY  34 -27.797  17.975  -4.407
  134    H    ALA  35           H        ALA  35 -25.356  17.247  -2.399
  135    HA   ALA  35           HA       ALA  35 -23.867  16.575  -4.834
  136    HB1  ALA  35           HB1      ALA  35 -23.562  18.907  -4.780
  137    HB2  ALA  35           HB2      ALA  35 -23.332  18.918  -3.031
  138    HB3  ALA  35           HB3      ALA  35 -22.092  18.230  -4.078
  139    H    ARG  36           H        ARG  36 -23.217  17.351  -1.408
  140    HA   ARG  36           HA       ARG  36 -21.991  16.278   0.182
  141    HB2  ARG  36           HB1      ARG  36 -22.880  13.801  -1.316
  142    HB3  ARG  36           HB2      ARG  36 -22.279  13.858   0.347
  143    HG2  ARG  36           HG1      ARG  36 -24.730  15.376  -0.512
  144    HG3  ARG  36           HG2      ARG  36 -24.792  13.690   0.028
  145    HD2  ARG  36           HD1      ARG  36 -24.051  14.225   2.197
  146    HD3  ARG  36           HD2      ARG  36 -23.470  15.815   1.684
  147    HE   ARG  36           HE       ARG  36 -26.249  15.665   1.269
  148   HH11  ARG  36          HH11      ARG  36 -23.910  15.846   3.842
  149   HH12  ARG  36          HH12      ARG  36 -24.988  16.644   4.940
  150   HH21  ARG  36          HH21      ARG  36 -27.676  16.715   2.705
  151   HH22  ARG  36          HH22      ARG  36 -27.129  17.137   4.293
  152    H    LYS  37           H        LYS  37 -19.997  17.120  -0.551
  153    HA   LYS  37           HA       LYS  37 -18.330  15.186  -2.024
  154    HB2  LYS  37           HB1      LYS  37 -18.554  18.145  -2.152
  155    HB3  LYS  37           HB2      LYS  37 -16.925  17.464  -2.285
  156    HG2  LYS  37           HG1      LYS  37 -18.473  15.901  -3.996
  157    HG3  LYS  37           HG2      LYS  37 -19.041  17.562  -4.241
  158    HD2  LYS  37           HD1      LYS  37 -16.526  18.174  -4.366
  159    HD3  LYS  37           HD2      LYS  37 -16.290  16.436  -4.633
  160    HE2  LYS  37           HE1      LYS  37 -16.430  17.544  -6.776
  161    HE3  LYS  37           HE2      LYS  37 -17.872  16.548  -6.534
  162    HZ1  LYS  37           HZ1      LYS  37 -18.078  18.984  -7.387
  163    HZ2  LYS  37           HZ2      LYS  37 -17.959  19.375  -5.746
  164    HZ3  LYS  37           HZ3      LYS  37 -19.210  18.372  -6.288
  165    H    GLY  38           H        GLY  38 -16.422  14.543  -1.148
  166    HA2  GLY  38           HA2      GLY  38 -15.245  15.963   1.082
  167    HA3  GLY  38           HA3      GLY  38 -15.953  14.411   1.507
  168    HA1  GLY  38           HA1      GLY  38 -15.069  15.858   0.224
  169    H    SER  39           H        SER  39 -13.364  14.649   2.018
  170    HA   SER  39           HA       SER  39 -11.501  14.162   0.028
  171    HB2  SER  39           HB1      SER  39 -11.664  13.521   2.944
  172    HB3  SER  39           HB2      SER  39 -10.379  12.759   1.989
  173    HG   SER  39           HG       SER  39  -9.381  14.606   1.868
  174    H    GLN  40           H        GLN  40 -10.746  12.374  -1.029
  175    HA   GLN  40           HA       GLN  40 -12.557  10.122  -1.173
  176    HB2  GLN  40           HB1      GLN  40 -10.380  11.242  -2.817
  177    HB3  GLN  40           HB2      GLN  40 -10.507   9.476  -2.844
  178    HG2  GLN  40           HG1      GLN  40 -12.612   9.495  -3.804
  179    HG3  GLN  40           HG2      GLN  40 -12.936  11.155  -3.284
  180   HE21  GLN  40          HE21      GLN  40 -11.748  12.871  -4.342
  181   HE22  GLN  40          HE22      GLN  40 -11.266  12.678  -5.989
  182    H    CYS  41           H        CYS  41  -9.198  10.727  -0.242
  183    HA   CYS  41           HA       CYS  41  -9.242   8.300   1.369
  184    HB2  CYS  41           HB1      CYS  41  -7.008   7.602   0.500
  185    HB3  CYS  41           HB2      CYS  41  -8.310   7.457  -0.681
  186    H    LEU  42           H        LEU  42  -7.809   8.328   3.107
  187    HA   LEU  42           HA       LEU  42  -6.785  10.983   3.766
  188    HB2  LEU  42           HB1      LEU  42  -8.081   8.951   5.223
  189    HB3  LEU  42           HB2      LEU  42  -6.425   9.037   5.849
  190    HG   LEU  42           HG       LEU  42  -8.375  11.338   5.711
  191   HD11  LEU  42          HD11      LEU  42  -7.355   9.792   8.090
  192   HD12  LEU  42          HD12      LEU  42  -8.961   9.626   7.381
  193   HD13  LEU  42          HD13      LEU  42  -8.477  11.153   8.118
  194   HD21  LEU  42          HD21      LEU  42  -6.420  12.096   7.417
  195   HD22  LEU  42          HD22      LEU  42  -6.462  12.522   5.705
  196   HD23  LEU  42          HD23      LEU  42  -5.489  11.155   6.250
  197    H    SER  43           H        SER  43  -5.708   7.727   3.129
  198    HA   SER  43           HA       SER  43  -3.020   8.602   2.716
  199    HB2  SER  43           HB1      SER  43  -1.889   7.507   4.471
  200    HB3  SER  43           HB2      SER  43  -3.253   8.316   5.265
  201    HG   SER  43           HG       SER  43  -2.807   5.972   5.740
  202    H    ASP  44           H        ASP  44  -1.575   6.465   2.517
  203    HA   ASP  44           HA       ASP  44  -2.526   5.064   0.311
  204    HB2  ASP  44           HB1      ASP  44  -0.573   3.750   0.433
  205    HB3  ASP  44           HB2      ASP  44  -0.115   5.309   1.131
  206    HD2  ASP  44           HD       ASP  44  -0.033   3.879   4.382
  207    H    THR  45           H        THR  45  -2.952   4.466   3.702
  208    HA   THR  45           HA       THR  45  -3.584   1.747   3.683
  209    HB   THR  45           HB       THR  45  -5.147   3.535   5.481
  210    HG1  THR  45           HG1      THR  45  -2.312   3.303   5.475
  211   HG21  THR  45          HG21      THR  45  -4.477   1.864   7.146
  212   HG22  THR  45          HG22      THR  45  -3.474   1.061   5.937
  213   HG23  THR  45          HG23      THR  45  -5.227   1.103   5.744
  214    H    ASP  46           H        ASP  46  -5.410   4.506   2.633
  215    HA   ASP  46           HA       ASP  46  -7.985   3.318   2.682
  216    HB2  ASP  46           HB1      ASP  46  -7.704   5.741   2.585
  217    HB3  ASP  46           HB2      ASP  46  -6.915   5.600   1.008
  218    HD2  ASP  46           HD       ASP  46 -10.848   5.425   1.173
  219    H    CYS  47           H        CYS  47  -5.327   3.220   0.440
  220    HA   CYS  47           HA       CYS  47  -6.965   1.956  -1.620
  221    HB2  CYS  47           HB1      CYS  47  -4.524   3.488  -1.580
  222    HB3  CYS  47           HB2      CYS  47  -4.244   1.942  -2.382
  223    H    ASN  48           H        ASN  48  -7.322  -0.150  -1.412
  224    HA   ASN  48           HA       ASN  48  -5.732  -1.877   0.180
  225    HB2  ASN  48           HB1      ASN  48  -8.041  -2.413  -0.063
  226    HB3  ASN  48           HB2      ASN  48  -7.926  -2.392  -1.828
  227   HD21  ASN  48          HD21      ASN  48  -8.595  -4.442  -2.207
  228   HD22  ASN  48          HD22      ASN  48  -7.719  -5.848  -1.717
  229    H    THR  49           H        THR  49  -5.819  -1.123  -3.241
  230    HA   THR  49           HA       THR  49  -4.164  -3.281  -4.086
  231    HB   THR  49           HB       THR  49  -3.895  -1.044  -5.853
  232    HG1  THR  49           HG1      THR  49  -6.088  -0.573  -6.186
  233   HG21  THR  49          HG21      THR  49  -5.543  -2.628  -7.173
  234   HG22  THR  49          HG22      THR  49  -5.142  -3.750  -5.873
  235   HG23  THR  49          HG23      THR  49  -3.865  -3.090  -6.893
  236    H    ARG  50           H        ARG  50  -2.103  -2.508  -5.462
  237    HA   ARG  50           HA       ARG  50  -0.221  -1.609  -3.481
  238    HB2  ARG  50           HB1      ARG  50   0.118  -2.382  -6.388
  239    HB3  ARG  50           HB2      ARG  50   1.454  -1.985  -5.297
  240    HG2  ARG  50           HG1      ARG  50   1.164  -3.907  -4.013
  241    HG3  ARG  50           HG2      ARG  50  -0.483  -4.159  -4.612
  242    HD2  ARG  50           HD1      ARG  50   0.236  -5.395  -6.327
  243    HD3  ARG  50           HD2      ARG  50   1.410  -4.154  -6.789
  244    HE   ARG  50           HE       ARG  50   2.506  -5.407  -4.604
  245   HH11  ARG  50          HH11      ARG  50   1.412  -6.370  -7.765
  246   HH12  ARG  50          HH12      ARG  50   2.538  -7.679  -7.900
  247   HH21  ARG  50          HH21      ARG  50   3.994  -7.128  -4.770
  248   HH22  ARG  50          HH22      ARG  50   4.007  -8.109  -6.195
  249    H    LYS  51           H        LYS  51  -1.640   0.506  -3.538
  250    HA   LYS  51           HA       LYS  51  -0.044   2.464  -4.990
  251    HB2  LYS  51           HB1      LYS  51  -3.068   2.372  -5.147
  252    HB3  LYS  51           HB2      LYS  51  -2.046   3.675  -5.776
  253    HG2  LYS  51           HG1      LYS  51  -1.015   2.143  -7.362
  254    HG3  LYS  51           HG2      LYS  51  -1.991   0.812  -6.713
  255    HD2  LYS  51           HD1      LYS  51  -4.042   2.181  -7.317
  256    HD3  LYS  51           HD2      LYS  51  -2.942   3.243  -8.214
  257    HE2  LYS  51           HE1      LYS  51  -2.995   1.858  -9.959
  258    HE3  LYS  51           HE2      LYS  51  -2.349   0.563  -8.940
  259    HZ1  LYS  51           HZ1      LYS  51  -4.696   0.177  -8.195
  260    HZ2  LYS  51           HZ2      LYS  51  -4.381  -0.209  -9.811
  261    HZ3  LYS  51           HZ3      LYS  51  -5.196   1.223  -9.427
  262    H    PHE  52           H        PHE  52  -0.385   4.674  -4.193
  263    HA   PHE  52           HA       PHE  52  -1.232   4.659  -1.373
  264    HB2  PHE  52           HB1      PHE  52   0.397   6.380  -0.934
  265    HB3  PHE  52           HB2      PHE  52   1.199   5.045  -1.766
  266    HD1  PHE  52           HD1      PHE  52   0.246   8.535  -1.956
  267    HD2  PHE  52           HD2      PHE  52   1.851   5.246  -4.131
  268    HE1  PHE  52           HE1      PHE  52   1.085  10.084  -3.673
  269    HE2  PHE  52           HE2      PHE  52   2.692   6.791  -5.852
  270    HZ   PHE  52           HZ       PHE  52   2.310   9.213  -5.624
  271    H    CYS  53           H        CYS  53  -1.796   6.954  -0.590
  272    HA   CYS  53           HA       CYS  53  -3.818   7.997  -2.419
  273    HB2  CYS  53           HB1      CYS  53  -4.596   7.461  -0.200
  274    HB3  CYS  53           HB2      CYS  53  -3.327   8.447   0.529
  275    H    LEU  54           H        LEU  54  -2.931   9.409  -3.820
  276    HA   LEU  54           HA       LEU  54  -0.916  11.303  -2.971
  277    HB2  LEU  54           HB1      LEU  54  -1.084  10.099  -5.247
  278    HB3  LEU  54           HB2      LEU  54  -2.312  11.319  -5.624
  279    HG   LEU  54           HG       LEU  54   0.191  12.457  -4.629
  280   HD11  LEU  54          HD11      LEU  54   0.925  11.980  -7.226
  281   HD12  LEU  54          HD12      LEU  54   0.263  10.426  -6.718
  282   HD13  LEU  54          HD13      LEU  54   1.579  11.164  -5.805
  283   HD21  LEU  54          HD21      LEU  54  -1.868  12.962  -6.693
  284   HD22  LEU  54          HD22      LEU  54  -0.252  13.596  -7.003
  285   HD23  LEU  54          HD23      LEU  54  -1.118  14.067  -5.541
  286    H    GLN  55           H        GLN  55  -1.256  13.338  -2.346
  287    HA   GLN  55           HA       GLN  55  -3.920  14.507  -2.815
  288    HB2  GLN  55           HB1      GLN  55  -2.144  14.876  -0.391
  289    HB3  GLN  55           HB2      GLN  55  -3.709  15.658  -0.654
  290    HG2  GLN  55           HG1      GLN  55  -4.551  13.175  -0.896
  291    HG3  GLN  55           HG2      GLN  55  -3.099  12.839   0.056
  292   HE21  GLN  55          HE21      GLN  55  -4.310  12.158   1.822
  293   HE22  GLN  55          HE22      GLN  55  -5.163  13.267   2.834
  294    HA   PRO  56           HA       PRO  56  -0.912  17.300  -4.849
  295    HB2  PRO  56           HB1      PRO  56  -2.649  18.091  -6.812
  296    HB3  PRO  56           HB2      PRO  56  -1.691  16.613  -6.898
  297    HG2  PRO  56           HG1      PRO  56  -4.541  16.984  -6.040
  298    HG3  PRO  56           HG2      PRO  56  -3.833  15.738  -7.133
  299    HD2  PRO  56           HD1      PRO  56  -4.454  15.230  -4.540
  300    HD3  PRO  56           HD2      PRO  56  -3.079  14.471  -5.361
  301    H    ARG  57           H        ARG  57  -0.791  19.546  -4.836
  302    HA   ARG  57           HA       ARG  57  -2.626  20.860  -3.032
  303    HB2  ARG  57           HB1      ARG  57  -0.160  21.199  -2.924
  304    HB3  ARG  57           HB2      ARG  57  -0.244  22.006  -4.496
  305    HG2  ARG  57           HG1      ARG  57  -1.142  23.908  -3.648
  306    HG3  ARG  57           HG2      ARG  57  -2.024  23.045  -2.378
  307    HD2  ARG  57           HD1      ARG  57   0.979  23.279  -2.338
  308    HD3  ARG  57           HD2      ARG  57  -0.070  24.535  -1.665
  309    HE   ARG  57           HE       ARG  57  -0.867  22.094  -0.580
  310   HH11  ARG  57          HH11      ARG  57   1.892  24.216  -0.533
  311   HH12  ARG  57          HH12      ARG  57   2.390  23.746   1.058
  312   HH21  ARG  57          HH21      ARG  57  -0.221  21.465   1.515
  313   HH22  ARG  57          HH22      ARG  57   1.189  22.180   2.222
  314    H    ASP  58           H        ASP  58  -2.046  20.700  -6.443
  315    HA   ASP  58           HA       ASP  58  -3.670  23.053  -6.992
  316    HB2  ASP  58           HB1      ASP  58  -2.083  21.152  -8.714
  317    HB3  ASP  58           HB2      ASP  58  -3.207  22.322  -9.419
  318    HD2  ASP  58           HD       ASP  58  -0.010  23.954  -9.283
  319    H    GLU  59           H        GLU  59  -3.976  19.624  -6.812
  320    HA   GLU  59           HA       GLU  59  -6.715  19.828  -7.879
  321    HB2  GLU  59           HB1      GLU  59  -4.558  18.084  -8.652
  322    HB3  GLU  59           HB2      GLU  59  -5.907  17.133  -8.015
  323    HG2  GLU  59           HG1      GLU  59  -7.324  17.714  -9.705
  324    HG3  GLU  59           HG2      GLU  59  -6.519  19.265  -9.983
  325    HE2  GLU  59           HE       GLU  59  -5.546  16.308 -12.263
  326    H    LYS  60           H        LYS  60  -7.903  17.630  -7.123
  327    HA   LYS  60           HA       LYS  60  -7.964  17.840  -4.231
  328    HB2  LYS  60           HB1      LYS  60  -9.764  16.842  -6.356
  329    HB3  LYS  60           HB2      LYS  60  -9.847  15.975  -4.815
  330    HG2  LYS  60           HG1      LYS  60  -9.909  18.572  -3.978
  331    HG3  LYS  60           HG2      LYS  60 -10.787  18.654  -5.517
  332    HD2  LYS  60           HD1      LYS  60 -12.416  17.112  -4.814
  333    HD3  LYS  60           HD2      LYS  60 -11.414  16.555  -3.461
  334    HE2  LYS  60           HE1      LYS  60 -12.816  17.906  -2.279
  335    HE3  LYS  60           HE2      LYS  60 -11.625  19.121  -2.769
  336    HZ1  LYS  60           HZ1      LYS  60 -13.730  18.693  -4.695
  337    HZ2  LYS  60           HZ2      LYS  60 -13.093  20.139  -4.091
  338    HZ3  LYS  60           HZ3      LYS  60 -14.271  19.303  -3.212
  339    HA   PRO  61           HA       PRO  61  -5.851  14.129  -3.226
  340    HB2  PRO  61           HB1      PRO  61  -7.348  13.132  -1.161
  341    HB3  PRO  61           HB2      PRO  61  -6.329  14.562  -1.021
  342    HG2  PRO  61           HG1      PRO  61  -9.280  14.373  -1.528
  343    HG3  PRO  61           HG2      PRO  61  -8.384  15.449  -0.391
  344    HD2  PRO  61           HD1      PRO  61  -9.317  16.306  -2.793
  345    HD3  PRO  61           HD2      PRO  61  -7.817  16.918  -2.075
  346    H    PHE  62           H        PHE  62  -5.748  12.069  -3.927
  347    HA   PHE  62           HA       PHE  62  -8.022  10.358  -4.127
  348    HB2  PHE  62           HB1      PHE  62  -8.227  10.153  -6.488
  349    HB3  PHE  62           HB2      PHE  62  -8.293  11.878  -6.127
  350    HD1  PHE  62           HD1      PHE  62  -5.882  13.051  -6.110
  351    HD2  PHE  62           HD2      PHE  62  -6.923   9.542  -8.284
  352    HE1  PHE  62           HE1      PHE  62  -4.035  13.478  -7.680
  353    HE2  PHE  62           HE2      PHE  62  -5.078   9.963  -9.855
  354    HZ   PHE  62           HZ       PHE  62  -3.630  11.933  -9.554
  355    H    CYS  63           H        CYS  63  -7.392   8.296  -5.396
  356    HA   CYS  63           HA       CYS  63  -4.787   7.483  -4.402
  357    HB2  CYS  63           HB1      CYS  63  -7.309   6.176  -5.082
  358    HB3  CYS  63           HB2      CYS  63  -5.906   5.298  -5.697
  359    H    ALA  64           H        ALA  64  -3.039   7.638  -5.625
  360    HA   ALA  64           HA       ALA  64  -3.332   7.364  -8.547
  361    HB1  ALA  64           HB1      ALA  64  -0.886   8.675  -7.757
  362    HB2  ALA  64           HB2      ALA  64  -2.160   9.228  -8.845
  363    HB3  ALA  64           HB3      ALA  64  -2.297   9.514  -7.110
  364    H    THR  65           H        THR  65  -1.466   6.453  -9.675
  365    HA   THR  65           HA       THR  65  -0.690   3.980  -8.698
  366    HB   THR  65           HB       THR  65   1.290   5.148 -10.513
  367    HG1  THR  65           HG1      THR  65  -0.159   5.533 -12.194
  368   HG21  THR  65          HG21      THR  65  -0.665   2.859 -10.769
  369   HG22  THR  65          HG22      THR  65   0.999   2.743 -10.197
  370   HG23  THR  65          HG23      THR  65   0.670   3.198 -11.869
  371    H    CYS  66           H        CYS  66   1.519   3.205  -8.226
  372    HA   CYS  66           HA       CYS  66   2.693   4.792  -6.138
  373    HB2  CYS  66           HB1      CYS  66   2.785   2.021  -7.040
  374    HB3  CYS  66           HB2      CYS  66   4.380   2.623  -6.584
  375    H    ARG  67           H        ARG  67   5.219   4.774  -6.066
  376    HA   ARG  67           HA       ARG  67   6.134   5.949  -8.602
  377    HB2  ARG  67           HB1      ARG  67   7.370   6.343  -5.874
  378    HB3  ARG  67           HB2      ARG  67   7.654   7.291  -7.340
  379    HG2  ARG  67           HG1      ARG  67   4.914   7.498  -6.926
  380    HG3  ARG  67           HG2      ARG  67   5.627   7.606  -5.306
  381    HD2  ARG  67           HD1      ARG  67   5.864   9.793  -5.823
  382    HD3  ARG  67           HD2      ARG  67   7.305   9.217  -6.674
  383    HE   ARG  67           HE       ARG  67   5.108   9.051  -8.411
  384   HH11  ARG  67          HH11      ARG  67   7.096  11.432  -6.832
  385   HH12  ARG  67          HH12      ARG  67   6.872  12.627  -8.066
  386   HH21  ARG  67          HH21      ARG  67   4.805  10.616 -10.043
  387   HH22  ARG  67          HH22      ARG  67   5.569  12.162  -9.892
  388    H    GLY  68           H        GLY  68   8.270   5.519  -9.340
  389    HA2  GLY  68           HA2      GLY  68   9.166   2.827  -8.620
  390    HA3  GLY  68           HA3      GLY  68   9.620   3.718 -10.065
  391    HA1  GLY  68           HA1      GLY  68   9.167   3.460  -8.004
  392    H    LEU  69           H        LEU  69  11.694   2.624  -9.063
  393    HA   LEU  69           HA       LEU  69  12.944   3.897  -6.867
  394    HB2  LEU  69           HB1      LEU  69  13.819   2.093  -9.076
  395    HB3  LEU  69           HB2      LEU  69  15.055   2.945  -8.134
  396    HG   LEU  69           HG       LEU  69  12.987   1.059  -7.007
  397   HD11  LEU  69          HD11      LEU  69  14.901   0.137  -8.454
  398   HD12  LEU  69          HD12      LEU  69  14.642  -0.566  -6.859
  399   HD13  LEU  69          HD13      LEU  69  15.944   0.596  -7.108
  400   HD21  LEU  69          HD21      LEU  69  14.488   1.230  -4.978
  401   HD22  LEU  69          HD22      LEU  69  13.497   2.645  -5.333
  402   HD23  LEU  69          HD23      LEU  69  15.211   2.643  -5.748
  403    H    ARG  70           H        ARG  70  12.657   4.699 -10.224
  404    HA   ARG  70           HA       ARG  70  14.745   6.735 -10.036
  405    HB2  ARG  70           HB1      ARG  70  13.058   5.782 -12.362
  406    HB3  ARG  70           HB2      ARG  70  14.272   7.066 -12.469
  407    HG2  ARG  70           HG1      ARG  70  15.511   4.808 -11.267
  408    HG3  ARG  70           HG2      ARG  70  14.638   4.267 -12.711
  409    HD2  ARG  70           HD1      ARG  70  15.739   6.119 -13.993
  410    HD3  ARG  70           HD2      ARG  70  16.711   6.449 -12.551
  411    HE   ARG  70           HE       ARG  70  17.174   3.830 -12.972
  412   HH11  ARG  70          HH11      ARG  70  17.295   6.611 -15.062
  413   HH12  ARG  70          HH12      ARG  70  18.540   5.958 -16.076
  414   HH21  ARG  70          HH21      ARG  70  18.813   2.960 -14.298
  415   HH22  ARG  70          HH22      ARG  70  19.401   3.880 -15.640
  416    H    ARG  71           H        ARG  71  11.839   6.670  -8.877
  417    HA   ARG  71           HA       ARG  71  10.931   9.235  -9.982
  418    HB2  ARG  71           HB1      ARG  71   9.576   6.934  -8.661
  419    HB3  ARG  71           HB2      ARG  71   8.899   8.545  -8.390
  420    HG2  ARG  71           HG1      ARG  71   9.453   7.456 -11.143
  421    HG3  ARG  71           HG2      ARG  71   7.911   7.231 -10.299
  422    HD2  ARG  71           HD1      ARG  71   7.529   9.602 -10.194
  423    HD3  ARG  71           HD2      ARG  71   9.156   9.926 -10.811
  424    HE   ARG  71           HE       ARG  71   8.398   9.544 -12.939
  425   HH11  ARG  71          HH11      ARG  71   6.059   8.353 -10.652
  426   HH12  ARG  71          HH12      ARG  71   4.850   8.039 -11.853
  427   HH21  ARG  71          HH21      ARG  71   6.815   9.136 -14.530
  428   HH22  ARG  71          HH22      ARG  71   5.281   8.485 -14.058
  429    H    ARG  72           H        ARG  72  10.697  11.034  -8.722
  430    HA   ARG  72           HA       ARG  72  12.210  11.101  -6.277
  431    HB2  ARG  72           HB1      ARG  72  11.600  13.526  -6.275
  432    HB3  ARG  72           HB2      ARG  72  12.407  12.981  -7.753
  433    HG2  ARG  72           HG1      ARG  72   9.559  12.717  -8.046
  434    HG3  ARG  72           HG2      ARG  72   9.983  14.362  -7.537
  435    HD2  ARG  72           HD1      ARG  72  11.868  14.019  -9.412
  436    HD3  ARG  72           HD2      ARG  72  10.632  12.922 -10.045
  437    HE   ARG  72           HE       ARG  72   9.571  15.489  -9.355
  438   HH11  ARG  72          HH11      ARG  72  11.258  13.693 -11.814
  439   HH12  ARG  72          HH12      ARG  72  10.733  14.719 -13.107
  440   HH21  ARG  72          HH21      ARG  72   8.872  16.847 -11.049
  441   HH22  ARG  72          HH22      ARG  72   9.376  16.512 -12.671
  442    H    CYS  73           H        CYS  73  11.455  11.627  -4.216
  443    HA   CYS  73           HA       CYS  73   8.572  11.729  -3.783
  444    HB2  CYS  73           HB1      CYS  73   8.696   9.979  -2.025
  445    HB3  CYS  73           HB2      CYS  73   9.013   9.358  -3.645
  446    H    GLN  74           H        GLN  74   8.172  11.954  -1.301
  447    HA   GLN  74           HA       GLN  74  10.189  13.822  -0.242
  448    HB2  GLN  74           HB1      GLN  74   7.526  14.334  -0.895
  449    HB3  GLN  74           HB2      GLN  74   7.528  14.171   0.868
  450    HG2  GLN  74           HG1      GLN  74   9.667  15.850  -0.299
  451    HG3  GLN  74           HG2      GLN  74   8.015  16.474  -0.395
  452   HE21  GLN  74          HE21      GLN  74  10.687  16.677   1.367
  453   HE22  GLN  74          HE22      GLN  74  10.025  16.984   2.932
  454    H    ARG  75           H        ARG  75   7.936  11.235   0.480
  455    HA   ARG  75           HA       ARG  75   9.356  10.783   3.007
  456    HB2  ARG  75           HB1      ARG  75   7.175  10.162   4.070
  457    HB3  ARG  75           HB2      ARG  75   7.346  11.882   3.697
  458    HG2  ARG  75           HG1      ARG  75   6.162  10.767   1.422
  459    HG3  ARG  75           HG2      ARG  75   5.353  10.011   2.806
  460    HD2  ARG  75           HD1      ARG  75   5.478  12.630   3.600
  461    HD3  ARG  75           HD2      ARG  75   5.256  12.779   1.851
  462    HE   ARG  75           HE       ARG  75   3.105  12.053   2.105
  463   HH11  ARG  75          HH11      ARG  75   4.925  11.194   4.945
  464   HH12  ARG  75          HH12      ARG  75   3.542  10.625   5.820
  465   HH21  ARG  75          HH21      ARG  75   1.276  11.307   3.245
  466   HH22  ARG  75          HH22      ARG  75   1.467  10.689   4.851
  467    H    ASP  76           H        ASP  76   8.596   8.557   3.933
  468    HA   ASP  76           HA       ASP  76   9.178   6.611   1.904
  469    HB2  ASP  76           HB1      ASP  76  10.191   6.164   3.976
  470    HB3  ASP  76           HB2      ASP  76   8.696   6.474   4.870
  471    HD2  ASP  76           HD       ASP  76   9.113   2.918   3.157
  472    H    ALA  77           H        ALA  77   6.346   7.662   3.670
  473    HA   ALA  77           HA       ALA  77   4.661   5.484   3.034
  474    HB1  ALA  77           HB1      ALA  77   4.092   8.331   3.817
  475    HB2  ALA  77           HB2      ALA  77   2.815   7.150   3.522
  476    HB3  ALA  77           HB3      ALA  77   3.986   6.878   4.812
  477    H    MET  78           H        MET  78   5.587   8.368   1.295
  478    HA   MET  78           HA       MET  78   3.526   8.368  -0.629
  479    HB2  MET  78           HB1      MET  78   6.243   9.575  -0.406
  480    HB3  MET  78           HB2      MET  78   5.490   9.525  -2.006
  481    HG2  MET  78           HG1      MET  78   3.535  10.726  -1.132
  482    HG3  MET  78           HG2      MET  78   4.306  10.786   0.456
  483    HE1  MET  78           HE1      MET  78   4.370  11.530  -3.107
  484    HE2  MET  78           HE2      MET  78   4.709  13.260  -3.152
  485    HE3  MET  78           HE3      MET  78   6.024  12.099  -3.340
  486    H    CYS  79           H        CYS  79   6.414   6.482  -0.278
  487    HA   CYS  79           HA       CYS  79   6.157   5.427  -3.000
  488    HB2  CYS  79           HB1      CYS  79   8.341   5.628  -1.018
  489    HB3  CYS  79           HB2      CYS  79   8.305   4.126  -1.943
  490    H    CYS  80           H        CYS  80   5.965   3.196  -3.403
  491    HA   CYS  80           HA       CYS  80   4.128   1.809  -1.864
  492    HB2  CYS  80           HB1      CYS  80   5.884   1.207  -4.140
  493    HB3  CYS  80           HB2      CYS  80   5.487  -0.205  -3.159
  494    HA   PRO  81           HA       PRO  81   6.267  -0.100   1.456
  495    HB2  PRO  81           HB1      PRO  81   5.111  -2.581   1.558
  496    HB3  PRO  81           HB2      PRO  81   4.283  -1.101   2.036
  497    HG2  PRO  81           HG1      PRO  81   4.166  -2.592  -0.564
  498    HG3  PRO  81           HG2      PRO  81   2.819  -1.896   0.412
  499    HD2  PRO  81           HD1      PRO  81   3.810  -0.672  -1.798
  500    HD3  PRO  81           HD2      PRO  81   3.198   0.228  -0.399
  501    H    GLY  82           H        GLY  82   8.349  -0.666   1.376
  502    HA2  GLY  82           HA2      GLY  82   9.644  -2.868   1.146
  503    HA3  GLY  82           HA3      GLY  82   9.170  -2.747  -0.542
  504    HA1  GLY  82           HA1      GLY  82   9.665  -2.022   1.394
  505    H    THR  83           H        THR  83   9.470   0.271  -0.269
  506    HA   THR  83           HA       THR  83  12.409   0.323  -0.504
  507    HB   THR  83           HB       THR  83  11.734   2.493  -1.921
  508    HG1  THR  83           HG1      THR  83   9.422   1.775  -1.528
  509   HG21  THR  83          HG21      THR  83  12.354  -0.285  -2.551
  510   HG22  THR  83          HG22      THR  83  12.995   1.203  -3.250
  511   HG23  THR  83          HG23      THR  83  11.476   0.532  -3.844
  512    H    LEU  84           H        LEU  84  13.254   2.667  -0.285
  513    HA   LEU  84           HA       LEU  84  11.827   4.069   1.868
  514    HB2  LEU  84           HB1      LEU  84  14.651   3.075   1.822
  515    HB3  LEU  84           HB2      LEU  84  14.251   4.550   2.720
  516    HG   LEU  84           HG       LEU  84  12.672   2.076   3.251
  517   HD11  LEU  84          HD11      LEU  84  14.298   1.320   4.878
  518   HD12  LEU  84          HD12      LEU  84  15.395   2.624   4.424
  519   HD13  LEU  84          HD13      LEU  84  15.019   1.345   3.269
  520   HD21  LEU  84          HD21      LEU  84  12.630   3.042   5.513
  521   HD22  LEU  84          HD22      LEU  84  11.998   4.155   4.298
  522   HD23  LEU  84          HD23      LEU  84  13.624   4.384   4.944
  523    H    CYS  85           H        CYS  85  11.742   6.228   1.657
  524    HA   CYS  85           HA       CYS  85  12.650   7.435  -0.760
  525    HB2  CYS  85           HB1      CYS  85  10.572   8.016   0.650
  526    HB3  CYS  85           HB2      CYS  85  11.682   8.949   1.656
  527    H    VAL  86           H        VAL  86  14.840   7.497  -0.945
  528    HA   VAL  86           HA       VAL  86  16.329   8.905   1.174
  529    HB   VAL  86           HB       VAL  86  17.401   6.983  -0.898
  530   HG11  VAL  86          HG11      VAL  86  19.478   7.116   0.478
  531   HG12  VAL  86          HG12      VAL  86  19.072   8.613  -0.364
  532   HG13  VAL  86          HG13      VAL  86  18.745   8.454   1.363
  533   HG21  VAL  86          HG21      VAL  86  17.926   5.749   1.379
  534   HG22  VAL  86          HG22      VAL  86  16.518   6.659   1.924
  535   HG23  VAL  86          HG23      VAL  86  16.378   5.549   0.560
  536    H    ASN  87           H        ASN  87  17.534  10.672   0.674
  537    HA   ASN  87           HA       ASN  87  18.150  12.547  -0.461
  538    HB2  ASN  87           HB1      ASN  87  19.450  10.534  -1.605
  539    HB3  ASN  87           HB2      ASN  87  18.446  10.985  -2.989
  540   HD21  ASN  87          HD21      ASN  87  20.722  11.361  -3.790
  541   HD22  ASN  87          HD22      ASN  87  21.355  12.956  -3.592
  542    H    ASP  88           H        ASP  88  15.361  12.004  -0.376
  543    HA   ASP  88           HA       ASP  88  13.409  12.803  -1.229
  544    HB2  ASP  88           HB1      ASP  88  14.979  14.355  -3.280
  545    HB3  ASP  88           HB2      ASP  88  13.452  14.783  -2.497
  546    HD2  ASP  88           HD       ASP  88  16.478  16.396  -0.964
  547    H    VAL  89           H        VAL  89  14.768  10.427  -2.372
  548    HA   VAL  89           HA       VAL  89  13.077  10.175  -4.729
  549    HB   VAL  89           HB       VAL  89  16.036   9.574  -4.834
  550   HG11  VAL  89          HG11      VAL  89  13.889   9.223  -6.925
  551   HG12  VAL  89          HG12      VAL  89  15.619   8.969  -7.171
  552   HG13  VAL  89          HG13      VAL  89  14.722   7.931  -6.061
  553   HG21  VAL  89          HG21      VAL  89  14.388  11.666  -6.251
  554   HG22  VAL  89          HG22      VAL  89  15.608  11.954  -5.010
  555   HG23  VAL  89          HG23      VAL  89  16.084  11.312  -6.582
  556    H    CYS  90           H        CYS  90  12.405   8.090  -5.137
  557    HA   CYS  90           HA       CYS  90  12.367   6.286  -2.987
  558    HB2  CYS  90           HB1      CYS  90  10.966   6.570  -5.324
  559    HB3  CYS  90           HB2      CYS  90  11.906   5.113  -5.646
  560    H    THR  91           H        THR  91  13.973   5.081  -2.249
  561    HA   THR  91           HA       THR  91  15.825   3.859  -4.184
  562    HB   THR  91           HB       THR  91  16.579   5.019  -1.494
  563    HG1  THR  91           HG1      THR  91  17.702   5.820  -3.944
  564   HG21  THR  91          HG21      THR  91  18.130   3.429  -3.524
  565   HG22  THR  91          HG22      THR  91  17.943   3.119  -1.797
  566   HG23  THR  91          HG23      THR  91  18.921   4.479  -2.349
  567    H    THR  92           H        THR  92  16.374   1.755  -3.828
  568    HA   THR  92           HA       THR  92  14.680   0.185  -2.194
  569    HB   THR  92           HB       THR  92  16.965  -1.354  -2.828
  570    HG1  THR  92           HG1      THR  92  17.094  -0.877  -5.104
  571   HG21  THR  92          HG21      THR  92  14.300  -1.090  -4.228
  572   HG22  THR  92          HG22      THR  92  14.663  -2.153  -2.867
  573   HG23  THR  92          HG23      THR  92  15.432  -2.427  -4.430
  574    H    MET  93           H        MET  93  15.168  -1.070  -0.362
  575    HA   MET  93           HA       MET  93  16.691   0.201   1.618
  576    HB2  MET  93           HB1      MET  93  14.745  -1.459   1.870
  577    HB3  MET  93           HB2      MET  93  15.974  -2.721   1.694
  578    HG2  MET  93           HG1      MET  93  17.104  -1.146   3.610
  579    HG3  MET  93           HG2      MET  93  15.384  -0.969   3.965
  580    HE1  MET  93           HE1      MET  93  15.477  -3.539   6.582
  581    HE2  MET  93           HE2      MET  93  15.519  -1.828   6.160
  582    HE3  MET  93           HE3      MET  93  14.170  -2.835   5.631
  583    H    GLU  94           H        GLU  94  17.510  -2.252  -0.715
  584    HA   GLU  94           HA       GLU  94  19.896  -3.153   0.541
  585    HB2  GLU  94           HB1      GLU  94  18.914  -3.292  -2.314
  586    HB3  GLU  94           HB2      GLU  94  20.434  -4.023  -1.776
  587    HG2  GLU  94           HG1      GLU  94  18.318  -4.836  -0.024
  588    HG3  GLU  94           HG2      GLU  94  17.858  -5.138  -1.706
  589    HE2  GLU  94           HE       GLU  94  19.675  -8.036  -1.453
  590    H    ASP  95           H        ASP  95  19.134  -0.572  -1.706
  591    HA   ASP  95           HA       ASP  95  21.879   0.063  -2.271
  592    HB2  ASP  95           HB1      ASP  95  19.216   1.101  -3.041
  593    HB3  ASP  95           HB2      ASP  95  20.521   2.294  -3.013
  594    HD2  ASP  95           HD       ASP  95  21.600  -0.623  -5.393
  595    H    ALA  96           H        ALA  96  19.433   1.139  -0.009
  596    HA   ALA  96           HA       ALA  96  20.763   3.487   0.865
  597    HB1  ALA  96           HB1      ALA  96  18.900   3.792   2.040
  598    HB2  ALA  96           HB2      ALA  96  18.306   2.283   1.347
  599    HB3  ALA  96           HB3      ALA  96  19.121   2.275   2.911
  600    H    THR  97           H        THR  97  22.410   3.754   2.230
  601    HA   THR  97           HA       THR  97  24.109   3.310   3.679
  602    HB   THR  97           HB       THR  97  22.619   0.997   4.854
  603    HG1  THR  97           HG1      THR  97  20.925   2.250   5.073
  604   HG21  THR  97          HG21      THR  97  23.986   1.349   6.584
  605   HG22  THR  97          HG22      THR  97  23.572   3.063   6.642
  606   HG23  THR  97          HG23      THR  97  24.855   2.502   5.570
  607    H    GLU  98           H        GLU  98  25.674   2.578   2.294
  608    HA   GLU  98           HA       GLU  98  25.888  -0.348   2.015
  609    HB2  GLU  98           HB1      GLU  98  25.493   1.299  -0.068
  610    HB3  GLU  98           HB2      GLU  98  27.258   1.390   0.038
  611    HG2  GLU  98           HG1      GLU  98  27.546  -0.664  -0.789
  612    HG3  GLU  98           HG2      GLU  98  26.230  -1.334   0.186
  613    HE2  GLU  98           HE       GLU  98  24.849   0.369  -3.102
  614    H    ASN  99           H        ASN  99  28.283  -0.910   1.379
  615    HA   ASN  99           HA       ASN  99  29.925   0.164   3.525
  616    HB2  ASN  99           HB1      ASN  99  30.163  -2.216   1.687
  617    HB3  ASN  99           HB2      ASN  99  31.516  -1.694   2.699
  618   HD21  ASN  99          HD21      ASN  99  31.578  -3.423   4.043
  619   HD22  ASN  99          HD22      ASN  99  30.318  -3.824   5.154
  620    H    LEU 100           H        LEU 100  29.906  -0.039   0.009
  621    HA   LEU 100           HA       LEU 100  31.189   0.941  -1.600
  622    HB2  LEU 100           HB1      LEU 100  31.532   3.092   0.495
  623    HB3  LEU 100           HB2      LEU 100  31.725   3.272  -1.258
  624    HG   LEU 100           HG       LEU 100  29.078   2.306  -0.516
  625   HD11  LEU 100          HD11      LEU 100  29.774   3.801   1.445
  626   HD12  LEU 100          HD12      LEU 100  28.254   4.161   0.628
  627   HD13  LEU 100          HD13      LEU 100  29.689   5.129   0.288
  628   HD21  LEU 100          HD21      LEU 100  29.551   3.078  -2.731
  629   HD22  LEU 100          HD22      LEU 100  30.152   4.620  -2.122
  630   HD23  LEU 100          HD23      LEU 100  28.439   4.220  -1.979
  631    H    TYR 101           H        TYR 101  33.428   2.445  -1.666
  632    HA   TYR 101           HA       TYR 101  35.698   2.341  -1.571
  633    HB2  TYR 101           HB1      TYR 101  34.824   2.283   1.058
  634    HB3  TYR 101           HB2      TYR 101  35.927   0.907   0.966
  635    HD1  TYR 101           HD1      TYR 101  38.214   1.232   1.203
  636    HD2  TYR 101           HD2      TYR 101  35.766   4.532   0.100
  637    HE1  TYR 101           HE1      TYR 101  40.152   2.732   1.409
  638    HE2  TYR 101           HE2      TYR 101  37.697   6.040   0.302
  639    HH   TYR 101           HH       TYR 101  40.918   4.861   0.694
  640    H    PHE 102           H        PHE 102  37.589   0.736  -1.207
  641    HA   PHE 102           HA       PHE 102  36.710  -1.900  -2.182
  642    HB2  PHE 102           HB1      PHE 102  38.916  -0.081  -2.966
  643    HB3  PHE 102           HB2      PHE 102  39.313  -1.800  -2.919
  644    HD1  PHE 102           HD1      PHE 102  38.533  -3.310  -4.560
  645    HD2  PHE 102           HD2      PHE 102  37.084   0.692  -4.472
  646    HE1  PHE 102           HE1      PHE 102  37.506  -3.637  -6.772
  647    HE2  PHE 102           HE2      PHE 102  36.054   0.371  -6.683
  648    HZ   PHE 102           HZ       PHE 102  36.263  -1.796  -7.835
  649    H    GLN 103           H        GLN 103  37.954  -3.756  -1.538
  650    HA   GLN 103           HA       GLN 103  39.526  -3.382   0.916
  651    HB2  GLN 103           HB1      GLN 103  38.448  -5.494   1.792
  652    HB3  GLN 103           HB2      GLN 103  37.404  -4.066   1.734
  653    HG2  GLN 103           HG1      GLN 103  37.328  -5.751  -0.676
  654    HG3  GLN 103           HG2      GLN 103  36.717  -6.509   0.801
  655   HE21  GLN 103          HE21      GLN 103  35.825  -4.783  -1.815
  656   HE22  GLN 103          HE22      GLN 103  34.393  -4.030  -1.207
  657    H    SER 104           H        SER 104  41.425  -3.720  -0.266
  658    HA   SER 104           HA       SER 104  42.133  -6.479  -0.611
  659    HB2  SER 104           HB1      SER 104  42.243  -6.678  -2.874
  660    HB3  SER 104           HB2      SER 104  41.004  -5.413  -2.830
  661    HG   SER 104           HG       SER 104  42.601  -4.723  -4.209
  662    H    LEU 105           H        LEU 105  44.305  -6.798  -0.422
  663    HA   LEU 105           HA       LEU 105  45.982  -4.380  -0.252
  664    HB2  LEU 105           HB1      LEU 105  45.538  -6.569   1.621
  665    HB3  LEU 105           HB2      LEU 105  47.253  -6.321   1.252
  666    HG   LEU 105           HG       LEU 105  46.335  -3.765   1.767
  667   HD11  LEU 105          HD11      LEU 105  44.268  -4.322   2.677
  668   HD12  LEU 105          HD12      LEU 105  45.311  -4.167   4.090
  669   HD13  LEU 105          HD13      LEU 105  44.897  -5.766   3.472
  670   HD21  LEU 105          HD21      LEU 105  48.440  -5.050   2.471
  671   HD22  LEU 105          HD22      LEU 105  47.503  -5.547   3.881
  672   HD23  LEU 105          HD23      LEU 105  47.804  -3.834   3.580
  673    H    GLU 106           H        GLU 106  48.348  -4.849  -0.547
  674    HA   GLU 106           HA       GLU 106  48.668  -6.691  -2.810
  675    HB2  GLU 106           HB1      GLU 106  50.722  -5.394  -3.307
  676    HB3  GLU 106           HB2      GLU 106  49.254  -4.405  -3.319
  677    HG2  GLU 106           HG1      GLU 106  49.971  -3.093  -1.666
  678    HG3  GLU 106           HG2      GLU 106  50.547  -4.470  -0.716
  679    HE2  GLU 106           HE       GLU 106  53.154  -2.371  -2.712
  680    H    HIS 107           H        HIS 107  50.795  -7.790  -2.999
  681    HA   HIS 107           HA       HIS 107  52.041  -8.399  -0.417
  682    HB2  HIS 107           HB1      HIS 107  50.602 -10.288  -2.221
  683    HB3  HIS 107           HB2      HIS 107  52.073 -10.867  -1.431
  684    HD1  HIS 107           HD1      HIS 107  52.011 -11.248   1.107
  685    HD2  HIS 107           HD2      HIS 107  48.438  -9.819  -0.463
  686    HE1  HIS 107           HE1      HIS 107  50.312 -11.526   2.939
  687    HE2  HIS 107           HE2      HIS 107  48.129 -10.652   1.982
  688    H    HIS 108           H        HIS 108  54.200  -8.925  -0.512
  689    HA   HIS 108           HA       HIS 108  55.481  -8.460  -3.108
  690    HB2  HIS 108           HB1      HIS 108  56.043  -7.610  -0.442
  691    HB3  HIS 108           HB2      HIS 108  57.391  -8.611  -0.995
  692    HD1  HIS 108           HD1      HIS 108  55.477  -5.521  -2.061
  693    HD2  HIS 108           HD2      HIS 108  59.141  -7.377  -2.686
  694    HE1  HIS 108           HE1      HIS 108  56.837  -3.889  -3.408
  695    HE2  HIS 108           HE2      HIS 108  59.075  -5.023  -3.793
  696    H    HIS 109           H        HIS 109  55.659 -10.353  -4.164
  697    HA   HIS 109           HA       HIS 109  57.484 -12.318  -3.177
  698    HB2  HIS 109           HB1      HIS 109  55.077 -12.775  -2.171
  699    HB3  HIS 109           HB2      HIS 109  54.797 -13.487  -3.763
  700    HD1  HIS 109           HD1      HIS 109  54.899 -15.938  -3.395
  701    HD2  HIS 109           HD2      HIS 109  58.012 -13.948  -1.494
  702    HE1  HIS 109           HE1      HIS 109  56.371 -17.743  -2.447
  703    HE2  HIS 109           HE2      HIS 109  58.273 -16.526  -1.284
  704    H    HIS 110           H        HIS 110  58.439 -13.382  -4.828
  705    HA   HIS 110           HA       HIS 110  57.156 -13.855  -7.337
  706    HB2  HIS 110           HB1      HIS 110  58.695 -12.455  -8.702
  707    HB3  HIS 110           HB2      HIS 110  57.589 -11.508  -7.702
  708    HD1  HIS 110           HD1      HIS 110  61.217 -12.514  -7.882
  709    HD2  HIS 110           HD2      HIS 110  58.771  -9.834  -5.858
  710    HE1  HIS 110           HE1      HIS 110  62.779 -10.972  -6.655
  711    HE2  HIS 110           HE2      HIS 110  61.287  -9.334  -5.417
  712    H    HIS 111           H        HIS 111  58.216 -15.389  -8.523
  713    HA   HIS 111           HA       HIS 111  60.961 -16.086  -7.811
  714    HB2  HIS 111           HB1      HIS 111  58.610 -17.604  -7.036
  715    HB3  HIS 111           HB2      HIS 111  59.689 -18.565  -8.051
  716    HD1  HIS 111           HD1      HIS 111  59.905 -16.458  -4.895
  717    HD2  HIS 111           HD2      HIS 111  61.770 -19.690  -6.724
  718    HE1  HIS 111           HE1      HIS 111  61.584 -17.299  -3.223
  719    HE2  HIS 111           HE2      HIS 111  62.723 -19.274  -4.339
  720    H    HIS 112           H        HIS 112  61.994 -17.488  -9.364
  721    HA   HIS 112           HA       HIS 112  60.688 -17.408 -12.005
  722    HB2  HIS 112           HB1      HIS 112  62.649 -15.871 -11.726
  723    HB3  HIS 112           HB2      HIS 112  63.660 -17.296 -11.461
  724    HD1  HIS 112           HD1      HIS 112  64.115 -18.848 -13.502
  725    HD2  HIS 112           HD2      HIS 112  61.967 -15.406 -14.395
  726    HE1  HIS 112           HE1      HIS 112  64.169 -18.653 -16.009
  727    HE2  HIS 112           HE2      HIS 112  62.854 -16.549 -16.556
  Start of MODEL   27
    1    H1   MET  18           H        MET  18 -41.441  65.476  -0.311
    2    HA   MET  18           HA       MET  18 -43.112  63.173  -0.064
    3    HB2  MET  18           HB1      MET  18 -44.527  65.464   0.159
    4    HB3  MET  18           HB2      MET  18 -44.526  65.270  -1.600
    5    HG2  MET  18           HG1      MET  18 -45.427  62.974  -1.314
    6    HG3  MET  18           HG2      MET  18 -45.526  63.281   0.421
    7    HE1  MET  18           HE1      MET  18 -48.557  62.704  -0.024
    8    HE2  MET  18           HE2      MET  18 -49.057  63.288  -1.611
    9    HE3  MET  18           HE3      MET  18 -47.631  62.261  -1.458
   10    H    LEU  19           H        LEU  19 -42.245  61.925  -1.577
   11    HA   LEU  19           HA       LEU  19 -41.640  63.120  -4.202
   12    HB2  LEU  19           HB1      LEU  19 -40.013  61.491  -2.400
   13    HB3  LEU  19           HB2      LEU  19 -40.093  60.847  -4.049
   14    HG   LEU  19           HG       LEU  19 -39.479  63.727  -3.819
   15   HD11  LEU  19          HD11      LEU  19 -37.493  61.613  -2.997
   16   HD12  LEU  19          HD12      LEU  19 -38.190  62.849  -1.949
   17   HD13  LEU  19          HD13      LEU  19 -37.132  63.315  -3.282
   18   HD21  LEU  19          HD21      LEU  19 -37.924  61.696  -5.351
   19   HD22  LEU  19          HD22      LEU  19 -38.308  63.368  -5.762
   20   HD23  LEU  19          HD23      LEU  19 -39.550  62.122  -5.886
   21    H    VAL  20           H        VAL  20 -41.640  61.501  -6.001
   22    HA   VAL  20           HA       VAL  20 -43.835  59.576  -5.605
   23    HB   VAL  20           HB       VAL  20 -44.131  59.773  -8.112
   24   HG11  VAL  20          HG11      VAL  20 -45.185  61.234  -6.045
   25   HG12  VAL  20          HG12      VAL  20 -44.676  62.484  -7.180
   26   HG13  VAL  20          HG13      VAL  20 -45.788  61.217  -7.701
   27   HG21  VAL  20          HG21      VAL  20 -43.246  61.760  -9.203
   28   HG22  VAL  20          HG22      VAL  20 -42.397  62.214  -7.724
   29   HG23  VAL  20          HG23      VAL  20 -41.931  60.753  -8.595
   30    H    LEU  21           H        LEU  21 -43.498  57.478  -6.029
   31    HA   LEU  21           HA       LEU  21 -40.890  56.482  -6.415
   32    HB2  LEU  21           HB1      LEU  21 -43.618  55.214  -6.554
   33    HB3  LEU  21           HB2      LEU  21 -42.129  54.291  -6.829
   34    HG   LEU  21           HG       LEU  21 -42.392  55.850  -4.302
   35   HD11  LEU  21          HD11      LEU  21 -43.351  53.572  -3.412
   36   HD12  LEU  21          HD12      LEU  21 -43.984  53.451  -5.053
   37   HD13  LEU  21          HD13      LEU  21 -44.421  54.826  -4.041
   38   HD21  LEU  21          HD21      LEU  21 -40.438  54.291  -5.310
   39   HD22  LEU  21          HD22      LEU  21 -41.356  53.095  -4.395
   40   HD23  LEU  21          HD23      LEU  21 -40.717  54.524  -3.584
   41    H    ASP  22           H        ASP  22 -39.871  55.605  -8.182
   42    HA   ASP  22           HA       ASP  22 -41.043  56.299 -10.781
   43    HB2  ASP  22           HB1      ASP  22 -38.863  57.300 -10.311
   44    HB3  ASP  22           HB2      ASP  22 -38.178  55.696 -10.022
   45    HD2  ASP  22           HD       ASP  22 -37.261  55.828 -13.336
   46    H    PHE  23           H        PHE  23 -38.743  53.797  -9.715
   47    HA   PHE  23           HA       PHE  23 -40.471  51.652 -10.493
   48    HB2  PHE  23           HB1      PHE  23 -38.617  52.772 -12.439
   49    HB3  PHE  23           HB2      PHE  23 -38.289  51.066 -12.129
   50    HD1  PHE  23           HD1      PHE  23 -40.425  53.396 -13.799
   51    HD2  PHE  23           HD2      PHE  23 -40.173  49.397 -12.364
   52    HE1  PHE  23           HE1      PHE  23 -42.278  52.750 -15.284
   53    HE2  PHE  23           HE2      PHE  23 -42.024  48.744 -13.848
   54    HZ   PHE  23           HZ       PHE  23 -43.078  50.421 -15.311
   55    H    ASN  24           H        ASN  24 -39.148  49.514 -10.504
   56    HA   ASN  24           HA       ASN  24 -36.750  49.536  -8.906
   57    HB2  ASN  24           HB1      ASN  24 -39.331  49.291  -7.640
   58    HB3  ASN  24           HB2      ASN  24 -38.415  47.793  -7.438
   59   HD21  ASN  24          HD21      ASN  24 -39.171  49.906  -5.516
   60   HD22  ASN  24          HD22      ASN  24 -37.689  50.401  -4.778
   61    H    ASN  25           H        ASN  25 -35.665  48.245 -10.283
   62    HA   ASN  25           HA       ASN  25 -36.899  45.679 -11.032
   63    HB2  ASN  25           HB1      ASN  25 -34.756  47.343 -12.368
   64    HB3  ASN  25           HB2      ASN  25 -35.080  45.665 -12.819
   65   HD21  ASN  25          HD21      ASN  25 -35.638  48.674 -13.767
   66   HD22  ASN  25          HD22      ASN  25 -37.178  48.498 -14.529
   67    H    ILE  26           H        ILE  26 -35.440  43.813 -11.166
   68    HA   ILE  26           HA       ILE  26 -32.983  43.947  -9.628
   69    HB   ILE  26           HB       ILE  26 -34.675  43.635  -7.881
   70   HG12  ILE  26          HG11      ILE  26 -33.238  41.013  -8.299
   71   HG13  ILE  26          HG12      ILE  26 -32.381  42.499  -7.856
   72   HG21  ILE  26          HG21      ILE  26 -36.221  41.899  -7.834
   73   HG22  ILE  26          HG22      ILE  26 -36.244  42.416  -9.520
   74   HG23  ILE  26          HG23      ILE  26 -35.355  40.965  -9.056
   75   HD11  ILE  26          HD11      ILE  26 -34.572  42.171  -6.078
   76   HD12  ILE  26          HD12      ILE  26 -33.663  40.661  -6.150
   77   HD13  ILE  26          HD13      ILE  26 -32.844  42.164  -5.726
   78    H    ARG  27           H        ARG  27 -31.529  42.462 -10.281
   79    HA   ARG  27           HA       ARG  27 -32.143  39.915 -11.312
   80    HB2  ARG  27           HB1      ARG  27 -31.594  40.219 -13.666
   81    HB3  ARG  27           HB2      ARG  27 -32.994  41.206 -13.221
   82    HG2  ARG  27           HG1      ARG  27 -31.476  43.171 -12.999
   83    HG3  ARG  27           HG2      ARG  27 -30.171  42.156 -13.635
   84    HD2  ARG  27           HD1      ARG  27 -31.314  41.853 -15.725
   85    HD3  ARG  27           HD2      ARG  27 -32.766  42.636 -15.087
   86    HE   ARG  27           HE       ARG  27 -30.562  44.401 -14.943
   87   HH11  ARG  27          HH11      ARG  27 -32.783  42.970 -17.210
   88   HH12  ARG  27          HH12      ARG  27 -32.681  44.282 -18.337
   89   HH21  ARG  27          HH21      ARG  27 -30.419  46.134 -16.418
   90   HH22  ARG  27          HH22      ARG  27 -31.335  46.081 -17.886
   91    H    SER  28           H        SER  28 -30.103  39.130 -12.705
   92    HA   SER  28           HA       SER  28 -27.891  38.600 -12.668
   93    HB2  SER  28           HB1      SER  28 -27.929  41.283 -13.001
   94    HB3  SER  28           HB2      SER  28 -27.042  41.176 -11.470
   95    HG   SER  28           HG       SER  28 -25.382  40.371 -12.486
   96    H    SER  29           H        SER  29 -25.836  38.870 -11.054
   97    HA   SER  29           HA       SER  29 -24.938  38.212  -9.072
   98    HB2  SER  29           HB1      SER  29 -26.855  40.208  -8.446
   99    HB3  SER  29           HB2      SER  29 -27.016  38.931  -7.226
  100    HG   SER  29           HG       SER  29 -25.112  39.414  -6.449
  101    H    ALA  30           H        ALA  30 -24.971  36.020  -9.243
  102    HA   ALA  30           HA       ALA  30 -27.011  34.634  -7.697
  103    HB1  ALA  30           HB1      ALA  30 -27.884  34.615  -9.990
  104    HB2  ALA  30           HB2      ALA  30 -26.397  33.841 -10.541
  105    HB3  ALA  30           HB3      ALA  30 -27.471  32.994  -9.428
  106    H    ASP  31           H        ASP  31 -26.363  32.066  -8.089
  107    HA   ASP  31           HA       ASP  31 -23.489  31.946  -7.443
  108    HB2  ASP  31           HB1      ASP  31 -25.754  30.246  -6.362
  109    HB3  ASP  31           HB2      ASP  31 -24.040  30.003  -6.000
  110    HD2  ASP  31           HD       ASP  31 -24.307  32.185  -3.394
  111    H    LEU  32           H        LEU  32 -22.622  29.631  -7.714
  112    HA   LEU  32           HA       LEU  32 -23.805  28.308 -10.049
  113    HB2  LEU  32           HB1      LEU  32 -21.654  29.986 -10.290
  114    HB3  LEU  32           HB2      LEU  32 -20.878  28.408 -10.075
  115    HG   LEU  32           HG       LEU  32 -23.002  28.288 -12.044
  116   HD11  LEU  32          HD11      LEU  32 -22.039  29.666 -13.738
  117   HD12  LEU  32          HD12      LEU  32 -20.692  30.108 -12.691
  118   HD13  LEU  32          HD13      LEU  32 -22.321  30.672 -12.317
  119   HD21  LEU  32          HD21      LEU  32 -21.284  26.588 -11.758
  120   HD22  LEU  32          HD22      LEU  32 -20.033  27.766 -12.157
  121   HD23  LEU  32          HD23      LEU  32 -21.212  27.284 -13.377
  122    H    HIS  33           H        HIS  33 -23.217  26.105 -10.302
  123    HA   HIS  33           HA       HIS  33 -22.821  24.737  -7.826
  124    HB2  HIS  33           HB1      HIS  33 -22.875  23.656 -10.656
  125    HB3  HIS  33           HB2      HIS  33 -22.983  22.687  -9.182
  126    HD1  HIS  33           HD1      HIS  33 -25.030  24.693 -11.494
  127    HD2  HIS  33           HD2      HIS  33 -25.432  23.009  -7.717
  128    HE1  HIS  33           HE1      HIS  33 -27.495  24.729 -11.001
  129    HE2  HIS  33           HE2      HIS  33 -27.743  23.700  -8.693
  130    H    GLY  34           H        GLY  34 -21.057  23.662  -7.059
  131    HA2  GLY  34           HA2      GLY  34 -18.520  24.270  -8.399
  132    HA3  GLY  34           HA3      GLY  34 -18.710  23.789  -6.719
  133    HA1  GLY  34           HA1      GLY  34 -19.117  23.767  -8.806
  134    H    ALA  35           H        ALA  35 -19.086  21.571  -6.230
  135    HA   ALA  35           HA       ALA  35 -18.439  19.715  -8.424
  136    HB1  ALA  35           HB1      ALA  35 -17.428  18.868  -5.827
  137    HB2  ALA  35           HB2      ALA  35 -16.628  18.910  -7.398
  138    HB3  ALA  35           HB3      ALA  35 -16.693  20.365  -6.404
  139    H    ARG  36           H        ARG  36 -18.717  17.340  -7.445
  140    HA   ARG  36           HA       ARG  36 -21.435  17.289  -6.321
  141    HB2  ARG  36           HB1      ARG  36 -19.945  15.516  -8.219
  142    HB3  ARG  36           HB2      ARG  36 -21.238  14.823  -7.229
  143    HG2  ARG  36           HG1      ARG  36 -22.883  16.214  -8.193
  144    HG3  ARG  36           HG2      ARG  36 -21.657  17.254  -8.939
  145    HD2  ARG  36           HD1      ARG  36 -22.144  16.021 -10.779
  146    HD3  ARG  36           HD2      ARG  36 -20.971  14.915 -10.050
  147    HE   ARG  36           HE       ARG  36 -23.681  14.462  -9.195
  148   HH11  ARG  36          HH11      ARG  36 -21.267  13.744 -11.600
  149   HH12  ARG  36          HH12      ARG  36 -21.999  12.248 -12.075
  150   HH21  ARG  36          HH21      ARG  36 -24.655  12.494  -9.813
  151   HH22  ARG  36          HH22      ARG  36 -23.926  11.538 -11.059
  152    H    LYS  37           H        LYS  37 -18.460  15.315  -6.282
  153    HA   LYS  37           HA       LYS  37 -18.475  15.160  -3.421
  154    HB2  LYS  37           HB1      LYS  37 -19.647  12.993  -5.049
  155    HB3  LYS  37           HB2      LYS  37 -18.474  12.471  -3.826
  156    HG2  LYS  37           HG1      LYS  37 -19.941  14.105  -2.303
  157    HG3  LYS  37           HG2      LYS  37 -21.171  13.637  -3.491
  158    HD2  LYS  37           HD1      LYS  37 -19.693  11.309  -2.691
  159    HD3  LYS  37           HD2      LYS  37 -20.277  12.170  -1.256
  160    HE2  LYS  37           HE1      LYS  37 -22.504  12.283  -2.766
  161    HE3  LYS  37           HE2      LYS  37 -21.791  10.788  -3.388
  162    HZ1  LYS  37           HZ1      LYS  37 -22.224  11.311  -0.501
  163    HZ2  LYS  37           HZ2      LYS  37 -21.785   9.845  -1.222
  164    HZ3  LYS  37           HZ3      LYS  37 -23.330  10.484  -1.479
  165    H    GLY  38           H        GLY  38 -17.382  12.904  -5.956
  166    HA2  GLY  38           HA2      GLY  38 -15.267  12.336  -6.658
  167    HA3  GLY  38           HA3      GLY  38 -14.704  13.854  -5.975
  168    HA1  GLY  38           HA1      GLY  38 -15.748  12.002  -5.998
  169    H    SER  39           H        SER  39 -13.088  13.495  -4.619
  170    HA   SER  39           HA       SER  39 -11.770  12.555  -3.017
  171    HB2  SER  39           HB1      SER  39 -14.392  11.567  -1.855
  172    HB3  SER  39           HB2      SER  39 -12.870  11.834  -0.988
  173    HG   SER  39           HG       SER  39 -14.646  13.546  -1.007
  174    H    GLN  40           H        GLN  40 -10.794  11.048  -4.422
  175    HA   GLN  40           HA       GLN  40 -11.853   8.510  -5.020
  176    HB2  GLN  40           HB1      GLN  40  -9.333   9.930  -5.388
  177    HB3  GLN  40           HB2      GLN  40  -9.096   8.200  -5.086
  178    HG2  GLN  40           HG1      GLN  40 -11.179   8.923  -7.062
  179    HG3  GLN  40           HG2      GLN  40  -9.497   9.224  -7.519
  180   HE21  GLN  40          HE21      GLN  40 -11.923   6.995  -7.550
  181   HE22  GLN  40          HE22      GLN  40 -10.988   5.560  -7.778
  182    H    CYS  41           H        CYS  41  -9.303   9.404  -2.689
  183    HA   CYS  41           HA       CYS  41 -10.198   7.210  -0.966
  184    HB2  CYS  41           HB1      CYS  41  -8.000   6.348  -0.636
  185    HB3  CYS  41           HB2      CYS  41  -8.259   6.446  -2.377
  186    H    LEU  42           H        LEU  42  -9.937   7.564   1.216
  187    HA   LEU  42           HA       LEU  42  -9.331  10.319   1.960
  188    HB2  LEU  42           HB1      LEU  42 -11.232   8.417   2.789
  189    HB3  LEU  42           HB2      LEU  42 -10.135   8.655   4.161
  190    HG   LEU  42           HG       LEU  42 -11.296  11.048   2.804
  191   HD11  LEU  42          HD11      LEU  42 -12.755   9.538   4.958
  192   HD12  LEU  42          HD12      LEU  42 -13.145   9.393   3.245
  193   HD13  LEU  42          HD13      LEU  42 -13.302  10.951   4.055
  194   HD21  LEU  42          HD21      LEU  42  -9.867  10.403   5.249
  195   HD22  LEU  42          HD22      LEU  42 -11.328  11.345   5.551
  196   HD23  LEU  42          HD23      LEU  42 -10.095  11.957   4.447
  197    H    SER  43           H        SER  43  -8.099   7.091   2.330
  198    HA   SER  43           HA       SER  43  -5.651   8.132   3.464
  199    HB2  SER  43           HB1      SER  43  -7.177   7.685   5.431
  200    HB3  SER  43           HB2      SER  43  -7.137   5.974   4.975
  201    HG   SER  43           HG       SER  43  -5.206   7.511   6.194
  202    H    ASP  44           H        ASP  44  -3.987   6.391   3.678
  203    HA   ASP  44           HA       ASP  44  -3.717   4.967   1.300
  204    HB2  ASP  44           HB1      ASP  44  -2.359   4.166   3.875
  205    HB3  ASP  44           HB2      ASP  44  -1.744   4.031   2.222
  206    HD2  ASP  44           HD       ASP  44  -0.751   7.366   2.159
  207    H    THR  45           H        THR  45  -5.247   4.089   4.293
  208    HA   THR  45           HA       THR  45  -5.267   1.306   4.065
  209    HB   THR  45           HB       THR  45  -7.726   2.554   5.141
  210    HG1  THR  45           HG1      THR  45  -6.449   4.113   5.947
  211   HG21  THR  45          HG21      THR  45  -7.401   0.989   6.912
  212   HG22  THR  45          HG22      THR  45  -5.728   0.704   6.435
  213   HG23  THR  45          HG23      THR  45  -7.046   0.145   5.406
  214    H    ASP  46           H        ASP  46  -7.054   3.729   2.359
  215    HA   ASP  46           HA       ASP  46  -9.210   2.107   1.483
  216    HB2  ASP  46           HB1      ASP  46  -8.754   4.747   1.403
  217    HB3  ASP  46           HB2      ASP  46  -8.259   4.333  -0.244
  218    HD2  ASP  46           HD       ASP  46 -11.805   2.939  -0.190
  219    H    CYS  47           H        CYS  47  -5.935   2.535   0.408
  220    HA   CYS  47           HA       CYS  47  -6.479   0.867  -1.955
  221    HB2  CYS  47           HB1      CYS  47  -4.233   2.794  -1.343
  222    HB3  CYS  47           HB2      CYS  47  -4.206   1.690  -2.719
  223    H    ASN  48           H        ASN  48  -6.501  -1.058  -0.662
  224    HA   ASN  48           HA       ASN  48  -4.495  -1.918   1.048
  225    HB2  ASN  48           HB1      ASN  48  -6.633  -3.202  -0.539
  226    HB3  ASN  48           HB2      ASN  48  -5.289  -4.261  -0.094
  227   HD21  ASN  48          HD21      ASN  48  -8.215  -3.737   0.809
  228   HD22  ASN  48          HD22      ASN  48  -8.097  -3.810   2.531
  229    H    THR  49           H        THR  49  -4.709  -2.158  -2.468
  230    HA   THR  49           HA       THR  49  -2.560  -3.838  -2.970
  231    HB   THR  49           HB       THR  49  -2.674  -1.657  -4.891
  232    HG1  THR  49           HG1      THR  49  -4.827  -1.777  -5.385
  233   HG21  THR  49          HG21      THR  49  -3.051  -4.623  -4.855
  234   HG22  THR  49          HG22      THR  49  -1.872  -3.653  -5.737
  235   HG23  THR  49          HG23      THR  49  -3.552  -3.699  -6.271
  236    H    ARG  50           H        ARG  50  -0.508  -3.010  -4.170
  237    HA   ARG  50           HA       ARG  50   0.992  -1.491  -2.252
  238    HB2  ARG  50           HB1      ARG  50   1.929  -2.373  -4.985
  239    HB3  ARG  50           HB2      ARG  50   2.912  -2.038  -3.552
  240    HG2  ARG  50           HG1      ARG  50   2.866  -4.195  -3.052
  241    HG3  ARG  50           HG2      ARG  50   1.119  -4.057  -2.798
  242    HD2  ARG  50           HD1      ARG  50   0.596  -4.904  -4.868
  243    HD3  ARG  50           HD2      ARG  50   2.105  -4.329  -5.589
  244    HE   ARG  50           HE       ARG  50   1.657  -6.862  -4.314
  245   HH11  ARG  50          HH11      ARG  50   4.045  -4.476  -5.169
  246   HH12  ARG  50          HH12      ARG  50   5.362  -5.602  -5.163
  247   HH21  ARG  50          HH21      ARG  50   3.384  -8.354  -4.303
  248   HH22  ARG  50          HH22      ARG  50   4.984  -7.807  -4.671
  249    H    LYS  51           H        LYS  51  -0.459   0.436  -2.569
  250    HA   LYS  51           HA       LYS  51   0.862   2.285  -4.382
  251    HB2  LYS  51           HB1      LYS  51  -2.130   1.819  -4.447
  252    HB3  LYS  51           HB2      LYS  51  -1.285   3.135  -5.279
  253    HG2  LYS  51           HG1      LYS  51  -0.045   1.493  -6.621
  254    HG3  LYS  51           HG2      LYS  51  -0.932   0.190  -5.809
  255    HD2  LYS  51           HD1      LYS  51  -3.016   0.913  -6.729
  256    HD3  LYS  51           HD2      LYS  51  -2.283   2.406  -7.342
  257    HE2  LYS  51           HE1      LYS  51  -2.236   1.209  -9.279
  258    HE3  LYS  51           HE2      LYS  51  -0.708   0.650  -8.583
  259    HZ1  LYS  51           HZ1      LYS  51  -1.946  -1.257  -7.637
  260    HZ2  LYS  51           HZ2      LYS  51  -1.932  -1.235  -9.328
  261    HZ3  LYS  51           HZ3      LYS  51  -3.319  -0.755  -8.487
  262    H    PHE  52           H        PHE  52   0.641   4.464  -3.783
  263    HA   PHE  52           HA       PHE  52  -0.293   4.832  -1.026
  264    HB2  PHE  52           HB1      PHE  52   1.200   6.676  -0.854
  265    HB3  PHE  52           HB2      PHE  52   2.095   5.380  -1.650
  266    HD1  PHE  52           HD1      PHE  52   0.910   8.754  -1.924
  267    HD2  PHE  52           HD2      PHE  52   2.385   5.437  -4.146
  268    HE1  PHE  52           HE1      PHE  52   1.450  10.254  -3.799
  269    HE2  PHE  52           HE2      PHE  52   2.928   6.932  -6.024
  270    HZ   PHE  52           HZ       PHE  52   2.461   9.344  -5.851
  271    H    CYS  53           H        CYS  53  -1.216   7.006  -0.509
  272    HA   CYS  53           HA       CYS  53  -3.136   7.759  -2.602
  273    HB2  CYS  53           HB1      CYS  53  -3.234   7.619   0.362
  274    HB3  CYS  53           HB2      CYS  53  -4.118   8.947  -0.387
  275    H    LEU  54           H        LEU  54  -2.053   9.295  -3.765
  276    HA   LEU  54           HA       LEU  54  -0.515  11.373  -2.562
  277    HB2  LEU  54           HB1      LEU  54  -0.403  10.366  -4.960
  278    HB3  LEU  54           HB2      LEU  54  -1.670  11.552  -5.315
  279    HG   LEU  54           HG       LEU  54   0.737  12.627  -3.994
  280   HD11  LEU  54          HD11      LEU  54   1.661  12.702  -6.500
  281   HD12  LEU  54          HD12      LEU  54   0.856  11.133  -6.541
  282   HD13  LEU  54          HD13      LEU  54   2.113  11.447  -5.346
  283   HD21  LEU  54          HD21      LEU  54  -0.643  14.319  -4.625
  284   HD22  LEU  54          HD22      LEU  54  -1.289  13.431  -6.005
  285   HD23  LEU  54          HD23      LEU  54   0.304  14.181  -6.106
  286    H    GLN  55           H        GLN  55  -1.098  13.365  -1.922
  287    HA   GLN  55           HA       GLN  55  -3.869  14.215  -2.446
  288    HB2  GLN  55           HB1      GLN  55  -2.299  14.848   0.057
  289    HB3  GLN  55           HB2      GLN  55  -4.019  15.138  -0.243
  290    HG2  GLN  55           HG1      GLN  55  -4.225  12.593  -0.486
  291    HG3  GLN  55           HG2      GLN  55  -2.626  12.538   0.270
  292   HE21  GLN  55          HE21      GLN  55  -2.394  13.110   2.418
  293   HE22  GLN  55          HE22      GLN  55  -3.741  13.282   3.485
  294    HA   PRO  56           HA       PRO  56  -1.157  17.461  -4.204
  295    HB2  PRO  56           HB1      PRO  56  -2.902  18.134  -6.205
  296    HB3  PRO  56           HB2      PRO  56  -1.763  16.793  -6.317
  297    HG2  PRO  56           HG1      PRO  56  -4.668  16.764  -5.572
  298    HG3  PRO  56           HG2      PRO  56  -3.767  15.674  -6.692
  299    HD2  PRO  56           HD1      PRO  56  -4.421  14.957  -4.158
  300    HD3  PRO  56           HD2      PRO  56  -2.931  14.417  -4.950
  301    H    ARG  57           H        ARG  57  -1.318  19.700  -4.075
  302    HA   ARG  57           HA       ARG  57  -3.377  20.680  -2.299
  303    HB2  ARG  57           HB1      ARG  57  -0.693  21.362  -2.890
  304    HB3  ARG  57           HB2      ARG  57  -1.685  22.768  -3.303
  305    HG2  ARG  57           HG1      ARG  57  -2.421  23.077  -1.131
  306    HG3  ARG  57           HG2      ARG  57  -2.060  21.403  -0.674
  307    HD2  ARG  57           HD1      ARG  57   0.256  21.804  -0.546
  308    HD3  ARG  57           HD2      ARG  57   0.116  23.316  -1.455
  309    HE   ARG  57           HE       ARG  57  -1.302  23.337   1.047
  310   HH11  ARG  57          HH11      ARG  57   1.758  23.884  -0.521
  311   HH12  ARG  57          HH12      ARG  57   2.340  24.962   0.703
  312   HH21  ARG  57          HH21      ARG  57  -0.546  24.755   2.666
  313   HH22  ARG  57          HH22      ARG  57   1.030  25.456   2.517
  314    H    ASP  58           H        ASP  58  -2.591  20.832  -5.681
  315    HA   ASP  58           HA       ASP  58  -4.487  22.977  -6.191
  316    HB2  ASP  58           HB1      ASP  58  -2.878  21.317  -8.151
  317    HB3  ASP  58           HB2      ASP  58  -3.769  22.800  -8.515
  318    HD2  ASP  58           HD       ASP  58  -1.340  24.683  -6.668
  319    H    GLU  59           H        GLU  59  -4.369  19.533  -6.208
  320    HA   GLU  59           HA       GLU  59  -7.060  19.464  -7.408
  321    HB2  GLU  59           HB1      GLU  59  -4.735  17.580  -7.740
  322    HB3  GLU  59           HB2      GLU  59  -6.400  17.043  -8.020
  323    HG2  GLU  59           HG1      GLU  59  -6.661  18.866  -9.689
  324    HG3  GLU  59           HG2      GLU  59  -4.944  19.239  -9.473
  325    HE2  GLU  59           HE       GLU  59  -4.417  17.018 -12.043
  326    H    LYS  60           H        LYS  60  -7.989  17.089  -6.838
  327    HA   LYS  60           HA       LYS  60  -8.204  17.112  -3.944
  328    HB2  LYS  60           HB1      LYS  60  -9.771  16.024  -6.211
  329    HB3  LYS  60           HB2      LYS  60  -9.827  15.088  -4.708
  330    HG2  LYS  60           HG1      LYS  60 -10.813  16.828  -3.503
  331    HG3  LYS  60           HG2      LYS  60 -10.349  18.037  -4.712
  332    HD2  LYS  60           HD1      LYS  60 -11.873  16.416  -6.244
  333    HD3  LYS  60           HD2      LYS  60 -12.649  16.185  -4.668
  334    HE2  LYS  60           HE1      LYS  60 -13.529  18.258  -4.652
  335    HE3  LYS  60           HE2      LYS  60 -12.040  18.979  -5.279
  336    HZ1  LYS  60           HZ1      LYS  60 -12.976  17.617  -7.414
  337    HZ2  LYS  60           HZ2      LYS  60 -13.216  19.269  -7.137
  338    HZ3  LYS  60           HZ3      LYS  60 -14.408  18.154  -6.690
  339    HA   PRO  61           HA       PRO  61  -5.700  13.621  -3.052
  340    HB2  PRO  61           HB1      PRO  61  -7.151  12.325  -1.125
  341    HB3  PRO  61           HB2      PRO  61  -6.320  13.854  -0.853
  342    HG2  PRO  61           HG1      PRO  61  -9.201  13.348  -1.513
  343    HG3  PRO  61           HG2      PRO  61  -8.492  14.451  -0.274
  344    HD2  PRO  61           HD1      PRO  61  -9.420  15.340  -2.665
  345    HD3  PRO  61           HD2      PRO  61  -8.037  16.079  -1.841
  346    H    PHE  62           H        PHE  62  -5.315  11.732  -4.029
  347    HA   PHE  62           HA       PHE  62  -7.467   9.840  -4.506
  348    HB2  PHE  62           HB1      PHE  62  -7.154   9.672  -6.871
  349    HB3  PHE  62           HB2      PHE  62  -7.418  11.376  -6.494
  350    HD1  PHE  62           HD1      PHE  62  -5.321   9.081  -8.165
  351    HD2  PHE  62           HD2      PHE  62  -5.301  12.835  -6.158
  352    HE1  PHE  62           HE1      PHE  62  -3.227   9.678  -9.311
  353    HE2  PHE  62           HE2      PHE  62  -3.207  13.438  -7.301
  354    HZ   PHE  62           HZ       PHE  62  -2.168  11.860  -8.879
  355    H    CYS  63           H        CYS  63  -6.415   7.910  -5.867
  356    HA   CYS  63           HA       CYS  63  -4.054   7.134  -4.327
  357    HB2  CYS  63           HB1      CYS  63  -6.274   5.750  -4.653
  358    HB3  CYS  63           HB2      CYS  63  -5.505   5.271  -6.168
  359    H    ALA  64           H        ALA  64  -2.090   6.897  -5.194
  360    HA   ALA  64           HA       ALA  64  -1.850   7.080  -8.127
  361    HB1  ALA  64           HB1      ALA  64   0.585   7.832  -6.858
  362    HB2  ALA  64           HB2      ALA  64  -0.485   8.807  -7.866
  363    HB3  ALA  64           HB3      ALA  64  -0.739   8.736  -6.123
  364    H    THR  65           H        THR  65  -0.944   5.403  -9.117
  365    HA   THR  65           HA       THR  65  -0.243   3.035  -7.878
  366    HB   THR  65           HB       THR  65  -0.709   2.971 -10.207
  367    HG1  THR  65           HG1      THR  65   2.096   2.544 -10.099
  368   HG21  THR  65          HG21      THR  65   1.640   4.838 -10.554
  369   HG22  THR  65          HG22      THR  65  -0.060   5.210 -10.843
  370   HG23  THR  65          HG23      THR  65   0.779   4.053 -11.877
  371    H    CYS  66           H        CYS  66   1.857   1.955  -7.760
  372    HA   CYS  66           HA       CYS  66   3.728   3.410  -6.272
  373    HB2  CYS  66           HB1      CYS  66   3.565   1.027  -6.008
  374    HB3  CYS  66           HB2      CYS  66   3.970   0.762  -7.705
  375    H    ARG  67           H        ARG  67   5.666   4.356  -6.751
  376    HA   ARG  67           HA       ARG  67   6.099   5.005  -9.562
  377    HB2  ARG  67           HB1      ARG  67   7.175   6.136  -6.978
  378    HB3  ARG  67           HB2      ARG  67   7.816   6.609  -8.559
  379    HG2  ARG  67           HG1      ARG  67   6.085   7.951  -9.009
  380    HG3  ARG  67           HG2      ARG  67   4.908   6.784  -8.384
  381    HD2  ARG  67           HD1      ARG  67   4.777   7.814  -6.401
  382    HD3  ARG  67           HD2      ARG  67   6.538   7.927  -6.272
  383    HE   ARG  67           HE       ARG  67   6.386  10.099  -6.942
  384   HH11  ARG  67          HH11      ARG  67   3.518   8.421  -7.978
  385   HH12  ARG  67          HH12      ARG  67   2.747   9.847  -8.591
  386   HH21  ARG  67          HH21      ARG  67   5.383  11.983  -7.744
  387   HH22  ARG  67          HH22      ARG  67   3.810  11.872  -8.458
  388    H    GLY  68           H        GLY  68   8.685   5.451  -9.865
  389    HA2  GLY  68           HA2      GLY  68   9.846   2.773  -9.588
  390    HA3  GLY  68           HA3      GLY  68  10.372   4.014 -10.715
  391    HA1  GLY  68           HA1      GLY  68   9.659   3.244  -8.867
  392    H    LEU  69           H        LEU  69  12.452   3.072  -9.687
  393    HA   LEU  69           HA       LEU  69  13.106   4.068  -7.068
  394    HB2  LEU  69           HB1      LEU  69  14.776   2.784  -9.233
  395    HB3  LEU  69           HB2      LEU  69  15.394   3.241  -7.636
  396    HG   LEU  69           HG       LEU  69  13.316   1.141  -8.239
  397   HD11  LEU  69          HD11      LEU  69  15.480   0.312  -8.728
  398   HD12  LEU  69          HD12      LEU  69  15.044  -0.322  -7.141
  399   HD13  LEU  69          HD13      LEU  69  16.163   1.036  -7.273
  400   HD21  LEU  69          HD21      LEU  69  12.676   2.215  -6.201
  401   HD22  LEU  69          HD22      LEU  69  14.336   2.201  -5.608
  402   HD23  LEU  69          HD23      LEU  69  13.451   0.686  -5.788
  403    H    ARG  70           H        ARG  70  13.243   5.260 -10.278
  404    HA   ARG  70           HA       ARG  70  15.293   7.234  -9.704
  405    HB2  ARG  70           HB1      ARG  70  13.569   6.763 -12.146
  406    HB3  ARG  70           HB2      ARG  70  14.828   8.001 -12.032
  407    HG2  ARG  70           HG1      ARG  70  15.805   5.355 -11.308
  408    HG3  ARG  70           HG2      ARG  70  15.159   5.431 -12.955
  409    HD2  ARG  70           HD1      ARG  70  17.211   7.340 -11.814
  410    HD3  ARG  70           HD2      ARG  70  17.577   5.943 -12.837
  411    HE   ARG  70           HE       ARG  70  16.653   8.486 -13.704
  412   HH11  ARG  70          HH11      ARG  70  16.444   5.079 -14.392
  413   HH12  ARG  70          HH12      ARG  70  16.108   5.307 -16.076
  414   HH21  ARG  70          HH21      ARG  70  16.210   8.799 -15.920
  415   HH22  ARG  70          HH22      ARG  70  15.976   7.423 -16.944
  416    H    ARG  71           H        ARG  71  11.851   6.967  -9.683
  417    HA   ARG  71           HA       ARG  71  11.074   9.616 -10.046
  418    HB2  ARG  71           HB1      ARG  71   9.903   7.175  -9.017
  419    HB3  ARG  71           HB2      ARG  71   9.367   8.579  -8.083
  420    HG2  ARG  71           HG1      ARG  71   7.839   8.055  -9.933
  421    HG3  ARG  71           HG2      ARG  71   8.567   9.664 -10.086
  422    HD2  ARG  71           HD1      ARG  71  10.225   8.763 -11.673
  423    HD3  ARG  71           HD2      ARG  71   9.465   7.171 -11.529
  424    HE   ARG  71           HE       ARG  71   8.569   9.346 -13.132
  425   HH11  ARG  71          HH11      ARG  71   7.473   6.625 -11.257
  426   HH12  ARG  71          HH12      ARG  71   6.005   6.429 -12.158
  427   HH21  ARG  71          HH21      ARG  71   6.641   9.099 -14.325
  428   HH22  ARG  71          HH22      ARG  71   5.534   7.836 -13.904
  429    H    ARG  72           H        ARG  72  11.466  11.402  -8.928
  430    HA   ARG  72           HA       ARG  72  12.932  11.366  -6.494
  431    HB2  ARG  72           HB1      ARG  72  11.478  13.621  -7.894
  432    HB3  ARG  72           HB2      ARG  72  12.583  13.826  -6.525
  433    HG2  ARG  72           HG1      ARG  72  13.444  12.516  -9.094
  434    HG3  ARG  72           HG2      ARG  72  13.520  14.267  -8.841
  435    HD2  ARG  72           HD1      ARG  72  14.777  12.319  -6.913
  436    HD3  ARG  72           HD2      ARG  72  15.629  12.919  -8.342
  437    HE   ARG  72           HE       ARG  72  15.199  14.322  -5.912
  438   HH11  ARG  72          HH11      ARG  72  15.427  14.757  -9.358
  439   HH12  ARG  72          HH12      ARG  72  15.959  16.403  -9.247
  440   HH21  ARG  72          HH21      ARG  72  15.898  16.488  -5.753
  441   HH22  ARG  72          HH22      ARG  72  16.227  17.386  -7.196
  442    H    CYS  73           H        CYS  73  12.298  11.711  -4.411
  443    HA   CYS  73           HA       CYS  73   9.497  12.297  -3.844
  444    HB2  CYS  73           HB1      CYS  73   9.139  10.397  -2.457
  445    HB3  CYS  73           HB2      CYS  73   9.765   9.793  -3.992
  446    H    GLN  74           H        GLN  74   9.134  12.705  -1.506
  447    HA   GLN  74           HA       GLN  74  11.576  13.726  -0.212
  448    HB2  GLN  74           HB1      GLN  74   8.997  15.027  -0.799
  449    HB3  GLN  74           HB2      GLN  74   9.599  15.275   0.847
  450    HG2  GLN  74           HG1      GLN  74  11.584  16.301   0.090
  451    HG3  GLN  74           HG2      GLN  74  11.296  15.775  -1.575
  452   HE21  GLN  74          HE21      GLN  74   9.677  17.647   0.969
  453   HE22  GLN  74          HE22      GLN  74   9.106  18.897  -0.077
  454    H    ARG  75           H        ARG  75   8.438  12.212   0.189
  455    HA   ARG  75           HA       ARG  75   9.246  11.413   2.906
  456    HB2  ARG  75           HB1      ARG  75   6.745  11.385   3.421
  457    HB3  ARG  75           HB2      ARG  75   7.523  12.970   3.295
  458    HG2  ARG  75           HG1      ARG  75   6.656  13.262   1.045
  459    HG3  ARG  75           HG2      ARG  75   5.926  11.649   1.111
  460    HD2  ARG  75           HD1      ARG  75   4.192  12.330   2.397
  461    HD3  ARG  75           HD2      ARG  75   5.205  13.440   3.331
  462    HE   ARG  75           HE       ARG  75   5.029  14.658   0.923
  463   HH11  ARG  75          HH11      ARG  75   2.667  13.362   3.129
  464   HH12  ARG  75          HH12      ARG  75   1.434  14.492   2.677
  465   HH21  ARG  75          HH21      ARG  75   3.413  16.151   0.320
  466   HH22  ARG  75          HH22      ARG  75   1.859  16.077   1.078
  467    H    ASP  76           H        ASP  76   8.876   9.309   3.480
  468    HA   ASP  76           HA       ASP  76   8.808   7.351   1.508
  469    HB2  ASP  76           HB1      ASP  76   9.418   7.301   4.100
  470    HB3  ASP  76           HB2      ASP  76   7.770   6.670   4.218
  471    HD2  ASP  76           HD       ASP  76   8.813   3.904   2.113
  472    H    ALA  77           H        ALA  77   6.217   9.026   3.076
  473    HA   ALA  77           HA       ALA  77   4.142   7.166   2.543
  474    HB1  ALA  77           HB1      ALA  77   3.257   8.590   4.019
  475    HB2  ALA  77           HB2      ALA  77   4.358   9.890   3.563
  476    HB3  ALA  77           HB3      ALA  77   2.894   9.605   2.624
  477    H    MET  78           H        MET  78   5.655   9.702   0.671
  478    HA   MET  78           HA       MET  78   3.658   9.892  -1.339
  479    HB2  MET  78           HB1      MET  78   6.446  10.836  -0.966
  480    HB3  MET  78           HB2      MET  78   5.878  10.702  -2.637
  481    HG2  MET  78           HG1      MET  78   4.297  12.175  -0.546
  482    HG3  MET  78           HG2      MET  78   5.597  12.944  -1.460
  483    HE1  MET  78           HE1      MET  78   5.786  13.007  -3.897
  484    HE2  MET  78           HE2      MET  78   5.047  11.567  -4.596
  485    HE3  MET  78           HE3      MET  78   4.427  13.166  -5.009
  486    H    CYS  79           H        CYS  79   6.380   7.775  -0.811
  487    HA   CYS  79           HA       CYS  79   6.088   6.596  -3.471
  488    HB2  CYS  79           HB1      CYS  79   8.320   7.142  -2.074
  489    HB3  CYS  79           HB2      CYS  79   8.037   5.490  -1.524
  490    H    CYS  80           H        CYS  80   5.598   4.420  -3.803
  491    HA   CYS  80           HA       CYS  80   3.589   3.302  -2.283
  492    HB2  CYS  80           HB1      CYS  80   4.195   1.130  -3.432
  493    HB3  CYS  80           HB2      CYS  80   3.900   2.504  -4.499
  494    HA   PRO  81           HA       PRO  81   5.399   1.412   1.240
  495    HB2  PRO  81           HB1      PRO  81   3.840  -0.822   1.527
  496    HB3  PRO  81           HB2      PRO  81   3.273   0.812   1.870
  497    HG2  PRO  81           HG1      PRO  81   2.908  -0.848  -0.601
  498    HG3  PRO  81           HG2      PRO  81   1.698   0.144   0.295
  499    HD2  PRO  81           HD1      PRO  81   2.887   0.996  -1.994
  500    HD3  PRO  81           HD2      PRO  81   2.431   2.098  -0.682
  501    H    GLY  82           H        GLY  82   7.360   0.508   1.224
  502    HA2  GLY  82           HA2      GLY  82   8.240  -1.915   1.186
  503    HA3  GLY  82           HA3      GLY  82   7.832  -1.817  -0.520
  504    HA1  GLY  82           HA1      GLY  82   8.407  -1.072   1.385
  505    H    THR  83           H        THR  83   8.668   1.153  -0.262
  506    HA   THR  83           HA       THR  83  11.559   0.646  -0.534
  507    HB   THR  83           HB       THR  83  11.284   2.927  -1.920
  508    HG1  THR  83           HG1      THR  83   8.868   1.511  -2.449
  509   HG21  THR  83          HG21      THR  83  11.866   0.303  -2.500
  510   HG22  THR  83          HG22      THR  83  11.965   1.650  -3.635
  511   HG23  THR  83          HG23      THR  83  10.514   0.649  -3.579
  512    H    LEU  84           H        LEU  84  12.827   2.806  -0.328
  513    HA   LEU  84           HA       LEU  84  11.750   4.350   1.935
  514    HB2  LEU  84           HB1      LEU  84  13.629   2.551   2.350
  515    HB3  LEU  84           HB2      LEU  84  14.676   3.829   1.707
  516    HG   LEU  84           HG       LEU  84  13.641   5.324   3.521
  517   HD11  LEU  84          HD11      LEU  84  12.028   3.144   3.931
  518   HD12  LEU  84          HD12      LEU  84  12.272   4.474   5.064
  519   HD13  LEU  84          HD13      LEU  84  13.221   2.996   5.222
  520   HD21  LEU  84          HD21      LEU  84  15.435   3.013   4.254
  521   HD22  LEU  84          HD22      LEU  84  15.234   4.488   5.199
  522   HD23  LEU  84          HD23      LEU  84  15.941   4.564   3.585
  523    H    CYS  85           H        CYS  85  11.933   6.510   1.791
  524    HA   CYS  85           HA       CYS  85  12.856   7.652  -0.676
  525    HB2  CYS  85           HB1      CYS  85  11.441   8.617   1.758
  526    HB3  CYS  85           HB2      CYS  85  12.323   9.820   0.815
  527    H    VAL  86           H        VAL  86  15.007   7.709  -0.967
  528    HA   VAL  86           HA       VAL  86  16.614   9.049   1.105
  529    HB   VAL  86           HB       VAL  86  17.585   6.783  -0.640
  530   HG11  VAL  86          HG11      VAL  86  19.485   6.858   1.067
  531   HG12  VAL  86          HG12      VAL  86  19.431   8.142  -0.142
  532   HG13  VAL  86          HG13      VAL  86  18.869   8.451   1.503
  533   HG21  VAL  86          HG21      VAL  86  17.719   6.045   2.053
  534   HG22  VAL  86          HG22      VAL  86  16.117   6.751   1.838
  535   HG23  VAL  86          HG23      VAL  86  16.630   5.404   0.822
  536    H    ASN  87           H        ASN  87  18.132  10.508   0.406
  537    HA   ASN  87           HA       ASN  87  19.068  12.073  -0.955
  538    HB2  ASN  87           HB1      ASN  87  19.830   9.701  -1.954
  539    HB3  ASN  87           HB2      ASN  87  18.924  10.310  -3.345
  540   HD21  ASN  87          HD21      ASN  87  19.425  12.803  -3.664
  541   HD22  ASN  87          HD22      ASN  87  21.112  13.156  -3.773
  542    H    ASP  88           H        ASP  88  16.181  11.962  -0.742
  543    HA   ASP  88           HA       ASP  88  14.362  13.029  -1.599
  544    HB2  ASP  88           HB1      ASP  88  16.577  14.515  -2.466
  545    HB3  ASP  88           HB2      ASP  88  15.568  14.307  -3.903
  546    HD2  ASP  88           HD       ASP  88  12.894  16.034  -2.277
  547    H    VAL  89           H        VAL  89  15.340  10.412  -2.653
  548    HA   VAL  89           HA       VAL  89  13.526  10.288  -4.928
  549    HB   VAL  89           HB       VAL  89  15.741  10.684  -5.942
  550   HG11  VAL  89          HG11      VAL  89  16.478   8.160  -4.473
  551   HG12  VAL  89          HG12      VAL  89  17.425   8.835  -5.800
  552   HG13  VAL  89          HG13      VAL  89  17.211   9.756  -4.310
  553   HG21  VAL  89          HG21      VAL  89  14.709   7.883  -6.383
  554   HG22  VAL  89          HG22      VAL  89  14.042   9.345  -7.111
  555   HG23  VAL  89          HG23      VAL  89  15.680   8.828  -7.513
  556    H    CYS  90           H        CYS  90  12.675   8.226  -5.311
  557    HA   CYS  90           HA       CYS  90  12.398   6.573  -3.051
  558    HB2  CYS  90           HB1      CYS  90  11.711   6.172  -5.964
  559    HB3  CYS  90           HB2      CYS  90  11.339   4.966  -4.731
  560    H    THR  91           H        THR  91  14.076   5.495  -2.222
  561    HA   THR  91           HA       THR  91  15.829   4.004  -4.059
  562    HB   THR  91           HB       THR  91  16.385   4.883  -1.218
  563    HG1  THR  91           HG1      THR  91  16.604   6.671  -2.461
  564   HG21  THR  91          HG21      THR  91  18.046   3.384  -3.238
  565   HG22  THR  91          HG22      THR  91  17.587   2.868  -1.615
  566   HG23  THR  91          HG23      THR  91  18.735   4.189  -1.829
  567    H    THR  92           H        THR  92  15.987   1.838  -3.909
  568    HA   THR  92           HA       THR  92  14.031   0.374  -2.491
  569    HB   THR  92           HB       THR  92  16.055  -1.444  -3.133
  570    HG1  THR  92           HG1      THR  92  17.177  -0.553  -4.679
  571   HG21  THR  92          HG21      THR  92  13.432  -0.619  -4.183
  572   HG22  THR  92          HG22      THR  92  14.040  -2.226  -3.786
  573   HG23  THR  92          HG23      THR  92  14.459  -1.479  -5.328
  574    H    MET  93           H        MET  93  14.101  -0.759  -0.609
  575    HA   MET  93           HA       MET  93  15.813   0.035   1.437
  576    HB2  MET  93           HB1      MET  93  13.654  -1.860   1.084
  577    HB3  MET  93           HB2      MET  93  14.915  -2.529   2.130
  578    HG2  MET  93           HG1      MET  93  14.523   0.118   2.995
  579    HG3  MET  93           HG2      MET  93  12.919  -0.566   2.724
  580    HE1  MET  93           HE1      MET  93  16.329  -0.975   4.449
  581    HE2  MET  93           HE2      MET  93  15.330   0.052   5.477
  582    HE3  MET  93           HE3      MET  93  15.844  -1.536   6.050
  583    H    GLU  94           H        GLU  94  15.939  -2.831  -0.644
  584    HA   GLU  94           HA       GLU  94  18.115  -4.087   0.613
  585    HB2  GLU  94           HB1      GLU  94  16.822  -4.259  -2.073
  586    HB3  GLU  94           HB2      GLU  94  18.409  -5.014  -1.855
  587    HG2  GLU  94           HG1      GLU  94  17.447  -6.241   0.122
  588    HG3  GLU  94           HG2      GLU  94  15.863  -5.641  -0.389
  589    HE2  GLU  94           HE       GLU  94  15.935  -8.709  -2.075
  590    H    ASP  95           H        ASP  95  17.935  -1.480  -1.688
  591    HA   ASP  95           HA       ASP  95  20.749  -1.567  -2.335
  592    HB2  ASP  95           HB1      ASP  95  18.411   0.116  -3.125
  593    HB3  ASP  95           HB2      ASP  95  20.029   0.805  -3.310
  594    HD2  ASP  95           HD       ASP  95  19.086  -2.296  -5.607
  595    H    ALA  96           H        ALA  96  18.601   0.369  -0.309
  596    HA   ALA  96           HA       ALA  96  20.402   2.367   0.443
  597    HB1  ALA  96           HB1      ALA  96  18.656   1.640   2.622
  598    HB2  ALA  96           HB2      ALA  96  18.666   3.095   1.625
  599    HB3  ALA  96           HB3      ALA  96  17.785   1.664   1.088
  600    H    THR  97           H        THR  97  20.880   2.517   3.009
  601    HA   THR  97           HA       THR  97  22.236   1.853   4.714
  602    HB   THR  97           HB       THR  97  21.858  -1.028   3.971
  603    HG1  THR  97           HG1      THR  97  19.850  -0.857   5.223
  604   HG21  THR  97          HG21      THR  97  22.818  -1.286   5.966
  605   HG22  THR  97          HG22      THR  97  21.418  -0.509   6.705
  606   HG23  THR  97          HG23      THR  97  22.816   0.456   6.232
  607    H    GLU  98           H        GLU  98  24.200   2.574   4.018
  608    HA   GLU  98           HA       GLU  98  26.354   2.487   3.293
  609    HB2  GLU  98           HB1      GLU  98  26.057   0.236   4.646
  610    HB3  GLU  98           HB2      GLU  98  26.243  -0.486   3.041
  611    HG2  GLU  98           HG1      GLU  98  28.351   1.030   2.882
  612    HG3  GLU  98           HG2      GLU  98  28.212   1.076   4.645
  613    HE2  GLU  98           HE       GLU  98  28.878  -2.412   4.824
  614    H    ASN  99           H        ASN  99  26.140   3.433   1.303
  615    HA   ASN  99           HA       ASN  99  26.525   1.715  -0.975
  616    HB2  ASN  99           HB1      ASN  99  24.018   1.826  -0.672
  617    HB3  ASN  99           HB2      ASN  99  24.131   3.558  -1.008
  618   HD21  ASN  99          HD21      ASN  99  22.970   3.520  -2.883
  619   HD22  ASN  99          HD22      ASN  99  23.533   2.770  -4.333
  620    H    LEU 100           H        LEU 100  28.520   2.970  -0.742
  621    HA   LEU 100           HA       LEU 100  29.954   4.622  -1.362
  622    HB2  LEU 100           HB1      LEU 100  28.147   4.232  -3.457
  623    HB3  LEU 100           HB2      LEU 100  28.251   5.989  -3.254
  624    HG   LEU 100           HG       LEU 100  30.877   5.345  -3.258
  625   HD11  LEU 100          HD11      LEU 100  31.400   3.610  -4.694
  626   HD12  LEU 100          HD12      LEU 100  29.779   3.555  -5.385
  627   HD13  LEU 100          HD13      LEU 100  30.064   2.939  -3.757
  628   HD21  LEU 100          HD21      LEU 100  30.156   7.088  -4.611
  629   HD22  LEU 100          HD22      LEU 100  28.978   6.082  -5.454
  630   HD23  LEU 100          HD23      LEU 100  30.701   5.883  -5.776
  631    H    TYR 101           H        TYR 101  27.842   5.142   0.696
  632    HA   TYR 101           HA       TYR 101  26.916   7.780   0.549
  633    HB2  TYR 101           HB1      TYR 101  26.686   5.703   2.344
  634    HB3  TYR 101           HB2      TYR 101  27.638   6.883   3.247
  635    HD1  TYR 101           HD1      TYR 101  24.535   6.683   1.180
  636    HD2  TYR 101           HD2      TYR 101  26.561   8.576   4.407
  637    HE1  TYR 101           HE1      TYR 101  22.495   7.950   1.709
  638    HE2  TYR 101           HE2      TYR 101  24.525   9.848   4.945
  639    HH   TYR 101           HH       TYR 101  22.290   9.994   4.566
  640    H    PHE 102           H        PHE 102  27.674   9.702   1.524
  641    HA   PHE 102           HA       PHE 102  30.595   9.769   1.903
  642    HB2  PHE 102           HB1      PHE 102  30.625  11.999   1.007
  643    HB3  PHE 102           HB2      PHE 102  29.752  10.963  -0.123
  644    HD1  PHE 102           HD1      PHE 102  29.394  13.640   2.360
  645    HD2  PHE 102           HD2      PHE 102  27.417  11.252  -0.557
  646    HE1  PHE 102           HE1      PHE 102  27.461  15.160   2.430
  647    HE2  PHE 102           HE2      PHE 102  25.483  12.769  -0.493
  648    HZ   PHE 102           HZ       PHE 102  25.502  14.727   1.001
  649    H    GLN 103           H        GLN 103  31.393  11.466   3.361
  650    HA   GLN 103           HA       GLN 103  29.577  12.662   5.234
  651    HB2  GLN 103           HB1      GLN 103  30.371  10.052   5.785
  652    HB3  GLN 103           HB2      GLN 103  31.442  11.056   6.777
  653    HG2  GLN 103           HG1      GLN 103  28.908  12.167   7.122
  654    HG3  GLN 103           HG2      GLN 103  28.659  10.415   7.150
  655   HE21  GLN 103          HE21      GLN 103  29.564   9.188   8.784
  656   HE22  GLN 103          HE22      GLN 103  30.218   9.891  10.219
  657    H    SER 104           H        SER 104  30.473  14.630   5.133
  658    HA   SER 104           HA       SER 104  33.154  14.973   6.182
  659    HB2  SER 104           HB1      SER 104  33.719  14.751   3.865
  660    HB3  SER 104           HB2      SER 104  32.393  15.822   3.383
  661    HG   SER 104           HG       SER 104  34.811  16.489   4.678
  662    H    LEU 105           H        LEU 105  32.866  16.425   7.729
  663    HA   LEU 105           HA       LEU 105  31.706  18.990   7.142
  664    HB2  LEU 105           HB1      LEU 105  30.123  16.921   8.386
  665    HB3  LEU 105           HB2      LEU 105  30.347  18.292   9.488
  666    HG   LEU 105           HG       LEU 105  29.634  19.509   7.119
  667   HD11  LEU 105          HD11      LEU 105  27.600  17.367   7.429
  668   HD12  LEU 105          HD12      LEU 105  29.058  17.004   6.505
  669   HD13  LEU 105          HD13      LEU 105  28.016  18.342   6.019
  670   HD21  LEU 105          HD21      LEU 105  28.235  18.792   9.652
  671   HD22  LEU 105          HD22      LEU 105  27.315  19.536   8.343
  672   HD23  LEU 105          HD23      LEU 105  28.706  20.374   9.032
  673    H    GLU 106           H        GLU 106  32.794  20.495   8.232
  674    HA   GLU 106           HA       GLU 106  34.615  19.654  10.338
  675    HB2  GLU 106           HB1      GLU 106  35.579  21.899  10.128
  676    HB3  GLU 106           HB2      GLU 106  35.481  21.085   8.559
  677    HG2  GLU 106           HG1      GLU 106  33.562  22.379   7.925
  678    HG3  GLU 106           HG2      GLU 106  33.473  23.097   9.540
  679    HE2  GLU 106           HE       GLU 106  36.253  25.166   8.862
  680    H    HIS 107           H        HIS 107  34.871  21.118  12.256
  681    HA   HIS 107           HA       HIS 107  32.211  21.857  13.276
  682    HB2  HIS 107           HB1      HIS 107  33.270  21.574  15.546
  683    HB3  HIS 107           HB2      HIS 107  33.122  20.093  14.597
  684    HD1  HIS 107           HD1      HIS 107  35.651  22.380  16.074
  685    HD2  HIS 107           HD2      HIS 107  35.555  18.998  13.661
  686    HE1  HIS 107           HE1      HIS 107  38.015  21.526  16.018
  687    HE2  HIS 107           HE2      HIS 107  37.959  19.460  14.544
  688    H    HIS 108           H        HIS 108  31.856  23.970  13.286
  689    HA   HIS 108           HA       HIS 108  33.433  25.810  14.682
  690    HB2  HIS 108           HB1      HIS 108  34.611  25.240  12.271
  691    HB3  HIS 108           HB2      HIS 108  33.640  26.660  11.874
  692    HD1  HIS 108           HD1      HIS 108  36.920  25.976  12.773
  693    HD2  HIS 108           HD2      HIS 108  34.120  28.693  14.199
  694    HE1  HIS 108           HE1      HIS 108  38.252  27.774  13.921
  695    HE2  HIS 108           HE2      HIS 108  36.541  29.435  14.794
  696    H    HIS 109           H        HIS 109  30.691  25.069  14.363
  697    HA   HIS 109           HA       HIS 109  29.401  27.246  12.949
  698    HB2  HIS 109           HB1      HIS 109  28.481  24.790  14.394
  699    HB3  HIS 109           HB2      HIS 109  27.334  26.108  14.137
  700    HD1  HIS 109           HD1      HIS 109  27.070  23.299  12.769
  701    HD2  HIS 109           HD2      HIS 109  28.686  26.695  11.005
  702    HE1  HIS 109           HE1      HIS 109  26.839  22.942  10.291
  703    HE2  HIS 109           HE2      HIS 109  27.826  25.017   9.211
  704    H    HIS 110           H        HIS 110  29.797  29.152  13.970
  705    HA   HIS 110           HA       HIS 110  29.384  29.343  16.854
  706    HB2  HIS 110           HB1      HIS 110  31.325  30.424  15.457
  707    HB3  HIS 110           HB2      HIS 110  30.125  31.674  15.120
  708    HD1  HIS 110           HD1      HIS 110  31.298  29.907  18.293
  709    HD2  HIS 110           HD2      HIS 110  30.348  33.697  16.880
  710    HE1  HIS 110           HE1      HIS 110  31.666  31.460  20.235
  711    HE2  HIS 110           HE2      HIS 110  31.085  33.778  19.374
  712    H    HIS 111           H        HIS 111  28.137  30.733  13.839
  713    HA   HIS 111           HA       HIS 111  26.196  31.810  13.339
  714    HB2  HIS 111           HB1      HIS 111  25.173  30.401  15.818
  715    HB3  HIS 111           HB2      HIS 111  24.178  31.107  14.542
  716    HD1  HIS 111           HD1      HIS 111  24.844  30.006  12.026
  717    HD2  HIS 111           HD2      HIS 111  25.464  27.734  15.450
  718    HE1  HIS 111           HE1      HIS 111  24.963  27.621  11.238
  719    HE2  HIS 111           HE2      HIS 111  25.340  26.231  13.328
  720    H    HIS 112           H        HIS 112  24.333  33.195  14.487
  721    HA   HIS 112           HA       HIS 112  23.856  35.172  15.507
  722    HB2  HIS 112           HB1      HIS 112  24.977  33.452  17.487
  723    HB3  HIS 112           HB2      HIS 112  25.572  35.088  17.790
  724    HD1  HIS 112           HD1      HIS 112  24.145  36.267  19.410
  725    HD2  HIS 112           HD2      HIS 112  21.924  33.740  16.971
  726    HE1  HIS 112           HE1      HIS 112  21.758  36.539  20.155
  727    HE2  HIS 112           HE2      HIS 112  20.400  34.996  18.665
  Start of MODEL   28
    1    H1   MET  18           H        MET  18 -79.251   3.145 -23.109
    2    HA   MET  18           HA       MET  18 -80.180   3.982 -21.172
    3    HB2  MET  18           HB1      MET  18 -81.315   1.400 -21.280
    4    HB3  MET  18           HB2      MET  18 -80.650   1.587 -19.651
    5    HG2  MET  18           HG1      MET  18 -82.100   3.257 -19.080
    6    HG3  MET  18           HG2      MET  18 -82.263   3.819 -20.745
    7    HE1  MET  18           HE1      MET  18 -85.166   3.229 -18.776
    8    HE2  MET  18           HE2      MET  18 -84.540   4.267 -20.058
    9    HE3  MET  18           HE3      MET  18 -85.860   3.146 -20.396
   10    H    LEU  19           H        LEU  19 -78.056   1.176 -20.991
   11    HA   LEU  19           HA       LEU  19 -76.831   2.184 -18.542
   12    HB2  LEU  19           HB1      LEU  19 -76.955  -0.391 -19.957
   13    HB3  LEU  19           HB2      LEU  19 -75.377  -0.010 -19.244
   14    HG   LEU  19           HG       LEU  19 -76.786  -1.391 -17.771
   15   HD11  LEU  19          HD11      LEU  19 -76.658   1.194 -16.342
   16   HD12  LEU  19          HD12      LEU  19 -75.161   0.607 -17.067
   17   HD13  LEU  19          HD13      LEU  19 -76.021  -0.389 -15.893
   18   HD21  LEU  19          HD21      LEU  19 -78.817   0.343 -18.589
   19   HD22  LEU  19          HD22      LEU  19 -78.558   0.697 -16.880
   20   HD23  LEU  19          HD23      LEU  19 -78.930  -0.949 -17.395
   21    H    VAL  20           H        VAL  20 -75.263   3.633 -18.709
   22    HA   VAL  20           HA       VAL  20 -73.549   3.609 -21.098
   23    HB   VAL  20           HB       VAL  20 -72.958   5.914 -20.538
   24   HG11  VAL  20          HG11      VAL  20 -75.389   6.855 -20.673
   25   HG12  VAL  20          HG12      VAL  20 -74.734   5.905 -22.008
   26   HG13  VAL  20          HG13      VAL  20 -75.830   5.155 -20.847
   27   HG21  VAL  20          HG21      VAL  20 -74.747   6.808 -18.689
   28   HG22  VAL  20          HG22      VAL  20 -74.323   5.226 -18.035
   29   HG23  VAL  20          HG23      VAL  20 -73.061   6.417 -18.351
   30    H    LEU  21           H        LEU  21 -71.341   3.516 -20.936
   31    HA   LEU  21           HA       LEU  21 -70.290   2.407 -18.489
   32    HB2  LEU  21           HB1      LEU  21 -68.192   2.173 -19.772
   33    HB3  LEU  21           HB2      LEU  21 -69.591   1.428 -20.562
   34    HG   LEU  21           HG       LEU  21 -69.535   3.918 -21.710
   35   HD11  LEU  21          HD11      LEU  21 -67.373   4.376 -20.604
   36   HD12  LEU  21          HD12      LEU  21 -67.263   4.375 -22.364
   37   HD13  LEU  21          HD13      LEU  21 -66.680   2.988 -21.443
   38   HD21  LEU  21          HD21      LEU  21 -69.730   1.523 -22.651
   39   HD22  LEU  21          HD22      LEU  21 -67.982   1.628 -22.859
   40   HD23  LEU  21          HD23      LEU  21 -69.040   2.782 -23.675
   41    H    ASP  22           H        ASP  22 -68.557   3.251 -17.280
   42    HA   ASP  22           HA       ASP  22 -67.489   5.857 -17.820
   43    HB2  ASP  22           HB1      ASP  22 -68.343   6.901 -15.722
   44    HB3  ASP  22           HB2      ASP  22 -69.603   6.593 -16.924
   45    HD2  ASP  22           HD       ASP  22 -71.012   4.048 -14.939
   46    H    PHE  23           H        PHE  23 -65.718   6.371 -16.509
   47    HA   PHE  23           HA       PHE  23 -64.990   4.982 -14.174
   48    HB2  PHE  23           HB1      PHE  23 -64.697   3.340 -16.312
   49    HB3  PHE  23           HB2      PHE  23 -63.115   4.122 -16.296
   50    HD1  PHE  23           HD1      PHE  23 -61.452   3.048 -15.154
   51    HD2  PHE  23           HD2      PHE  23 -65.468   2.637 -13.804
   52    HE1  PHE  23           HE1      PHE  23 -60.693   1.536 -13.366
   53    HE2  PHE  23           HE2      PHE  23 -64.715   1.126 -12.014
   54    HZ   PHE  23           HZ       PHE  23 -62.325   0.574 -11.792
   55    H    ASN  24           H        ASN  24 -62.468   5.227 -13.835
   56    HA   ASN  24           HA       ASN  24 -61.050   7.228 -15.181
   57    HB2  ASN  24           HB1      ASN  24 -63.104   8.241 -13.467
   58    HB3  ASN  24           HB2      ASN  24 -61.535   8.633 -12.751
   59   HD21  ASN  24          HD21      ASN  24 -61.573  10.792 -13.153
   60   HD22  ASN  24          HD22      ASN  24 -61.513  11.471 -14.741
   61    H    ASN  25           H        ASN  25 -58.978   7.467 -14.380
   62    HA   ASN  25           HA       ASN  25 -58.158   6.829 -11.770
   63    HB2  ASN  25           HB1      ASN  25 -58.852   4.537 -12.907
   64    HB3  ASN  25           HB2      ASN  25 -57.240   4.671 -13.622
   65   HD21  ASN  25          HD21      ASN  25 -58.560   5.443 -10.420
   66   HD22  ASN  25          HD22      ASN  25 -57.411   4.505  -9.534
   67    H    ILE  26           H        ILE  26 -56.493   8.166 -11.602
   68    HA   ILE  26           HA       ILE  26 -54.399   8.087 -13.651
   69    HB   ILE  26           HB       ILE  26 -54.172  10.591 -13.445
   70   HG12  ILE  26          HG11      ILE  26 -57.032  10.823 -12.744
   71   HG13  ILE  26          HG12      ILE  26 -55.966  10.350 -11.409
   72   HG21  ILE  26          HG21      ILE  26 -55.955  11.054 -15.072
   73   HG22  ILE  26          HG22      ILE  26 -55.098   9.556 -15.432
   74   HG23  ILE  26          HG23      ILE  26 -56.694   9.501 -14.685
   75   HD11  ILE  26          HD11      ILE  26 -54.548  12.396 -12.407
   76   HD12  ILE  26          HD12      ILE  26 -56.180  12.917 -12.826
   77   HD13  ILE  26          HD13      ILE  26 -55.769  12.571 -11.147
   78    H    ARG  27           H        ARG  27 -52.343   8.338 -12.887
   79    HA   ARG  27           HA       ARG  27 -51.953   9.142 -10.105
   80    HB2  ARG  27           HB1      ARG  27 -50.460   7.183  -9.713
   81    HB3  ARG  27           HB2      ARG  27 -52.166   6.755  -9.914
   82    HG2  ARG  27           HG1      ARG  27 -51.771   6.037 -12.194
   83    HG3  ARG  27           HG2      ARG  27 -50.080   6.551 -12.075
   84    HD2  ARG  27           HD1      ARG  27 -49.543   4.531 -11.305
   85    HD3  ARG  27           HD2      ARG  27 -50.541   4.853  -9.881
   86    HE   ARG  27           HE       ARG  27 -52.133   3.441 -10.721
   87   HH11  ARG  27          HH11      ARG  27 -49.931   4.315 -13.271
   88   HH12  ARG  27          HH12      ARG  27 -50.598   3.193 -14.410
   89   HH21  ARG  27          HH21      ARG  27 -53.021   1.960 -12.211
   90   HH22  ARG  27          HH22      ARG  27 -52.356   1.854 -13.806
   91    H    SER  28           H        SER  28 -49.968  10.054  -9.682
   92    HA   SER  28           HA       SER  28 -48.155  10.331 -11.989
   93    HB2  SER  28           HB1      SER  28 -48.972  12.484 -11.838
   94    HB3  SER  28           HB2      SER  28 -49.229  12.371 -10.089
   95    HG   SER  28           HG       SER  28 -47.430  13.470 -10.019
   96    H    SER  29           H        SER  29 -45.987  10.135 -11.635
   97    HA   SER  29           HA       SER  29 -44.887  10.077  -8.973
   98    HB2  SER  29           HB1      SER  29 -45.536   7.585 -10.441
   99    HB3  SER  29           HB2      SER  29 -43.916   7.657  -9.724
  100    HG   SER  29           HG       SER  29 -44.802   7.920  -7.723
  101    H    ALA  30           H        ALA  30 -42.712  10.448  -8.959
  102    HA   ALA  30           HA       ALA  30 -40.976   9.942 -11.136
  103    HB1  ALA  30           HB1      ALA  30 -42.432  11.895 -11.955
  104    HB2  ALA  30           HB2      ALA  30 -41.513  12.873 -10.809
  105    HB3  ALA  30           HB3      ALA  30 -40.681  12.034 -12.118
  106    H    ASP  31           H        ASP  31 -38.841  11.177 -10.828
  107    HA   ASP  31           HA       ASP  31 -38.285  12.248  -8.236
  108    HB2  ASP  31           HB1      ASP  31 -38.472   9.706  -7.898
  109    HB3  ASP  31           HB2      ASP  31 -36.962   9.604  -8.813
  110    HD2  ASP  31           HD       ASP  31 -35.359  11.479  -6.160
  111    H    LEU  32           H        LEU  32 -36.479  10.311 -10.629
  112    HA   LEU  32           HA       LEU  32 -34.561  10.740 -11.780
  113    HB2  LEU  32           HB1      LEU  32 -35.872  13.460 -11.845
  114    HB3  LEU  32           HB2      LEU  32 -34.425  13.040 -12.777
  115    HG   LEU  32           HG       LEU  32 -36.760  11.273 -13.157
  116   HD11  LEU  32          HD11      LEU  32 -36.733  14.149 -14.037
  117   HD12  LEU  32          HD12      LEU  32 -37.971  13.310 -13.101
  118   HD13  LEU  32          HD13      LEU  32 -37.727  12.907 -14.800
  119   HD21  LEU  32          HD21      LEU  32 -35.774  10.858 -15.136
  120   HD22  LEU  32          HD22      LEU  32 -34.355  11.556 -14.356
  121   HD23  LEU  32          HD23      LEU  32 -35.363  12.551 -15.407
  122    H    HIS  33           H        HIS  33 -34.201  10.742  -9.032
  123    HA   HIS  33           HA       HIS  33 -31.845  12.422  -8.824
  124    HB2  HIS  33           HB1      HIS  33 -34.153  13.433  -7.782
  125    HB3  HIS  33           HB2      HIS  33 -33.510  12.551  -6.392
  126    HD1  HIS  33           HD1      HIS  33 -31.138  13.304  -5.500
  127    HD2  HIS  33           HD2      HIS  33 -32.839  15.801  -8.350
  128    HE1  HIS  33           HE1      HIS  33 -29.837  15.452  -5.374
  129    HE2  HIS  33           HE2      HIS  33 -30.876  16.980  -7.117
  130    H    GLY  34           H        GLY  34 -30.358  11.717  -7.234
  131    HA2  GLY  34           HA2      GLY  34 -30.178  10.159  -5.229
  132    HA3  GLY  34           HA3      GLY  34 -30.894   8.968  -6.305
  133    HA1  GLY  34           HA1      GLY  34 -29.750  10.685  -5.792
  134    H    ALA  35           H        ALA  35 -28.018  10.479  -5.272
  135    HA   ALA  35           HA       ALA  35 -26.417   8.606  -6.743
  136    HB1  ALA  35           HB1      ALA  35 -25.637   9.853  -8.414
  137    HB2  ALA  35           HB2      ALA  35 -26.957  10.971  -8.066
  138    HB3  ALA  35           HB3      ALA  35 -25.364  11.238  -7.357
  139    H    ARG  36           H        ARG  36 -23.969   9.267  -6.404
  140    HA   ARG  36           HA       ARG  36 -23.686  10.276  -3.650
  141    HB2  ARG  36           HB1      ARG  36 -22.561   7.814  -4.943
  142    HB3  ARG  36           HB2      ARG  36 -21.663   8.610  -3.642
  143    HG2  ARG  36           HG1      ARG  36 -23.083   7.921  -2.038
  144    HG3  ARG  36           HG2      ARG  36 -24.504   8.122  -3.076
  145    HD2  ARG  36           HD1      ARG  36 -23.303   6.045  -4.326
  146    HD3  ARG  36           HD2      ARG  36 -22.779   5.766  -2.658
  147    HE   ARG  36           HE       ARG  36 -24.919   5.161  -2.122
  148   HH11  ARG  36          HH11      ARG  36 -24.944   6.853  -5.164
  149   HH12  ARG  36          HH12      ARG  36 -26.613   6.518  -5.486
  150   HH21  ARG  36          HH21      ARG  36 -27.117   4.712  -2.534
  151   HH22  ARG  36          HH22      ARG  36 -27.848   5.301  -3.989
  152    H    LYS  37           H        LYS  37 -21.914  11.544  -3.203
  153    HA   LYS  37           HA       LYS  37 -20.022  12.081  -5.376
  154    HB2  LYS  37           HB1      LYS  37 -22.133  13.786  -4.801
  155    HB3  LYS  37           HB2      LYS  37 -20.766  14.503  -3.933
  156    HG2  LYS  37           HG1      LYS  37 -19.527  14.835  -5.889
  157    HG3  LYS  37           HG2      LYS  37 -20.537  13.709  -6.813
  158    HD2  LYS  37           HD1      LYS  37 -22.387  15.229  -6.808
  159    HD3  LYS  37           HD2      LYS  37 -21.563  16.299  -5.661
  160    HE2  LYS  37           HE1      LYS  37 -20.926  17.453  -7.482
  161    HE3  LYS  37           HE2      LYS  37 -19.739  16.156  -7.683
  162    HZ1  LYS  37           HZ1      LYS  37 -22.379  15.669  -8.805
  163    HZ2  LYS  37           HZ2      LYS  37 -20.852  15.274  -9.417
  164    HZ3  LYS  37           HZ3      LYS  37 -21.447  16.849  -9.578
  165    H    GLY  38           H        GLY  38 -17.965  12.568  -4.721
  166    HA2  GLY  38           HA2      GLY  38 -17.164  13.573  -2.259
  167    HA3  GLY  38           HA3      GLY  38 -17.214  11.825  -2.087
  168    HA1  GLY  38           HA1      GLY  38 -17.066  13.672  -3.132
  169    H    SER  39           H        SER  39 -14.864  12.322  -1.643
  170    HA   SER  39           HA       SER  39 -13.216  12.968  -3.912
  171    HB2  SER  39           HB1      SER  39 -11.974  11.687  -1.539
  172    HB3  SER  39           HB2      SER  39 -11.506  13.153  -2.416
  173    HG   SER  39           HG       SER  39 -12.634  13.133  -0.128
  174    H    GLN  40           H        GLN  40 -11.341  11.476  -4.453
  175    HA   GLN  40           HA       GLN  40 -12.407   9.000  -5.378
  176    HB2  GLN  40           HB1      GLN  40 -10.063  10.617  -5.841
  177    HB3  GLN  40           HB2      GLN  40  -9.607   8.919  -5.634
  178    HG2  GLN  40           HG1      GLN  40 -10.143   8.565  -7.750
  179    HG3  GLN  40           HG2      GLN  40 -11.830   8.877  -7.317
  180   HE21  GLN  40          HE21      GLN  40 -11.983  11.488  -6.888
  181   HE22  GLN  40          HE22      GLN  40 -11.537  12.389  -8.292
  182    H    CYS  41           H        CYS  41  -9.774   9.777  -3.103
  183    HA   CYS  41           HA       CYS  41 -10.380   7.294  -1.665
  184    HB2  CYS  41           HB1      CYS  41  -7.926   6.872  -1.408
  185    HB3  CYS  41           HB2      CYS  41  -8.528   6.666  -3.054
  186    H    LEU  42           H        LEU  42  -9.705   7.282   0.538
  187    HA   LEU  42           HA       LEU  42  -9.436   9.987   1.645
  188    HB2  LEU  42           HB1      LEU  42 -11.315   8.239   2.243
  189    HB3  LEU  42           HB2      LEU  42 -10.058   7.598   3.316
  190    HG   LEU  42           HG       LEU  42 -10.645  10.503   3.490
  191   HD11  LEU  42          HD11      LEU  42 -12.412   8.552   4.920
  192   HD12  LEU  42          HD12      LEU  42 -12.850   9.192   3.336
  193   HD13  LEU  42          HD13      LEU  42 -12.621  10.290   4.697
  194   HD21  LEU  42          HD21      LEU  42  -9.958   8.305   5.433
  195   HD22  LEU  42          HD22      LEU  42 -10.324   9.963   5.914
  196   HD23  LEU  42          HD23      LEU  42  -8.925   9.629   4.891
  197    H    SER  43           H        SER  43  -7.867   6.906   1.416
  198    HA   SER  43           HA       SER  43  -5.432   7.992   2.477
  199    HB2  SER  43           HB1      SER  43  -6.992   7.101   4.446
  200    HB3  SER  43           HB2      SER  43  -6.304   5.546   3.947
  201    HG   SER  43           HG       SER  43  -5.079   7.715   5.166
  202    H    ASP  44           H        ASP  44  -3.717   6.177   2.592
  203    HA   ASP  44           HA       ASP  44  -3.450   5.039   0.064
  204    HB2  ASP  44           HB1      ASP  44  -1.508   3.909   0.904
  205    HB3  ASP  44           HB2      ASP  44  -1.592   5.492   1.689
  206    HD2  ASP  44           HD       ASP  44  -2.822   3.703   4.645
  207    H    THR  45           H        THR  45  -5.018   3.843   2.918
  208    HA   THR  45           HA       THR  45  -5.087   1.095   2.156
  209    HB   THR  45           HB       THR  45  -7.219   1.336   3.828
  210    HG1  THR  45           HG1      THR  45  -5.392   3.285   4.777
  211   HG21  THR  45          HG21      THR  45  -4.536   1.405   5.105
  212   HG22  THR  45          HG22      THR  45  -4.859   0.120   3.941
  213   HG23  THR  45          HG23      THR  45  -5.883   0.299   5.365
  214    H    ASP  46           H        ASP  46  -6.989   3.883   1.384
  215    HA   ASP  46           HA       ASP  46  -9.323   2.477   0.520
  216    HB2  ASP  46           HB1      ASP  46  -8.732   5.109   1.055
  217    HB3  ASP  46           HB2      ASP  46  -8.833   5.098  -0.710
  218    HD2  ASP  46           HD       ASP  46 -12.146   4.423   1.355
  219    H    CYS  47           H        CYS  47  -6.306   3.408  -0.947
  220    HA   CYS  47           HA       CYS  47  -7.180   2.970  -3.651
  221    HB2  CYS  47           HB1      CYS  47  -4.588   3.598  -2.301
  222    HB3  CYS  47           HB2      CYS  47  -4.538   2.925  -3.930
  223    H    ASN  48           H        ASN  48  -4.523   1.358  -1.913
  224    HA   ASN  48           HA       ASN  48  -5.541  -1.250  -2.112
  225    HB2  ASN  48           HB1      ASN  48  -4.825  -0.356  -4.594
  226    HB3  ASN  48           HB2      ASN  48  -3.330  -1.129  -4.057
  227   HD21  ASN  48          HD21      ASN  48  -5.161  -1.934  -6.162
  228   HD22  ASN  48          HD22      ASN  48  -5.676  -3.536  -5.768
  229    H    THR  49           H        THR  49  -3.615  -2.905  -1.976
  230    HA   THR  49           HA       THR  49  -2.076  -2.140   0.294
  231    HB   THR  49           HB       THR  49  -2.852  -4.443   0.022
  232    HG1  THR  49           HG1      THR  49  -0.583  -5.405   0.216
  233   HG21  THR  49          HG21      THR  49  -0.781  -5.031  -2.025
  234   HG22  THR  49          HG22      THR  49  -2.273  -4.265  -2.570
  235   HG23  THR  49          HG23      THR  49  -2.333  -5.814  -1.729
  236    H    ARG  50           H        ARG  50  -1.495  -2.194  -3.124
  237    HA   ARG  50           HA       ARG  50   1.339  -1.538  -2.651
  238    HB2  ARG  50           HB1      ARG  50   0.372  -3.549  -4.205
  239    HB3  ARG  50           HB2      ARG  50   0.500  -2.242  -5.390
  240    HG2  ARG  50           HG1      ARG  50   2.783  -2.145  -5.273
  241    HG3  ARG  50           HG2      ARG  50   2.824  -2.759  -3.612
  242    HD2  ARG  50           HD1      ARG  50   2.422  -4.993  -4.314
  243    HD3  ARG  50           HD2      ARG  50   1.978  -4.463  -5.941
  244    HE   ARG  50           HE       ARG  50   4.188  -4.492  -6.497
  245   HH11  ARG  50          HH11      ARG  50   3.915  -4.321  -3.031
  246   HH12  ARG  50          HH12      ARG  50   5.619  -4.487  -2.759
  247   HH21  ARG  50          HH21      ARG  50   6.432  -4.712  -6.151
  248   HH22  ARG  50          HH22      ARG  50   7.049  -4.708  -4.534
  249    H    LYS  51           H        LYS  51  -0.986   0.273  -2.540
  250    HA   LYS  51           HA       LYS  51   0.073   2.311  -4.315
  251    HB2  LYS  51           HB1      LYS  51  -2.792   1.353  -4.439
  252    HB3  LYS  51           HB2      LYS  51  -2.256   2.908  -5.094
  253    HG2  LYS  51           HG1      LYS  51  -0.572   1.558  -6.469
  254    HG3  LYS  51           HG2      LYS  51  -1.549   0.148  -6.022
  255    HD2  LYS  51           HD1      LYS  51  -3.555   1.292  -6.954
  256    HD3  LYS  51           HD2      LYS  51  -2.496   2.601  -7.503
  257    HE2  LYS  51           HE1      LYS  51  -2.362   1.418  -9.415
  258    HE3  LYS  51           HE2      LYS  51  -1.211   0.424  -8.509
  259    HZ1  LYS  51           HZ1      LYS  51  -2.631  -1.179  -9.216
  260    HZ2  LYS  51           HZ2      LYS  51  -3.977  -0.156  -9.254
  261    HZ3  LYS  51           HZ3      LYS  51  -3.424  -0.772  -7.778
  262    H    PHE  52           H        PHE  52  -0.414   4.428  -3.661
  263    HA   PHE  52           HA       PHE  52  -1.620   4.619  -0.980
  264    HB2  PHE  52           HB1      PHE  52  -0.112   6.387  -0.440
  265    HB3  PHE  52           HB2      PHE  52   0.852   5.080  -1.132
  266    HD1  PHE  52           HD1      PHE  52   1.645   5.236  -3.492
  267    HD2  PHE  52           HD2      PHE  52  -0.157   8.518  -1.468
  268    HE1  PHE  52           HE1      PHE  52   2.589   6.778  -5.161
  269    HE2  PHE  52           HE2      PHE  52   0.783  10.066  -3.134
  270    HZ   PHE  52           HZ       PHE  52   2.157   9.196  -4.984
  271    H    CYS  53           H        CYS  53  -2.390   6.927  -0.501
  272    HA   CYS  53           HA       CYS  53  -3.981   7.830  -2.802
  273    HB2  CYS  53           HB1      CYS  53  -5.272   7.043  -0.866
  274    HB3  CYS  53           HB2      CYS  53  -4.462   8.229   0.159
  275    H    LEU  54           H        LEU  54  -3.127   9.535  -3.790
  276    HA   LEU  54           HA       LEU  54  -1.472  11.423  -2.332
  277    HB2  LEU  54           HB1      LEU  54  -1.189  10.439  -4.778
  278    HB3  LEU  54           HB2      LEU  54  -2.217  11.824  -5.184
  279    HG   LEU  54           HG       LEU  54   0.095  12.489  -3.502
  280   HD11  LEU  54          HD11      LEU  54   1.496  11.144  -4.660
  281   HD12  LEU  54          HD12      LEU  54   1.412  12.462  -5.828
  282   HD13  LEU  54          HD13      LEU  54   0.416  11.024  -6.049
  283   HD21  LEU  54          HD21      LEU  54  -1.382  13.588  -5.848
  284   HD22  LEU  54          HD22      LEU  54   0.257  14.156  -5.520
  285   HD23  LEU  54          HD23      LEU  54  -1.003  14.342  -4.299
  286    H    GLN  55           H        GLN  55  -2.000  13.487  -1.828
  287    HA   GLN  55           HA       GLN  55  -4.528  14.585  -2.814
  288    HB2  GLN  55           HB1      GLN  55  -5.014  15.389  -0.454
  289    HB3  GLN  55           HB2      GLN  55  -5.247  13.662  -0.761
  290    HG2  GLN  55           HG1      GLN  55  -3.546  13.029   0.593
  291    HG3  GLN  55           HG2      GLN  55  -2.592  14.476   0.240
  292   HE21  GLN  55          HE21      GLN  55  -5.836  13.931   1.573
  293   HE22  GLN  55          HE22      GLN  55  -5.594  14.876   3.000
  294    HA   PRO  56           HA       PRO  56  -1.203  17.728  -3.060
  295    HB2  PRO  56           HB1      PRO  56  -2.182  18.891  -5.339
  296    HB3  PRO  56           HB2      PRO  56  -1.150  17.461  -5.341
  297    HG2  PRO  56           HG1      PRO  56  -4.138  17.651  -5.526
  298    HG3  PRO  56           HG2      PRO  56  -2.997  16.648  -6.497
  299    HD2  PRO  56           HD1      PRO  56  -4.463  15.634  -4.450
  300    HD3  PRO  56           HD2      PRO  56  -2.834  15.055  -4.839
  301    H    ARG  57           H        ARG  57  -1.275  19.985  -2.734
  302    HA   ARG  57           HA       ARG  57  -3.674  20.895  -1.402
  303    HB2  ARG  57           HB1      ARG  57  -2.336  22.880  -0.821
  304    HB3  ARG  57           HB2      ARG  57  -1.518  21.371  -0.388
  305    HG2  ARG  57           HG1      ARG  57  -0.506  21.769  -2.865
  306    HG3  ARG  57           HG2      ARG  57  -0.759  23.440  -2.332
  307    HD2  ARG  57           HD1      ARG  57   0.446  22.802  -0.184
  308    HD3  ARG  57           HD2      ARG  57   0.902  21.308  -1.012
  309    HE   ARG  57           HE       ARG  57   1.613  23.441  -2.662
  310   HH11  ARG  57          HH11      ARG  57   2.473  22.112   0.438
  311   HH12  ARG  57          HH12      ARG  57   4.110  22.674   0.372
  312   HH21  ARG  57          HH21      ARG  57   3.767  24.188  -2.761
  313   HH22  ARG  57          HH22      ARG  57   4.845  23.855  -1.448
  314    H    ASP  58           H        ASP  58  -1.822  21.718  -4.293
  315    HA   ASP  58           HA       ASP  58  -3.585  23.895  -4.991
  316    HB2  ASP  58           HB1      ASP  58  -1.175  22.615  -6.246
  317    HB3  ASP  58           HB2      ASP  58  -2.203  23.687  -7.206
  318    HD2  ASP  58           HD       ASP  58   0.066  25.278  -4.391
  319    H    GLU  59           H        GLU  59  -3.385  20.505  -5.584
  320    HA   GLU  59           HA       GLU  59  -5.480  20.726  -7.642
  321    HB2  GLU  59           HB1      GLU  59  -3.057  19.191  -7.536
  322    HB3  GLU  59           HB2      GLU  59  -4.445  18.092  -7.590
  323    HG2  GLU  59           HG1      GLU  59  -5.258  19.602  -9.539
  324    HG3  GLU  59           HG2      GLU  59  -3.564  20.113  -9.601
  325    HE2  GLU  59           HE       GLU  59  -2.811  16.564 -10.246
  326    H    LYS  60           H        LYS  60  -6.680  18.401  -7.670
  327    HA   LYS  60           HA       LYS  60  -7.941  18.243  -5.044
  328    HB2  LYS  60           HB1      LYS  60  -9.651  16.858  -6.261
  329    HB3  LYS  60           HB2      LYS  60  -9.482  18.521  -6.846
  330    HG2  LYS  60           HG1      LYS  60  -8.738  17.891  -8.873
  331    HG3  LYS  60           HG2      LYS  60  -7.805  16.534  -8.217
  332    HD2  LYS  60           HD1      LYS  60  -9.907  15.264  -7.901
  333    HD3  LYS  60           HD2      LYS  60 -10.793  16.607  -8.643
  334    HE2  LYS  60           HE1      LYS  60  -9.439  16.326 -10.707
  335    HE3  LYS  60           HE2      LYS  60  -8.659  14.926  -9.956
  336    HZ1  LYS  60           HZ1      LYS  60 -11.372  15.193 -11.008
  337    HZ2  LYS  60           HZ2      LYS  60 -11.158  14.194  -9.660
  338    HZ3  LYS  60           HZ3      LYS  60 -10.305  13.882 -11.088
  339    HA   PRO  61           HA       PRO  61  -6.214  14.372  -3.903
  340    HB2  PRO  61           HB1      PRO  61  -8.302  13.222  -2.556
  341    HB3  PRO  61           HB2      PRO  61  -7.363  14.573  -1.924
  342    HG2  PRO  61           HG1      PRO  61 -10.000  14.593  -3.350
  343    HG3  PRO  61           HG2      PRO  61  -9.500  15.486  -1.865
  344    HD2  PRO  61           HD1      PRO  61  -9.613  16.659  -4.310
  345    HD3  PRO  61           HD2      PRO  61  -8.411  17.108  -3.088
  346    H    PHE  62           H        PHE  62  -5.902  12.429  -4.825
  347    HA   PHE  62           HA       PHE  62  -8.068  10.948  -6.023
  348    HB2  PHE  62           HB1      PHE  62  -6.825  10.789  -8.247
  349    HB3  PHE  62           HB2      PHE  62  -7.672  12.303  -7.919
  350    HD1  PHE  62           HD1      PHE  62  -6.579  14.261  -8.378
  351    HD2  PHE  62           HD2      PHE  62  -4.292  10.816  -7.368
  352    HE1  PHE  62           HE1      PHE  62  -4.506  15.532  -8.753
  353    HE2  PHE  62           HE2      PHE  62  -2.216  12.081  -7.741
  354    HZ   PHE  62           HZ       PHE  62  -2.321  14.442  -8.434
  355    H    CYS  63           H        CYS  63  -7.266   8.857  -6.966
  356    HA   CYS  63           HA       CYS  63  -5.392   7.680  -5.130
  357    HB2  CYS  63           HB1      CYS  63  -7.494   6.563  -5.960
  358    HB3  CYS  63           HB2      CYS  63  -6.700   6.385  -7.527
  359    H    ALA  64           H        ALA  64  -3.354   6.951  -5.524
  360    HA   ALA  64           HA       ALA  64  -2.223   7.567  -8.177
  361    HB1  ALA  64           HB1      ALA  64  -0.636   7.568  -5.627
  362    HB2  ALA  64           HB2      ALA  64  -0.212   8.269  -7.190
  363    HB3  ALA  64           HB3      ALA  64  -1.480   9.002  -6.210
  364    H    THR  65           H        THR  65  -0.179   6.298  -8.628
  365    HA   THR  65           HA       THR  65  -0.676   3.489  -7.949
  366    HB   THR  65           HB       THR  65   0.798   2.968  -9.877
  367    HG1  THR  65           HG1      THR  65   1.717   4.553 -11.032
  368   HG21  THR  65          HG21      THR  65  -0.774   3.617 -11.613
  369   HG22  THR  65          HG22      THR  65  -1.455   4.860 -10.562
  370   HG23  THR  65          HG23      THR  65  -1.649   3.155 -10.155
  371    H    CYS  66           H        CYS  66   1.361   2.101  -7.888
  372    HA   CYS  66           HA       CYS  66   2.912   2.802  -5.689
  373    HB2  CYS  66           HB1      CYS  66   2.560   0.488  -6.558
  374    HB3  CYS  66           HB2      CYS  66   3.680   0.854  -7.873
  375    H    ARG  67           H        ARG  67   5.035   3.510  -5.440
  376    HA   ARG  67           HA       ARG  67   5.993   5.194  -7.618
  377    HB2  ARG  67           HB1      ARG  67   6.806   4.968  -4.714
  378    HB3  ARG  67           HB2      ARG  67   7.572   6.063  -5.872
  379    HG2  ARG  67           HG1      ARG  67   4.622   6.231  -5.631
  380    HG3  ARG  67           HG2      ARG  67   5.587   6.817  -4.264
  381    HD2  ARG  67           HD1      ARG  67   6.558   8.517  -5.487
  382    HD3  ARG  67           HD2      ARG  67   6.342   7.662  -7.020
  383    HE   ARG  67           HE       ARG  67   3.801   8.200  -6.227
  384   HH11  ARG  67          HH11      ARG  67   6.661  10.132  -6.680
  385   HH12  ARG  67          HH12      ARG  67   5.785  11.564  -7.112
  386   HH21  ARG  67          HH21      ARG  67   2.636  10.078  -6.792
  387   HH22  ARG  67          HH22      ARG  67   3.494  11.531  -7.174
  388    H    GLY  68           H        GLY  68   7.681   4.698  -8.866
  389    HA2  GLY  68           HA2      GLY  68   9.058   2.188  -8.435
  390    HA3  GLY  68           HA3      GLY  68   9.229   3.250  -9.825
  391    HA1  GLY  68           HA1      GLY  68   9.065   2.759  -7.763
  392    H    LEU  69           H        LEU  69  11.486   2.180  -8.948
  393    HA   LEU  69           HA       LEU  69  12.806   3.608  -6.886
  394    HB2  LEU  69           HB1      LEU  69  13.855   1.977  -9.201
  395    HB3  LEU  69           HB2      LEU  69  14.880   2.653  -7.923
  396    HG   LEU  69           HG       LEU  69  12.730   0.563  -7.583
  397   HD11  LEU  69          HD11      LEU  69  14.329  -0.940  -7.886
  398   HD12  LEU  69          HD12      LEU  69  15.340  -0.166  -6.667
  399   HD13  LEU  69          HD13      LEU  69  15.428   0.361  -8.348
  400   HD21  LEU  69          HD21      LEU  69  13.756   0.472  -5.240
  401   HD22  LEU  69          HD22      LEU  69  12.655   1.801  -5.601
  402   HD23  LEU  69          HD23      LEU  69  14.397   2.075  -5.598
  403    H    ARG  70           H        ARG  70  12.277   4.219 -10.261
  404    HA   ARG  70           HA       ARG  70  14.246   6.375 -10.300
  405    HB2  ARG  70           HB1      ARG  70  12.464   5.231 -12.462
  406    HB3  ARG  70           HB2      ARG  70  13.602   6.565 -12.706
  407    HG2  ARG  70           HG1      ARG  70  14.904   4.286 -11.483
  408    HG3  ARG  70           HG2      ARG  70  14.120   3.859 -13.013
  409    HD2  ARG  70           HD1      ARG  70  15.332   5.529 -14.211
  410    HD3  ARG  70           HD2      ARG  70  15.925   6.248 -12.707
  411    HE   ARG  70           HE       ARG  70  17.055   4.036 -14.104
  412   HH11  ARG  70          HH11      ARG  70  16.576   5.392 -10.934
  413   HH12  ARG  70          HH12      ARG  70  17.967   4.620 -10.250
  414   HH21  ARG  70          HH21      ARG  70  18.889   3.012 -13.215
  415   HH22  ARG  70          HH22      ARG  70  19.283   3.267 -11.549
  416    H    ARG  71           H        ARG  71  11.431   6.214  -8.942
  417    HA   ARG  71           HA       ARG  71  10.293   8.657 -10.103
  418    HB2  ARG  71           HB1      ARG  71   9.191   6.406  -8.472
  419    HB3  ARG  71           HB2      ARG  71   8.418   7.994  -8.362
  420    HG2  ARG  71           HG1      ARG  71   8.925   6.690 -11.021
  421    HG3  ARG  71           HG2      ARG  71   7.488   6.317 -10.054
  422    HD2  ARG  71           HD1      ARG  71   7.771   9.148 -10.117
  423    HD3  ARG  71           HD2      ARG  71   7.949   8.540 -11.769
  424    HE   ARG  71           HE       ARG  71   5.752   7.239 -10.860
  425   HH11  ARG  71          HH11      ARG  71   6.690  10.589 -10.984
  426   HH12  ARG  71          HH12      ARG  71   5.068  11.174 -11.137
  427   HH21  ARG  71          HH21      ARG  71   3.610   7.996 -11.061
  428   HH22  ARG  71          HH22      ARG  71   3.315   9.697 -11.180
  429    H    ARG  72           H        ARG  72  10.131  10.530  -8.971
  430    HA   ARG  72           HA       ARG  72  11.817  10.843  -6.676
  431    HB2  ARG  72           HB1      ARG  72   9.898  12.821  -7.931
  432    HB3  ARG  72           HB2      ARG  72  11.201  13.200  -6.793
  433    HG2  ARG  72           HG1      ARG  72  12.336  11.774  -8.979
  434    HG3  ARG  72           HG2      ARG  72  11.311  13.070  -9.618
  435    HD2  ARG  72           HD1      ARG  72  13.351  13.522  -7.437
  436    HD3  ARG  72           HD2      ARG  72  13.727  13.673  -9.159
  437    HE   ARG  72           HE       ARG  72  12.340  15.564  -7.552
  438   HH11  ARG  72          HH11      ARG  72  12.510  14.247 -10.769
  439   HH12  ARG  72          HH12      ARG  72  11.889  15.675 -11.528
  440   HH21  ARG  72          HH21      ARG  72  11.522  17.451  -8.538
  441   HH22  ARG  72          HH22      ARG  72  11.328  17.497 -10.258
  442    H    CYS  73           H        CYS  73  11.204  11.539  -4.594
  443    HA   CYS  73           HA       CYS  73   8.371  11.344  -3.896
  444    HB2  CYS  73           HB1      CYS  73   8.995   9.922  -1.902
  445    HB3  CYS  73           HB2      CYS  73   9.069   9.112  -3.467
  446    H    GLN  74           H        GLN  74   7.965  12.070  -1.633
  447    HA   GLN  74           HA       GLN  74   9.903  14.152  -0.865
  448    HB2  GLN  74           HB1      GLN  74   7.453  14.680  -1.764
  449    HB3  GLN  74           HB2      GLN  74   7.042  14.371  -0.069
  450    HG2  GLN  74           HG1      GLN  74   7.629  16.436   0.448
  451    HG3  GLN  74           HG2      GLN  74   9.285  16.072  -0.059
  452   HE21  GLN  74          HE21      GLN  74   6.188  16.603  -1.716
  453   HE22  GLN  74          HE22      GLN  74   6.793  17.770  -2.835
  454    H    ARG  75           H        ARG  75   7.757  11.617   0.240
  455    HA   ARG  75           HA       ARG  75   8.997  11.813   2.905
  456    HB2  ARG  75           HB1      ARG  75   6.340  12.246   2.377
  457    HB3  ARG  75           HB2      ARG  75   6.360  10.530   2.810
  458    HG2  ARG  75           HG1      ARG  75   7.858  11.463   4.816
  459    HG3  ARG  75           HG2      ARG  75   6.891  12.909   4.479
  460    HD2  ARG  75           HD1      ARG  75   4.866  11.829   4.953
  461    HD3  ARG  75           HD2      ARG  75   5.594  10.225   4.783
  462    HE   ARG  75           HE       ARG  75   6.922  11.319   6.890
  463   HH11  ARG  75          HH11      ARG  75   3.563  10.815   6.122
  464   HH12  ARG  75          HH12      ARG  75   3.076  10.639   7.776
  465   HH21  ARG  75          HH21      ARG  75   6.293  11.090   9.071
  466   HH22  ARG  75          HH22      ARG  75   4.629  10.796   9.453
  467    H    ASP  76           H        ASP  76   8.958   9.731   4.114
  468    HA   ASP  76           HA       ASP  76  10.009   7.644   2.462
  469    HB2  ASP  76           HB1      ASP  76  10.949   8.074   4.675
  470    HB3  ASP  76           HB2      ASP  76   9.392   7.696   5.424
  471    HD2  ASP  76           HD       ASP  76  10.875   4.467   3.727
  472    H    ALA  77           H        ALA  77   7.030   8.137   4.288
  473    HA   ALA  77           HA       ALA  77   6.001   5.517   3.795
  474    HB1  ALA  77           HB1      ALA  77   4.872   8.050   4.913
  475    HB2  ALA  77           HB2      ALA  77   3.802   6.711   4.497
  476    HB3  ALA  77           HB3      ALA  77   5.084   6.478   5.685
  477    H    MET  78           H        MET  78   5.931   8.557   2.104
  478    HA   MET  78           HA       MET  78   3.705   8.187   0.464
  479    HB2  MET  78           HB1      MET  78   6.142   9.840   0.425
  480    HB3  MET  78           HB2      MET  78   5.430   9.535  -1.167
  481    HG2  MET  78           HG1      MET  78   3.225  10.319  -0.209
  482    HG3  MET  78           HG2      MET  78   4.141  10.856   1.201
  483    HE1  MET  78           HE1      MET  78   5.529  11.402  -2.741
  484    HE2  MET  78           HE2      MET  78   3.873  10.840  -2.509
  485    HE3  MET  78           HE3      MET  78   4.178  12.499  -3.026
  486    H    CYS  79           H        CYS  79   6.950   6.890   0.251
  487    HA   CYS  79           HA       CYS  79   6.530   5.802  -2.396
  488    HB2  CYS  79           HB1      CYS  79   8.773   6.255  -0.630
  489    HB3  CYS  79           HB2      CYS  79   8.797   4.601  -1.243
  490    H    CYS  80           H        CYS  80   6.524   3.562  -2.896
  491    HA   CYS  80           HA       CYS  80   4.811   1.994  -1.377
  492    HB2  CYS  80           HB1      CYS  80   6.609   1.558  -3.685
  493    HB3  CYS  80           HB2      CYS  80   6.165   0.107  -2.785
  494    HA   PRO  81           HA       PRO  81   7.170   0.088   1.792
  495    HB2  PRO  81           HB1      PRO  81   6.184  -2.468   1.811
  496    HB3  PRO  81           HB2      PRO  81   5.274  -1.069   2.379
  497    HG2  PRO  81           HG1      PRO  81   5.177  -2.446  -0.283
  498    HG3  PRO  81           HG2      PRO  81   3.819  -1.887   0.761
  499    HD2  PRO  81           HD1      PRO  81   4.660  -0.501  -1.416
  500    HD3  PRO  81           HD2      PRO  81   4.031   0.291   0.039
  501    H    GLY  82           H        GLY  82   9.038  -1.058   2.149
  502    HA2  GLY  82           HA2      GLY  82  10.567  -2.842   1.649
  503    HA3  GLY  82           HA3      GLY  82   9.997  -2.812  -0.012
  504    HA1  GLY  82           HA1      GLY  82  10.550  -1.987   1.866
  505    H    THR  83           H        THR  83  10.127   0.230   0.148
  506    HA   THR  83           HA       THR  83  13.051   0.486  -0.120
  507    HB   THR  83           HB       THR  83  12.675   2.099  -1.957
  508    HG1  THR  83           HG1      THR  83   9.985   1.411  -1.437
  509   HG21  THR  83          HG21      THR  83  11.218  -0.161  -3.071
  510   HG22  THR  83          HG22      THR  83  12.585  -0.662  -2.077
  511   HG23  THR  83          HG23      THR  83  12.838   0.428  -3.438
  512    H    LEU  84           H        LEU  84  13.737   2.851  -0.111
  513    HA   LEU  84           HA       LEU  84  12.088   4.397   1.774
  514    HB2  LEU  84           HB1      LEU  84  14.743   3.324   2.134
  515    HB3  LEU  84           HB2      LEU  84  14.759   5.094   2.239
  516    HG   LEU  84           HG       LEU  84  12.616   3.910   3.811
  517   HD11  LEU  84          HD11      LEU  84  13.745   2.153   4.606
  518   HD12  LEU  84          HD12      LEU  84  14.674   3.346   5.514
  519   HD13  LEU  84          HD13      LEU  84  15.286   2.735   3.977
  520   HD21  LEU  84          HD21      LEU  84  13.734   6.267   3.801
  521   HD22  LEU  84          HD22      LEU  84  14.905   5.504   4.877
  522   HD23  LEU  84          HD23      LEU  84  13.197   5.549   5.321
  523    H    CYS  85           H        CYS  85  12.288   6.675   1.652
  524    HA   CYS  85           HA       CYS  85  12.830   7.623  -1.018
  525    HB2  CYS  85           HB1      CYS  85  10.874   8.348   0.424
  526    HB3  CYS  85           HB2      CYS  85  12.032   9.270   1.383
  527    H    VAL  86           H        VAL  86  14.965   7.748  -1.468
  528    HA   VAL  86           HA       VAL  86  16.651   9.310   0.380
  529    HB   VAL  86           HB       VAL  86  17.537   7.235  -1.631
  530   HG11  VAL  86          HG11      VAL  86  19.745   7.504  -0.651
  531   HG12  VAL  86          HG12      VAL  86  19.167   9.041  -1.295
  532   HG13  VAL  86          HG13      VAL  86  19.129   8.741   0.443
  533   HG21  VAL  86          HG21      VAL  86  17.216   7.141   1.359
  534   HG22  VAL  86          HG22      VAL  86  16.485   6.085   0.150
  535   HG23  VAL  86          HG23      VAL  86  18.218   5.995   0.468
  536    H    ASN  87           H        ASN  87  17.609  11.116  -0.350
  537    HA   ASN  87           HA       ASN  87  18.043  12.902  -1.692
  538    HB2  ASN  87           HB1      ASN  87  19.575  11.078  -2.628
  539    HB3  ASN  87           HB2      ASN  87  18.395  10.915  -3.933
  540   HD21  ASN  87          HD21      ASN  87  19.998  11.552  -5.420
  541   HD22  ASN  87          HD22      ASN  87  20.440  13.213  -5.599
  542    H    ASP  88           H        ASP  88  15.319  12.250  -1.414
  543    HA   ASP  88           HA       ASP  88  13.284  12.817  -2.259
  544    HB2  ASP  88           HB1      ASP  88  14.931  14.794  -3.071
  545    HB3  ASP  88           HB2      ASP  88  14.402  14.179  -4.643
  546    HD2  ASP  88           HD       ASP  88  11.902  16.322  -2.547
  547    H    VAL  89           H        VAL  89  14.723  10.397  -3.173
  548    HA   VAL  89           HA       VAL  89  12.968   9.784  -5.417
  549    HB   VAL  89           HB       VAL  89  15.943   9.269  -5.545
  550   HG11  VAL  89          HG11      VAL  89  15.421   8.465  -7.840
  551   HG12  VAL  89          HG12      VAL  89  14.741   7.456  -6.563
  552   HG13  VAL  89          HG13      VAL  89  13.706   8.579  -7.446
  553   HG21  VAL  89          HG21      VAL  89  15.893  10.801  -7.474
  554   HG22  VAL  89          HG22      VAL  89  14.198  11.149  -7.135
  555   HG23  VAL  89          HG23      VAL  89  15.442  11.603  -5.969
  556    H    CYS  90           H        CYS  90  12.304   7.678  -5.478
  557    HA   CYS  90           HA       CYS  90  12.515   6.143  -3.125
  558    HB2  CYS  90           HB1      CYS  90  10.881   6.151  -5.351
  559    HB3  CYS  90           HB2      CYS  90  11.767   4.633  -5.520
  560    H    THR  91           H        THR  91  14.193   5.005  -2.447
  561    HA   THR  91           HA       THR  91  15.877   3.644  -4.447
  562    HB   THR  91           HB       THR  91  16.814   4.941  -1.880
  563    HG1  THR  91           HG1      THR  91  17.499   5.569  -4.573
  564   HG21  THR  91          HG21      THR  91  18.276   3.313  -3.956
  565   HG22  THR  91          HG22      THR  91  18.114   2.969  -2.234
  566   HG23  THR  91          HG23      THR  91  19.086   4.338  -2.773
  567    H    THR  92           H        THR  92  16.412   1.553  -4.050
  568    HA   THR  92           HA       THR  92  14.853   0.050  -2.255
  569    HB   THR  92           HB       THR  92  17.117  -1.504  -2.867
  570    HG1  THR  92           HG1      THR  92  17.882  -0.669  -4.644
  571   HG21  THR  92          HG21      THR  92  14.322  -1.263  -3.907
  572   HG22  THR  92          HG22      THR  92  15.062  -2.564  -2.973
  573   HG23  THR  92          HG23      THR  92  15.453  -2.372  -4.682
  574    H    MET  93           H        MET  93  15.253  -0.813  -0.267
  575    HA   MET  93           HA       MET  93  16.953   0.508   1.497
  576    HB2  MET  93           HB1      MET  93  14.997  -1.505   1.649
  577    HB3  MET  93           HB2      MET  93  16.457  -2.197   2.376
  578    HG2  MET  93           HG1      MET  93  16.135   0.468   3.347
  579    HG3  MET  93           HG2      MET  93  14.608  -0.400   3.523
  580    HE1  MET  93           HE1      MET  93  17.074   0.876   5.126
  581    HE2  MET  93           HE2      MET  93  16.476   0.210   6.644
  582    HE3  MET  93           HE3      MET  93  18.067  -0.257   6.042
  583    H    GLU  94           H        GLU  94  17.534  -2.219  -0.585
  584    HA   GLU  94           HA       GLU  94  19.842  -3.238   0.675
  585    HB2  GLU  94           HB1      GLU  94  18.950  -3.323  -2.214
  586    HB3  GLU  94           HB2      GLU  94  20.332  -4.228  -1.578
  587    HG2  GLU  94           HG1      GLU  94  18.951  -5.890  -1.107
  588    HG3  GLU  94           HG2      GLU  94  18.225  -4.853   0.130
  589    HE2  GLU  94           HE       GLU  94  16.237  -5.462  -3.233
  590    H    ASP  95           H        ASP  95  19.361  -0.708  -1.728
  591    HA   ASP  95           HA       ASP  95  22.162  -0.294  -2.182
  592    HB2  ASP  95           HB1      ASP  95  19.816   0.444  -3.478
  593    HB3  ASP  95           HB2      ASP  95  20.444   1.968  -2.840
  594    HD2  ASP  95           HD       ASP  95  21.974   1.083  -6.097
  595    H    ALA  96           H        ALA  96  19.672   1.203  -0.186
  596    HA   ALA  96           HA       ALA  96  21.143   3.438   0.672
  597    HB1  ALA  96           HB1      ALA  96  18.990   3.746   1.267
  598    HB2  ALA  96           HB2      ALA  96  18.709   2.029   1.553
  599    HB3  ALA  96           HB3      ALA  96  19.523   3.004   2.775
  600    H    THR  97           H        THR  97  20.889   0.156   1.964
  601    HA   THR  97           HA       THR  97  23.104   0.790   3.806
  602    HB   THR  97           HB       THR  97  22.158  -1.378   4.991
  603    HG1  THR  97           HG1      THR  97  19.875  -1.448   4.802
  604   HG21  THR  97          HG21      THR  97  20.796   0.071   6.448
  605   HG22  THR  97          HG22      THR  97  20.891   1.354   5.241
  606   HG23  THR  97          HG23      THR  97  22.353   0.800   6.058
  607    H    GLU  98           H        GLU  98  24.795   0.181   2.497
  608    HA   GLU  98           HA       GLU  98  24.813  -2.237   0.989
  609    HB2  GLU  98           HB1      GLU  98  26.473   0.064   1.287
  610    HB3  GLU  98           HB2      GLU  98  27.474  -1.377   1.530
  611    HG2  GLU  98           HG1      GLU  98  25.668  -0.971  -0.850
  612    HG3  GLU  98           HG2      GLU  98  27.385  -0.549  -0.818
  613    HE2  GLU  98           HE       GLU  98  26.376  -4.341  -1.189
  614    H    ASN  99           H        ASN  99  26.338  -4.016   1.317
  615    HA   ASN  99           HA       ASN  99  26.441  -4.760   4.147
  616    HB2  ASN  99           HB1      ASN  99  26.879  -6.497   1.702
  617    HB3  ASN  99           HB2      ASN  99  26.690  -7.050   3.372
  618   HD21  ASN  99          HD21      ASN  99  24.716  -7.454   4.132
  619   HD22  ASN  99          HD22      ASN  99  23.242  -7.119   3.295
  620    H    LEU 100           H        LEU 100  28.326  -5.631   5.090
  621    HA   LEU 100           HA       LEU 100  30.825  -5.104   3.628
  622    HB2  LEU 100           HB1      LEU 100  30.097  -4.329   6.449
  623    HB3  LEU 100           HB2      LEU 100  31.774  -4.428   5.886
  624    HG   LEU 100           HG       LEU 100  29.829  -2.697   4.418
  625   HD11  LEU 100          HD11      LEU 100  29.871  -2.331   7.016
  626   HD12  LEU 100          HD12      LEU 100  29.931  -0.961   5.907
  627   HD13  LEU 100          HD13      LEU 100  31.412  -1.550   6.663
  628   HD21  LEU 100          HD21      LEU 100  31.665  -1.822   3.461
  629   HD22  LEU 100          HD22      LEU 100  32.429  -3.321   3.988
  630   HD23  LEU 100          HD23      LEU 100  32.592  -1.858   4.961
  631    H    TYR 101           H        TYR 101  32.722  -6.220   4.615
  632    HA   TYR 101           HA       TYR 101  31.905  -8.838   5.693
  633    HB2  TYR 101           HB1      TYR 101  34.070  -9.662   4.663
  634    HB3  TYR 101           HB2      TYR 101  32.803  -9.196   3.526
  635    HD1  TYR 101           HD1      TYR 101  36.020  -8.133   4.993
  636    HD2  TYR 101           HD2      TYR 101  33.095  -7.395   1.993
  637    HE1  TYR 101           HE1      TYR 101  37.570  -6.586   3.871
  638    HE2  TYR 101           HE2      TYR 101  34.636  -5.847   0.862
  639    HH   TYR 101           HH       TYR 101  37.929  -5.662   1.607
  640    H    PHE 102           H        PHE 102  32.822  -9.565   7.527
  641    HA   PHE 102           HA       PHE 102  34.513  -7.727   9.003
  642    HB2  PHE 102           HB1      PHE 102  32.839 -10.098   9.648
  643    HB3  PHE 102           HB2      PHE 102  34.233  -9.804  10.691
  644    HD1  PHE 102           HD1      PHE 102  33.893  -8.543  12.569
  645    HD2  PHE 102           HD2      PHE 102  31.452  -7.841   9.154
  646    HE1  PHE 102           HE1      PHE 102  32.626  -6.850  13.828
  647    HE2  PHE 102           HE2      PHE 102  30.182  -6.147  10.406
  648    HZ   PHE 102           HZ       PHE 102  30.768  -5.649  12.745
  649    H    GLN 103           H        GLN 103  36.640  -7.802   8.746
  650    HA   GLN 103           HA       GLN 103  37.978 -10.402   8.767
  651    HB2  GLN 103           HB1      GLN 103  37.623  -8.982   6.410
  652    HB3  GLN 103           HB2      GLN 103  39.263  -8.549   6.919
  653    HG2  GLN 103           HG1      GLN 103  39.822 -10.948   7.095
  654    HG3  GLN 103           HG2      GLN 103  38.207 -11.333   6.487
  655   HE21  GLN 103          HE21      GLN 103  41.051  -9.391   5.648
  656   HE22  GLN 103          HE22      GLN 103  40.971  -9.692   3.949
  657    H    SER 104           H        SER 104  40.390 -10.127   9.035
  658    HA   SER 104           HA       SER 104  42.149  -9.378  10.269
  659    HB2  SER 104           HB1      SER 104  40.892  -6.634   9.956
  660    HB3  SER 104           HB2      SER 104  42.588  -6.998  10.327
  661    HG   SER 104           HG       SER 104  41.796  -6.547   8.004
  662    H    LEU 105           H        LEU 105  41.885 -10.247  12.251
  663    HA   LEU 105           HA       LEU 105  40.167  -8.824  14.169
  664    HB2  LEU 105           HB1      LEU 105  40.663 -11.621  13.617
  665    HB3  LEU 105           HB2      LEU 105  40.989 -11.232  15.315
  666    HG   LEU 105           HG       LEU 105  38.548 -10.034  14.865
  667   HD11  LEU 105          HD11      LEU 105  38.873 -11.798  12.748
  668   HD12  LEU 105          HD12      LEU 105  37.359 -11.095  13.316
  669   HD13  LEU 105          HD13      LEU 105  37.872 -12.675  13.904
  670   HD21  LEU 105          HD21      LEU 105  37.770 -11.518  16.458
  671   HD22  LEU 105          HD22      LEU 105  39.511 -11.549  16.742
  672   HD23  LEU 105          HD23      LEU 105  38.741 -12.855  15.839
  673    H    GLU 106           H        GLU 106  40.968  -8.911  16.471
  674    HA   GLU 106           HA       GLU 106  43.357  -7.538  16.737
  675    HB2  GLU 106           HB1      GLU 106  41.521  -7.636  18.427
  676    HB3  GLU 106           HB2      GLU 106  42.069  -9.263  18.857
  677    HG2  GLU 106           HG1      GLU 106  43.488  -8.393  20.310
  678    HG3  GLU 106           HG2      GLU 106  44.333  -7.598  18.976
  679    HE2  GLU 106           HE       GLU 106  42.169  -4.712  19.598
  680    H    HIS 107           H        HIS 107  45.450  -8.076  17.100
  681    HA   HIS 107           HA       HIS 107  46.302 -10.677  17.885
  682    HB2  HIS 107           HB1      HIS 107  45.638 -10.661  15.281
  683    HB3  HIS 107           HB2      HIS 107  47.301 -10.078  15.152
  684    HD1  HIS 107           HD1      HIS 107  45.347 -13.088  16.290
  685    HD2  HIS 107           HD2      HIS 107  49.277 -11.969  15.538
  686    HE1  HIS 107           HE1      HIS 107  46.681 -15.219  16.370
  687    HE2  HIS 107           HE2      HIS 107  49.082 -14.536  15.910
  688    H    HIS 108           H        HIS 108  48.669 -10.855  17.964
  689    HA   HIS 108           HA       HIS 108  49.918  -8.195  18.173
  690    HB2  HIS 108           HB1      HIS 108  51.484  -9.343  19.807
  691    HB3  HIS 108           HB2      HIS 108  49.816  -9.130  20.350
  692    HD1  HIS 108           HD1      HIS 108  51.878 -11.875  18.702
  693    HD2  HIS 108           HD2      HIS 108  48.714 -11.386  21.350
  694    HE1  HIS 108           HE1      HIS 108  51.297 -14.191  19.490
  695    HE2  HIS 108           HE2      HIS 108  49.362 -13.893  21.108
  696    H    HIS 109           H        HIS 109  52.180  -8.028  17.657
  697    HA   HIS 109           HA       HIS 109  52.857  -9.361  15.247
  698    HB2  HIS 109           HB1      HIS 109  54.212  -7.397  17.053
  699    HB3  HIS 109           HB2      HIS 109  55.175  -8.226  15.825
  700    HD1  HIS 109           HD1      HIS 109  55.336  -6.994  13.700
  701    HD2  HIS 109           HD2      HIS 109  51.776  -6.176  15.681
  702    HE1  HIS 109           HE1      HIS 109  54.142  -5.305  12.268
  703    HE2  HIS 109           HE2      HIS 109  51.964  -4.806  13.477
  704    H    HIS 110           H        HIS 110  53.294 -11.481  15.272
  705    HA   HIS 110           HA       HIS 110  54.305 -12.972  17.382
  706    HB2  HIS 110           HB1      HIS 110  54.954 -14.649  15.622
  707    HB3  HIS 110           HB2      HIS 110  53.275 -14.107  15.550
  708    HD1  HIS 110           HD1      HIS 110  56.467 -14.011  13.636
  709    HD2  HIS 110           HD2      HIS 110  52.597 -12.536  13.312
  710    HE1  HIS 110           HE1      HIS 110  56.256 -13.188  11.269
  711    HE2  HIS 110           HE2      HIS 110  53.890 -12.287  11.070
  712    H    HIS 111           H        HIS 111  56.318 -13.570  18.061
  713    HA   HIS 111           HA       HIS 111  58.688 -12.945  16.571
  714    HB2  HIS 111           HB1      HIS 111  59.653 -11.324  18.032
  715    HB3  HIS 111           HB2      HIS 111  58.048 -10.736  17.588
  716    HD1  HIS 111           HD1      HIS 111  59.530  -9.823  20.184
  717    HD2  HIS 111           HD2      HIS 111  56.642 -12.803  19.996
  718    HE1  HIS 111           HE1      HIS 111  58.573  -9.978  22.504
  719    HE2  HIS 111           HE2      HIS 111  56.805 -11.799  22.390
  720    H    HIS 112           H        HIS 112  60.689 -13.433  17.936
  721    HA   HIS 112           HA       HIS 112  60.144 -15.402  20.035
  722    HB2  HIS 112           HB1      HIS 112  60.663 -16.221  17.479
  723    HB3  HIS 112           HB2      HIS 112  62.288 -16.188  18.173
  724    HD1  HIS 112           HD1      HIS 112  62.586 -17.637  20.445
  725    HD2  HIS 112           HD2      HIS 112  59.233 -18.459  18.133
  726    HE1  HIS 112           HE1      HIS 112  61.775 -19.889  21.214
  727    HE2  HIS 112           HE2      HIS 112  59.725 -20.392  19.803
  Start of MODEL   29
    1    H1   MET  18           H        MET  18 -61.499  21.928  39.174
    2    HA   MET  18           HA       MET  18 -59.443  23.925  38.698
    3    HB2  MET  18           HB1      MET  18 -59.672  22.754  40.896
    4    HB3  MET  18           HB2      MET  18 -59.199  21.253  40.087
    5    HG2  MET  18           HG1      MET  18 -57.226  22.007  41.074
    6    HG3  MET  18           HG2      MET  18 -57.088  22.488  39.382
    7    HE1  MET  18           HE1      MET  18 -55.220  24.906  39.942
    8    HE2  MET  18           HE2      MET  18 -56.290  24.281  38.688
    9    HE3  MET  18           HE3      MET  18 -56.471  25.941  39.256
   10    H    LEU  19           H        LEU  19 -59.204  23.789  36.442
   11    HA   LEU  19           HA       LEU  19 -58.276  21.240  35.345
   12    HB2  LEU  19           HB1      LEU  19 -59.447  23.730  34.229
   13    HB3  LEU  19           HB2      LEU  19 -58.285  22.856  33.215
   14    HG   LEU  19           HG       LEU  19 -59.815  20.798  33.730
   15   HD11  LEU  19          HD11      LEU  19 -61.596  21.246  34.977
   16   HD12  LEU  19          HD12      LEU  19 -62.214  22.206  33.633
   17   HD13  LEU  19          HD13      LEU  19 -61.282  22.981  34.913
   18   HD21  LEU  19          HD21      LEU  19 -59.502  21.594  31.510
   19   HD22  LEU  19          HD22      LEU  19 -60.473  23.033  31.821
   20   HD23  LEU  19          HD23      LEU  19 -61.240  21.446  31.769
   21    H    VAL  20           H        VAL  20 -56.167  20.873  35.499
   22    HA   VAL  20           HA       VAL  20 -54.294  23.120  35.457
   23    HB   VAL  20           HB       VAL  20 -53.787  20.206  36.075
   24   HG11  VAL  20          HG11      VAL  20 -52.031  22.548  35.761
   25   HG12  VAL  20          HG12      VAL  20 -51.734  21.559  37.192
   26   HG13  VAL  20          HG13      VAL  20 -51.677  20.830  35.587
   27   HG21  VAL  20          HG21      VAL  20 -53.407  22.001  38.279
   28   HG22  VAL  20          HG22      VAL  20 -55.037  22.182  37.631
   29   HG23  VAL  20          HG23      VAL  20 -54.467  20.597  38.155
   30    H    LEU  21           H        LEU  21 -53.500  23.697  33.551
   31    HA   LEU  21           HA       LEU  21 -53.475  21.869  31.315
   32    HB2  LEU  21           HB1      LEU  21 -52.354  24.670  31.459
   33    HB3  LEU  21           HB2      LEU  21 -52.765  23.745  30.004
   34    HG   LEU  21           HG       LEU  21 -54.840  24.567  32.022
   35   HD11  LEU  21          HD11      LEU  21 -53.699  26.106  29.714
   36   HD12  LEU  21          HD12      LEU  21 -53.981  26.640  31.370
   37   HD13  LEU  21          HD13      LEU  21 -55.347  26.373  30.287
   38   HD21  LEU  21          HD21      LEU  21 -55.895  24.465  29.457
   39   HD22  LEU  21          HD22      LEU  21 -56.100  23.263  30.733
   40   HD23  LEU  21          HD23      LEU  21 -54.810  23.077  29.543
   41    H    ASP  22           H        ASP  22 -51.601  21.333  30.085
   42    HA   ASP  22           HA       ASP  22 -49.054  21.571  31.533
   43    HB2  ASP  22           HB1      ASP  22 -50.099  19.317  31.878
   44    HB3  ASP  22           HB2      ASP  22 -49.988  19.061  30.131
   45    HD2  ASP  22           HD       ASP  22 -46.555  19.122  32.136
   46    H    PHE  23           H        PHE  23 -47.571  22.512  30.313
   47    HA   PHE  23           HA       PHE  23 -47.942  23.130  27.598
   48    HB2  PHE  23           HB1      PHE  23 -45.601  23.257  29.477
   49    HB3  PHE  23           HB2      PHE  23 -45.371  23.590  27.758
   50    HD1  PHE  23           HD1      PHE  23 -45.619  25.740  26.984
   51    HD2  PHE  23           HD2      PHE  23 -47.583  24.597  30.583
   52    HE1  PHE  23           HE1      PHE  23 -46.371  28.060  27.307
   53    HE2  PHE  23           HE2      PHE  23 -48.339  26.915  30.911
   54    HZ   PHE  23           HZ       PHE  23 -47.734  28.651  29.271
   55    H    ASN  24           H        ASN  24 -47.460  22.087  25.764
   56    HA   ASN  24           HA       ASN  24 -46.399  19.387  25.963
   57    HB2  ASN  24           HB1      ASN  24 -48.236  20.762  24.233
   58    HB3  ASN  24           HB2      ASN  24 -46.938  20.056  23.262
   59   HD21  ASN  24          HD21      ASN  24 -47.314  18.091  22.575
   60   HD22  ASN  24          HD22      ASN  24 -48.288  16.899  23.361
   61    H    ASN  25           H        ASN  25 -45.456  22.534  24.836
   62    HA   ASN  25           HA       ASN  25 -43.543  23.349  23.913
   63    HB2  ASN  25           HB1      ASN  25 -42.419  20.876  25.252
   64    HB3  ASN  25           HB2      ASN  25 -41.431  22.175  24.574
   65   HD21  ASN  25          HD21      ASN  25 -42.799  21.030  27.338
   66   HD22  ASN  25          HD22      ASN  25 -42.796  22.479  28.281
   67    H    ILE  26           H        ILE  26 -44.283  23.038  21.763
   68    HA   ILE  26           HA       ILE  26 -43.847  20.640  20.311
   69    HB   ILE  26           HB       ILE  26 -44.352  21.932  18.317
   70   HG12  ILE  26          HG11      ILE  26 -44.999  24.480  19.162
   71   HG13  ILE  26          HG12      ILE  26 -43.484  24.150  20.021
   72   HG21  ILE  26          HG21      ILE  26 -46.057  21.426  20.343
   73   HG22  ILE  26          HG22      ILE  26 -46.261  23.170  20.185
   74   HG23  ILE  26          HG23      ILE  26 -46.547  22.121  18.797
   75   HD11  ILE  26          HD11      ILE  26 -43.823  24.947  17.339
   76   HD12  ILE  26          HD12      ILE  26 -42.325  24.580  18.194
   77   HD13  ILE  26          HD13      ILE  26 -43.179  23.305  17.325
   78    H    ARG  27           H        ARG  27 -42.138  19.933  19.171
   79    HA   ARG  27           HA       ARG  27 -39.642  21.400  19.432
   80    HB2  ARG  27           HB1      ARG  27 -40.313  18.626  18.436
   81    HB3  ARG  27           HB2      ARG  27 -38.679  19.303  18.388
   82    HG2  ARG  27           HG1      ARG  27 -39.388  19.742  20.994
   83    HG3  ARG  27           HG2      ARG  27 -40.185  18.201  20.633
   84    HD2  ARG  27           HD1      ARG  27 -38.147  17.392  21.267
   85    HD3  ARG  27           HD2      ARG  27 -37.826  17.659  19.548
   86    HE   ARG  27           HE       ARG  27 -37.142  20.019  20.743
   87   HH11  ARG  27          HH11      ARG  27 -36.219  16.686  21.145
   88   HH12  ARG  27          HH12      ARG  27 -34.613  17.060  21.679
   89   HH21  ARG  27          HH21      ARG  27 -35.030  20.523  21.445
   90   HH22  ARG  27          HH22      ARG  27 -33.939  19.242  21.850
   91    H    SER  28           H        SER  28 -38.176  21.593  17.569
   92    HA   SER  28           HA       SER  28 -39.631  21.965  15.035
   93    HB2  SER  28           HB1      SER  28 -37.614  23.804  16.346
   94    HB3  SER  28           HB2      SER  28 -38.072  23.930  14.637
   95    HG   SER  28           HG       SER  28 -39.296  25.064  16.593
   96    H    SER  29           H        SER  29 -38.795  20.872  13.392
   97    HA   SER  29           HA       SER  29 -36.445  19.312  13.665
   98    HB2  SER  29           HB1      SER  29 -38.644  19.287  11.991
   99    HB3  SER  29           HB2      SER  29 -37.326  19.771  10.909
  100    HG   SER  29           HG       SER  29 -37.506  17.504  11.012
  101    H    ALA  30           H        ALA  30 -34.554  19.398  12.264
  102    HA   ALA  30           HA       ALA  30 -33.673  22.166  11.881
  103    HB1  ALA  30           HB1      ALA  30 -31.722  19.984  11.551
  104    HB2  ALA  30           HB2      ALA  30 -31.592  21.506  12.436
  105    HB3  ALA  30           HB3      ALA  30 -32.437  20.136  13.157
  106    H    ASP  31           H        ASP  31 -34.001  19.100  10.170
  107    HA   ASP  31           HA       ASP  31 -33.875  18.547   7.964
  108    HB2  ASP  31           HB1      ASP  31 -35.678  20.494   8.146
  109    HB3  ASP  31           HB2      ASP  31 -34.488  21.355   7.164
  110    HD2  ASP  31           HD       ASP  31 -35.753  18.055   5.385
  111    H    LEU  32           H        LEU  32 -31.424  19.256   9.128
  112    HA   LEU  32           HA       LEU  32 -30.028  20.931   7.203
  113    HB2  LEU  32           HB1      LEU  32 -29.697  20.459   9.893
  114    HB3  LEU  32           HB2      LEU  32 -28.411  19.486   9.160
  115    HG   LEU  32           HG       LEU  32 -27.594  21.685   9.812
  116   HD11  LEU  32          HD11      LEU  32 -26.206  21.618   8.083
  117   HD12  LEU  32          HD12      LEU  32 -27.462  22.192   6.986
  118   HD13  LEU  32          HD13      LEU  32 -27.298  20.467   7.312
  119   HD21  LEU  32          HD21      LEU  32 -29.168  23.057   7.712
  120   HD22  LEU  32          HD22      LEU  32 -28.550  23.664   9.248
  121   HD23  LEU  32          HD23      LEU  32 -30.001  22.662   9.216
  122    H    HIS  33           H        HIS  33 -29.519  20.014   5.325
  123    HA   HIS  33           HA       HIS  33 -29.218  17.225   4.934
  124    HB2  HIS  33           HB1      HIS  33 -29.556  19.427   3.302
  125    HB3  HIS  33           HB2      HIS  33 -27.904  18.917   2.937
  126    HD1  HIS  33           HD1      HIS  33 -28.175  15.884   3.034
  127    HD2  HIS  33           HD2      HIS  33 -30.944  18.380   1.199
  128    HE1  HIS  33           HE1      HIS  33 -29.365  14.445   1.348
  129    HE2  HIS  33           HE2      HIS  33 -31.058  15.970   0.227
  130    H    GLY  34           H        GLY  34 -27.545  15.964   5.396
  131    HA2  GLY  34           HA2      GLY  34 -25.092  17.036   6.392
  132    HA3  GLY  34           HA3      GLY  34 -25.445  15.338   6.109
  133    HA1  GLY  34           HA1      GLY  34 -25.371  17.411   5.644
  134    H    ALA  35           H        ALA  35 -23.943  14.499   4.832
  135    HA   ALA  35           HA       ALA  35 -23.390  15.775   2.274
  136    HB1  ALA  35           HB1      ALA  35 -21.695  16.542   4.042
  137    HB2  ALA  35           HB2      ALA  35 -21.055  14.901   3.938
  138    HB3  ALA  35           HB3      ALA  35 -21.076  15.932   2.507
  139    H    ARG  36           H        ARG  36 -22.240  14.341   0.779
  140    HA   ARG  36           HA       ARG  36 -21.942  11.565   1.452
  141    HB2  ARG  36           HB1      ARG  36 -23.627  10.668  -0.021
  142    HB3  ARG  36           HB2      ARG  36 -24.399  11.760   1.139
  143    HG2  ARG  36           HG1      ARG  36 -24.341  13.551  -0.608
  144    HG3  ARG  36           HG2      ARG  36 -23.781  12.318  -1.751
  145    HD2  ARG  36           HD1      ARG  36 -26.010  11.177  -0.502
  146    HD3  ARG  36           HD2      ARG  36 -26.453  12.862  -0.798
  147    HE   ARG  36           HE       ARG  36 -26.040  10.809  -2.772
  148   HH11  ARG  36          HH11      ARG  36 -26.113  14.235  -2.159
  149   HH12  ARG  36          HH12      ARG  36 -26.443  14.654  -3.807
  150   HH21  ARG  36          HH21      ARG  36 -26.474  11.349  -4.945
  151   HH22  ARG  36          HH22      ARG  36 -26.649  13.013  -5.391
  152    H    LYS  37           H        LYS  37 -20.629  10.507   0.030
  153    HA   LYS  37           HA       LYS  37 -19.030  10.280  -1.574
  154    HB2  LYS  37           HB1      LYS  37 -21.230  10.247  -2.896
  155    HB3  LYS  37           HB2      LYS  37 -20.822  11.904  -3.369
  156    HG2  LYS  37           HG1      LYS  37 -20.007  10.673  -5.143
  157    HG3  LYS  37           HG2      LYS  37 -18.570  10.882  -4.127
  158    HD2  LYS  37           HD1      LYS  37 -18.901   8.659  -3.158
  159    HD3  LYS  37           HD2      LYS  37 -20.359   8.449  -4.145
  160    HE2  LYS  37           HE1      LYS  37 -18.644   9.037  -6.109
  161    HE3  LYS  37           HE2      LYS  37 -17.500   8.365  -4.937
  162    HZ1  LYS  37           HZ1      LYS  37 -18.497   6.302  -5.007
  163    HZ2  LYS  37           HZ2      LYS  37 -18.637   6.802  -6.616
  164    HZ3  LYS  37           HZ3      LYS  37 -19.972   6.898  -5.582
  165    H    GLY  38           H        GLY  38 -17.805  11.837  -0.162
  166    HA2  GLY  38           HA2      GLY  38 -17.314  14.377  -1.586
  167    HA3  GLY  38           HA3      GLY  38 -17.052  14.140   0.136
  168    HA1  GLY  38           HA1      GLY  38 -17.108  13.586  -1.916
  169    H    SER  39           H        SER  39 -15.414  14.689  -2.532
  170    HA   SER  39           HA       SER  39 -13.266  14.384  -3.218
  171    HB2  SER  39           HB1      SER  39 -12.889  13.294  -0.409
  172    HB3  SER  39           HB2      SER  39 -11.595  13.803  -1.509
  173    HG   SER  39           HG       SER  39 -12.668  15.329   0.197
  174    H    GLN  40           H        GLN  40 -11.390  12.522  -3.027
  175    HA   GLN  40           HA       GLN  40 -12.737  10.123  -4.030
  176    HB2  GLN  40           HB1      GLN  40 -10.376  11.593  -4.781
  177    HB3  GLN  40           HB2      GLN  40  -9.959   9.906  -4.439
  178    HG2  GLN  40           HG1      GLN  40 -10.660   9.351  -6.460
  179    HG3  GLN  40           HG2      GLN  40 -12.295   9.823  -5.981
  180   HE21  GLN  40          HE21      GLN  40 -10.831  10.037  -8.554
  181   HE22  GLN  40          HE22      GLN  40 -10.960  11.699  -9.010
  182    H    CYS  41           H        CYS  41  -9.643  10.665  -2.348
  183    HA   CYS  41           HA       CYS  41 -10.386   8.538  -0.456
  184    HB2  CYS  41           HB1      CYS  41  -8.124   7.640  -0.539
  185    HB3  CYS  41           HB2      CYS  41  -8.853   7.611  -2.144
  186    H    LEU  42           H        LEU  42  -9.552   8.729   1.632
  187    HA   LEU  42           HA       LEU  42  -8.606  11.426   2.298
  188    HB2  LEU  42           HB1      LEU  42 -10.425   9.525   3.528
  189    HB3  LEU  42           HB2      LEU  42  -9.188  10.090   4.664
  190    HG   LEU  42           HG       LEU  42  -9.859  12.414   4.227
  191   HD11  LEU  42          HD11      LEU  42 -10.673  12.141   1.947
  192   HD12  LEU  42          HD12      LEU  42 -11.904  12.875   2.974
  193   HD13  LEU  42          HD13      LEU  42 -12.023  11.171   2.535
  194   HD21  LEU  42          HD21      LEU  42 -12.397  11.011   4.886
  195   HD22  LEU  42          HD22      LEU  42 -11.615  12.371   5.691
  196   HD23  LEU  42          HD23      LEU  42 -10.992  10.736   5.914
  197    H    SER  43           H        SER  43  -7.717   8.081   2.372
  198    HA   SER  43           HA       SER  43  -5.030   8.791   3.178
  199    HB2  SER  43           HB1      SER  43  -6.868   7.803   5.109
  200    HB3  SER  43           HB2      SER  43  -5.720   6.500   4.757
  201    HG   SER  43           HG       SER  43  -5.325   8.820   6.116
  202    H    ASP  44           H        ASP  44  -3.536   6.928   2.995
  203    HA   ASP  44           HA       ASP  44  -3.788   5.630   0.550
  204    HB2  ASP  44           HB1      ASP  44  -2.082   4.943   2.956
  205    HB3  ASP  44           HB2      ASP  44  -1.906   4.174   1.373
  206    HD2  ASP  44           HD       ASP  44  -1.182   8.007   0.977
  207    H    THR  45           H        THR  45  -4.968   4.737   3.681
  208    HA   THR  45           HA       THR  45  -5.336   1.964   3.190
  209    HB   THR  45           HB       THR  45  -7.267   3.146   5.040
  210    HG1  THR  45           HG1      THR  45  -5.548   3.750   6.539
  211   HG21  THR  45          HG21      THR  45  -6.803   0.820   5.175
  212   HG22  THR  45          HG22      THR  45  -6.062   1.553   6.596
  213   HG23  THR  45          HG23      THR  45  -5.063   1.099   5.217
  214    H    ASP  46           H        ASP  46  -7.120   4.802   2.339
  215    HA   ASP  46           HA       ASP  46  -9.529   3.298   1.694
  216    HB2  ASP  46           HB1      ASP  46  -8.930   6.022   2.323
  217    HB3  ASP  46           HB2      ASP  46  -9.664   5.970   0.714
  218    HD2  ASP  46           HD       ASP  46 -11.904   4.668   3.730
  219    H    CYS  47           H        CYS  47  -6.719   3.347   0.273
  220    HA   CYS  47           HA       CYS  47  -7.754   3.746  -2.454
  221    HB2  CYS  47           HB1      CYS  47  -5.654   5.000  -1.506
  222    HB3  CYS  47           HB2      CYS  47  -4.835   3.472  -1.831
  223    H    ASN  48           H        ASN  48  -6.395   1.461  -0.234
  224    HA   ASN  48           HA       ASN  48  -6.102  -0.792  -0.330
  225    HB2  ASN  48           HB1      ASN  48  -8.298  -0.219  -2.063
  226    HB3  ASN  48           HB2      ASN  48  -7.321  -1.489  -2.812
  227   HD21  ASN  48          HD21      ASN  48  -9.976  -1.243  -1.205
  228   HD22  ASN  48          HD22      ASN  48  -9.897  -2.605  -0.145
  229    H    THR  49           H        THR  49  -5.178  -2.589  -1.750
  230    HA   THR  49           HA       THR  49  -3.433  -3.375  -2.982
  231    HB   THR  49           HB       THR  49  -3.298  -1.178  -4.912
  232    HG1  THR  49           HG1      THR  49  -5.406  -1.486  -5.699
  233   HG21  THR  49          HG21      THR  49  -2.902  -2.876  -6.324
  234   HG22  THR  49          HG22      THR  49  -4.314  -3.777  -5.774
  235   HG23  THR  49          HG23      THR  49  -2.800  -3.879  -4.877
  236    H    ARG  50           H        ARG  50  -1.328  -2.362  -4.267
  237    HA   ARG  50           HA       ARG  50   0.135  -1.051  -2.139
  238    HB2  ARG  50           HB1      ARG  50   2.111  -1.427  -3.613
  239    HB3  ARG  50           HB2      ARG  50   1.221  -2.906  -3.216
  240    HG2  ARG  50           HG1      ARG  50   0.326  -1.611  -5.688
  241    HG3  ARG  50           HG2      ARG  50   2.007  -2.171  -5.716
  242    HD2  ARG  50           HD1      ARG  50   0.934  -4.348  -4.645
  243    HD3  ARG  50           HD2      ARG  50  -0.511  -3.733  -5.458
  244    HE   ARG  50           HE       ARG  50   0.402  -4.341  -7.462
  245   HH11  ARG  50          HH11      ARG  50   2.920  -4.229  -5.061
  246   HH12  ARG  50          HH12      ARG  50   4.127  -4.902  -6.106
  247   HH21  ARG  50          HH21      ARG  50   1.982  -5.228  -8.848
  248   HH22  ARG  50          HH22      ARG  50   3.592  -5.469  -8.261
  249    H    LYS  51           H        LYS  51  -1.513   0.821  -2.737
  250    HA   LYS  51           HA       LYS  51   0.009   2.701  -4.408
  251    HB2  LYS  51           HB1      LYS  51  -3.008   2.428  -4.357
  252    HB3  LYS  51           HB2      LYS  51  -2.094   3.655  -5.250
  253    HG2  LYS  51           HG1      LYS  51  -1.020   1.854  -6.570
  254    HG3  LYS  51           HG2      LYS  51  -2.057   0.684  -5.734
  255    HD2  LYS  51           HD1      LYS  51  -4.048   1.696  -6.634
  256    HD3  LYS  51           HD2      LYS  51  -3.100   3.021  -7.331
  257    HE2  LYS  51           HE1      LYS  51  -2.678   1.842  -9.179
  258    HE3  LYS  51           HE2      LYS  51  -2.063   0.491  -8.216
  259    HZ1  LYS  51           HZ1      LYS  51  -4.770   0.358  -7.897
  260    HZ2  LYS  51           HZ2      LYS  51  -3.839  -0.616  -8.920
  261    HZ3  LYS  51           HZ3      LYS  51  -4.585   0.777  -9.526
  262    H    PHE  52           H        PHE  52  -0.583   4.999  -3.948
  263    HA   PHE  52           HA       PHE  52  -1.201   5.327  -1.085
  264    HB2  PHE  52           HB1      PHE  52   0.184   7.431  -1.249
  265    HB3  PHE  52           HB2      PHE  52   1.082   5.923  -1.430
  266    HD1  PHE  52           HD1      PHE  52  -0.601   8.526  -3.495
  267    HD2  PHE  52           HD2      PHE  52   2.531   5.657  -3.203
  268    HE1  PHE  52           HE1      PHE  52   0.307   9.302  -5.646
  269    HE2  PHE  52           HE2      PHE  52   3.445   6.431  -5.352
  270    HZ   PHE  52           HZ       PHE  52   2.334   8.256  -6.576
  271    H    CYS  53           H        CYS  53  -2.089   7.501  -0.519
  272    HA   CYS  53           HA       CYS  53  -4.160   8.215  -2.463
  273    HB2  CYS  53           HB1      CYS  53  -4.908   7.580  -0.217
  274    HB3  CYS  53           HB2      CYS  53  -3.919   8.863   0.483
  275    H    LEU  54           H        LEU  54  -3.114   9.603  -3.853
  276    HA   LEU  54           HA       LEU  54  -1.531  11.800  -2.880
  277    HB2  LEU  54           HB1      LEU  54  -1.479  10.446  -5.173
  278    HB3  LEU  54           HB2      LEU  54  -2.569  11.754  -5.661
  279    HG   LEU  54           HG       LEU  54  -0.254  12.213  -6.298
  280   HD11  LEU  54          HD11      LEU  54  -0.053  14.444  -5.196
  281   HD12  LEU  54          HD12      LEU  54  -1.406  13.991  -4.159
  282   HD13  LEU  54          HD13      LEU  54  -1.636  14.116  -5.903
  283   HD21  LEU  54          HD21      LEU  54   0.448  11.022  -3.964
  284   HD22  LEU  54          HD22      LEU  54   0.642  12.726  -3.549
  285   HD23  LEU  54          HD23      LEU  54   1.515  12.047  -4.924
  286    H    GLN  55           H        GLN  55  -2.468  13.484  -1.933
  287    HA   GLN  55           HA       GLN  55  -4.922  14.573  -3.142
  288    HB2  GLN  55           HB1      GLN  55  -5.479  15.388  -0.800
  289    HB3  GLN  55           HB2      GLN  55  -5.637  13.649  -1.089
  290    HG2  GLN  55           HG1      GLN  55  -3.951  13.103   0.314
  291    HG3  GLN  55           HG2      GLN  55  -3.027  14.563  -0.068
  292   HE21  GLN  55          HE21      GLN  55  -4.784  13.032   2.266
  293   HE22  GLN  55          HE22      GLN  55  -5.157  14.385   3.274
  294    HA   PRO  56           HA       PRO  56  -1.739  17.858  -3.379
  295    HB2  PRO  56           HB1      PRO  56  -2.731  18.946  -5.691
  296    HB3  PRO  56           HB2      PRO  56  -1.636  17.564  -5.656
  297    HG2  PRO  56           HG1      PRO  56  -4.626  17.617  -5.891
  298    HG3  PRO  56           HG2      PRO  56  -3.426  16.654  -6.829
  299    HD2  PRO  56           HD1      PRO  56  -4.879  15.603  -4.792
  300    HD3  PRO  56           HD2      PRO  56  -3.219  15.091  -5.148
  301    H    ARG  57           H        ARG  57  -1.924  20.132  -3.134
  302    HA   ARG  57           HA       ARG  57  -4.363  20.945  -1.814
  303    HB2  ARG  57           HB1      ARG  57  -1.717  21.543  -1.435
  304    HB3  ARG  57           HB2      ARG  57  -2.302  22.988  -2.270
  305    HG2  ARG  57           HG1      ARG  57  -4.141  23.131  -0.566
  306    HG3  ARG  57           HG2      ARG  57  -3.308  21.841   0.319
  307    HD2  ARG  57           HD1      ARG  57  -1.733  23.233   1.113
  308    HD3  ARG  57           HD2      ARG  57  -1.541  24.029  -0.455
  309    HE   ARG  57           HE       ARG  57  -3.944  24.931   0.525
  310   HH11  ARG  57          HH11      ARG  57  -0.627  24.957   1.582
  311   HH12  ARG  57          HH12      ARG  57  -0.783  26.440   2.464
  312   HH21  ARG  57          HH21      ARG  57  -4.163  26.884   1.684
  313   HH22  ARG  57          HH22      ARG  57  -2.794  27.534   2.522
  314    H    ASP  58           H        ASP  58  -2.493  21.960  -4.657
  315    HA   ASP  58           HA       ASP  58  -4.417  23.948  -5.425
  316    HB2  ASP  58           HB1      ASP  58  -2.282  22.760  -7.202
  317    HB3  ASP  58           HB2      ASP  58  -3.014  24.366  -7.297
  318    HD2  ASP  58           HD       ASP  58   0.147  23.924  -5.088
  319    H    GLU  59           H        GLU  59  -3.992  20.571  -5.969
  320    HA   GLU  59           HA       GLU  59  -6.076  20.626  -8.050
  321    HB2  GLU  59           HB1      GLU  59  -3.575  19.201  -7.845
  322    HB3  GLU  59           HB2      GLU  59  -4.923  18.060  -7.971
  323    HG2  GLU  59           HG1      GLU  59  -5.659  19.025 -10.029
  324    HG3  GLU  59           HG2      GLU  59  -4.502  20.354  -9.869
  325    HE2  GLU  59           HE       GLU  59  -3.238  16.904 -11.299
  326    H    LYS  60           H        LYS  60  -7.136  18.234  -8.046
  327    HA   LYS  60           HA       LYS  60  -8.390  18.037  -5.413
  328    HB2  LYS  60           HB1      LYS  60 -10.052  16.585  -6.630
  329    HB3  LYS  60           HB2      LYS  60  -9.962  18.263  -7.189
  330    HG2  LYS  60           HG1      LYS  60  -8.167  16.464  -8.635
  331    HG3  LYS  60           HG2      LYS  60  -9.882  16.044  -8.786
  332    HD2  LYS  60           HD1      LYS  60 -10.443  18.136  -9.708
  333    HD3  LYS  60           HD2      LYS  60  -8.909  18.858  -9.190
  334    HE2  LYS  60           HE1      LYS  60  -7.983  18.342 -11.150
  335    HE3  LYS  60           HE2      LYS  60  -8.308  16.629 -10.843
  336    HZ1  LYS  60           HZ1      LYS  60  -9.345  17.233 -12.881
  337    HZ2  LYS  60           HZ2      LYS  60 -10.106  18.573 -12.184
  338    HZ3  LYS  60           HZ3      LYS  60 -10.577  17.008 -11.743
  339    HA   PRO  61           HA       PRO  61  -6.507  14.227  -4.312
  340    HB2  PRO  61           HB1      PRO  61  -8.539  12.987  -2.957
  341    HB3  PRO  61           HB2      PRO  61  -7.648  14.369  -2.323
  342    HG2  PRO  61           HG1      PRO  61 -10.295  14.297  -3.731
  343    HG3  PRO  61           HG2      PRO  61  -9.820  15.197  -2.242
  344    HD2  PRO  61           HD1      PRO  61  -9.994  16.383  -4.678
  345    HD3  PRO  61           HD2      PRO  61  -8.802  16.868  -3.461
  346    H    PHE  62           H        PHE  62  -6.181  12.219  -5.130
  347    HA   PHE  62           HA       PHE  62  -8.267  10.672  -6.335
  348    HB2  PHE  62           HB1      PHE  62  -7.563  10.705  -8.606
  349    HB3  PHE  62           HB2      PHE  62  -7.709  12.391  -8.105
  350    HD1  PHE  62           HD1      PHE  62  -5.443  13.365  -7.033
  351    HD2  PHE  62           HD2      PHE  62  -5.702  10.190  -9.856
  352    HE1  PHE  62           HE1      PHE  62  -3.125  13.803  -7.733
  353    HE2  PHE  62           HE2      PHE  62  -3.385  10.623 -10.560
  354    HZ   PHE  62           HZ       PHE  62  -2.093  12.431  -9.499
  355    H    CYS  63           H        CYS  63  -7.670   8.540  -6.683
  356    HA   CYS  63           HA       CYS  63  -5.413   7.627  -5.207
  357    HB2  CYS  63           HB1      CYS  63  -7.715   6.444  -6.589
  358    HB3  CYS  63           HB2      CYS  63  -6.261   5.450  -6.671
  359    H    ALA  64           H        ALA  64  -3.386   7.614  -5.891
  360    HA   ALA  64           HA       ALA  64  -2.868   7.346  -8.779
  361    HB1  ALA  64           HB1      ALA  64  -1.525   8.893  -6.622
  362    HB2  ALA  64           HB2      ALA  64  -0.546   8.288  -7.958
  363    HB3  ALA  64           HB3      ALA  64  -1.910   9.360  -8.280
  364    H    THR  65           H        THR  65  -1.210   5.975  -9.491
  365    HA   THR  65           HA       THR  65  -0.957   3.541  -8.089
  366    HB   THR  65           HB       THR  65   0.806   3.006  -9.821
  367    HG1  THR  65           HG1      THR  65   1.115   5.485 -10.061
  368   HG21  THR  65          HG21      THR  65  -1.032   3.567 -11.746
  369   HG22  THR  65          HG22      THR  65  -2.018   3.678 -10.288
  370   HG23  THR  65          HG23      THR  65  -1.131   2.195 -10.642
  371    H    CYS  66           H        CYS  66   1.272   2.520  -7.718
  372    HA   CYS  66           HA       CYS  66   2.588   4.008  -5.687
  373    HB2  CYS  66           HB1      CYS  66   2.361   1.354  -6.290
  374    HB3  CYS  66           HB2      CYS  66   4.018   1.681  -6.799
  375    H    ARG  67           H        ARG  67   5.107   4.032  -5.709
  376    HA   ARG  67           HA       ARG  67   5.928   5.326  -8.221
  377    HB2  ARG  67           HB1      ARG  67   6.885   5.736  -5.380
  378    HB3  ARG  67           HB2      ARG  67   7.637   6.484  -6.797
  379    HG2  ARG  67           HG1      ARG  67   4.774   6.947  -6.744
  380    HG3  ARG  67           HG2      ARG  67   5.575   7.526  -5.274
  381    HD2  ARG  67           HD1      ARG  67   5.932   9.380  -6.525
  382    HD3  ARG  67           HD2      ARG  67   7.308   8.436  -7.111
  383    HE   ARG  67           HE       ARG  67   5.267   7.742  -8.779
  384   HH11  ARG  67          HH11      ARG  67   6.732  10.748  -7.810
  385   HH12  ARG  67          HH12      ARG  67   6.400  11.544  -9.313
  386   HH21  ARG  67          HH21      ARG  67   4.825   8.780 -10.762
  387   HH22  ARG  67          HH22      ARG  67   5.315  10.424 -10.991
  388    H    GLY  68           H        GLY  68   7.946   4.875  -9.119
  389    HA2  GLY  68           HA2      GLY  68   8.965   2.230  -8.463
  390    HA3  GLY  68           HA3      GLY  68   9.395   3.196  -9.867
  391    HA1  GLY  68           HA1      GLY  68   8.956   2.834  -7.819
  392    H    LEU  69           H        LEU  69  11.578   2.401  -9.262
  393    HA   LEU  69           HA       LEU  69  12.836   3.334  -6.890
  394    HB2  LEU  69           HB1      LEU  69  13.691   2.017  -9.411
  395    HB3  LEU  69           HB2      LEU  69  14.928   2.882  -8.484
  396    HG   LEU  69           HG       LEU  69  13.222   0.623  -7.440
  397   HD11  LEU  69          HD11      LEU  69  15.333   0.438  -9.169
  398   HD12  LEU  69          HD12      LEU  69  14.809  -0.823  -8.054
  399   HD13  LEU  69          HD13      LEU  69  16.114   0.271  -7.597
  400   HD21  LEU  69          HD21      LEU  69  13.771   2.057  -5.629
  401   HD22  LEU  69          HD22      LEU  69  15.428   2.254  -6.200
  402   HD23  LEU  69          HD23      LEU  69  14.893   0.698  -5.563
  403    H    ARG  70           H        ARG  70  13.331   4.302 -10.291
  404    HA   ARG  70           HA       ARG  70  14.870   6.573  -9.714
  405    HB2  ARG  70           HB1      ARG  70  13.182   5.819 -12.101
  406    HB3  ARG  70           HB2      ARG  70  14.149   7.301 -12.048
  407    HG2  ARG  70           HG1      ARG  70  15.625   4.859 -11.343
  408    HG3  ARG  70           HG2      ARG  70  15.025   4.924 -13.008
  409    HD2  ARG  70           HD1      ARG  70  16.182   7.462 -12.200
  410    HD3  ARG  70           HD2      ARG  70  17.328   6.127 -12.012
  411    HE   ARG  70           HE       ARG  70  16.268   5.751 -14.497
  412   HH11  ARG  70          HH11      ARG  70  17.872   8.385 -12.882
  413   HH12  ARG  70          HH12      ARG  70  18.571   9.021 -14.334
  414   HH21  ARG  70          HH21      ARG  70  17.182   6.579 -16.415
  415   HH22  ARG  70          HH22      ARG  70  18.177   7.995 -16.343
  416    H    ARG  71           H        ARG  71  11.446   6.044  -9.675
  417    HA   ARG  71           HA       ARG  71  10.427   8.586 -10.027
  418    HB2  ARG  71           HB1      ARG  71   9.550   6.102  -8.783
  419    HB3  ARG  71           HB2      ARG  71   8.894   7.527  -7.963
  420    HG2  ARG  71           HG1      ARG  71   7.390   6.684  -9.710
  421    HG3  ARG  71           HG2      ARG  71   7.944   8.335 -10.031
  422    HD2  ARG  71           HD1      ARG  71   9.167   7.733 -11.856
  423    HD3  ARG  71           HD2      ARG  71   9.575   6.151 -11.176
  424    HE   ARG  71           HE       ARG  71   7.728   5.263 -12.203
  425   HH11  ARG  71          HH11      ARG  71   7.491   8.737 -12.209
  426   HH12  ARG  71          HH12      ARG  71   6.109   8.771 -13.253
  427   HH21  ARG  71          HH21      ARG  71   5.910   5.295 -13.578
  428   HH22  ARG  71          HH22      ARG  71   5.210   6.812 -14.031
  429    H    ARG  72           H        ARG  72   9.984  10.325  -8.672
  430    HA   ARG  72           HA       ARG  72  11.861  10.655  -6.488
  431    HB2  ARG  72           HB1      ARG  72   9.926  12.520  -7.868
  432    HB3  ARG  72           HB2      ARG  72  10.868  13.000  -6.449
  433    HG2  ARG  72           HG1      ARG  72  12.712  11.872  -8.250
  434    HG3  ARG  72           HG2      ARG  72  11.654  12.928  -9.200
  435    HD2  ARG  72           HD1      ARG  72  12.305  14.833  -8.094
  436    HD3  ARG  72           HD2      ARG  72  12.686  13.952  -6.606
  437    HE   ARG  72           HE       ARG  72  14.830  13.724  -7.349
  438   HH11  ARG  72          HH11      ARG  72  12.777  14.432 -10.070
  439   HH12  ARG  72          HH12      ARG  72  14.090  14.576 -11.190
  440   HH21  ARG  72          HH21      ARG  72  16.569  13.912  -8.814
  441   HH22  ARG  72          HH22      ARG  72  16.247  14.279 -10.475
  442    H    CYS  73           H        CYS  73  11.220  11.444  -4.389
  443    HA   CYS  73           HA       CYS  73   8.453  11.159  -3.593
  444    HB2  CYS  73           HB1      CYS  73   8.950   9.489  -1.830
  445    HB3  CYS  73           HB2      CYS  73   9.153   8.846  -3.460
  446    H    GLN  74           H        GLN  74   8.133  11.735  -1.295
  447    HA   GLN  74           HA       GLN  74  10.232  13.586  -0.376
  448    HB2  GLN  74           HB1      GLN  74   7.579  14.141  -1.063
  449    HB3  GLN  74           HB2      GLN  74   7.604  14.149   0.707
  450    HG2  GLN  74           HG1      GLN  74   9.734  15.638  -0.751
  451    HG3  GLN  74           HG2      GLN  74   8.103  16.321  -0.680
  452   HE21  GLN  74          HE21      GLN  74   7.182  16.754   1.391
  453   HE22  GLN  74          HE22      GLN  74   8.202  17.073   2.749
  454    H    ARG  75           H        ARG  75   8.081  11.004   0.459
  455    HA   ARG  75           HA       ARG  75   9.187  11.007   3.190
  456    HB2  ARG  75           HB1      ARG  75   6.532  11.335   2.532
  457    HB3  ARG  75           HB2      ARG  75   6.640   9.601   2.860
  458    HG2  ARG  75           HG1      ARG  75   7.822  10.255   5.036
  459    HG3  ARG  75           HG2      ARG  75   7.215  11.887   4.710
  460    HD2  ARG  75           HD1      ARG  75   4.916  10.653   4.388
  461    HD3  ARG  75           HD2      ARG  75   5.701   9.396   5.355
  462    HE   ARG  75           HE       ARG  75   6.084  11.807   6.684
  463   HH11  ARG  75          HH11      ARG  75   3.446   9.738   5.745
  464   HH12  ARG  75          HH12      ARG  75   2.439  10.199   7.077
  465   HH21  ARG  75          HH21      ARG  75   4.765  12.423   8.442
  466   HH22  ARG  75          HH22      ARG  75   3.190  11.727   8.610
  467    H    ASP  76           H        ASP  76   9.099   8.793   4.211
  468    HA   ASP  76           HA       ASP  76  10.366   6.922   2.434
  469    HB2  ASP  76           HB1      ASP  76   9.555   6.351   5.282
  470    HB3  ASP  76           HB2      ASP  76  10.905   5.672   4.365
  471    HD2  ASP  76           HD       ASP  76  12.847   8.557   4.890
  472    H    ALA  77           H        ALA  77   7.276   7.167   4.104
  473    HA   ALA  77           HA       ALA  77   6.403   4.541   3.335
  474    HB1  ALA  77           HB1      ALA  77   5.124   6.876   4.692
  475    HB2  ALA  77           HB2      ALA  77   4.133   5.542   4.101
  476    HB3  ALA  77           HB3      ALA  77   5.397   5.240   5.293
  477    H    MET  78           H        MET  78   6.303   7.715   1.952
  478    HA   MET  78           HA       MET  78   4.114   7.528   0.252
  479    HB2  MET  78           HB1      MET  78   6.630   9.082   0.318
  480    HB3  MET  78           HB2      MET  78   5.844   8.961  -1.263
  481    HG2  MET  78           HG1      MET  78   4.295   9.788   1.172
  482    HG3  MET  78           HG2      MET  78   5.263  10.946   0.258
  483    HE1  MET  78           HE1      MET  78   5.020  10.142  -2.708
  484    HE2  MET  78           HE2      MET  78   3.572  11.007  -3.225
  485    HE3  MET  78           HE3      MET  78   4.730  11.789  -2.147
  486    H    CYS  79           H        CYS  79   7.212   5.984   0.080
  487    HA   CYS  79           HA       CYS  79   6.756   5.120  -2.675
  488    HB2  CYS  79           HB1      CYS  79   9.081   5.447  -0.938
  489    HB3  CYS  79           HB2      CYS  79   9.087   3.901  -1.788
  490    H    CYS  80           H        CYS  80   6.842   2.880  -3.257
  491    HA   CYS  80           HA       CYS  80   5.168   1.223  -1.815
  492    HB2  CYS  80           HB1      CYS  80   6.975   0.942  -4.107
  493    HB3  CYS  80           HB2      CYS  80   6.747  -0.560  -3.208
  494    HA   PRO  81           HA       PRO  81   7.473  -0.646   1.415
  495    HB2  PRO  81           HB1      PRO  81   6.578  -3.234   1.365
  496    HB3  PRO  81           HB2      PRO  81   5.598  -1.876   1.916
  497    HG2  PRO  81           HG1      PRO  81   5.648  -3.218  -0.764
  498    HG3  PRO  81           HG2      PRO  81   4.233  -2.720   0.234
  499    HD2  PRO  81           HD1      PRO  81   5.106  -1.276  -1.892
  500    HD3  PRO  81           HD2      PRO  81   4.396  -0.526  -0.452
  501    H    GLY  82           H        GLY  82   9.447  -1.528   1.733
  502    HA2  GLY  82           HA2      GLY  82  11.060  -3.285   1.316
  503    HA3  GLY  82           HA3      GLY  82  10.510  -3.323  -0.352
  504    HA1  GLY  82           HA1      GLY  82  10.994  -2.428   1.514
  505    H    THR  83           H        THR  83  10.472  -0.261  -0.209
  506    HA   THR  83           HA       THR  83  13.369   0.096  -0.630
  507    HB   THR  83           HB       THR  83  12.517   2.070  -2.123
  508    HG1  THR  83           HG1      THR  83  10.251   1.466  -1.424
  509   HG21  THR  83          HG21      THR  83  11.959  -0.046  -3.845
  510   HG22  THR  83          HG22      THR  83  13.047  -0.730  -2.638
  511   HG23  THR  83          HG23      THR  83  13.535   0.693  -3.557
  512    H    LEU  84           H        LEU  84  13.951   2.535  -0.556
  513    HA   LEU  84           HA       LEU  84  12.528   3.837   1.664
  514    HB2  LEU  84           HB1      LEU  84  15.058   2.670   1.826
  515    HB3  LEU  84           HB2      LEU  84  15.362   4.409   1.666
  516    HG   LEU  84           HG       LEU  84  13.343   3.630   3.675
  517   HD11  LEU  84          HD11      LEU  84  16.237   2.871   3.875
  518   HD12  LEU  84          HD12      LEU  84  14.809   1.899   4.231
  519   HD13  LEU  84          HD13      LEU  84  15.268   3.219   5.308
  520   HD21  LEU  84          HD21      LEU  84  15.255   5.774   3.128
  521   HD22  LEU  84          HD22      LEU  84  15.176   5.299   4.825
  522   HD23  LEU  84          HD23      LEU  84  13.714   5.817   3.984
  523    H    CYS  85           H        CYS  85  12.885   6.157   1.808
  524    HA   CYS  85           HA       CYS  85  13.215   7.327  -0.858
  525    HB2  CYS  85           HB1      CYS  85  11.129   7.692   0.589
  526    HB3  CYS  85           HB2      CYS  85  12.147   8.735   1.584
  527    H    VAL  86           H        VAL  86  15.247   7.928  -1.259
  528    HA   VAL  86           HA       VAL  86  16.665   9.469   0.815
  529    HB   VAL  86           HB       VAL  86  17.966   7.677  -1.238
  530   HG11  VAL  86          HG11      VAL  86  19.719   8.177   0.859
  531   HG12  VAL  86          HG12      VAL  86  19.778   8.880  -0.759
  532   HG13  VAL  86          HG13      VAL  86  18.949   9.733   0.545
  533   HG21  VAL  86          HG21      VAL  86  17.613   7.208   1.721
  534   HG22  VAL  86          HG22      VAL  86  16.700   6.396   0.448
  535   HG23  VAL  86          HG23      VAL  86  18.440   6.148   0.580
  536    H    ASN  87           H        ASN  87  17.596  11.361   0.209
  537    HA   ASN  87           HA       ASN  87  17.930  13.247  -1.019
  538    HB2  ASN  87           HB1      ASN  87  19.450  11.365  -2.127
  539    HB3  ASN  87           HB2      ASN  87  18.369  11.643  -3.496
  540   HD21  ASN  87          HD21      ASN  87  21.184  12.195  -3.332
  541   HD22  ASN  87          HD22      ASN  87  21.378  13.891  -3.597
  542    H    ASP  88           H        ASP  88  15.242  12.342  -0.827
  543    HA   ASP  88           HA       ASP  88  13.181  12.836  -1.653
  544    HB2  ASP  88           HB1      ASP  88  14.564  15.019  -2.181
  545    HB3  ASP  88           HB2      ASP  88  14.364  14.481  -3.854
  546    HD2  ASP  88           HD       ASP  88  11.205  15.864  -1.927
  547    H    VAL  89           H        VAL  89  14.828  10.621  -2.747
  548    HA   VAL  89           HA       VAL  89  13.149  10.073  -5.073
  549    HB   VAL  89           HB       VAL  89  16.151   9.738  -5.142
  550   HG11  VAL  89          HG11      VAL  89  15.080   7.947  -6.333
  551   HG12  VAL  89          HG12      VAL  89  14.015   9.082  -7.167
  552   HG13  VAL  89          HG13      VAL  89  15.746   9.085  -7.505
  553   HG21  VAL  89          HG21      VAL  89  15.826  11.353  -7.134
  554   HG22  VAL  89          HG22      VAL  89  14.296  11.755  -6.354
  555   HG23  VAL  89          HG23      VAL  89  15.817  12.011  -5.498
  556    H    CYS  90           H        CYS  90  12.713   7.906  -5.403
  557    HA   CYS  90           HA       CYS  90  12.898   6.215  -3.141
  558    HB2  CYS  90           HB1      CYS  90  11.356   6.293  -5.422
  559    HB3  CYS  90           HB2      CYS  90  12.365   4.871  -5.693
  560    H    THR  91           H        THR  91  14.101   4.358  -2.785
  561    HA   THR  91           HA       THR  91  16.134   3.567  -4.698
  562    HB   THR  91           HB       THR  91  17.287   5.353  -3.507
  563    HG1  THR  91           HG1      THR  91  19.016   4.133  -3.483
  564   HG21  THR  91          HG21      THR  91  16.159   3.967  -1.144
  565   HG22  THR  91          HG22      THR  91  16.441   5.685  -1.421
  566   HG23  THR  91          HG23      THR  91  17.784   4.631  -0.976
  567    H    THR  92           H        THR  92  17.283   1.605  -4.028
  568    HA   THR  92           HA       THR  92  15.492  -0.287  -2.879
  569    HB   THR  92           HB       THR  92  17.519  -1.842  -3.051
  570    HG1  THR  92           HG1      THR  92  19.337  -1.052  -3.924
  571   HG21  THR  92          HG21      THR  92  17.164  -2.198  -5.343
  572   HG22  THR  92          HG22      THR  92  16.860  -0.488  -5.652
  573   HG23  THR  92          HG23      THR  92  15.666  -1.452  -4.784
  574    H    MET  93           H        MET  93  16.042  -1.733  -1.078
  575    HA   MET  93           HA       MET  93  16.720  -0.247   1.252
  576    HB2  MET  93           HB1      MET  93  15.180  -2.385   0.868
  577    HB3  MET  93           HB2      MET  93  16.671  -3.225   1.316
  578    HG2  MET  93           HG1      MET  93  16.553  -2.600   3.477
  579    HG3  MET  93           HG2      MET  93  15.923  -1.002   3.079
  580    HE1  MET  93           HE1      MET  93  14.008  -0.215   3.366
  581    HE2  MET  93           HE2      MET  93  12.418  -0.979   3.380
  582    HE3  MET  93           HE3      MET  93  13.386  -0.927   4.855
  583    H    GLU  94           H        GLU  94  18.436  -2.503  -0.809
  584    HA   GLU  94           HA       GLU  94  20.640  -2.903   0.955
  585    HB2  GLU  94           HB1      GLU  94  20.326  -3.336  -2.022
  586    HB3  GLU  94           HB2      GLU  94  21.769  -3.797  -1.104
  587    HG2  GLU  94           HG1      GLU  94  19.971  -5.056   0.388
  588    HG3  GLU  94           HG2      GLU  94  19.071  -5.020  -1.135
  589    HE2  GLU  94           HE       GLU  94  22.538  -6.931  -1.413
  590    H    ASP  95           H        ASP  95  19.841  -0.558  -1.500
  591    HA   ASP  95           HA       ASP  95  22.493   0.529  -1.691
  592    HB2  ASP  95           HB1      ASP  95  19.786   1.369  -2.713
  593    HB3  ASP  95           HB2      ASP  95  21.188   2.439  -2.855
  594    HD2  ASP  95           HD       ASP  95  21.082   0.456  -5.861
  595    H    ALA  96           H        ALA  96  19.432   1.676  -0.276
  596    HA   ALA  96           HA       ALA  96  20.448   4.021   0.869
  597    HB1  ALA  96           HB1      ALA  96  18.360   4.320   1.623
  598    HB2  ALA  96           HB2      ALA  96  17.978   2.889   0.664
  599    HB3  ALA  96           HB3      ALA  96  18.304   2.733   2.390
  600    H    THR  97           H        THR  97  19.860   0.849   2.391
  601    HA   THR  97           HA       THR  97  21.346   1.665   4.751
  602    HB   THR  97           HB       THR  97  20.320  -1.119   4.307
  603    HG1  THR  97           HG1      THR  97  18.351  -0.371   4.208
  604   HG21  THR  97          HG21      THR  97  20.264   0.549   6.809
  605   HG22  THR  97          HG22      THR  97  21.692  -0.367   6.330
  606   HG23  THR  97          HG23      THR  97  20.176  -1.206   6.654
  607    H    GLU  98           H        GLU  98  23.421   1.909   3.752
  608    HA   GLU  98           HA       GLU  98  24.878  -0.611   3.640
  609    HB2  GLU  98           HB1      GLU  98  24.074   0.362   1.283
  610    HB3  GLU  98           HB2      GLU  98  25.542   1.330   1.487
  611    HG2  GLU  98           HG1      GLU  98  26.529  -1.097   2.081
  612    HG3  GLU  98           HG2      GLU  98  25.233  -1.555   0.968
  613    HE2  GLU  98           HE       GLU  98  28.492  -0.255  -0.587
  614    H    ASN  99           H        ASN  99  27.218  -0.313   3.760
  615    HA   ASN  99           HA       ASN  99  27.880   1.819   5.577
  616    HB2  ASN  99           HB1      ASN  99  28.722  -0.684   5.498
  617    HB3  ASN  99           HB2      ASN  99  29.950  -0.006   4.422
  618   HD21  ASN  99          HD21      ASN  99  31.330  -0.805   6.217
  619   HD22  ASN  99          HD22      ASN  99  31.649   0.280   7.523
  620    H    LEU 100           H        LEU 100  29.166   3.570   5.224
  621    HA   LEU 100           HA       LEU 100  30.299   3.928   2.537
  622    HB2  LEU 100           HB1      LEU 100  28.220   5.525   3.878
  623    HB3  LEU 100           HB2      LEU 100  29.555   6.464   3.190
  624    HG   LEU 100           HG       LEU 100  28.275   4.436   1.441
  625   HD11  LEU 100          HD11      LEU 100  26.985   7.093   2.037
  626   HD12  LEU 100          HD12      LEU 100  26.376   5.530   2.583
  627   HD13  LEU 100          HD13      LEU 100  26.450   5.894   0.858
  628   HD21  LEU 100          HD21      LEU 100  29.152   7.273   0.933
  629   HD22  LEU 100          HD22      LEU 100  28.780   6.035  -0.266
  630   HD23  LEU 100          HD23      LEU 100  30.201   5.866   0.764
  631    H    TYR 101           H        TYR 101  31.774   5.917   2.508
  632    HA   TYR 101           HA       TYR 101  33.285   6.024   5.037
  633    HB2  TYR 101           HB1      TYR 101  35.332   6.279   3.718
  634    HB3  TYR 101           HB2      TYR 101  34.501   4.773   3.318
  635    HD1  TYR 101           HD1      TYR 101  33.265   4.548   1.180
  636    HD2  TYR 101           HD2      TYR 101  35.624   7.981   2.050
  637    HE1  TYR 101           HE1      TYR 101  33.260   5.149  -1.205
  638    HE2  TYR 101           HE2      TYR 101  35.624   8.592  -0.332
  639    HH   TYR 101           HH       TYR 101  33.983   8.082  -2.364
  640    H    PHE 102           H        PHE 102  34.718   8.001   5.173
  641    HA   PHE 102           HA       PHE 102  33.252  10.339   4.137
  642    HB2  PHE 102           HB1      PHE 102  34.018   9.605   6.813
  643    HB3  PHE 102           HB2      PHE 102  34.819  11.111   6.364
  644    HD1  PHE 102           HD1      PHE 102  33.738  12.986   7.097
  645    HD2  PHE 102           HD2      PHE 102  31.425   9.656   5.802
  646    HE1  PHE 102           HE1      PHE 102  31.675  14.249   7.545
  647    HE2  PHE 102           HE2      PHE 102  29.358  10.914   6.247
  648    HZ   PHE 102           HZ       PHE 102  29.481  13.214   7.119
  649    H    GLN 103           H        GLN 103  36.454   9.794   5.606
  650    HA   GLN 103           HA       GLN 103  37.805  10.594   3.188
  651    HB2  GLN 103           HB1      GLN 103  39.024  12.474   4.326
  652    HB3  GLN 103           HB2      GLN 103  37.316  12.789   3.986
  653    HG2  GLN 103           HG1      GLN 103  36.715  12.804   6.180
  654    HG3  GLN 103           HG2      GLN 103  38.000  11.680   6.646
  655   HE21  GLN 103          HE21      GLN 103  38.525  13.048   8.390
  656   HE22  GLN 103          HE22      GLN 103  39.434  14.497   8.148
  657    H    SER 104           H        SER 104  40.283  10.949   3.838
  658    HA   SER 104           HA       SER 104  40.975   8.650   5.544
  659    HB2  SER 104           HB1      SER 104  41.661   9.198   2.877
  660    HB3  SER 104           HB2      SER 104  43.126   9.540   3.815
  661    HG   SER 104           HG       SER 104  43.192   7.480   4.515
  662    H    LEU 105           H        LEU 105  43.500   8.935   6.145
  663    HA   LEU 105           HA       LEU 105  43.815  11.628   7.293
  664    HB2  LEU 105           HB1      LEU 105  43.036   9.788   8.904
  665    HB3  LEU 105           HB2      LEU 105  44.670   9.127   8.717
  666    HG   LEU 105           HG       LEU 105  45.164  11.746   9.380
  667   HD11  LEU 105          HD11      LEU 105  43.175  10.986  11.427
  668   HD12  LEU 105          HD12      LEU 105  42.544  11.604   9.901
  669   HD13  LEU 105          HD13      LEU 105  43.666  12.580  10.851
  670   HD21  LEU 105          HD21      LEU 105  45.105   9.163  10.868
  671   HD22  LEU 105          HD22      LEU 105  45.447  10.654  11.746
  672   HD23  LEU 105          HD23      LEU 105  46.479  10.165  10.402
  673    H    GLU 106           H        GLU 106  45.875  12.457   7.346
  674    HA   GLU 106           HA       GLU 106  48.067  10.765   6.390
  675    HB2  GLU 106           HB1      GLU 106  46.764  12.781   4.845
  676    HB3  GLU 106           HB2      GLU 106  48.397  13.344   5.232
  677    HG2  GLU 106           HG1      GLU 106  49.387  11.854   3.883
  678    HG3  GLU 106           HG2      GLU 106  48.264  10.562   4.333
  679    HE2  GLU 106           HE       GLU 106  46.615  10.949   1.370
  680    H    HIS 107           H        HIS 107  50.206  11.767   6.724
  681    HA   HIS 107           HA       HIS 107  50.419  14.019   8.495
  682    HB2  HIS 107           HB1      HIS 107  49.851  11.721   9.794
  683    HB3  HIS 107           HB2      HIS 107  51.611  11.594   9.715
  684    HD1  HIS 107           HD1      HIS 107  49.008  14.104  10.886
  685    HD2  HIS 107           HD2      HIS 107  52.920  12.943  11.669
  686    HE1  HIS 107           HE1      HIS 107  49.719  15.448  12.888
  687    HE2  HIS 107           HE2      HIS 107  52.111  14.739  13.367
  688    H    HIS 108           H        HIS 108  52.615  14.655   8.876
  689    HA   HIS 108           HA       HIS 108  54.456  13.549   6.867
  690    HB2  HIS 108           HB1      HIS 108  53.981  16.281   7.957
  691    HB3  HIS 108           HB2      HIS 108  55.638  15.863   7.512
  692    HD1  HIS 108           HD1      HIS 108  52.240  16.362   5.999
  693    HD2  HIS 108           HD2      HIS 108  56.156  15.682   4.789
  694    HE1  HIS 108           HE1      HIS 108  52.252  16.746   3.514
  695    HE2  HIS 108           HE2      HIS 108  54.645  16.331   2.773
  696    H    HIS 109           H        HIS 109  56.690  13.312   7.401
  697    HA   HIS 109           HA       HIS 109  57.254  13.149  10.283
  698    HB2  HIS 109           HB1      HIS 109  58.034  11.095   8.197
  699    HB3  HIS 109           HB2      HIS 109  58.486  11.052   9.904
  700    HD1  HIS 109           HD1      HIS 109  56.669  10.380  11.616
  701    HD2  HIS 109           HD2      HIS 109  55.390  10.306   7.664
  702    HE1  HIS 109           HE1      HIS 109  54.477   9.148  11.641
  703    HE2  HIS 109           HE2      HIS 109  53.693   9.103   9.227
  704    H    HIS 110           H        HIS 110  58.818  12.896   7.086
  705    HA   HIS 110           HA       HIS 110  61.303  13.926   8.112
  706    HB2  HIS 110           HB1      HIS 110  60.920  12.232   6.170
  707    HB3  HIS 110           HB2      HIS 110  60.659  13.677   5.188
  708    HD1  HIS 110           HD1      HIS 110  62.809  13.131   3.820
  709    HD2  HIS 110           HD2      HIS 110  63.471  13.891   7.850
  710    HE1  HIS 110           HE1      HIS 110  65.289  13.488   4.038
  711    HE2  HIS 110           HE2      HIS 110  65.695  13.953   6.500
  712    H    HIS 111           H        HIS 111  60.599  15.969   8.923
  713    HA   HIS 111           HA       HIS 111  59.312  17.948   7.430
  714    HB2  HIS 111           HB1      HIS 111  60.204  19.543   9.061
  715    HB3  HIS 111           HB2      HIS 111  59.591  18.091   9.859
  716    HD1  HIS 111           HD1      HIS 111  62.708  20.024   9.301
  717    HD2  HIS 111           HD2      HIS 111  61.566  16.413  11.010
  718    HE1  HIS 111           HE1      HIS 111  64.691  19.260  10.646
  719    HE2  HIS 111           HE2      HIS 111  63.993  17.053  11.691
  720    H    HIS 112           H        HIS 112  62.609  16.865   7.406
  721    HA   HIS 112           HA       HIS 112  63.308  19.049   5.556
  722    HB2  HIS 112           HB1      HIS 112  64.586  18.537   7.841
  723    HB3  HIS 112           HB2      HIS 112  65.429  17.373   6.811
  724    HD1  HIS 112           HD1      HIS 112  65.017  21.046   7.350
  725    HD2  HIS 112           HD2      HIS 112  67.119  18.467   4.862
  726    HE1  HIS 112           HE1      HIS 112  66.725  22.478   6.186
  727    HE2  HIS 112           HE2      HIS 112  68.011  20.903   4.666
  Start of MODEL   30
    1    H1   MET  18           H        MET  18 -38.170  36.334  26.448
    2    HA   MET  18           HA       MET  18 -39.764  38.365  25.433
    3    HB2  MET  18           HB1      MET  18 -36.883  38.530  24.519
    4    HB3  MET  18           HB2      MET  18 -38.235  39.342  23.714
    5    HG2  MET  18           HG1      MET  18 -38.682  40.669  25.693
    6    HG3  MET  18           HG2      MET  18 -37.410  39.812  26.568
    7    HE1  MET  18           HE1      MET  18 -38.449  42.732  25.027
    8    HE2  MET  18           HE2      MET  18 -37.278  43.250  26.240
    9    HE3  MET  18           HE3      MET  18 -37.017  43.641  24.539
   10    H    LEU  19           H        LEU  19 -40.690  36.204  25.058
   11    HA   LEU  19           HA       LEU  19 -39.584  34.861  22.690
   12    HB2  LEU  19           HB1      LEU  19 -40.851  33.945  25.122
   13    HB3  LEU  19           HB2      LEU  19 -41.713  33.351  23.692
   14    HG   LEU  19           HG       LEU  19 -39.587  32.389  22.858
   15   HD11  LEU  19          HD11      LEU  19 -37.863  32.121  24.823
   16   HD12  LEU  19          HD12      LEU  19 -38.571  33.644  25.358
   17   HD13  LEU  19          HD13      LEU  19 -37.825  33.532  23.764
   18   HD21  LEU  19          HD21      LEU  19 -41.317  31.243  24.432
   19   HD22  LEU  19          HD22      LEU  19 -40.017  31.334  25.620
   20   HD23  LEU  19          HD23      LEU  19 -39.770  30.459  24.109
   21    H    VAL  20           H        VAL  20 -40.765  34.611  20.844
   22    HA   VAL  20           HA       VAL  20 -43.365  35.999  20.760
   23    HB   VAL  20           HB       VAL  20 -41.603  37.137  19.459
   24   HG11  VAL  20          HG11      VAL  20 -41.564  34.620  17.798
   25   HG12  VAL  20          HG12      VAL  20 -40.674  36.106  17.465
   26   HG13  VAL  20          HG13      VAL  20 -40.283  35.142  18.890
   27   HG21  VAL  20          HG21      VAL  20 -43.260  36.155  17.265
   28   HG22  VAL  20          HG22      VAL  20 -44.182  36.591  18.704
   29   HG23  VAL  20          HG23      VAL  20 -43.121  37.777  17.943
   30    H    LEU  21           H        LEU  21 -45.084  35.005  19.811
   31    HA   LEU  21           HA       LEU  21 -44.807  32.155  19.296
   32    HB2  LEU  21           HB1      LEU  21 -47.055  34.021  19.876
   33    HB3  LEU  21           HB2      LEU  21 -47.411  32.539  18.971
   34    HG   LEU  21           HG       LEU  21 -46.091  31.437  20.999
   35   HD11  LEU  21          HD11      LEU  21 -47.481  33.268  22.743
   36   HD12  LEU  21          HD12      LEU  21 -46.222  34.091  21.822
   37   HD13  LEU  21          HD13      LEU  21 -45.816  32.690  22.811
   38   HD21  LEU  21          HD21      LEU  21 -48.939  32.310  21.390
   39   HD22  LEU  21          HD22      LEU  21 -48.171  30.803  21.887
   40   HD23  LEU  21          HD23      LEU  21 -48.479  31.114  20.178
   41    H    ASP  22           H        ASP  22 -45.429  31.134  17.388
   42    HA   ASP  22           HA       ASP  22 -46.238  32.732  15.106
   43    HB2  ASP  22           HB1      ASP  22 -43.505  32.197  15.540
   44    HB3  ASP  22           HB2      ASP  22 -44.021  31.086  14.264
   45    HD2  ASP  22           HD       ASP  22 -44.612  33.704  12.034
   46    H    PHE  23           H        PHE  23 -46.487  31.280  13.124
   47    HA   PHE  23           HA       PHE  23 -47.422  28.622  13.988
   48    HB2  PHE  23           HB1      PHE  23 -48.821  30.777  12.658
   49    HB3  PHE  23           HB2      PHE  23 -48.813  29.331  11.647
   50    HD1  PHE  23           HD1      PHE  23 -50.470  30.977  14.264
   51    HD2  PHE  23           HD2      PHE  23 -49.439  27.094  12.860
   52    HE1  PHE  23           HE1      PHE  23 -52.300  30.012  15.599
   53    HE2  PHE  23           HE2      PHE  23 -51.267  26.123  14.190
   54    HZ   PHE  23           HZ       PHE  23 -52.701  27.582  15.561
   55    H    ASN  24           H        ASN  24 -47.639  27.072  12.093
   56    HA   ASN  24           HA       ASN  24 -45.507  27.499  10.115
   57    HB2  ASN  24           HB1      ASN  24 -45.532  25.578  12.266
   58    HB3  ASN  24           HB2      ASN  24 -45.540  24.741  10.709
   59   HD21  ASN  24          HD21      ASN  24 -43.904  27.393  12.390
   60   HD22  ASN  24          HD22      ASN  24 -42.345  27.093  11.710
   61    H    ASN  25           H        ASN  25 -45.812  26.515   8.116
   62    HA   ASN  25           HA       ASN  25 -48.449  25.266   7.703
   63    HB2  ASN  25           HB1      ASN  25 -48.168  26.317   5.315
   64    HB3  ASN  25           HB2      ASN  25 -48.764  27.307   6.652
   65   HD21  ASN  25          HD21      ASN  25 -48.062  29.263   6.000
   66   HD22  ASN  25          HD22      ASN  25 -46.398  29.684   5.810
   67    H    ILE  26           H        ILE  26 -48.542  23.485   6.409
   68    HA   ILE  26           HA       ILE  26 -46.157  22.005   6.006
   69    HB   ILE  26           HB       ILE  26 -47.555  20.333   4.929
   70   HG12  ILE  26          HG11      ILE  26 -50.158  21.364   5.210
   71   HG13  ILE  26          HG12      ILE  26 -49.224  22.624   4.384
   72   HG21  ILE  26          HG21      ILE  26 -48.942  19.790   6.775
   73   HG22  ILE  26          HG22      ILE  26 -47.543  20.642   7.426
   74   HG23  ILE  26          HG23      ILE  26 -49.084  21.481   7.251
   75   HD11  ILE  26          HD11      ILE  26 -48.436  20.726   2.835
   76   HD12  ILE  26          HD12      ILE  26 -49.819  19.842   3.480
   77   HD13  ILE  26          HD13      ILE  26 -50.064  21.371   2.637
   78    H    ARG  27           H        ARG  27 -45.372  21.159   3.962
   79    HA   ARG  27           HA       ARG  27 -46.012  22.758   1.599
   80    HB2  ARG  27           HB1      ARG  27 -43.450  22.770   3.086
   81    HB3  ARG  27           HB2      ARG  27 -43.324  22.638   1.326
   82    HG2  ARG  27           HG1      ARG  27 -45.177  24.719   2.264
   83    HG3  ARG  27           HG2      ARG  27 -43.477  24.974   2.688
   84    HD2  ARG  27           HD1      ARG  27 -44.044  24.126  -0.102
   85    HD3  ARG  27           HD2      ARG  27 -44.534  25.762   0.359
   86    HE   ARG  27           HE       ARG  27 -41.849  24.794   0.012
   87   HH11  ARG  27          HH11      ARG  27 -43.857  27.196   1.536
   88   HH12  ARG  27          HH12      ARG  27 -42.577  28.352   1.697
   89   HH21  ARG  27          HH21      ARG  27 -40.155  26.308   0.219
   90   HH22  ARG  27          HH22      ARG  27 -40.472  27.847   0.946
   91    H    SER  28           H        SER  28 -44.709  21.865  -0.344
   92    HA   SER  28           HA       SER  28 -45.290  19.055  -0.496
   93    HB2  SER  28           HB1      SER  28 -44.616  19.254  -2.854
   94    HB3  SER  28           HB2      SER  28 -45.744  20.543  -2.399
   95    HG   SER  28           HG       SER  28 -43.973  21.364  -3.581
   96    H    SER  29           H        SER  29 -43.677  17.540  -1.507
   97    HA   SER  29           HA       SER  29 -41.076  17.899  -0.183
   98    HB2  SER  29           HB1      SER  29 -42.468  15.352  -1.070
   99    HB3  SER  29           HB2      SER  29 -40.892  15.435  -0.262
  100    HG   SER  29           HG       SER  29 -42.390  15.068   1.320
  101    H    ALA  30           H        ALA  30 -39.175  17.603  -1.290
  102    HA   ALA  30           HA       ALA  30 -39.313  16.929  -4.136
  103    HB1  ALA  30           HB1      ALA  30 -38.175  18.843  -4.870
  104    HB2  ALA  30           HB2      ALA  30 -39.410  19.448  -3.763
  105    HB3  ALA  30           HB3      ALA  30 -37.735  19.314  -3.228
  106    H    ASP  31           H        ASP  31 -36.878  17.036  -4.994
  107    HA   ASP  31           HA       ASP  31 -35.297  15.467  -3.069
  108    HB2  ASP  31           HB1      ASP  31 -35.289  15.415  -6.099
  109    HB3  ASP  31           HB2      ASP  31 -34.192  14.481  -5.073
  110    HD2  ASP  31           HD       ASP  31 -37.822  13.135  -5.648
  111    H    LEU  32           H        LEU  32 -33.076  15.839  -2.878
  112    HA   LEU  32           HA       LEU  32 -32.094  18.327  -4.110
  113    HB2  LEU  32           HB1      LEU  32 -30.833  18.736  -1.989
  114    HB3  LEU  32           HB2      LEU  32 -32.594  18.883  -1.859
  115    HG   LEU  32           HG       LEU  32 -31.801  16.212  -1.175
  116   HD11  LEU  32          HD11      LEU  32 -30.525  18.336   0.533
  117   HD12  LEU  32          HD12      LEU  32 -29.642  17.378  -0.655
  118   HD13  LEU  32          HD13      LEU  32 -30.415  16.585   0.717
  119   HD21  LEU  32          HD21      LEU  32 -32.853  18.342   0.664
  120   HD22  LEU  32          HD22      LEU  32 -33.136  16.601   0.715
  121   HD23  LEU  32          HD23      LEU  32 -33.866  17.577  -0.561
  122    H    HIS  33           H        HIS  33 -30.500  17.812  -5.448
  123    HA   HIS  33           HA       HIS  33 -28.659  15.645  -4.682
  124    HB2  HIS  33           HB1      HIS  33 -30.146  15.717  -6.918
  125    HB3  HIS  33           HB2      HIS  33 -28.736  16.612  -7.491
  126    HD1  HIS  33           HD1      HIS  33 -29.651  13.649  -8.355
  127    HD2  HIS  33           HD2      HIS  33 -26.522  14.672  -5.821
  128    HE1  HIS  33           HE1      HIS  33 -28.064  11.699  -8.425
  129    HE2  HIS  33           HE2      HIS  33 -26.150  12.324  -6.877
  130    H    GLY  34           H        GLY  34 -27.010  16.638  -3.651
  131    HA2  GLY  34           HA2      GLY  34 -25.947  19.150  -4.675
  132    HA3  GLY  34           HA3      GLY  34 -25.463  18.340  -3.192
  133    HA1  GLY  34           HA1      GLY  34 -26.021  18.476  -5.240
  134    H    ALA  35           H        ALA  35 -23.275  18.399  -3.541
  135    HA   ALA  35           HA       ALA  35 -21.910  17.896  -5.893
  136    HB1  ALA  35           HB1      ALA  35 -21.223  18.388  -3.250
  137    HB2  ALA  35           HB2      ALA  35 -20.487  16.826  -3.613
  138    HB3  ALA  35           HB3      ALA  35 -20.118  18.229  -4.616
  139    H    ARG  36           H        ARG  36 -20.537  15.995  -6.416
  140    HA   ARG  36           HA       ARG  36 -22.153  13.644  -6.559
  141    HB2  ARG  36           HB1      ARG  36 -19.515  14.522  -7.603
  142    HB3  ARG  36           HB2      ARG  36 -19.771  12.777  -7.455
  143    HG2  ARG  36           HG1      ARG  36 -21.903  14.376  -8.776
  144    HG3  ARG  36           HG2      ARG  36 -20.388  14.106  -9.656
  145    HD2  ARG  36           HD1      ARG  36 -20.837  11.601  -8.769
  146    HD3  ARG  36           HD2      ARG  36 -22.502  12.190  -8.883
  147    HE   ARG  36           HE       ARG  36 -21.454  12.901 -11.267
  148   HH11  ARG  36          HH11      ARG  36 -21.525   9.904  -9.497
  149   HH12  ARG  36          HH12      ARG  36 -21.517   8.913 -10.918
  150   HH21  ARG  36          HH21      ARG  36 -21.443  11.607 -13.145
  151   HH22  ARG  36          HH22      ARG  36 -21.470   9.882 -12.992
  152    H    LYS  37           H        LYS  37 -18.827  14.028  -5.325
  153    HA   LYS  37           HA       LYS  37 -19.508  12.171  -3.147
  154    HB2  LYS  37           HB1      LYS  37 -17.081  12.115  -4.947
  155    HB3  LYS  37           HB2      LYS  37 -17.147  11.269  -3.394
  156    HG2  LYS  37           HG1      LYS  37 -18.014   9.525  -4.451
  157    HG3  LYS  37           HG2      LYS  37 -19.467  10.500  -4.733
  158    HD2  LYS  37           HD1      LYS  37 -18.806   9.714  -6.864
  159    HD3  LYS  37           HD2      LYS  37 -18.301  11.412  -6.791
  160    HE2  LYS  37           HE1      LYS  37 -16.014  10.732  -6.232
  161    HE3  LYS  37           HE2      LYS  37 -16.517   9.036  -6.260
  162    HZ1  LYS  37           HZ1      LYS  37 -16.979   9.188  -8.586
  163    HZ2  LYS  37           HZ2      LYS  37 -15.416   9.779  -8.325
  164    HZ3  LYS  37           HZ3      LYS  37 -16.692  10.855  -8.599
  165    H    GLY  38           H        GLY  38 -18.351  12.453  -1.201
  166    HA2  GLY  38           HA2      GLY  38 -17.366  15.180  -0.851
  167    HA3  GLY  38           HA3      GLY  38 -17.798  14.058   0.431
  168    HA1  GLY  38           HA1      GLY  38 -16.951  14.655  -1.427
  169    H    SER  39           H        SER  39 -16.316  12.241   0.816
  170    HA   SER  39           HA       SER  39 -13.534  13.062   0.302
  171    HB2  SER  39           HB1      SER  39 -13.460  11.199   2.368
  172    HB3  SER  39           HB2      SER  39 -13.364  12.961   2.543
  173    HG   SER  39           HG       SER  39 -15.201  12.859   3.533
  174    H    GLN  40           H        GLN  40 -12.470  11.861  -1.111
  175    HA   GLN  40           HA       GLN  40 -13.463   9.396  -2.105
  176    HB2  GLN  40           HB1      GLN  40 -11.994  11.120  -3.306
  177    HB3  GLN  40           HB2      GLN  40 -10.636  10.378  -2.444
  178    HG2  GLN  40           HG1      GLN  40 -10.877   9.501  -4.719
  179    HG3  GLN  40           HG2      GLN  40 -11.081   8.248  -3.486
  180   HE21  GLN  40          HE21      GLN  40 -12.641   6.882  -3.919
  181   HE22  GLN  40          HE22      GLN  40 -14.113   7.236  -4.753
  182    H    CYS  41           H        CYS  41 -10.469  10.118  -0.300
  183    HA   CYS  41           HA       CYS  41 -10.739   7.561   1.088
  184    HB2  CYS  41           HB1      CYS  41  -8.265   7.145   0.709
  185    HB3  CYS  41           HB2      CYS  41  -9.315   6.896  -0.685
  186    H    LEU  42           H        LEU  42  -9.605   7.445   3.067
  187    HA   LEU  42           HA       LEU  42  -8.886  10.081   4.143
  188    HB2  LEU  42           HB1      LEU  42  -9.945   7.562   5.392
  189    HB3  LEU  42           HB2      LEU  42  -9.150   8.808   6.369
  190    HG   LEU  42           HG       LEU  42 -10.936  10.372   5.206
  191   HD11  LEU  42          HD11      LEU  42 -13.085   9.154   4.976
  192   HD12  LEU  42          HD12      LEU  42 -12.196   7.637   5.095
  193   HD13  LEU  42          HD13      LEU  42 -11.897   8.730   3.743
  194   HD21  LEU  42          HD21      LEU  42 -10.961   8.716   7.635
  195   HD22  LEU  42          HD22      LEU  42 -12.528   9.362   7.149
  196   HD23  LEU  42          HD23      LEU  42 -11.175  10.456   7.440
  197    H    SER  43           H        SER  43  -7.684   6.896   3.509
  198    HA   SER  43           HA       SER  43  -5.010   7.757   4.264
  199    HB2  SER  43           HB1      SER  43  -6.174   5.177   5.354
  200    HB3  SER  43           HB2      SER  43  -4.552   5.825   5.653
  201    HG   SER  43           HG       SER  43  -6.011   6.273   7.375
  202    H    ASP  44           H        ASP  44  -3.434   5.822   3.763
  203    HA   ASP  44           HA       ASP  44  -3.710   5.277   0.990
  204    HB2  ASP  44           HB1      ASP  44  -1.606   4.067   1.196
  205    HB3  ASP  44           HB2      ASP  44  -1.521   5.592   2.087
  206    HD2  ASP  44           HD       ASP  44  -1.392   2.211   4.140
  207    H    THR  45           H        THR  45  -4.542   3.542   3.868
  208    HA   THR  45           HA       THR  45  -4.727   0.959   2.641
  209    HB   THR  45           HB       THR  45  -6.107   0.442   4.754
  210    HG1  THR  45           HG1      THR  45  -6.343   2.008   6.190
  211   HG21  THR  45          HG21      THR  45  -3.298   0.793   4.327
  212   HG22  THR  45          HG22      THR  45  -4.126  -0.379   5.354
  213   HG23  THR  45          HG23      THR  45  -3.690   1.204   5.996
  214    H    ASP  46           H        ASP  46  -6.805   3.706   2.945
  215    HA   ASP  46           HA       ASP  46  -9.289   2.390   2.573
  216    HB2  ASP  46           HB1      ASP  46  -8.740   4.831   3.368
  217    HB3  ASP  46           HB2      ASP  46  -8.817   5.199   1.640
  218    HD2  ASP  46           HD       ASP  46 -12.171   4.477   3.567
  219    H    CYS  47           H        CYS  47  -6.760   3.375   0.421
  220    HA   CYS  47           HA       CYS  47  -8.341   3.326  -1.967
  221    HB2  CYS  47           HB1      CYS  47  -5.675   4.039  -1.230
  222    HB3  CYS  47           HB2      CYS  47  -5.587   2.877  -2.555
  223    H    ASN  48           H        ASN  48  -5.573   1.259  -1.085
  224    HA   ASN  48           HA       ASN  48  -7.069  -1.142  -1.662
  225    HB2  ASN  48           HB1      ASN  48  -5.013  -0.039  -3.541
  226    HB3  ASN  48           HB2      ASN  48  -5.134  -1.791  -3.337
  227   HD21  ASN  48          HD21      ASN  48  -5.781   0.070  -5.595
  228   HD22  ASN  48          HD22      ASN  48  -7.394  -0.348  -6.051
  229    H    THR  49           H        THR  49  -3.599  -0.391  -1.853
  230    HA   THR  49           HA       THR  49  -2.892  -1.134   0.738
  231    HB   THR  49           HB       THR  49  -3.617  -3.359   0.365
  232    HG1  THR  49           HG1      THR  49  -1.331  -2.975   1.122
  233   HG21  THR  49          HG21      THR  49  -2.824  -2.823  -2.353
  234   HG22  THR  49          HG22      THR  49  -3.876  -4.092  -1.725
  235   HG23  THR  49          HG23      THR  49  -2.132  -4.347  -1.796
  236    H    ARG  50           H        ARG  50  -2.034  -1.077  -2.660
  237    HA   ARG  50           HA       ARG  50   0.736  -0.410  -1.917
  238    HB2  ARG  50           HB1      ARG  50  -0.388  -1.592  -4.464
  239    HB3  ARG  50           HB2      ARG  50   1.282  -1.036  -4.289
  240    HG2  ARG  50           HG1      ARG  50   1.912  -2.820  -3.053
  241    HG3  ARG  50           HG2      ARG  50   0.335  -2.954  -2.259
  242    HD2  ARG  50           HD1      ARG  50   0.664  -4.885  -3.670
  243    HD3  ARG  50           HD2      ARG  50  -0.607  -3.865  -4.357
  244    HE   ARG  50           HE       ARG  50   1.658  -3.028  -5.615
  245   HH11  ARG  50          HH11      ARG  50   0.090  -6.107  -5.191
  246   HH12  ARG  50          HH12      ARG  50   0.654  -6.748  -6.699
  247   HH21  ARG  50          HH21      ARG  50   2.407  -3.861  -7.602
  248   HH22  ARG  50          HH22      ARG  50   1.973  -5.471  -8.069
  249    H    LYS  51           H        LYS  51  -1.471   1.456  -1.885
  250    HA   LYS  51           HA       LYS  51  -0.340   3.449  -3.680
  251    HB2  LYS  51           HB1      LYS  51  -3.117   2.369  -3.857
  252    HB3  LYS  51           HB2      LYS  51  -2.881   4.107  -4.113
  253    HG2  LYS  51           HG1      LYS  51  -2.040   3.809  -6.154
  254    HG3  LYS  51           HG2      LYS  51  -0.980   2.497  -5.607
  255    HD2  LYS  51           HD1      LYS  51  -3.302   1.186  -5.496
  256    HD3  LYS  51           HD2      LYS  51  -3.723   2.379  -6.738
  257    HE2  LYS  51           HE1      LYS  51  -1.580   1.708  -7.931
  258    HE3  LYS  51           HE2      LYS  51  -1.496   0.354  -6.794
  259    HZ1  LYS  51           HZ1      LYS  51  -4.070   0.587  -8.021
  260    HZ2  LYS  51           HZ2      LYS  51  -3.045  -0.754  -7.915
  261    HZ3  LYS  51           HZ3      LYS  51  -2.840   0.371  -9.162
  262    H    PHE  52           H        PHE  52  -0.613   5.569  -2.979
  263    HA   PHE  52           HA       PHE  52  -1.553   5.810  -0.209
  264    HB2  PHE  52           HB1      PHE  52  -0.225   7.941  -0.203
  265    HB3  PHE  52           HB2      PHE  52   0.735   6.478  -0.446
  266    HD1  PHE  52           HD1      PHE  52  -0.574   9.494  -2.060
  267    HD2  PHE  52           HD2      PHE  52   1.850   6.026  -2.522
  268    HE1  PHE  52           HE1      PHE  52   0.377  10.438  -4.125
  269    HE2  PHE  52           HE2      PHE  52   2.805   6.965  -4.586
  270    HZ   PHE  52           HZ       PHE  52   2.069   9.173  -5.390
  271    H    CYS  53           H        CYS  53  -2.771   7.674   0.429
  272    HA   CYS  53           HA       CYS  53  -4.664   8.488  -1.623
  273    HB2  CYS  53           HB1      CYS  53  -5.471   7.676   0.571
  274    HB3  CYS  53           HB2      CYS  53  -4.667   9.038   1.352
  275    H    LEU  54           H        LEU  54  -3.737  10.049  -2.866
  276    HA   LEU  54           HA       LEU  54  -2.486  12.345  -1.555
  277    HB2  LEU  54           HB1      LEU  54  -1.255  11.341  -3.385
  278    HB3  LEU  54           HB2      LEU  54  -2.653  11.546  -4.456
  279    HG   LEU  54           HG       LEU  54  -2.201  14.115  -3.692
  280   HD11  LEU  54          HD11      LEU  54   0.143  14.572  -3.729
  281   HD12  LEU  54          HD12      LEU  54   0.523  12.875  -4.016
  282   HD13  LEU  54          HD13      LEU  54  -0.159  13.374  -2.470
  283   HD21  LEU  54          HD21      LEU  54  -0.635  13.053  -5.986
  284   HD22  LEU  54          HD22      LEU  54  -1.689  14.464  -5.892
  285   HD23  LEU  54          HD23      LEU  54  -2.387  12.846  -5.995
  286    H    GLN  55           H        GLN  55  -3.494  14.231  -1.315
  287    HA   GLN  55           HA       GLN  55  -5.871  14.776  -2.962
  288    HB2  GLN  55           HB1      GLN  55  -5.607  15.524  -0.045
  289    HB3  GLN  55           HB2      GLN  55  -7.043  15.668  -1.071
  290    HG2  GLN  55           HG1      GLN  55  -6.912  13.120  -1.308
  291    HG3  GLN  55           HG2      GLN  55  -5.803  13.193   0.068
  292   HE21  GLN  55          HE21      GLN  55  -6.713  14.726   1.865
  293   HE22  GLN  55          HE22      GLN  55  -8.345  14.396   2.323
  294    HA   PRO  56           HA       PRO  56  -2.968  18.283  -3.476
  295    HB2  PRO  56           HB1      PRO  56  -3.722  18.803  -6.057
  296    HB3  PRO  56           HB2      PRO  56  -2.531  17.578  -5.618
  297    HG2  PRO  56           HG1      PRO  56  -5.456  17.263  -6.211
  298    HG3  PRO  56           HG2      PRO  56  -4.061  16.275  -6.789
  299    HD2  PRO  56           HD1      PRO  56  -5.686  15.474  -4.766
  300    HD3  PRO  56           HD2      PRO  56  -3.957  15.089  -4.815
  301    H    ARG  57           H        ARG  57  -3.380  20.541  -3.817
  302    HA   ARG  57           HA       ARG  57  -6.011  21.329  -2.912
  303    HB2  ARG  57           HB1      ARG  57  -3.339  22.450  -2.906
  304    HB3  ARG  57           HB2      ARG  57  -4.526  23.634  -3.474
  305    HG2  ARG  57           HG1      ARG  57  -5.487  23.862  -1.454
  306    HG3  ARG  57           HG2      ARG  57  -5.312  22.142  -1.069
  307    HD2  ARG  57           HD1      ARG  57  -2.715  22.877  -1.032
  308    HD3  ARG  57           HD2      ARG  57  -3.478  24.397  -0.547
  309    HE   ARG  57           HE       ARG  57  -4.444  22.120   0.915
  310   HH11  ARG  57          HH11      ARG  57  -1.969  24.562   0.730
  311   HH12  ARG  57          HH12      ARG  57  -1.587  24.488   2.419
  312   HH21  ARG  57          HH21      ARG  57  -3.950  22.014   3.139
  313   HH22  ARG  57          HH22      ARG  57  -2.714  23.038   3.788
  314    H    ASP  58           H        ASP  58  -3.961  21.914  -5.752
  315    HA   ASP  58           HA       ASP  58  -5.960  23.460  -7.105
  316    HB2  ASP  58           HB1      ASP  58  -3.324  22.256  -7.949
  317    HB3  ASP  58           HB2      ASP  58  -4.381  23.090  -9.094
  318    HD2  ASP  58           HD       ASP  58  -1.997  25.380  -7.371
  319    H    GLU  59           H        GLU  59  -5.219  20.106  -6.816
  320    HA   GLU  59           HA       GLU  59  -7.126  19.490  -8.975
  321    HB2  GLU  59           HB1      GLU  59  -4.513  18.435  -8.361
  322    HB3  GLU  59           HB2      GLU  59  -5.724  17.146  -8.296
  323    HG2  GLU  59           HG1      GLU  59  -5.938  17.079 -10.506
  324    HG3  GLU  59           HG2      GLU  59  -6.071  18.840 -10.618
  325    HE2  GLU  59           HE       GLU  59  -2.874  17.404 -12.012
  326    H    LYS  60           H        LYS  60  -7.933  17.045  -8.508
  327    HA   LYS  60           HA       LYS  60  -9.249  17.218  -5.892
  328    HB2  LYS  60           HB1      LYS  60 -10.817  15.498  -6.901
  329    HB3  LYS  60           HB2      LYS  60 -10.854  17.111  -7.631
  330    HG2  LYS  60           HG1      LYS  60  -8.964  15.246  -8.892
  331    HG3  LYS  60           HG2      LYS  60 -10.672  14.791  -9.020
  332    HD2  LYS  60           HD1      LYS  60 -11.162  16.489 -10.421
  333    HD3  LYS  60           HD2      LYS  60 -10.121  17.627  -9.550
  334    HE2  LYS  60           HE1      LYS  60  -8.488  17.381 -11.049
  335    HE3  LYS  60           HE2      LYS  60  -8.509  15.626 -10.824
  336    HZ1  LYS  60           HZ1      LYS  60  -9.663  15.326 -12.695
  337    HZ2  LYS  60           HZ2      LYS  60  -9.203  16.903 -13.095
  338    HZ3  LYS  60           HZ3      LYS  60 -10.714  16.618 -12.390
  339    HA   PRO  61           HA       PRO  61  -7.197  13.690  -4.278
  340    HB2  PRO  61           HB1      PRO  61  -9.176  12.546  -2.769
  341    HB3  PRO  61           HB2      PRO  61  -8.361  14.045  -2.328
  342    HG2  PRO  61           HG1      PRO  61 -10.990  13.648  -3.717
  343    HG3  PRO  61           HG2      PRO  61 -10.571  14.766  -2.364
  344    HD2  PRO  61           HD1      PRO  61 -10.784  15.598  -4.940
  345    HD3  PRO  61           HD2      PRO  61  -9.628  16.304  -3.799
  346    H    PHE  62           H        PHE  62  -6.724  11.663  -4.916
  347    HA   PHE  62           HA       PHE  62  -8.733   9.841  -5.869
  348    HB2  PHE  62           HB1      PHE  62  -7.955   9.592  -8.124
  349    HB3  PHE  62           HB2      PHE  62  -8.297  11.303  -7.857
  350    HD1  PHE  62           HD1      PHE  62  -6.281  12.779  -7.125
  351    HD2  PHE  62           HD2      PHE  62  -5.917   9.000  -9.049
  352    HE1  PHE  62           HE1      PHE  62  -4.008  13.374  -7.855
  353    HE2  PHE  62           HE2      PHE  62  -3.642   9.588  -9.781
  354    HZ   PHE  62           HZ       PHE  62  -2.684  11.777  -9.184
  355    H    CYS  63           H        CYS  63  -7.458   7.866  -6.950
  356    HA   CYS  63           HA       CYS  63  -5.627   6.985  -4.896
  357    HB2  CYS  63           HB1      CYS  63  -7.529   5.704  -6.351
  358    HB3  CYS  63           HB2      CYS  63  -6.081   5.267  -7.258
  359    H    ALA  64           H        ALA  64  -3.557   7.544  -5.013
  360    HA   ALA  64           HA       ALA  64  -2.283   7.766  -7.651
  361    HB1  ALA  64           HB1      ALA  64  -0.426   8.795  -6.049
  362    HB2  ALA  64           HB2      ALA  64  -1.777   9.747  -6.663
  363    HB3  ALA  64           HB3      ALA  64  -1.839   9.079  -5.032
  364    H    THR  65           H        THR  65  -0.407   6.661  -8.145
  365    HA   THR  65           HA       THR  65   0.144   4.339  -6.441
  366    HB   THR  65           HB       THR  65   1.323   4.631  -9.172
  367    HG1  THR  65           HG1      THR  65  -1.400   4.294  -8.546
  368   HG21  THR  65          HG21      THR  65   0.404   2.382  -7.404
  369   HG22  THR  65          HG22      THR  65   2.007   2.673  -8.080
  370   HG23  THR  65          HG23      THR  65   0.692   2.140  -9.126
  371    H    CYS  66           H        CYS  66   2.444   3.587  -6.384
  372    HA   CYS  66           HA       CYS  66   4.101   5.647  -5.361
  373    HB2  CYS  66           HB1      CYS  66   5.810   3.877  -5.140
  374    HB3  CYS  66           HB2      CYS  66   4.249   3.393  -4.476
  375    H    ARG  67           H        ARG  67   6.513   5.681  -6.116
  376    HA   ARG  67           HA       ARG  67   6.469   6.232  -9.002
  377    HB2  ARG  67           HB1      ARG  67   8.523   7.219  -7.024
  378    HB3  ARG  67           HB2      ARG  67   8.182   7.840  -8.645
  379    HG2  ARG  67           HG1      ARG  67   5.778   8.241  -7.534
  380    HG3  ARG  67           HG2      ARG  67   6.800   8.362  -6.090
  381    HD2  ARG  67           HD1      ARG  67   8.029  10.172  -6.961
  382    HD3  ARG  67           HD2      ARG  67   7.454   9.865  -8.604
  383    HE   ARG  67           HE       ARG  67   5.352  10.535  -6.764
  384   HH11  ARG  67          HH11      ARG  67   7.781  11.793  -8.917
  385   HH12  ARG  67          HH12      ARG  67   6.963  13.300  -9.170
  386   HH21  ARG  67          HH21      ARG  67   4.266  12.515  -7.088
  387   HH22  ARG  67          HH22      ARG  67   4.965  13.710  -8.128
  388    H    GLY  68           H        GLY  68   9.072   6.273  -9.663
  389    HA2  GLY  68           HA2      GLY  68   9.783   3.441  -9.468
  390    HA3  GLY  68           HA3      GLY  68  10.408   4.589 -10.644
  391    HA1  GLY  68           HA1      GLY  68   9.754   3.926  -8.732
  392    H    LEU  69           H        LEU  69  12.325   3.171  -9.730
  393    HA   LEU  69           HA       LEU  69  13.415   3.999  -7.222
  394    HB2  LEU  69           HB1      LEU  69  14.338   2.340  -9.524
  395    HB3  LEU  69           HB2      LEU  69  15.540   2.937  -8.367
  396    HG   LEU  69           HG       LEU  69  13.166   1.200  -7.690
  397   HD11  LEU  69          HD11      LEU  69  15.626   0.511  -8.841
  398   HD12  LEU  69          HD12      LEU  69  14.428  -0.568  -8.128
  399   HD13  LEU  69          HD13      LEU  69  15.742   0.066  -7.139
  400   HD21  LEU  69          HD21      LEU  69  14.561   0.980  -5.527
  401   HD22  LEU  69          HD22      LEU  69  13.571   2.423  -5.759
  402   HD23  LEU  69          HD23      LEU  69  15.311   2.491  -6.045
  403    H    ARG  70           H        ARG  70  13.582   5.166 -10.477
  404    HA   ARG  70           HA       ARG  70  15.875   6.872  -9.908
  405    HB2  ARG  70           HB1      ARG  70  14.201   6.591 -12.415
  406    HB3  ARG  70           HB2      ARG  70  15.686   7.543 -12.267
  407    HG2  ARG  70           HG1      ARG  70  16.542   5.105 -11.411
  408    HG3  ARG  70           HG2      ARG  70  15.332   4.661 -12.625
  409    HD2  ARG  70           HD1      ARG  70  16.763   6.749 -13.801
  410    HD3  ARG  70           HD2      ARG  70  17.983   5.764 -12.980
  411    HE   ARG  70           HE       ARG  70  16.362   3.995 -14.351
  412   HH11  ARG  70          HH11      ARG  70  18.458   6.667 -15.118
  413   HH12  ARG  70          HH12      ARG  70  18.883   6.054 -16.681
  414   HH21  ARG  70          HH21      ARG  70  16.914   3.179 -16.408
  415   HH22  ARG  70          HH22      ARG  70  18.003   4.070 -17.414
  416    H    ARG  71           H        ARG  71  12.585   6.986  -9.457
  417    HA   ARG  71           HA       ARG  71  12.188   9.779 -10.073
  418    HB2  ARG  71           HB1      ARG  71  10.539   7.501  -9.294
  419    HB3  ARG  71           HB2      ARG  71  10.085   8.987  -8.447
  420    HG2  ARG  71           HG1      ARG  71   8.796   8.655 -10.513
  421    HG3  ARG  71           HG2      ARG  71   9.764  10.139 -10.544
  422    HD2  ARG  71           HD1      ARG  71  11.359   9.213 -12.014
  423    HD3  ARG  71           HD2      ARG  71  10.777   7.568 -11.720
  424    HE   ARG  71           HE       ARG  71   8.807   9.298 -12.905
  425   HH11  ARG  71          HH11      ARG  71  11.459   7.126 -13.511
  426   HH12  ARG  71          HH12      ARG  71  10.951   6.747 -15.124
  427   HH21  ARG  71          HH21      ARG  71   8.128   8.807 -15.026
  428   HH22  ARG  71          HH22      ARG  71   9.057   7.705 -15.985
  429    H    ARG  72           H        ARG  72  11.778  11.430  -8.554
  430    HA   ARG  72           HA       ARG  72  13.371  11.207  -6.160
  431    HB2  ARG  72           HB1      ARG  72  11.716  13.511  -7.222
  432    HB3  ARG  72           HB2      ARG  72  12.858  13.600  -5.872
  433    HG2  ARG  72           HG1      ARG  72  14.183  12.491  -8.162
  434    HG3  ARG  72           HG2      ARG  72  13.379  14.008  -8.599
  435    HD2  ARG  72           HD1      ARG  72  15.085  13.775  -6.126
  436    HD3  ARG  72           HD2      ARG  72  15.773  14.150  -7.712
  437    HE   ARG  72           HE       ARG  72  13.765  15.961  -7.434
  438   HH11  ARG  72          HH11      ARG  72  16.516  15.059  -5.501
  439   HH12  ARG  72          HH12      ARG  72  16.717  16.638  -4.816
  440   HH21  ARG  72          HH21      ARG  72  14.019  18.044  -6.539
  441   HH22  ARG  72          HH22      ARG  72  15.296  18.335  -5.407
  442    H    CYS  73           H        CYS  73  12.614  11.708  -4.030
  443    HA   CYS  73           HA       CYS  73   9.736  11.560  -3.580
  444    HB2  CYS  73           HB1      CYS  73  10.016   9.770  -1.882
  445    HB3  CYS  73           HB2      CYS  73  10.374   9.229  -3.524
  446    H    GLN  74           H        GLN  74   9.127  12.097  -1.373
  447    HA   GLN  74           HA       GLN  74  11.170  13.750  -0.039
  448    HB2  GLN  74           HB1      GLN  74   8.906  14.690  -1.165
  449    HB3  GLN  74           HB2      GLN  74   8.307  14.319   0.460
  450    HG2  GLN  74           HG1      GLN  74  10.055  15.724   1.441
  451    HG3  GLN  74           HG2      GLN  74  10.645  16.102  -0.183
  452   HE21  GLN  74          HE21      GLN  74  10.003  18.162   1.377
  453   HE22  GLN  74          HE22      GLN  74   8.526  18.898   0.868
  454    H    ARG  75           H        ARG  75   8.764  11.286   0.307
  455    HA   ARG  75           HA       ARG  75   9.523  10.997   3.133
  456    HB2  ARG  75           HB1      ARG  75   6.739  10.433   2.112
  457    HB3  ARG  75           HB2      ARG  75   7.288  10.532   3.792
  458    HG2  ARG  75           HG1      ARG  75   7.683  12.934   3.537
  459    HG3  ARG  75           HG2      ARG  75   7.121  12.835   1.860
  460    HD2  ARG  75           HD1      ARG  75   4.946  12.764   2.449
  461    HD3  ARG  75           HD2      ARG  75   5.267  11.692   3.820
  462    HE   ARG  75           HE       ARG  75   5.333  13.522   5.186
  463   HH11  ARG  75          HH11      ARG  75   5.710  14.563   1.886
  464   HH12  ARG  75          HH12      ARG  75   5.623  16.250   2.270
  465   HH21  ARG  75          HH21      ARG  75   5.216  15.741   5.706
  466   HH22  ARG  75          HH22      ARG  75   5.343  16.919   4.443
  467    H    ASP  76           H        ASP  76   8.724   8.750   3.943
  468    HA   ASP  76           HA       ASP  76   9.925   6.794   2.204
  469    HB2  ASP  76           HB1      ASP  76   9.381   5.224   4.133
  470    HB3  ASP  76           HB2      ASP  76  10.476   6.564   4.497
  471    HD2  ASP  76           HD       ASP  76   8.247   7.998   6.709
  472    H    ALA  77           H        ALA  77   6.735   7.156   3.752
  473    HA   ALA  77           HA       ALA  77   5.531   4.953   2.487
  474    HB1  ALA  77           HB1      ALA  77   3.573   5.622   3.474
  475    HB2  ALA  77           HB2      ALA  77   4.752   6.445   4.497
  476    HB3  ALA  77           HB3      ALA  77   3.907   7.337   3.231
  477    H    MET  78           H        MET  78   6.238   8.145   1.372
  478    HA   MET  78           HA       MET  78   4.337   8.532  -0.604
  479    HB2  MET  78           HB1      MET  78   7.084   9.473  -0.086
  480    HB3  MET  78           HB2      MET  78   6.564   9.570  -1.775
  481    HG2  MET  78           HG1      MET  78   4.400  10.635  -0.573
  482    HG3  MET  78           HG2      MET  78   5.659  11.097   0.574
  483    HE1  MET  78           HE1      MET  78   4.527  10.921  -2.956
  484    HE2  MET  78           HE2      MET  78   5.049  12.427  -3.712
  485    HE3  MET  78           HE3      MET  78   6.157  11.057  -3.617
  486    H    CYS  79           H        CYS  79   7.039   6.351  -0.523
  487    HA   CYS  79           HA       CYS  79   6.638   5.663  -3.349
  488    HB2  CYS  79           HB1      CYS  79   8.931   5.729  -1.578
  489    HB3  CYS  79           HB2      CYS  79   8.761   4.141  -2.328
  490    H    CYS  80           H        CYS  80   7.032   3.212  -3.758
  491    HA   CYS  80           HA       CYS  80   4.884   1.806  -2.602
  492    HB2  CYS  80           HB1      CYS  80   6.980   1.289  -4.584
  493    HB3  CYS  80           HB2      CYS  80   6.498  -0.152  -3.687
  494    HA   PRO  81           HA       PRO  81   6.517  -0.100   0.995
  495    HB2  PRO  81           HB1      PRO  81   5.423  -2.608   0.887
  496    HB3  PRO  81           HB2      PRO  81   4.490  -1.155   1.242
  497    HG2  PRO  81           HG1      PRO  81   4.824  -2.609  -1.359
  498    HG3  PRO  81           HG2      PRO  81   3.323  -1.959  -0.600
  499    HD2  PRO  81           HD1      PRO  81   4.622  -0.678  -2.612
  500    HD3  PRO  81           HD2      PRO  81   3.772   0.185  -1.320
  501    H    GLY  82           H        GLY  82   8.603  -0.606   1.228
  502    HA2  GLY  82           HA2      GLY  82  10.165  -2.498   1.315
  503    HA3  GLY  82           HA3      GLY  82   9.651  -2.895  -0.318
  504    HA1  GLY  82           HA1      GLY  82  10.107  -1.619   1.318
  505    H    THR  83           H        THR  83  10.026   0.438   0.363
  506    HA   THR  83           HA       THR  83  12.739   0.449  -0.765
  507    HB   THR  83           HB       THR  83  12.018   2.521  -2.086
  508    HG1  THR  83           HG1      THR  83   9.442   1.401  -2.087
  509   HG21  THR  83          HG21      THR  83  12.519   0.760  -3.468
  510   HG22  THR  83          HG22      THR  83  10.799   0.938  -3.819
  511   HG23  THR  83          HG23      THR  83  11.348  -0.313  -2.705
  512    H    LEU  84           H        LEU  84  13.883   2.494  -0.441
  513    HA   LEU  84           HA       LEU  84  12.861   4.022   1.859
  514    HB2  LEU  84           HB1      LEU  84  15.003   2.284   1.918
  515    HB3  LEU  84           HB2      LEU  84  15.766   3.864   1.675
  516    HG   LEU  84           HG       LEU  84  15.745   3.427   4.013
  517   HD11  LEU  84          HD11      LEU  84  13.434   5.292   3.544
  518   HD12  LEU  84          HD12      LEU  84  15.106   5.725   3.193
  519   HD13  LEU  84          HD13      LEU  84  14.626   5.335   4.843
  520   HD21  LEU  84          HD21      LEU  84  13.711   1.797   3.672
  521   HD22  LEU  84          HD22      LEU  84  12.777   3.218   4.139
  522   HD23  LEU  84          HD23      LEU  84  14.004   2.572   5.229
  523    H    CYS  85           H        CYS  85  13.136   6.205   1.810
  524    HA   CYS  85           HA       CYS  85  13.824   7.372  -0.736
  525    HB2  CYS  85           HB1      CYS  85  11.934   8.072   0.907
  526    HB3  CYS  85           HB2      CYS  85  13.213   8.947   1.749
  527    H    VAL  86           H        VAL  86  15.985   7.289  -1.114
  528    HA   VAL  86           HA       VAL  86  17.744   8.557   0.884
  529    HB   VAL  86           HB       VAL  86  18.476   6.508  -1.213
  530   HG11  VAL  86          HG11      VAL  86  20.689   6.522  -0.177
  531   HG12  VAL  86          HG12      VAL  86  20.276   8.112  -0.821
  532   HG13  VAL  86          HG13      VAL  86  20.175   7.808   0.914
  533   HG21  VAL  86          HG21      VAL  86  17.243   5.491   0.593
  534   HG22  VAL  86          HG22      VAL  86  18.946   5.061   0.743
  535   HG23  VAL  86          HG23      VAL  86  18.256   6.302   1.788
  536    H    ASN  87           H        ASN  87  18.880  10.310   0.303
  537    HA   ASN  87           HA       ASN  87  19.561  12.109  -0.913
  538    HB2  ASN  87           HB1      ASN  87  20.716   9.980  -2.049
  539    HB3  ASN  87           HB2      ASN  87  19.729  10.506  -3.417
  540   HD21  ASN  87          HD21      ASN  87  21.542  11.059  -4.620
  541   HD22  ASN  87          HD22      ASN  87  22.470  12.477  -4.282
  542    H    ASP  88           H        ASP  88  16.753  11.660  -0.740
  543    HA   ASP  88           HA       ASP  88  14.808  12.507  -1.564
  544    HB2  ASP  88           HB1      ASP  88  16.798  14.300  -2.348
  545    HB3  ASP  88           HB2      ASP  88  15.871  13.997  -3.823
  546    HD2  ASP  88           HD       ASP  88  13.701  15.457  -0.838
  547    H    VAL  89           H        VAL  89  16.092  10.068  -2.698
  548    HA   VAL  89           HA       VAL  89  14.399   9.882  -5.084
  549    HB   VAL  89           HB       VAL  89  17.259   8.914  -4.975
  550   HG11  VAL  89          HG11      VAL  89  16.895   8.209  -7.294
  551   HG12  VAL  89          HG12      VAL  89  15.822   7.359  -6.181
  552   HG13  VAL  89          HG13      VAL  89  15.201   8.682  -7.169
  553   HG21  VAL  89          HG21      VAL  89  17.527  11.131  -5.463
  554   HG22  VAL  89          HG22      VAL  89  17.247  10.503  -7.088
  555   HG23  VAL  89          HG23      VAL  89  15.931  11.276  -6.202
  556    H    CYS  90           H        CYS  90  13.487   7.878  -5.438
  557    HA   CYS  90           HA       CYS  90  13.177   6.195  -3.183
  558    HB2  CYS  90           HB1      CYS  90  11.695   6.644  -5.381
  559    HB3  CYS  90           HB2      CYS  90  12.484   5.145  -5.874
  560    H    THR  91           H        THR  91  14.834   5.024  -2.445
  561    HA   THR  91           HA       THR  91  16.386   3.438  -4.386
  562    HB   THR  91           HB       THR  91  17.278   4.403  -1.661
  563    HG1  THR  91           HG1      THR  91  18.436   5.186  -4.111
  564   HG21  THR  91          HG21      THR  91  19.463   3.530  -2.283
  565   HG22  THR  91          HG22      THR  91  18.822   2.972  -3.827
  566   HG23  THR  91          HG23      THR  91  18.260   2.242  -2.324
  567    H    THR  92           H        THR  92  16.161   1.308  -4.275
  568    HA   THR  92           HA       THR  92  14.400  -0.025  -2.623
  569    HB   THR  92           HB       THR  92  16.076  -2.050  -3.171
  570    HG1  THR  92           HG1      THR  92  16.584  -0.384  -5.381
  571   HG21  THR  92          HG21      THR  92  13.921  -0.694  -4.640
  572   HG22  THR  92          HG22      THR  92  14.103  -2.394  -4.209
  573   HG23  THR  92          HG23      THR  92  14.936  -1.748  -5.622
  574    H    MET  93           H        MET  93  14.576  -1.256  -0.758
  575    HA   MET  93           HA       MET  93  16.270  -0.315   1.254
  576    HB2  MET  93           HB1      MET  93  14.393  -2.603   0.947
  577    HB3  MET  93           HB2      MET  93  15.559  -2.687   2.276
  578    HG2  MET  93           HG1      MET  93  14.654  -0.892   3.394
  579    HG3  MET  93           HG2      MET  93  13.966  -0.201   1.923
  580    HE1  MET  93           HE1      MET  93  11.530  -0.229   4.224
  581    HE2  MET  93           HE2      MET  93  11.647  -1.786   5.043
  582    HE3  MET  93           HE3      MET  93  13.077  -0.767   4.879
  583    H    GLU  94           H        GLU  94  16.541  -3.130  -0.860
  584    HA   GLU  94           HA       GLU  94  18.713  -4.377   0.385
  585    HB2  GLU  94           HB1      GLU  94  17.924  -4.310  -2.536
  586    HB3  GLU  94           HB2      GLU  94  19.131  -5.409  -1.848
  587    HG2  GLU  94           HG1      GLU  94  17.530  -6.584  -0.593
  588    HG3  GLU  94           HG2      GLU  94  16.313  -5.321  -0.831
  589    HE2  GLU  94           HE       GLU  94  16.977  -7.252  -4.206
  590    H    ASP  95           H        ASP  95  18.545  -1.563  -1.628
  591    HA   ASP  95           HA       ASP  95  21.415  -1.526  -2.103
  592    HB2  ASP  95           HB1      ASP  95  19.397  -0.691  -3.657
  593    HB3  ASP  95           HB2      ASP  95  19.711   0.815  -2.785
  594    HD2  ASP  95           HD       ASP  95  21.869   0.713  -5.702
  595    H    ALA  96           H        ALA  96  19.011   0.052  -0.106
  596    HA   ALA  96           HA       ALA  96  20.800   2.075   0.875
  597    HB1  ALA  96           HB1      ALA  96  18.577   2.744   0.920
  598    HB2  ALA  96           HB2      ALA  96  18.024   1.207   1.586
  599    HB3  ALA  96           HB3      ALA  96  18.906   2.343   2.606
  600    H    THR  97           H        THR  97  20.965   2.279   3.373
  601    HA   THR  97           HA       THR  97  21.929   1.534   5.295
  602    HB   THR  97           HB       THR  97  20.776  -1.192   4.744
  603    HG1  THR  97           HG1      THR  97  19.445   1.174   5.592
  604   HG21  THR  97          HG21      THR  97  21.282  -1.602   6.878
  605   HG22  THR  97          HG22      THR  97  20.488  -0.120   7.410
  606   HG23  THR  97          HG23      THR  97  22.173  -0.080   6.892
  607    H    GLU  98           H        GLU  98  23.953   1.765   4.010
  608    HA   GLU  98           HA       GLU  98  26.029   1.047   3.417
  609    HB2  GLU  98           HB1      GLU  98  25.328  -0.334   5.708
  610    HB3  GLU  98           HB2      GLU  98  25.859  -1.615   4.607
  611    HG2  GLU  98           HG1      GLU  98  27.857  -1.121   5.551
  612    HG3  GLU  98           HG2      GLU  98  27.878   0.045   4.220
  613    HE2  GLU  98           HE       GLU  98  27.927   1.400   7.875
  614    H    ASN  99           H        ASN  99  27.230  -1.018   2.471
  615    HA   ASN  99           HA       ASN  99  25.548  -1.916   0.247
  616    HB2  ASN  99           HB1      ASN  99  27.530  -2.245  -1.007
  617    HB3  ASN  99           HB2      ASN  99  27.765  -0.724  -0.137
  618   HD21  ASN  99          HD21      ASN  99  29.727  -2.601  -1.221
  619   HD22  ASN  99          HD22      ASN  99  30.736  -3.049   0.108
  620    H    LEU 100           H        LEU 100  26.676  -4.148  -0.638
  621    HA   LEU 100           HA       LEU 100  26.089  -6.059   1.488
  622    HB2  LEU 100           HB1      LEU 100  25.968  -6.042  -1.458
  623    HB3  LEU 100           HB2      LEU 100  26.494  -7.569  -0.729
  624    HG   LEU 100           HG       LEU 100  24.092  -7.558  -1.186
  625   HD11  LEU 100          HD11      LEU 100  23.764  -7.540   1.641
  626   HD12  LEU 100          HD12      LEU 100  25.354  -8.201   1.257
  627   HD13  LEU 100          HD13      LEU 100  23.906  -8.918   0.550
  628   HD21  LEU 100          HD21      LEU 100  22.599  -6.018  -0.342
  629   HD22  LEU 100          HD22      LEU 100  23.992  -4.999  -0.705
  630   HD23  LEU 100          HD23      LEU 100  23.685  -5.516   0.954
  631    H    TYR 101           H        TYR 101  27.452  -7.825   1.972
  632    HA   TYR 101           HA       TYR 101  30.240  -7.174   1.937
  633    HB2  TYR 101           HB1      TYR 101  28.507  -8.926   3.392
  634    HB3  TYR 101           HB2      TYR 101  29.850  -9.875   2.748
  635    HD1  TYR 101           HD1      TYR 101  31.489 -10.231   4.324
  636    HD2  TYR 101           HD2      TYR 101  29.579  -6.432   4.190
  637    HE1  TYR 101           HE1      TYR 101  32.957  -9.436   6.130
  638    HE2  TYR 101           HE2      TYR 101  31.042  -5.626   5.995
  639    HH   TYR 101           HH       TYR 101  32.381  -6.569   7.837
  640    H    PHE 102           H        PHE 102  31.935  -8.539   1.112
  641    HA   PHE 102           HA       PHE 102  31.271 -10.519  -0.888
  642    HB2  PHE 102           HB1      PHE 102  32.301  -9.428  -2.758
  643    HB3  PHE 102           HB2      PHE 102  31.100  -8.324  -2.086
  644    HD1  PHE 102           HD1      PHE 102  34.638  -8.883  -2.679
  645    HD2  PHE 102           HD2      PHE 102  31.776  -6.336  -0.826
  646    HE1  PHE 102           HE1      PHE 102  36.347  -7.128  -2.461
  647    HE2  PHE 102           HE2      PHE 102  33.480  -4.576  -0.605
  648    HZ   PHE 102           HZ       PHE 102  35.769  -4.970  -1.424
  649    H    GLN 103           H        GLN 103  32.977 -11.884  -1.379
  650    HA   GLN 103           HA       GLN 103  35.529 -11.336  -0.025
  651    HB2  GLN 103           HB1      GLN 103  35.615 -13.843   0.442
  652    HB3  GLN 103           HB2      GLN 103  34.506 -12.880   1.429
  653    HG2  GLN 103           HG1      GLN 103  32.647 -13.835   0.553
  654    HG3  GLN 103           HG2      GLN 103  33.395 -14.079  -1.031
  655   HE21  GLN 103          HE21      GLN 103  32.136 -16.157  -0.557
  656   HE22  GLN 103          HE22      GLN 103  33.047 -17.440   0.154
  657    H    SER 104           H        SER 104  37.205 -11.456  -1.355
  658    HA   SER 104           HA       SER 104  36.885 -12.935  -3.878
  659    HB2  SER 104           HB1      SER 104  37.312 -10.407  -3.908
  660    HB3  SER 104           HB2      SER 104  38.948 -10.798  -3.348
  661    HG   SER 104           HG       SER 104  39.428 -11.277  -5.324
  662    H    LEU 105           H        LEU 105  37.637 -14.944  -3.429
  663    HA   LEU 105           HA       LEU 105  40.207 -15.224  -2.059
  664    HB2  LEU 105           HB1      LEU 105  38.073 -17.218  -2.826
  665    HB3  LEU 105           HB2      LEU 105  39.637 -17.672  -2.123
  666    HG   LEU 105           HG       LEU 105  37.687 -15.847  -0.732
  667   HD11  LEU 105          HD11      LEU 105  36.948 -17.756   0.549
  668   HD12  LEU 105          HD12      LEU 105  38.011 -18.821  -0.369
  669   HD13  LEU 105          HD13      LEU 105  36.648 -18.038  -1.166
  670   HD21  LEU 105          HD21      LEU 105  39.634 -17.544   0.704
  671   HD22  LEU 105          HD22      LEU 105  39.095 -15.898   1.039
  672   HD23  LEU 105          HD23      LEU 105  40.295 -16.194  -0.221
  673    H    GLU 106           H        GLU 106  41.747 -16.850  -2.937
  674    HA   GLU 106           HA       GLU 106  41.628 -17.347  -5.786
  675    HB2  GLU 106           HB1      GLU 106  43.048 -15.089  -4.726
  676    HB3  GLU 106           HB2      GLU 106  44.205 -16.245  -5.405
  677    HG2  GLU 106           HG1      GLU 106  41.780 -15.377  -6.950
  678    HG3  GLU 106           HG2      GLU 106  43.267 -14.418  -6.934
  679    HE2  GLU 106           HE       GLU 106  44.390 -17.853  -8.298
  680    H    HIS 107           H        HIS 107  42.645 -19.192  -6.308
  681    HA   HIS 107           HA       HIS 107  44.282 -20.464  -4.219
  682    HB2  HIS 107           HB1      HIS 107  43.709 -22.607  -5.371
  683    HB3  HIS 107           HB2      HIS 107  42.315 -21.761  -4.694
  684    HD1  HIS 107           HD1      HIS 107  40.737 -20.507  -6.419
  685    HD2  HIS 107           HD2      HIS 107  43.582 -23.025  -8.099
  686    HE1  HIS 107           HE1      HIS 107  39.991 -20.875  -8.792
  687    HE2  HIS 107           HE2      HIS 107  41.729 -22.412  -9.820
  688    H    HIS 108           H        HIS 108  46.213 -21.501  -4.767
  689    HA   HIS 108           HA       HIS 108  47.321 -20.726  -7.386
  690    HB2  HIS 108           HB1      HIS 108  48.257 -20.175  -4.766
  691    HB3  HIS 108           HB2      HIS 108  49.381 -21.334  -5.483
  692    HD1  HIS 108           HD1      HIS 108  49.296 -20.305  -8.416
  693    HD2  HIS 108           HD2      HIS 108  49.761 -17.895  -5.064
  694    HE1  HIS 108           HE1      HIS 108  50.429 -18.218  -9.241
  695    HE2  HIS 108           HE2      HIS 108  50.714 -16.743  -7.195
  696    H    HIS 109           H        HIS 109  49.488 -22.173  -7.668
  697    HA   HIS 109           HA       HIS 109  49.275 -24.891  -6.853
  698    HB2  HIS 109           HB1      HIS 109  48.640 -25.941  -8.896
  699    HB3  HIS 109           HB2      HIS 109  47.417 -24.715  -8.546
  700    HD1  HIS 109           HD1      HIS 109  47.947 -25.797 -11.427
  701    HD2  HIS 109           HD2      HIS 109  49.516 -22.281  -9.864
  702    HE1  HIS 109           HE1      HIS 109  48.484 -24.356 -13.418
  703    HE2  HIS 109           HE2      HIS 109  49.443 -22.208 -12.464
  704    H    HIS 110           H        HIS 110  50.873 -26.287  -8.063
  705    HA   HIS 110           HA       HIS 110  53.073 -24.702  -9.194
  706    HB2  HIS 110           HB1      HIS 110  53.251 -25.444  -6.660
  707    HB3  HIS 110           HB2      HIS 110  53.722 -26.988  -7.379
  708    HD1  HIS 110           HD1      HIS 110  56.107 -26.615  -6.320
  709    HD2  HIS 110           HD2      HIS 110  55.028 -23.880  -9.256
  710    HE1  HIS 110           HE1      HIS 110  58.243 -25.464  -6.984
  711    HE2  HIS 110           HE2      HIS 110  57.584 -23.792  -8.778
  712    H    HIS 111           H        HIS 111  51.841 -27.986  -8.606
  713    HA   HIS 111           HA       HIS 111  51.826 -29.862  -9.893
  714    HB2  HIS 111           HB1      HIS 111  51.442 -27.650 -11.690
  715    HB3  HIS 111           HB2      HIS 111  52.391 -28.902 -12.496
  716    HD1  HIS 111           HD1      HIS 111  51.064 -31.422 -11.343
  717    HD2  HIS 111           HD2      HIS 111  48.969 -28.126 -12.760
  718    HE1  HIS 111           HE1      HIS 111  48.782 -32.287 -11.954
  719    HE2  HIS 111           HE2      HIS 111  47.501 -30.271 -12.820
  720    H    HIS 112           H        HIS 112  53.177 -31.143 -11.537
  721    HA   HIS 112           HA       HIS 112  56.019 -30.546 -11.045
  722    HB2  HIS 112           HB1      HIS 112  55.194 -32.590  -9.934
  723    HB3  HIS 112           HB2      HIS 112  54.711 -33.236 -11.507
  724    HD1  HIS 112           HD1      HIS 112  57.942 -31.448 -11.456
  725    HD2  HIS 112           HD2      HIS 112  56.580 -35.353 -11.053
  726    HE1  HIS 112           HE1      HIS 112  59.979 -32.901 -11.712
  727    HE2  HIS 112           HE2      HIS 112  59.147 -35.287 -11.467
  Start of MODEL   31
    1    H1   MET  18           H        MET  18  16.458 -15.702   5.491
    2    HA   MET  18           HA       MET  18  13.612 -15.370   5.254
    3    HB2  MET  18           HB1      MET  18  15.350 -16.834   7.247
    4    HB3  MET  18           HB2      MET  18  13.582 -16.819   7.324
    5    HG2  MET  18           HG1      MET  18  13.361 -18.017   5.311
    6    HG3  MET  18           HG2      MET  18  15.050 -17.735   4.876
    7    HE1  MET  18           HE1      MET  18  14.974 -19.953   4.143
    8    HE2  MET  18           HE2      MET  18  15.881 -21.128   5.096
    9    HE3  MET  18           HE3      MET  18  14.122 -21.226   5.016
   10    H    LEU  19           H        LEU  19  13.816 -12.968   5.545
   11    HA   LEU  19           HA       LEU  19  13.564 -12.320   8.402
   12    HB2  LEU  19           HB1      LEU  19  15.472 -11.289   6.502
   13    HB3  LEU  19           HB2      LEU  19  14.423  -9.991   7.096
   14    HG   LEU  19           HG       LEU  19  15.159 -11.319   9.404
   15   HD11  LEU  19          HD11      LEU  19  17.735 -11.168   9.076
   16   HD12  LEU  19          HD12      LEU  19  17.349 -11.440   7.377
   17   HD13  LEU  19          HD13      LEU  19  16.873 -12.628   8.590
   18   HD21  LEU  19          HD21      LEU  19  16.242  -8.857   8.054
   19   HD22  LEU  19          HD22      LEU  19  16.668  -9.322   9.701
   20   HD23  LEU  19          HD23      LEU  19  14.990  -8.958   9.293
   21    H    VAL  20           H        VAL  20  12.755 -11.460   5.072
   22    HA   VAL  20           HA       VAL  20  10.887  -9.442   5.629
   23    HB   VAL  20           HB       VAL  20  10.867 -11.358   3.294
   24   HG11  VAL  20          HG11      VAL  20   9.896  -9.088   2.290
   25   HG12  VAL  20          HG12      VAL  20   8.865 -10.317   3.026
   26   HG13  VAL  20          HG13      VAL  20   9.352  -8.900   3.957
   27   HG21  VAL  20          HG21      VAL  20  11.937  -9.078   2.328
   28   HG22  VAL  20          HG22      VAL  20  12.571  -9.051   3.974
   29   HG23  VAL  20          HG23      VAL  20  12.894 -10.433   2.927
   30    H    LEU  21           H        LEU  21   8.972  -9.529   6.587
   31    HA   LEU  21           HA       LEU  21   7.747 -12.076   7.181
   32    HB2  LEU  21           HB1      LEU  21   7.472  -9.283   8.078
   33    HB3  LEU  21           HB2      LEU  21   5.968 -10.219   8.056
   34    HG   LEU  21           HG       LEU  21   8.474 -10.958   9.567
   35   HD11  LEU  21          HD11      LEU  21   6.823  -8.978  10.254
   36   HD12  LEU  21          HD12      LEU  21   7.586 -10.042  11.436
   37   HD13  LEU  21          HD13      LEU  21   5.923 -10.338  10.928
   38   HD21  LEU  21          HD21      LEU  21   7.620 -13.014   9.551
   39   HD22  LEU  21          HD22      LEU  21   6.117 -12.463   8.808
   40   HD23  LEU  21          HD23      LEU  21   6.316 -12.385  10.559
   41    H    ASP  22           H        ASP  22   5.593 -12.655   6.640
   42    HA   ASP  22           HA       ASP  22   4.593 -11.344   4.197
   43    HB2  ASP  22           HB1      ASP  22   5.403 -14.008   4.557
   44    HB3  ASP  22           HB2      ASP  22   3.637 -14.055   4.526
   45    HD2  ASP  22           HD       ASP  22   5.364 -12.629   1.240
   46    H    PHE  23           H        PHE  23   2.158 -12.326   3.894
   47    HA   PHE  23           HA       PHE  23  -0.006 -12.059   4.540
   48    HB2  PHE  23           HB1      PHE  23   0.750 -13.961   6.051
   49    HB3  PHE  23           HB2      PHE  23   0.933 -12.753   7.324
   50    HD1  PHE  23           HD1      PHE  23  -1.668 -13.569   4.770
   51    HD2  PHE  23           HD2      PHE  23  -0.776 -12.702   8.841
   52    HE1  PHE  23           HE1      PHE  23  -4.055 -13.771   5.333
   53    HE2  PHE  23           HE2      PHE  23  -3.160 -12.903   9.410
   54    HZ   PHE  23           HZ       PHE  23  -4.803 -13.439   7.656
   55    H    ASN  24           H        ASN  24   0.890  -9.697   4.190
   56    HA   ASN  24           HA       ASN  24   0.913  -8.064   6.565
   57    HB2  ASN  24           HB1      ASN  24   1.052  -7.464   3.608
   58    HB3  ASN  24           HB2      ASN  24   0.946  -6.181   4.821
   59   HD21  ASN  24          HD21      ASN  24   2.901  -5.282   4.753
   60   HD22  ASN  24          HD22      ASN  24   4.389  -6.119   5.017
   61    H    ASN  25           H        ASN  25  -1.350  -8.872   4.006
   62    HA   ASN  25           HA       ASN  25  -3.338  -7.031   5.103
   63    HB2  ASN  25           HB1      ASN  25  -2.729  -7.824   2.504
   64    HB3  ASN  25           HB2      ASN  25  -4.226  -8.685   2.877
   65   HD21  ASN  25          HD21      ASN  25  -3.995  -6.661   0.948
   66   HD22  ASN  25          HD22      ASN  25  -4.976  -5.327   1.446
   67    H    ILE  26           H        ILE  26  -4.930  -7.679   6.397
   68    HA   ILE  26           HA       ILE  26  -5.291 -10.565   6.809
   69    HB   ILE  26           HB       ILE  26  -6.423  -9.913   8.928
   70   HG12  ILE  26          HG11      ILE  26  -5.292  -7.157   8.464
   71   HG13  ILE  26          HG12      ILE  26  -6.957  -7.566   8.017
   72   HG21  ILE  26          HG21      ILE  26  -4.344  -9.202  10.093
   73   HG22  ILE  26          HG22      ILE  26  -4.119 -10.570   9.005
   74   HG23  ILE  26          HG23      ILE  26  -3.596  -8.958   8.515
   75   HD11  ILE  26          HD11      ILE  26  -6.510  -6.474  10.308
   76   HD12  ILE  26          HD12      ILE  26  -7.628  -7.835  10.209
   77   HD13  ILE  26          HD13      ILE  26  -5.983  -8.085  10.791
   78    H    ARG  27           H        ARG  27  -7.681 -10.908   7.780
   79    HA   ARG  27           HA       ARG  27  -9.433 -10.309   5.557
   80    HB2  ARG  27           HB1      ARG  27  -9.546 -12.103   7.950
   81    HB3  ARG  27           HB2      ARG  27 -11.051 -11.682   7.121
   82    HG2  ARG  27           HG1      ARG  27 -10.592 -12.954   5.317
   83    HG3  ARG  27           HG2      ARG  27  -8.860 -12.592   5.380
   84    HD2  ARG  27           HD1      ARG  27  -8.716 -14.757   6.040
   85    HD3  ARG  27           HD2      ARG  27  -9.083 -14.049   7.620
   86    HE   ARG  27           HE       ARG  27 -11.068 -15.165   7.593
   87   HH11  ARG  27          HH11      ARG  27  -9.921 -14.868   4.319
   88   HH12  ARG  27          HH12      ARG  27 -11.195 -15.832   3.647
   89   HH21  ARG  27          HH21      ARG  27 -12.749 -16.435   6.720
   90   HH22  ARG  27          HH22      ARG  27 -12.803 -16.722   5.014
   91    H    SER  28           H        SER  28  -9.421  -7.968   6.023
   92    HA   SER  28           HA       SER  28 -10.544  -6.878   8.362
   93    HB2  SER  28           HB1      SER  28 -10.640  -4.797   7.190
   94    HB3  SER  28           HB2      SER  28  -9.197  -5.644   6.604
   95    HG   SER  28           HG       SER  28 -11.705  -5.403   5.307
   96    H    SER  29           H        SER  29 -12.615  -5.869   8.650
   97    HA   SER  29           HA       SER  29 -14.766  -6.578   6.847
   98    HB2  SER  29           HB1      SER  29 -14.249  -8.035   9.364
   99    HB3  SER  29           HB2      SER  29 -15.914  -7.468   9.159
  100    HG   SER  29           HG       SER  29 -15.962  -9.343   8.109
  101    H    ALA  30           H        ALA  30 -16.576  -5.300   7.095
  102    HA   ALA  30           HA       ALA  30 -16.923  -3.606   9.395
  103    HB1  ALA  30           HB1      ALA  30 -16.925  -1.656   7.439
  104    HB2  ALA  30           HB2      ALA  30 -15.683  -1.904   8.667
  105    HB3  ALA  30           HB3      ALA  30 -15.497  -2.622   7.067
  106    H    ASP  31           H        ASP  31 -17.767  -3.748   5.929
  107    HA   ASP  31           HA       ASP  31 -19.769  -3.701   4.848
  108    HB2  ASP  31           HB1      ASP  31 -19.938  -5.765   6.472
  109    HB3  ASP  31           HB2      ASP  31 -21.141  -4.759   7.288
  110    HD2  ASP  31           HD       ASP  31 -22.145  -6.531   3.957
  111    H    LEU  32           H        LEU  32 -19.374  -1.284   5.333
  112    HA   LEU  32           HA       LEU  32 -21.642  -0.226   6.889
  113    HB2  LEU  32           HB1      LEU  32 -18.846   0.683   6.499
  114    HB3  LEU  32           HB2      LEU  32 -20.096   1.939   6.551
  115    HG   LEU  32           HG       LEU  32 -19.003   1.549   8.734
  116   HD11  LEU  32          HD11      LEU  32 -21.938   1.070   8.383
  117   HD12  LEU  32          HD12      LEU  32 -21.102   2.524   8.928
  118   HD13  LEU  32          HD13      LEU  32 -21.209   1.119   9.989
  119   HD21  LEU  32          HD21      LEU  32 -19.074  -0.450   9.869
  120   HD22  LEU  32          HD22      LEU  32 -18.873  -1.007   8.207
  121   HD23  LEU  32          HD23      LEU  32 -20.467  -1.041   8.964
  122    H    HIS  33           H        HIS  33 -22.908   1.422   6.004
  123    HA   HIS  33           HA       HIS  33 -22.734   1.632   3.076
  124    HB2  HIS  33           HB1      HIS  33 -25.017   1.624   5.012
  125    HB3  HIS  33           HB2      HIS  33 -25.200   2.493   3.484
  126    HD1  HIS  33           HD1      HIS  33 -25.552   1.134   1.374
  127    HD2  HIS  33           HD2      HIS  33 -24.706  -1.208   4.699
  128    HE1  HIS  33           HE1      HIS  33 -25.995  -1.235   0.657
  129    HE2  HIS  33           HE2      HIS  33 -25.479  -2.668   2.689
  130    H    GLY  34           H        GLY  34 -21.016   3.291   3.636
  131    HA2  GLY  34           HA2      GLY  34 -22.160   5.899   3.313
  132    HA3  GLY  34           HA3      GLY  34 -21.428   5.691   4.898
  133    HA1  GLY  34           HA1      GLY  34 -21.729   5.297   2.830
  134    H    ALA  35           H        ALA  35 -19.351   6.198   5.081
  135    HA   ALA  35           HA       ALA  35 -17.208   6.758   4.554
  136    HB1  ALA  35           HB1      ALA  35 -16.023   5.379   3.045
  137    HB2  ALA  35           HB2      ALA  35 -17.260   4.354   3.776
  138    HB3  ALA  35           HB3      ALA  35 -17.486   4.981   2.143
  139    H    ARG  36           H        ARG  36 -19.088   8.592   3.767
  140    HA   ARG  36           HA       ARG  36 -17.686   9.978   1.690
  141    HB2  ARG  36           HB1      ARG  36 -19.227   8.373   0.460
  142    HB3  ARG  36           HB2      ARG  36 -20.571   9.316   1.117
  143    HG2  ARG  36           HG1      ARG  36 -18.902  11.234   0.012
  144    HG3  ARG  36           HG2      ARG  36 -18.843   9.882  -1.132
  145    HD2  ARG  36           HD1      ARG  36 -21.499  10.741  -0.060
  146    HD3  ARG  36           HD2      ARG  36 -20.713  11.727  -1.300
  147    HE   ARG  36           HE       ARG  36 -21.927   9.154  -1.657
  148   HH11  ARG  36          HH11      ARG  36 -19.528  11.365  -2.875
  149   HH12  ARG  36          HH12      ARG  36 -19.555  10.714  -4.481
  150   HH21  ARG  36          HH21      ARG  36 -21.972   8.289  -3.768
  151   HH22  ARG  36          HH22      ARG  36 -20.946   8.966  -4.987
  152    H    LYS  37           H        LYS  37 -17.520  11.346   3.588
  153    HA   LYS  37           HA       LYS  37 -19.441  13.443   3.557
  154    HB2  LYS  37           HB1      LYS  37 -20.170  11.375   5.203
  155    HB3  LYS  37           HB2      LYS  37 -19.297  12.441   6.314
  156    HG2  LYS  37           HG1      LYS  37 -21.408  13.562   4.509
  157    HG3  LYS  37           HG2      LYS  37 -21.849  12.732   6.012
  158    HD2  LYS  37           HD1      LYS  37 -20.950  14.357   7.353
  159    HD3  LYS  37           HD2      LYS  37 -19.731  14.813   6.150
  160    HE2  LYS  37           HE1      LYS  37 -21.100  16.639   5.994
  161    HE3  LYS  37           HE2      LYS  37 -21.863  15.587   4.793
  162    HZ1  LYS  37           HZ1      LYS  37 -23.096  14.857   7.079
  163    HZ2  LYS  37           HZ2      LYS  37 -23.712  15.963   5.958
  164    HZ3  LYS  37           HZ3      LYS  37 -22.878  16.517   7.321
  165    H    GLY  38           H        GLY  38 -16.973  11.919   5.632
  166    HA2  GLY  38           HA2      GLY  38 -15.921  14.530   6.364
  167    HA3  GLY  38           HA3      GLY  38 -15.369  12.975   6.967
  168    HA1  GLY  38           HA1      GLY  38 -16.038  14.366   5.505
  169    H    SER  39           H        SER  39 -13.706  11.922   5.952
  170    HA   SER  39           HA       SER  39 -12.306  13.489   3.899
  171    HB2  SER  39           HB1      SER  39 -11.084  13.029   6.017
  172    HB3  SER  39           HB2      SER  39 -11.219  11.293   5.679
  173    HG   SER  39           HG       SER  39  -9.287  11.818   4.843
  174    H    GLN  40           H        GLN  40 -11.372  12.443   2.087
  175    HA   GLN  40           HA       GLN  40 -13.004  10.622   0.773
  176    HB2  GLN  40           HB1      GLN  40 -11.351  12.141  -0.307
  177    HB3  GLN  40           HB2      GLN  40 -10.060  11.071   0.263
  178    HG2  GLN  40           HG1      GLN  40 -10.260  10.098  -1.738
  179    HG3  GLN  40           HG2      GLN  40 -11.664   9.302  -1.013
  180   HE21  GLN  40          HE21      GLN  40 -11.023  10.149  -3.800
  181   HE22  GLN  40          HE22      GLN  40 -12.383  11.090  -4.301
  182    H    CYS  41           H        CYS  41 -10.004  10.061   2.574
  183    HA   CYS  41           HA       CYS  41 -10.778   7.256   2.877
  184    HB2  CYS  41           HB1      CYS  41  -8.506   6.480   2.374
  185    HB3  CYS  41           HB2      CYS  41  -9.237   7.276   0.981
  186    H    LEU  42           H        LEU  42 -10.221   6.361   4.816
  187    HA   LEU  42           HA       LEU  42  -9.463   8.168   6.910
  188    HB2  LEU  42           HB1      LEU  42 -10.821   5.704   6.704
  189    HB3  LEU  42           HB2      LEU  42  -9.401   5.420   7.727
  190    HG   LEU  42           HG       LEU  42 -10.543   7.776   8.706
  191   HD11  LEU  42          HD11      LEU  42 -12.635   5.729   8.005
  192   HD12  LEU  42          HD12      LEU  42 -12.590   7.432   7.546
  193   HD13  LEU  42          HD13      LEU  42 -12.857   6.979   9.229
  194   HD21  LEU  42          HD21      LEU  42 -10.891   6.493  10.688
  195   HD22  LEU  42          HD22      LEU  42  -9.416   5.902   9.921
  196   HD23  LEU  42          HD23      LEU  42 -10.915   4.984   9.776
  197    H    SER  43           H        SER  43  -7.859   5.788   4.961
  198    HA   SER  43           HA       SER  43  -5.312   6.544   6.138
  199    HB2  SER  43           HB1      SER  43  -6.562   4.213   7.012
  200    HB3  SER  43           HB2      SER  43  -5.404   3.651   5.794
  201    HG   SER  43           HG       SER  43  -4.782   4.103   8.194
  202    H    ASP  44           H        ASP  44  -3.503   5.244   4.914
  203    HA   ASP  44           HA       ASP  44  -3.867   5.842   2.130
  204    HB2  ASP  44           HB1      ASP  44  -1.504   5.081   1.911
  205    HB3  ASP  44           HB2      ASP  44  -1.729   6.329   3.143
  206    HD2  ASP  44           HD       ASP  44  -0.739   2.686   4.358
  207    H    THR  45           H        THR  45  -3.993   3.008   4.115
  208    HA   THR  45           HA       THR  45  -3.769   1.172   1.886
  209    HB   THR  45           HB       THR  45  -4.727   0.357   4.607
  210    HG1  THR  45           HG1      THR  45  -2.711   0.505   5.422
  211   HG21  THR  45          HG21      THR  45  -3.822  -0.944   2.220
  212   HG22  THR  45          HG22      THR  45  -4.464  -1.660   3.699
  213   HG23  THR  45          HG23      THR  45  -2.736  -1.339   3.553
  214    H    ASP  46           H        ASP  46  -6.120   3.199   2.768
  215    HA   ASP  46           HA       ASP  46  -8.351   1.337   2.481
  216    HB2  ASP  46           HB1      ASP  46  -7.986   4.055   3.548
  217    HB3  ASP  46           HB2      ASP  46  -9.471   3.838   2.613
  218    HD2  ASP  46           HD       ASP  46  -9.657   2.680   6.204
  219    H    CYS  47           H        CYS  47  -6.330   2.497   0.364
  220    HA   CYS  47           HA       CYS  47  -8.128   3.735  -1.529
  221    HB2  CYS  47           HB1      CYS  47  -5.295   3.518  -1.180
  222    HB3  CYS  47           HB2      CYS  47  -5.711   2.932  -2.792
  223    H    ASN  48           H        ASN  48  -6.278   0.698  -1.365
  224    HA   ASN  48           HA       ASN  48  -8.354  -0.821  -2.553
  225    HB2  ASN  48           HB1      ASN  48  -7.604   0.368  -4.579
  226    HB3  ASN  48           HB2      ASN  48  -5.965  -0.243  -4.319
  227   HD21  ASN  48          HD21      ASN  48  -5.578  -2.499  -4.504
  228   HD22  ASN  48          HD22      ASN  48  -6.610  -3.489  -5.474
  229    H    THR  49           H        THR  49  -4.820  -1.004  -2.937
  230    HA   THR  49           HA       THR  49  -4.554  -2.970  -0.855
  231    HB   THR  49           HB       THR  49  -4.047  -3.875  -3.696
  232    HG1  THR  49           HG1      THR  49  -5.951  -4.890  -3.604
  233   HG21  THR  49          HG21      THR  49  -3.003  -5.662  -2.840
  234   HG22  THR  49          HG22      THR  49  -4.237  -5.888  -1.601
  235   HG23  THR  49          HG23      THR  49  -2.915  -4.753  -1.333
  236    H    ARG  50           H        ARG  50  -2.825  -2.372  -3.916
  237    HA   ARG  50           HA       ARG  50  -0.416  -1.787  -2.338
  238    HB2  ARG  50           HB1      ARG  50   0.835  -2.262  -4.416
  239    HB3  ARG  50           HB2      ARG  50  -0.149  -3.633  -3.885
  240    HG2  ARG  50           HG1      ARG  50  -1.824  -2.223  -5.598
  241    HG3  ARG  50           HG2      ARG  50  -0.229  -2.161  -6.367
  242    HD2  ARG  50           HD1      ARG  50  -1.426  -4.725  -5.315
  243    HD3  ARG  50           HD2      ARG  50  -1.702  -4.140  -6.962
  244    HE   ARG  50           HE       ARG  50   0.668  -5.378  -5.960
  245   HH11  ARG  50          HH11      ARG  50  -0.543  -3.087  -8.283
  246   HH12  ARG  50          HH12      ARG  50   0.784  -3.297  -9.377
  247   HH21  ARG  50          HH21      ARG  50   2.421  -5.663  -7.391
  248   HH22  ARG  50          HH22      ARG  50   2.469  -4.763  -8.869
  249    H    LYS  51           H        LYS  51  -2.238   0.254  -2.441
  250    HA   LYS  51           HA       LYS  51  -0.741   2.258  -3.934
  251    HB2  LYS  51           HB1      LYS  51  -3.223   1.264  -4.857
  252    HB3  LYS  51           HB2      LYS  51  -3.532   2.879  -4.199
  253    HG2  LYS  51           HG1      LYS  51  -1.678   3.752  -5.617
  254    HG3  LYS  51           HG2      LYS  51  -1.569   2.145  -6.359
  255    HD2  LYS  51           HD1      LYS  51  -4.202   3.584  -6.266
  256    HD3  LYS  51           HD2      LYS  51  -3.001   3.993  -7.503
  257    HE2  LYS  51           HE1      LYS  51  -4.088   2.359  -8.654
  258    HE3  LYS  51           HE2      LYS  51  -2.954   1.338  -7.760
  259    HZ1  LYS  51           HZ1      LYS  51  -5.276   1.828  -6.210
  260    HZ2  LYS  51           HZ2      LYS  51  -4.628   0.352  -6.723
  261    HZ3  LYS  51           HZ3      LYS  51  -5.706   1.193  -7.718
  262    H    PHE  52           H        PHE  52  -1.106   4.425  -3.185
  263    HA   PHE  52           HA       PHE  52  -2.218   4.506  -0.458
  264    HB2  PHE  52           HB1      PHE  52  -0.603   6.167   0.120
  265    HB3  PHE  52           HB2      PHE  52   0.264   4.858  -0.684
  266    HD1  PHE  52           HD1      PHE  52  -0.397   8.353  -0.675
  267    HD2  PHE  52           HD2      PHE  52   0.791   5.116  -3.170
  268    HE1  PHE  52           HE1      PHE  52   0.557   9.949  -2.286
  269    HE2  PHE  52           HE2      PHE  52   1.746   6.706  -4.785
  270    HZ   PHE  52           HZ       PHE  52   1.631   9.126  -4.344
  271    H    CYS  53           H        CYS  53  -2.614   6.988   0.128
  272    HA   CYS  53           HA       CYS  53  -4.565   7.908  -1.847
  273    HB2  CYS  53           HB1      CYS  53  -4.381   7.919   1.053
  274    HB3  CYS  53           HB2      CYS  53  -4.762   9.524   0.426
  275    H    LEU  54           H        LEU  54  -3.321   8.992  -3.346
  276    HA   LEU  54           HA       LEU  54  -1.389  10.969  -2.550
  277    HB2  LEU  54           HB1      LEU  54  -1.086   9.645  -4.584
  278    HB3  LEU  54           HB2      LEU  54  -2.571  10.344  -5.252
  279    HG   LEU  54           HG       LEU  54  -1.107  12.584  -4.743
  280   HD11  LEU  54          HD11      LEU  54   1.149  12.201  -5.543
  281   HD12  LEU  54          HD12      LEU  54   0.831  10.472  -5.679
  282   HD13  LEU  54          HD13      LEU  54   0.845  11.244  -4.093
  283   HD21  LEU  54          HD21      LEU  54  -2.317  11.531  -6.857
  284   HD22  LEU  54          HD22      LEU  54  -0.649  11.226  -7.340
  285   HD23  LEU  54          HD23      LEU  54  -1.181  12.872  -6.998
  286    H    GLN  55           H        GLN  55  -1.869  12.962  -1.934
  287    HA   GLN  55           HA       GLN  55  -4.314  14.213  -3.000
  288    HB2  GLN  55           HB1      GLN  55  -4.279  15.556  -0.829
  289    HB3  GLN  55           HB2      GLN  55  -4.757  13.854  -0.715
  290    HG2  GLN  55           HG1      GLN  55  -2.793  13.219   0.328
  291    HG3  GLN  55           HG2      GLN  55  -1.913  14.636  -0.261
  292   HE21  GLN  55          HE21      GLN  55  -1.339  15.852   1.383
  293   HE22  GLN  55          HE22      GLN  55  -2.326  16.268   2.739
  294    HA   PRO  56           HA       PRO  56  -0.834  16.811  -4.456
  295    HB2  PRO  56           HB1      PRO  56  -2.097  17.581  -6.763
  296    HB3  PRO  56           HB2      PRO  56  -1.207  16.068  -6.599
  297    HG2  PRO  56           HG1      PRO  56  -4.153  16.576  -6.363
  298    HG3  PRO  56           HG2      PRO  56  -3.290  15.261  -7.243
  299    HD2  PRO  56           HD1      PRO  56  -4.452  14.881  -4.819
  300    HD3  PRO  56           HD2      PRO  56  -2.972  14.042  -5.314
  301    H    ARG  57           H        ARG  57  -0.637  19.062  -4.558
  302    HA   ARG  57           HA       ARG  57  -2.712  20.513  -3.166
  303    HB2  ARG  57           HB1      ARG  57  -0.165  20.719  -2.820
  304    HB3  ARG  57           HB2      ARG  57  -0.191  21.717  -4.282
  305    HG2  ARG  57           HG1      ARG  57  -1.066  23.488  -3.224
  306    HG3  ARG  57           HG2      ARG  57  -2.180  22.485  -2.278
  307    HD2  ARG  57           HD1      ARG  57  -0.720  23.441  -0.692
  308    HD3  ARG  57           HD2      ARG  57  -0.158  21.779  -0.913
  309    HE   ARG  57           HE       ARG  57   1.312  23.241  -2.694
  310   HH11  ARG  57          HH11      ARG  57   0.760  23.351   0.741
  311   HH12  ARG  57          HH12      ARG  57   2.323  24.006   1.103
  312   HH21  ARG  57          HH21      ARG  57   3.372  24.105  -2.230
  313   HH22  ARG  57          HH22      ARG  57   3.807  24.436  -0.588
  314    H    ASP  58           H        ASP  58  -1.562  20.160  -6.414
  315    HA   ASP  58           HA       ASP  58  -2.991  22.518  -7.348
  316    HB2  ASP  58           HB1      ASP  58  -0.958  20.676  -8.452
  317    HB3  ASP  58           HB2      ASP  58  -2.145  21.273  -9.616
  318    HD2  ASP  58           HD       ASP  58   0.432  23.857  -8.079
  319    H    GLU  59           H        GLU  59  -3.436  19.112  -7.058
  320    HA   GLU  59           HA       GLU  59  -5.942  19.325  -8.594
  321    HB2  GLU  59           HB1      GLU  59  -3.765  17.611  -9.068
  322    HB3  GLU  59           HB2      GLU  59  -5.023  16.602  -8.340
  323    HG2  GLU  59           HG1      GLU  59  -6.388  18.135 -10.210
  324    HG3  GLU  59           HG2      GLU  59  -4.861  17.720 -11.000
  325    HE2  GLU  59           HE       GLU  59  -7.526  15.022 -11.066
  326    H    LYS  60           H        LYS  60  -7.314  17.198  -7.943
  327    HA   LYS  60           HA       LYS  60  -7.836  17.558  -5.106
  328    HB2  LYS  60           HB1      LYS  60  -9.341  16.586  -7.460
  329    HB3  LYS  60           HB2      LYS  60  -9.719  15.783  -5.928
  330    HG2  LYS  60           HG1      LYS  60 -10.545  17.709  -4.950
  331    HG3  LYS  60           HG2      LYS  60  -9.667  18.765  -6.071
  332    HD2  LYS  60           HD1      LYS  60 -11.820  18.948  -6.880
  333    HD3  LYS  60           HD2      LYS  60 -11.176  17.632  -7.879
  334    HE2  LYS  60           HE1      LYS  60 -12.368  16.744  -5.338
  335    HE3  LYS  60           HE2      LYS  60 -13.501  17.525  -6.451
  336    HZ1  LYS  60           HZ1      LYS  60 -13.417  15.813  -7.867
  337    HZ2  LYS  60           HZ2      LYS  60 -12.807  14.936  -6.557
  338    HZ3  LYS  60           HZ3      LYS  60 -11.748  15.598  -7.698
  339    HA   PRO  61           HA       PRO  61  -6.148  13.772  -3.666
  340    HB2  PRO  61           HB1      PRO  61  -8.012  12.948  -1.837
  341    HB3  PRO  61           HB2      PRO  61  -6.936  14.321  -1.579
  342    HG2  PRO  61           HG1      PRO  61  -9.778  14.285  -2.541
  343    HG3  PRO  61           HG2      PRO  61  -9.004  15.352  -1.310
  344    HD2  PRO  61           HD1      PRO  61  -9.493  16.163  -3.855
  345    HD3  PRO  61           HD2      PRO  61  -8.088  16.716  -2.927
  346    H    PHE  62           H        PHE  62  -6.062  11.694  -4.302
  347    HA   PHE  62           HA       PHE  62  -8.336  10.057  -4.741
  348    HB2  PHE  62           HB1      PHE  62  -8.352   9.843  -7.110
  349    HB3  PHE  62           HB2      PHE  62  -8.403  11.573  -6.764
  350    HD1  PHE  62           HD1      PHE  62  -6.937   9.200  -8.804
  351    HD2  PHE  62           HD2      PHE  62  -5.956  12.668  -6.539
  352    HE1  PHE  62           HE1      PHE  62  -4.957   9.562 -10.221
  353    HE2  PHE  62           HE2      PHE  62  -3.976  13.036  -7.953
  354    HZ   PHE  62           HZ       PHE  62  -3.476  11.483  -9.797
  355    H    CYS  63           H        CYS  63  -7.645   7.976  -5.950
  356    HA   CYS  63           HA       CYS  63  -5.251   7.034  -4.658
  357    HB2  CYS  63           HB1      CYS  63  -7.301   5.703  -6.438
  358    HB3  CYS  63           HB2      CYS  63  -5.894   4.853  -5.797
  359    H    ALA  64           H        ALA  64  -3.288   6.814  -5.518
  360    HA   ALA  64           HA       ALA  64  -2.960   6.635  -8.409
  361    HB1  ALA  64           HB1      ALA  64  -1.983   8.908  -6.734
  362    HB2  ALA  64           HB2      ALA  64  -1.070   8.399  -8.155
  363    HB3  ALA  64           HB3      ALA  64  -2.743   8.932  -8.327
  364    H    THR  65           H        THR  65  -1.343   5.303  -8.971
  365    HA   THR  65           HA       THR  65  -0.105   3.614  -7.165
  366    HB   THR  65           HB       THR  65   1.529   4.069  -9.546
  367    HG1  THR  65           HG1      THR  65  -0.022   4.195 -10.972
  368   HG21  THR  65          HG21      THR  65   1.035   1.666  -9.880
  369   HG22  THR  65          HG22      THR  65  -0.082   1.730  -8.515
  370   HG23  THR  65          HG23      THR  65   1.639   2.017  -8.261
  371    H    CYS  66           H        CYS  66   2.249   3.364  -6.760
  372    HA   CYS  66           HA       CYS  66   3.300   5.776  -5.633
  373    HB2  CYS  66           HB1      CYS  66   5.167   4.374  -4.887
  374    HB3  CYS  66           HB2      CYS  66   3.615   3.626  -4.512
  375    H    ARG  67           H        ARG  67   5.390   6.687  -6.091
  376    HA   ARG  67           HA       ARG  67   5.835   7.036  -8.887
  377    HB2  ARG  67           HB1      ARG  67   7.696   7.912  -6.680
  378    HB3  ARG  67           HB2      ARG  67   7.470   8.644  -8.274
  379    HG2  ARG  67           HG1      ARG  67   5.442   8.631  -6.036
  380    HG3  ARG  67           HG2      ARG  67   6.455  10.000  -6.528
  381    HD2  ARG  67           HD1      ARG  67   5.092   8.957  -8.830
  382    HD3  ARG  67           HD2      ARG  67   3.926   9.257  -7.533
  383    HE   ARG  67           HE       ARG  67   5.399  11.225  -9.024
  384   HH11  ARG  67          HH11      ARG  67   3.720  10.550  -6.050
  385   HH12  ARG  67          HH12      ARG  67   3.371  12.214  -5.717
  386   HH21  ARG  67          HH21      ARG  67   4.946  13.419  -8.597
  387   HH22  ARG  67          HH22      ARG  67   4.068  13.845  -7.168
  388    H    GLY  68           H        GLY  68   7.755   6.575 -10.067
  389    HA2  GLY  68           HA2      GLY  68   8.722   3.968  -9.776
  390    HA3  GLY  68           HA3      GLY  68   9.453   5.208 -10.784
  391    HA1  GLY  68           HA1      GLY  68   8.650   4.378  -8.999
  392    H    LEU  69           H        LEU  69  11.174   3.506  -9.748
  393    HA   LEU  69           HA       LEU  69  12.119   4.016  -7.152
  394    HB2  LEU  69           HB1      LEU  69  13.118   2.676  -9.586
  395    HB3  LEU  69           HB2      LEU  69  14.363   3.258  -8.465
  396    HG   LEU  69           HG       LEU  69  12.139   1.335  -7.785
  397   HD11  LEU  69          HD11      LEU  69  14.955   0.524  -7.578
  398   HD12  LEU  69          HD12      LEU  69  14.362   0.775  -9.220
  399   HD13  LEU  69          HD13      LEU  69  13.550  -0.373  -8.154
  400   HD21  LEU  69          HD21      LEU  69  14.379   2.503  -6.147
  401   HD22  LEU  69          HD22      LEU  69  13.484   1.058  -5.679
  402   HD23  LEU  69          HD23      LEU  69  12.645   2.601  -5.840
  403    H    ARG  70           H        ARG  70  13.407   5.171 -10.275
  404    HA   ARG  70           HA       ARG  70  15.256   6.969  -9.126
  405    HB2  ARG  70           HB1      ARG  70  13.994   6.976 -11.879
  406    HB3  ARG  70           HB2      ARG  70  15.400   7.936 -11.400
  407    HG2  ARG  70           HG1      ARG  70  16.668   6.257 -12.110
  408    HG3  ARG  70           HG2      ARG  70  16.096   5.352 -10.696
  409    HD2  ARG  70           HD1      ARG  70  14.401   4.266 -11.926
  410    HD3  ARG  70           HD2      ARG  70  14.547   5.409 -13.268
  411    HE   ARG  70           HE       ARG  70  16.997   4.197 -13.112
  412   HH11  ARG  70          HH11      ARG  70  13.710   3.126 -13.517
  413   HH12  ARG  70          HH12      ARG  70  14.140   1.734 -14.455
  414   HH21  ARG  70          HH21      ARG  70  17.577   2.367 -14.344
  415   HH22  ARG  70          HH22      ARG  70  16.341   1.303 -14.924
  416    H    ARG  71           H        ARG  71  11.870   7.180  -9.752
  417    HA   ARG  71           HA       ARG  71  11.443   9.889 -10.052
  418    HB2  ARG  71           HB1      ARG  71   9.885   7.596  -9.429
  419    HB3  ARG  71           HB2      ARG  71   9.457   8.863  -8.269
  420    HG2  ARG  71           HG1      ARG  71   7.994   8.912 -10.224
  421    HG3  ARG  71           HG2      ARG  71   8.955  10.395 -10.086
  422    HD2  ARG  71           HD1      ARG  71  10.261   9.903 -11.917
  423    HD3  ARG  71           HD2      ARG  71  10.027   8.159 -11.732
  424    HE   ARG  71           HE       ARG  71   8.147   8.296 -13.037
  425   HH11  ARG  71          HH11      ARG  71   9.095  11.493 -12.036
  426   HH12  ARG  71          HH12      ARG  71   7.968  12.295 -13.079
  427   HH21  ARG  71          HH21      ARG  71   6.660   9.341 -14.414
  428   HH22  ARG  71          HH22      ARG  71   6.582  11.070 -14.431
  429    H    ARG  72           H        ARG  72  11.096  11.613  -8.648
  430    HA   ARG  72           HA       ARG  72  12.694  11.595  -6.279
  431    HB2  ARG  72           HB1      ARG  72  10.911  13.648  -7.581
  432    HB3  ARG  72           HB2      ARG  72  11.708  13.950  -6.030
  433    HG2  ARG  72           HG1      ARG  72  13.763  13.031  -7.643
  434    HG3  ARG  72           HG2      ARG  72  12.789  14.051  -8.713
  435    HD2  ARG  72           HD1      ARG  72  13.637  14.965  -5.969
  436    HD3  ARG  72           HD2      ARG  72  14.653  15.189  -7.398
  437    HE   ARG  72           HE       ARG  72  12.325  16.689  -6.702
  438   HH11  ARG  72          HH11      ARG  72  14.226  15.523  -9.376
  439   HH12  ARG  72          HH12      ARG  72  13.724  16.786 -10.451
  440   HH21  ARG  72          HH21      ARG  72  11.658  18.356  -8.108
  441   HH22  ARG  72          HH22      ARG  72  12.264  18.397  -9.729
  442    H    CYS  73           H        CYS  73  11.922  12.264  -4.149
  443    HA   CYS  73           HA       CYS  73   9.116  11.895  -3.550
  444    HB2  CYS  73           HB1      CYS  73   9.476  10.082  -1.936
  445    HB3  CYS  73           HB2      CYS  73   9.896   9.580  -3.576
  446    H    GLN  74           H        GLN  74   8.621  12.350  -1.280
  447    HA   GLN  74           HA       GLN  74  10.650  14.114  -0.075
  448    HB2  GLN  74           HB1      GLN  74   7.879  14.546  -0.746
  449    HB3  GLN  74           HB2      GLN  74   8.125  14.748   0.996
  450    HG2  GLN  74           HG1      GLN  74   8.950  16.769   0.669
  451    HG3  GLN  74           HG2      GLN  74  10.244  16.079  -0.321
  452   HE21  GLN  74          HE21      GLN  74   8.107  18.423  -0.369
  453   HE22  GLN  74          HE22      GLN  74   7.696  18.482  -2.045
  454    H    ARG  75           H        ARG  75   8.502  11.449   0.412
  455    HA   ARG  75           HA       ARG  75   9.525  11.173   3.154
  456    HB2  ARG  75           HB1      ARG  75   6.922  11.858   2.592
  457    HB3  ARG  75           HB2      ARG  75   6.829  10.097   2.752
  458    HG2  ARG  75           HG1      ARG  75   7.573  10.129   4.973
  459    HG3  ARG  75           HG2      ARG  75   8.176  11.789   4.828
  460    HD2  ARG  75           HD1      ARG  75   5.966  12.688   4.759
  461    HD3  ARG  75           HD2      ARG  75   5.263  11.074   4.575
  462    HE   ARG  75           HE       ARG  75   5.379  10.800   6.843
  463   HH11  ARG  75          HH11      ARG  75   7.429  13.456   5.911
  464   HH12  ARG  75          HH12      ARG  75   7.764  13.939   7.541
  465   HH21  ARG  75          HH21      ARG  75   5.812  11.426   8.992
  466   HH22  ARG  75          HH22      ARG  75   6.845  12.783   9.293
  467    H    ASP  76           H        ASP  76   9.485   8.965   3.966
  468    HA   ASP  76           HA       ASP  76  10.269   7.097   1.917
  469    HB2  ASP  76           HB1      ASP  76   9.947   6.396   4.826
  470    HB3  ASP  76           HB2      ASP  76  11.098   5.751   3.648
  471    HD2  ASP  76           HD       ASP  76  12.001   9.122   5.507
  472    H    ALA  77           H        ALA  77   7.439   7.758   3.773
  473    HA   ALA  77           HA       ALA  77   6.243   5.165   3.465
  474    HB1  ALA  77           HB1      ALA  77   4.667   7.636   4.050
  475    HB2  ALA  77           HB2      ALA  77   4.442   5.993   4.652
  476    HB3  ALA  77           HB3      ALA  77   5.771   6.980   5.260
  477    H    MET  78           H        MET  78   5.855   8.330   1.903
  478    HA   MET  78           HA       MET  78   3.767   7.622   0.172
  479    HB2  MET  78           HB1      MET  78   4.357   9.590  -1.114
  480    HB3  MET  78           HB2      MET  78   4.473   9.948   0.616
  481    HG2  MET  78           HG1      MET  78   6.570  10.612   0.383
  482    HG3  MET  78           HG2      MET  78   7.009   9.033  -0.275
  483    HE1  MET  78           HE1      MET  78   4.985   9.167  -2.955
  484    HE2  MET  78           HE2      MET  78   6.257   9.564  -4.109
  485    HE3  MET  78           HE3      MET  78   6.561   8.387  -2.831
  486    H    CYS  79           H        CYS  79   7.125   6.868   0.112
  487    HA   CYS  79           HA       CYS  79   7.417   6.396  -2.668
  488    HB2  CYS  79           HB1      CYS  79   9.013   6.142  -0.288
  489    HB3  CYS  79           HB2      CYS  79   9.160   4.673  -1.252
  490    H    CYS  80           H        CYS  80   7.867   4.207  -3.591
  491    HA   CYS  80           HA       CYS  80   5.639   2.583  -3.517
  492    HB2  CYS  80           HB1      CYS  80   8.467   2.164  -4.420
  493    HB3  CYS  80           HB2      CYS  80   7.353   0.796  -4.416
  494    HA   PRO  81           HA       PRO  81   5.898  -0.015   0.008
  495    HB2  PRO  81           HB1      PRO  81   5.023  -2.419  -0.971
  496    HB3  PRO  81           HB2      PRO  81   3.968  -1.029  -0.718
  497    HG2  PRO  81           HG1      PRO  81   5.298  -1.973  -3.234
  498    HG3  PRO  81           HG2      PRO  81   3.599  -1.428  -2.978
  499    HD2  PRO  81           HD1      PRO  81   5.500   0.166  -4.084
  500    HD3  PRO  81           HD2      PRO  81   4.197   0.797  -3.061
  501    H    GLY  82           H        GLY  82   7.769  -0.624   0.897
  502    HA2  GLY  82           HA2      GLY  82   9.419  -2.268   1.325
  503    HA3  GLY  82           HA3      GLY  82   9.251  -2.832  -0.331
  504    HA1  GLY  82           HA1      GLY  82   9.361  -1.392   1.230
  505    H    THR  83           H        THR  83   9.460   0.555   0.030
  506    HA   THR  83           HA       THR  83  12.344   0.504  -0.557
  507    HB   THR  83           HB       THR  83  12.042   2.301  -2.205
  508    HG1  THR  83           HG1      THR  83   9.856   2.731  -2.905
  509   HG21  THR  83          HG21      THR  83  11.744   0.819  -3.869
  510   HG22  THR  83          HG22      THR  83  10.138   0.364  -3.300
  511   HG23  THR  83          HG23      THR  83  11.569  -0.370  -2.579
  512    H    LEU  84           H        LEU  84  13.260   2.817  -0.436
  513    HA   LEU  84           HA       LEU  84  11.982   4.297   1.762
  514    HB2  LEU  84           HB1      LEU  84  14.813   3.341   1.504
  515    HB3  LEU  84           HB2      LEU  84  14.438   4.800   2.437
  516    HG   LEU  84           HG       LEU  84  12.955   2.295   3.071
  517   HD11  LEU  84          HD11      LEU  84  15.762   2.856   4.015
  518   HD12  LEU  84          HD12      LEU  84  15.300   1.588   2.880
  519   HD13  LEU  84          HD13      LEU  84  14.719   1.536   4.544
  520   HD21  LEU  84          HD21      LEU  84  13.725   4.836   4.399
  521   HD22  LEU  84          HD22      LEU  84  13.560   3.399   5.408
  522   HD23  LEU  84          HD23      LEU  84  12.198   3.954   4.434
  523    H    CYS  85           H        CYS  85  12.748   6.549   1.955
  524    HA   CYS  85           HA       CYS  85  13.212   7.680  -0.714
  525    HB2  CYS  85           HB1      CYS  85  11.182   8.336   0.667
  526    HB3  CYS  85           HB2      CYS  85  12.301   9.161   1.755
  527    H    VAL  86           H        VAL  86  15.302   8.018  -1.108
  528    HA   VAL  86           HA       VAL  86  16.895   9.379   0.963
  529    HB   VAL  86           HB       VAL  86  17.999   7.350  -0.981
  530   HG11  VAL  86          HG11      VAL  86  19.160   9.208   0.968
  531   HG12  VAL  86          HG12      VAL  86  19.759   7.552   1.085
  532   HG13  VAL  86          HG13      VAL  86  19.889   8.433  -0.438
  533   HG21  VAL  86          HG21      VAL  86  16.495   6.266   0.615
  534   HG22  VAL  86          HG22      VAL  86  18.175   5.826   0.919
  535   HG23  VAL  86          HG23      VAL  86  17.373   7.009   1.952
  536    H    ASN  87           H        ASN  87  18.100  11.089   0.309
  537    HA   ASN  87           HA       ASN  87  18.740  12.848  -0.987
  538    HB2  ASN  87           HB1      ASN  87  20.041  10.767  -1.942
  539    HB3  ASN  87           HB2      ASN  87  18.998  11.021  -3.346
  540   HD21  ASN  87          HD21      ASN  87  19.598  12.457  -4.813
  541   HD22  ASN  87          HD22      ASN  87  20.839  13.642  -4.612
  542    H    ASP  88           H        ASP  88  15.962  12.427  -0.820
  543    HA   ASP  88           HA       ASP  88  14.003  13.121  -1.744
  544    HB2  ASP  88           HB1      ASP  88  15.932  14.969  -2.497
  545    HB3  ASP  88           HB2      ASP  88  15.123  14.569  -4.018
  546    HD2  ASP  88           HD       ASP  88  12.230  16.197  -3.094
  547    H    VAL  89           H        VAL  89  15.379  10.686  -2.750
  548    HA   VAL  89           HA       VAL  89  13.721  10.327  -5.127
  549    HB   VAL  89           HB       VAL  89  16.660   9.626  -5.074
  550   HG11  VAL  89          HG11      VAL  89  15.985   7.970  -6.435
  551   HG12  VAL  89          HG12      VAL  89  14.416   8.719  -6.735
  552   HG13  VAL  89          HG13      VAL  89  15.835   9.254  -7.634
  553   HG21  VAL  89          HG21      VAL  89  16.193  12.020  -5.442
  554   HG22  VAL  89          HG22      VAL  89  16.898  11.245  -6.861
  555   HG23  VAL  89          HG23      VAL  89  15.169  11.591  -6.812
  556    H    CYS  90           H        CYS  90  12.901   8.291  -5.352
  557    HA   CYS  90           HA       CYS  90  12.811   6.619  -3.093
  558    HB2  CYS  90           HB1      CYS  90  11.402   6.851  -5.466
  559    HB3  CYS  90           HB2      CYS  90  12.182   5.274  -5.612
  560    H    THR  91           H        THR  91  13.713   4.606  -2.673
  561    HA   THR  91           HA       THR  91  15.701   3.515  -4.486
  562    HB   THR  91           HB       THR  91  16.999   5.162  -3.196
  563    HG1  THR  91           HG1      THR  91  18.581   3.755  -3.180
  564   HG21  THR  91          HG21      THR  91  15.785   5.315  -1.152
  565   HG22  THR  91          HG22      THR  91  17.376   4.665  -0.753
  566   HG23  THR  91          HG23      THR  91  15.980   3.591  -0.835
  567    H    THR  92           H        THR  92  16.109   1.350  -4.158
  568    HA   THR  92           HA       THR  92  14.141  -0.185  -2.898
  569    HB   THR  92           HB       THR  92  15.822  -2.093  -3.159
  570    HG1  THR  92           HG1      THR  92  17.569  -1.404  -4.670
  571   HG21  THR  92          HG21      THR  92  15.015  -0.386  -5.511
  572   HG22  THR  92          HG22      THR  92  14.141  -1.757  -4.828
  573   HG23  THR  92          HG23      THR  92  15.673  -2.014  -5.662
  574    H    MET  93           H        MET  93  14.450  -1.771  -1.151
  575    HA   MET  93           HA       MET  93  15.368  -0.519   1.215
  576    HB2  MET  93           HB1      MET  93  13.563  -2.410   0.785
  577    HB3  MET  93           HB2      MET  93  14.941  -3.471   1.118
  578    HG2  MET  93           HG1      MET  93  15.263  -2.047   3.246
  579    HG3  MET  93           HG2      MET  93  13.614  -1.500   2.933
  580    HE1  MET  93           HE1      MET  93  13.946  -3.371   5.894
  581    HE2  MET  93           HE2      MET  93  13.057  -2.073   5.096
  582    HE3  MET  93           HE3      MET  93  12.248  -3.596   5.471
  583    H    GLU  94           H        GLU  94  16.856  -2.653  -1.073
  584    HA   GLU  94           HA       GLU  94  18.964  -3.551   0.638
  585    HB2  GLU  94           HB1      GLU  94  18.504  -3.615  -2.338
  586    HB3  GLU  94           HB2      GLU  94  20.032  -4.158  -1.627
  587    HG2  GLU  94           HG1      GLU  94  19.109  -6.163  -1.420
  588    HG3  GLU  94           HG2      GLU  94  18.117  -5.467  -0.130
  589    HE2  GLU  94           HE       GLU  94  15.475  -4.997  -2.563
  590    H    ASP  95           H        ASP  95  18.515  -0.881  -1.590
  591    HA   ASP  95           HA       ASP  95  21.250  -0.066  -1.623
  592    HB2  ASP  95           HB1      ASP  95  18.716   0.844  -2.760
  593    HB3  ASP  95           HB2      ASP  95  19.749   2.184  -2.244
  594    HD2  ASP  95           HD       ASP  95  22.266   1.132  -4.554
  595    H    ALA  96           H        ALA  96  18.358   1.138   0.065
  596    HA   ALA  96           HA       ALA  96  19.875   3.041   1.597
  597    HB1  ALA  96           HB1      ALA  96  17.799   3.626   2.631
  598    HB2  ALA  96           HB2      ALA  96  17.505   3.394   0.906
  599    HB3  ALA  96           HB3      ALA  96  17.038   2.141   2.058
  600    H    THR  97           H        THR  97  20.756   2.791   3.558
  601    HA   THR  97           HA       THR  97  19.981   0.492   5.201
  602    HB   THR  97           HB       THR  97  22.508   0.244   5.732
  603    HG1  THR  97           HG1      THR  97  22.769   1.186   3.071
  604   HG21  THR  97          HG21      THR  97  21.530  -0.682   3.031
  605   HG22  THR  97          HG22      THR  97  21.059  -1.423   4.561
  606   HG23  THR  97          HG23      THR  97  22.746  -1.452   4.048
  607    H    GLU  98           H        GLU  98  22.607   2.889   5.368
  608    HA   GLU  98           HA       GLU  98  21.375   4.558   7.272
  609    HB2  GLU  98           HB1      GLU  98  21.786   2.348   8.559
  610    HB3  GLU  98           HB2      GLU  98  23.487   2.837   8.539
  611    HG2  GLU  98           HG1      GLU  98  22.091   5.102   9.396
  612    HG3  GLU  98           HG2      GLU  98  21.344   3.734  10.234
  613    HE2  GLU  98           HE       GLU  98  24.008   3.444  12.358
  614    H    ASN  99           H        ASN  99  22.521   5.519   5.235
  615    HA   ASN  99           HA       ASN  99  24.139   6.884   4.403
  616    HB2  ASN  99           HB1      ASN  99  23.809   7.595   7.006
  617    HB3  ASN  99           HB2      ASN  99  25.535   7.213   6.986
  618   HD21  ASN  99          HD21      ASN  99  23.190   8.889   4.912
  619   HD22  ASN  99          HD22      ASN  99  24.197  10.256   4.594
  620    H    LEU 100           H        LEU 100  24.648   4.074   4.385
  621    HA   LEU 100           HA       LEU 100  27.257   3.421   5.213
  622    HB2  LEU 100           HB1      LEU 100  25.121   2.190   3.759
  623    HB3  LEU 100           HB2      LEU 100  26.639   1.951   2.877
  624    HG   LEU 100           HG       LEU 100  26.161   0.067   4.346
  625   HD11  LEU 100          HD11      LEU 100  28.296   0.031   5.576
  626   HD12  LEU 100          HD12      LEU 100  28.498   1.750   5.236
  627   HD13  LEU 100          HD13      LEU 100  28.478   0.586   3.912
  628   HD21  LEU 100          HD21      LEU 100  25.971   0.246   6.689
  629   HD22  LEU 100          HD22      LEU 100  24.907   1.488   6.029
  630   HD23  LEU 100          HD23      LEU 100  26.485   1.933   6.681
  631    H    TYR 101           H        TYR 101  29.104   2.956   3.788
  632    HA   TYR 101           HA       TYR 101  29.247   4.426   1.294
  633    HB2  TYR 101           HB1      TYR 101  30.617   5.297   3.806
  634    HB3  TYR 101           HB2      TYR 101  31.476   5.478   2.276
  635    HD1  TYR 101           HD1      TYR 101  29.384   7.129   4.503
  636    HD2  TYR 101           HD2      TYR 101  29.957   6.549   0.327
  637    HE1  TYR 101           HE1      TYR 101  28.177   9.225   4.053
  638    HE2  TYR 101           HE2      TYR 101  28.753   8.642  -0.135
  639    HH   TYR 101           HH       TYR 101  27.801  10.452   0.745
  640    H    PHE 102           H        PHE 102  31.184   3.970   0.083
  641    HA   PHE 102           HA       PHE 102  32.543   1.514   0.978
  642    HB2  PHE 102           HB1      PHE 102  32.639   0.752  -1.302
  643    HB3  PHE 102           HB2      PHE 102  30.966   1.171  -0.926
  644    HD1  PHE 102           HD1      PHE 102  33.794   1.865  -3.041
  645    HD2  PHE 102           HD2      PHE 102  30.008   3.323  -1.752
  646    HE1  PHE 102           HE1      PHE 102  33.716   3.371  -4.985
  647    HE2  PHE 102           HE2      PHE 102  29.924   4.831  -3.694
  648    HZ   PHE 102           HZ       PHE 102  31.778   4.855  -5.314
  649    H    GLN 103           H        GLN 103  34.740   1.259   0.418
  650    HA   GLN 103           HA       GLN 103  36.092   3.715  -0.477
  651    HB2  GLN 103           HB1      GLN 103  36.562   2.050   1.952
  652    HB3  GLN 103           HB2      GLN 103  37.970   2.754   1.141
  653    HG2  GLN 103           HG1      GLN 103  35.920   4.746   1.441
  654    HG3  GLN 103           HG2      GLN 103  36.270   3.979   2.996
  655   HE21  GLN 103          HE21      GLN 103  37.851   4.840   4.123
  656   HE22  GLN 103          HE22      GLN 103  39.167   5.765   3.494
  657    H    SER 104           H        SER 104  37.675   3.463  -1.956
  658    HA   SER 104           HA       SER 104  38.051   0.798  -3.055
  659    HB2  SER 104           HB1      SER 104  38.417   3.583  -4.014
  660    HB3  SER 104           HB2      SER 104  39.553   2.384  -4.656
  661    HG   SER 104           HG       SER 104  37.985   1.439  -5.729
  662    H    LEU 105           H        LEU 105  39.503  -0.383  -1.959
  663    HA   LEU 105           HA       LEU 105  42.102   0.857  -1.338
  664    HB2  LEU 105           HB1      LEU 105  40.717  -1.486  -0.022
  665    HB3  LEU 105           HB2      LEU 105  42.351  -0.919   0.366
  666    HG   LEU 105           HG       LEU 105  40.515   1.266   0.608
  667   HD11  LEU 105          HD11      LEU 105  39.037   0.494   2.298
  668   HD12  LEU 105          HD12      LEU 105  39.811  -1.090   2.344
  669   HD13  LEU 105          HD13      LEU 105  38.876  -0.607   0.929
  670   HD21  LEU 105          HD21      LEU 105  41.463   1.434   2.792
  671   HD22  LEU 105          HD22      LEU 105  42.749   0.956   1.683
  672   HD23  LEU 105          HD23      LEU 105  42.008  -0.243   2.746
  673    H    GLU 106           H        GLU 106  43.838  -1.006  -1.111
  674    HA   GLU 106           HA       GLU 106  43.537  -2.986  -3.237
  675    HB2  GLU 106           HB1      GLU 106  44.684  -0.661  -3.907
  676    HB3  GLU 106           HB2      GLU 106  46.099  -1.482  -3.231
  677    HG2  GLU 106           HG1      GLU 106  46.384  -2.339  -5.264
  678    HG3  GLU 106           HG2      GLU 106  45.038  -3.410  -4.849
  679    HE2  GLU 106           HE       GLU 106  42.819  -1.581  -6.870
  680    H    HIS 107           H        HIS 107  45.163  -4.663  -3.178
  681    HA   HIS 107           HA       HIS 107  46.455  -4.902  -0.540
  682    HB2  HIS 107           HB1      HIS 107  46.155  -7.388  -0.825
  683    HB3  HIS 107           HB2      HIS 107  44.661  -6.476  -0.591
  684    HD1  HIS 107           HD1      HIS 107  42.846  -7.149  -2.114
  685    HD2  HIS 107           HD2      HIS 107  46.585  -7.745  -3.825
  686    HE1  HIS 107           HE1      HIS 107  42.399  -8.170  -4.368
  687    HE2  HIS 107           HE2      HIS 107  44.683  -8.533  -5.416
  688    H    HIS 108           H        HIS 108  48.431  -6.111  -0.459
  689    HA   HIS 108           HA       HIS 108  49.980  -5.831  -2.924
  690    HB2  HIS 108           HB1      HIS 108  50.658  -5.978  -0.008
  691    HB3  HIS 108           HB2      HIS 108  51.887  -6.414  -1.201
  692    HD1  HIS 108           HD1      HIS 108  51.408  -3.722   0.763
  693    HD2  HIS 108           HD2      HIS 108  51.490  -4.049  -3.378
  694    HE1  HIS 108           HE1      HIS 108  51.971  -1.421  -0.082
  695    HE2  HIS 108           HE2      HIS 108  52.021  -1.620  -2.613
  696    H    HIS 109           H        HIS 109  49.032  -7.715  -3.919
  697    HA   HIS 109           HA       HIS 109  50.585 -10.075  -3.438
  698    HB2  HIS 109           HB1      HIS 109  48.576 -10.110  -1.791
  699    HB3  HIS 109           HB2      HIS 109  47.614 -10.479  -3.225
  700    HD1  HIS 109           HD1      HIS 109  50.603 -11.894  -1.360
  701    HD2  HIS 109           HD2      HIS 109  47.555 -13.109  -3.908
  702    HE1  HIS 109           HE1      HIS 109  50.797 -14.398  -1.492
  703    HE2  HIS 109           HE2      HIS 109  48.933 -15.142  -3.050
  704    H    HIS 110           H        HIS 110  50.724  -8.681  -5.642
  705    HA   HIS 110           HA       HIS 110  49.136 -10.201  -7.603
  706    HB2  HIS 110           HB1      HIS 110  49.020  -7.451  -7.187
  707    HB3  HIS 110           HB2      HIS 110  50.079  -7.627  -8.590
  708    HD1  HIS 110           HD1      HIS 110  48.664 -10.061  -9.921
  709    HD2  HIS 110           HD2      HIS 110  46.732  -6.668  -8.497
  710    HE1  HIS 110           HE1      HIS 110  46.491  -9.944 -11.182
  711    HE2  HIS 110           HE2      HIS 110  45.310  -7.871 -10.313
  712    H    HIS 111           H        HIS 111  52.083  -8.229  -7.241
  713    HA   HIS 111           HA       HIS 111  53.594 -10.286  -8.647
  714    HB2  HIS 111           HB1      HIS 111  52.681  -8.054 -10.024
  715    HB3  HIS 111           HB2      HIS 111  54.343  -7.629  -9.595
  716    HD1  HIS 111           HD1      HIS 111  52.682 -10.758 -11.013
  717    HD2  HIS 111           HD2      HIS 111  56.042  -8.373 -11.544
  718    HE1  HIS 111           HE1      HIS 111  53.948 -11.797 -12.921
  719    HE2  HIS 111           HE2      HIS 111  56.003 -10.339 -13.246
  720    H    HIS 112           H        HIS 112  53.653  -7.155  -6.992
  721    HA   HIS 112           HA       HIS 112  56.391  -7.675  -6.095
  722    HB2  HIS 112           HB1      HIS 112  54.946  -5.327  -6.797
  723    HB3  HIS 112           HB2      HIS 112  55.356  -5.205  -5.085
  724    HD1  HIS 112           HD1      HIS 112  58.138  -6.566  -5.148
  725    HD2  HIS 112           HD2      HIS 112  56.866  -3.669  -7.840
  726    HE1  HIS 112           HE1      HIS 112  60.238  -5.526  -6.058
  727    HE2  HIS 112           HE2      HIS 112  59.461  -3.756  -7.705
  Start of MODEL   32
    1    H1   MET  18           H        MET  18 -31.349  -3.332 -33.418
    2    HA   MET  18           HA       MET  18 -30.404  -5.450 -33.264
    3    HB2  MET  18           HB1      MET  18 -28.433  -4.184 -35.136
    4    HB3  MET  18           HB2      MET  18 -28.001  -5.674 -34.286
    5    HG2  MET  18           HG1      MET  18 -28.871  -6.620 -36.145
    6    HG3  MET  18           HG2      MET  18 -30.364  -6.439 -35.219
    7    HE1  MET  18           HE1      MET  18 -31.393  -6.159 -38.678
    8    HE2  MET  18           HE2      MET  18 -31.538  -6.891 -37.081
    9    HE3  MET  18           HE3      MET  18 -32.515  -5.481 -37.497
   10    H    LEU  19           H        LEU  19 -30.156  -5.382 -31.094
   11    HA   LEU  19           HA       LEU  19 -27.516  -4.706 -30.082
   12    HB2  LEU  19           HB1      LEU  19 -29.841  -3.035 -29.693
   13    HB3  LEU  19           HB2      LEU  19 -29.240  -3.658 -28.146
   14    HG   LEU  19           HG       LEU  19 -27.010  -2.698 -29.626
   15   HD11  LEU  19          HD11      LEU  19 -29.420  -0.920 -29.660
   16   HD12  LEU  19          HD12      LEU  19 -28.275  -1.269 -30.955
   17   HD13  LEU  19          HD13      LEU  19 -27.788  -0.250 -29.600
   18   HD21  LEU  19          HD21      LEU  19 -27.502  -2.878 -27.109
   19   HD22  LEU  19          HD22      LEU  19 -28.298  -1.315 -27.298
   20   HD23  LEU  19          HD23      LEU  19 -26.584  -1.485 -27.684
   21    H    VAL  20           H        VAL  20 -26.911  -5.919 -28.340
   22    HA   VAL  20           HA       VAL  20 -28.595  -8.180 -27.699
   23    HB   VAL  20           HB       VAL  20 -26.146  -8.428 -28.066
   24   HG11  VAL  20          HG11      VAL  20 -25.548  -6.297 -26.886
   25   HG12  VAL  20          HG12      VAL  20 -25.836  -7.138 -25.362
   26   HG13  VAL  20          HG13      VAL  20 -24.561  -7.690 -26.449
   27   HG21  VAL  20          HG21      VAL  20 -27.200  -9.251 -25.362
   28   HG22  VAL  20          HG22      VAL  20 -27.346 -10.150 -26.873
   29   HG23  VAL  20          HG23      VAL  20 -25.762  -9.924 -26.131
   30    H    LEU  21           H        LEU  21 -29.533  -8.641 -25.752
   31    HA   LEU  21           HA       LEU  21 -30.246  -6.474 -24.078
   32    HB2  LEU  21           HB1      LEU  21 -30.957  -9.241 -24.408
   33    HB3  LEU  21           HB2      LEU  21 -30.727  -8.873 -22.690
   34    HG   LEU  21           HG       LEU  21 -32.436  -7.034 -24.286
   35   HD11  LEU  21          HD11      LEU  21 -32.950  -9.596 -24.702
   36   HD12  LEU  21          HD12      LEU  21 -34.236  -8.412 -24.475
   37   HD13  LEU  21          HD13      LEU  21 -33.735  -9.438 -23.131
   38   HD21  LEU  21          HD21      LEU  21 -33.729  -7.216 -22.078
   39   HD22  LEU  21          HD22      LEU  21 -32.174  -6.385 -22.059
   40   HD23  LEU  21          HD23      LEU  21 -32.297  -8.042 -21.464
   41    H    ASP  22           H        ASP  22 -29.574  -5.892 -22.053
   42    HA   ASP  22           HA       ASP  22 -27.603  -7.464 -20.636
   43    HB2  ASP  22           HB1      ASP  22 -26.181  -6.241 -22.199
   44    HB3  ASP  22           HB2      ASP  22 -26.918  -4.714 -21.696
   45    HD2  ASP  22           HD       ASP  22 -24.197  -6.356 -19.344
   46    H    PHE  23           H        PHE  23 -29.098  -7.529 -18.966
   47    HA   PHE  23           HA       PHE  23 -28.994  -5.390 -17.114
   48    HB2  PHE  23           HB1      PHE  23 -31.026  -5.157 -19.060
   49    HB3  PHE  23           HB2      PHE  23 -31.825  -5.679 -17.576
   50    HD1  PHE  23           HD1      PHE  23 -31.372  -4.362 -15.438
   51    HD2  PHE  23           HD2      PHE  23 -30.426  -2.915 -19.328
   52    HE1  PHE  23           HE1      PHE  23 -31.306  -2.063 -14.563
   53    HE2  PHE  23           HE2      PHE  23 -30.358  -0.615 -18.459
   54    HZ   PHE  23           HZ       PHE  23 -30.797  -0.186 -16.074
   55    H    ASN  24           H        ASN  24 -29.254  -6.191 -15.120
   56    HA   ASN  24           HA       ASN  24 -30.551  -8.825 -14.866
   57    HB2  ASN  24           HB1      ASN  24 -27.982  -7.785 -13.893
   58    HB3  ASN  24           HB2      ASN  24 -28.940  -8.591 -12.645
   59   HD21  ASN  24          HD21      ASN  24 -26.440  -9.302 -14.187
   60   HD22  ASN  24          HD22      ASN  24 -26.738 -10.906 -14.754
   61    H    ASN  25           H        ASN  25 -31.508  -9.271 -12.727
   62    HA   ASN  25           HA       ASN  25 -32.339  -6.883 -11.251
   63    HB2  ASN  25           HB1      ASN  25 -34.020  -7.677 -13.104
   64    HB3  ASN  25           HB2      ASN  25 -34.409  -8.943 -11.933
   65   HD21  ASN  25          HD21      ASN  25 -36.386  -7.308 -12.623
   66   HD22  ASN  25          HD22      ASN  25 -36.760  -6.200 -11.350
   67    H    ILE  26           H        ILE  26 -31.488  -7.337  -9.312
   68    HA   ILE  26           HA       ILE  26 -31.845 -10.040  -8.213
   69    HB   ILE  26           HB       ILE  26 -30.007  -7.863  -7.213
   70   HG12  ILE  26          HG11      ILE  26 -28.337  -9.745  -8.158
   71   HG13  ILE  26          HG12      ILE  26 -29.684  -9.965  -9.286
   72   HG21  ILE  26          HG21      ILE  26 -30.128  -9.184  -5.388
   73   HG22  ILE  26          HG22      ILE  26 -30.693 -10.581  -6.302
   74   HG23  ILE  26          HG23      ILE  26 -28.978 -10.169  -6.291
   75   HD11  ILE  26          HD11      ILE  26 -28.614  -8.385 -10.464
   76   HD12  ILE  26          HD12      ILE  26 -29.447  -7.287  -9.363
   77   HD13  ILE  26          HD13      ILE  26 -27.774  -7.747  -9.050
   78    H    ARG  27           H        ARG  27 -33.190 -10.378  -6.564
   79    HA   ARG  27           HA       ARG  27 -34.626  -8.114  -5.443
   80    HB2  ARG  27           HB1      ARG  27 -35.456 -10.574  -6.201
   81    HB3  ARG  27           HB2      ARG  27 -35.203 -10.846  -4.469
   82    HG2  ARG  27           HG1      ARG  27 -37.385 -10.195  -4.433
   83    HG3  ARG  27           HG2      ARG  27 -36.593  -8.619  -4.258
   84    HD2  ARG  27           HD1      ARG  27 -37.206  -9.667  -6.998
   85    HD3  ARG  27           HD2      ARG  27 -38.495  -8.951  -6.021
   86    HE   ARG  27           HE       ARG  27 -36.366  -7.565  -7.333
   87   HH11  ARG  27          HH11      ARG  27 -38.533  -7.480  -4.610
   88   HH12  ARG  27          HH12      ARG  27 -38.478  -5.755  -4.454
   89   HH21  ARG  27          HH21      ARG  27 -36.285  -5.294  -7.138
   90   HH22  ARG  27          HH22      ARG  27 -37.200  -4.513  -5.893
   91    H    SER  28           H        SER  28 -34.708  -7.583  -3.269
   92    HA   SER  28           HA       SER  28 -33.821  -7.189  -1.208
   93    HB2  SER  28           HB1      SER  28 -33.212 -10.160  -1.239
   94    HB3  SER  28           HB2      SER  28 -33.430  -9.127   0.185
   95    HG   SER  28           HG       SER  28 -35.292 -10.470  -0.617
   96    H    SER  29           H        SER  29 -32.101  -6.051  -2.499
   97    HA   SER  29           HA       SER  29 -29.480  -7.238  -1.875
   98    HB2  SER  29           HB1      SER  29 -28.541  -6.344  -3.915
   99    HB3  SER  29           HB2      SER  29 -29.970  -7.308  -4.328
  100    HG   SER  29           HG       SER  29 -30.046  -5.355  -5.440
  101    H    ALA  30           H        ALA  30 -31.295  -4.258  -2.488
  102    HA   ALA  30           HA       ALA  30 -29.231  -2.678  -1.163
  103    HB1  ALA  30           HB1      ALA  30 -31.485  -2.102  -2.973
  104    HB2  ALA  30           HB2      ALA  30 -31.128  -0.870  -1.761
  105    HB3  ALA  30           HB3      ALA  30 -29.876  -1.382  -2.893
  106    H    ASP  31           H        ASP  31 -29.507  -1.606   0.757
  107    HA   ASP  31           HA       ASP  31 -32.069  -1.836   2.144
  108    HB2  ASP  31           HB1      ASP  31 -29.500  -2.600   3.539
  109    HB3  ASP  31           HB2      ASP  31 -31.162  -2.829   4.102
  110    HD2  ASP  31           HD       ASP  31 -31.583  -5.685   2.144
  111    H    LEU  32           H        LEU  32 -32.189   0.427   1.790
  112    HA   LEU  32           HA       LEU  32 -31.952   2.619   2.344
  113    HB2  LEU  32           HB1      LEU  32 -30.519   1.691   4.824
  114    HB3  LEU  32           HB2      LEU  32 -31.502   3.148   4.596
  115    HG   LEU  32           HG       LEU  32 -32.587   0.331   4.629
  116   HD11  LEU  32          HD11      LEU  32 -33.154   2.287   6.784
  117   HD12  LEU  32          HD12      LEU  32 -31.581   1.491   6.791
  118   HD13  LEU  32          HD13      LEU  32 -33.056   0.526   6.844
  119   HD21  LEU  32          HD21      LEU  32 -33.679   2.705   3.631
  120   HD22  LEU  32          HD22      LEU  32 -34.453   2.447   5.195
  121   HD23  LEU  32          HD23      LEU  32 -34.522   1.191   3.958
  122    H    HIS  33           H        HIS  33 -30.446   2.879   0.592
  123    HA   HIS  33           HA       HIS  33 -27.657   3.222   1.478
  124    HB2  HIS  33           HB1      HIS  33 -28.865   2.388  -1.135
  125    HB3  HIS  33           HB2      HIS  33 -27.303   3.211  -1.133
  126    HD1  HIS  33           HD1      HIS  33 -26.890   0.600  -2.185
  127    HD2  HIS  33           HD2      HIS  33 -27.181   1.123   1.925
  128    HE1  HIS  33           HE1      HIS  33 -25.798  -1.426  -1.171
  129    HE2  HIS  33           HE2      HIS  33 -25.976  -1.107   1.341
  130    H    GLY  34           H        GLY  34 -26.636   5.153   1.164
  131    HA2  GLY  34           HA2      GLY  34 -27.113   7.186  -0.558
  132    HA3  GLY  34           HA3      GLY  34 -28.337   7.438   0.679
  133    HA1  GLY  34           HA1      GLY  34 -26.497   6.732  -0.119
  134    H    ALA  35           H        ALA  35 -24.841   6.778   0.432
  135    HA   ALA  35           HA       ALA  35 -24.381   8.315   2.865
  136    HB1  ALA  35           HB1      ALA  35 -21.908   7.593   2.058
  137    HB2  ALA  35           HB2      ALA  35 -22.957   6.584   3.055
  138    HB3  ALA  35           HB3      ALA  35 -22.876   6.320   1.313
  139    H    ARG  36           H        ARG  36 -22.449   9.826   2.839
  140    HA   ARG  36           HA       ARG  36 -21.652  11.097   0.442
  141    HB2  ARG  36           HB1      ARG  36 -22.788  13.284   0.825
  142    HB3  ARG  36           HB2      ARG  36 -23.884  11.977   0.353
  143    HG2  ARG  36           HG1      ARG  36 -23.838  11.899   3.144
  144    HG3  ARG  36           HG2      ARG  36 -23.906  13.616   2.717
  145    HD2  ARG  36           HD1      ARG  36 -25.721  12.516   0.970
  146    HD3  ARG  36           HD2      ARG  36 -25.929  11.524   2.419
  147    HE   ARG  36           HE       ARG  36 -26.970  13.294   3.401
  148   HH11  ARG  36          HH11      ARG  36 -24.957  14.492   0.826
  149   HH12  ARG  36          HH12      ARG  36 -25.487  16.132   0.999
  150   HH21  ARG  36          HH21      ARG  36 -27.676  15.450   3.639
  151   HH22  ARG  36          HH22      ARG  36 -27.033  16.676   2.600
  152    H    LYS  37           H        LYS  37 -19.928  10.303   2.109
  153    HA   LYS  37           HA       LYS  37 -19.378  11.899   4.377
  154    HB2  LYS  37           HB1      LYS  37 -17.798   9.953   2.727
  155    HB3  LYS  37           HB2      LYS  37 -16.988  10.921   3.968
  156    HG2  LYS  37           HG1      LYS  37 -18.648  10.046   5.629
  157    HG3  LYS  37           HG2      LYS  37 -19.220   8.945   4.363
  158    HD2  LYS  37           HD1      LYS  37 -16.851   8.108   4.149
  159    HD3  LYS  37           HD2      LYS  37 -16.473   9.053   5.600
  160    HE2  LYS  37           HE1      LYS  37 -18.615   7.738   6.526
  161    HE3  LYS  37           HE2      LYS  37 -18.071   6.571   5.310
  162    HZ1  LYS  37           HZ1      LYS  37 -16.195   6.100   6.458
  163    HZ2  LYS  37           HZ2      LYS  37 -17.144   6.581   7.773
  164    HZ3  LYS  37           HZ3      LYS  37 -16.033   7.660   7.091
  165    H    GLY  38           H        GLY  38 -17.696  11.792   1.225
  166    HA2  GLY  38           HA2      GLY  38 -17.182  13.755  -0.035
  167    HA3  GLY  38           HA3      GLY  38 -17.270  14.691   1.451
  168    HA1  GLY  38           HA1      GLY  38 -16.807  13.005   0.240
  169    H    SER  39           H        SER  39 -15.484  11.715   0.681
  170    HA   SER  39           HA       SER  39 -12.955  13.018   0.537
  171    HB2  SER  39           HB1      SER  39 -13.071  13.289   2.890
  172    HB3  SER  39           HB2      SER  39 -13.738  11.661   3.115
  173    HG   SER  39           HG       SER  39 -11.746  11.078   3.403
  174    H    GLN  40           H        GLN  40 -12.210  11.827  -1.098
  175    HA   GLN  40           HA       GLN  40 -12.868   9.184  -1.675
  176    HB2  GLN  40           HB1      GLN  40 -11.151  11.199  -2.738
  177    HB3  GLN  40           HB2      GLN  40 -10.235   9.686  -2.637
  178    HG2  GLN  40           HG1      GLN  40 -12.899   9.265  -3.709
  179    HG3  GLN  40           HG2      GLN  40 -11.969  10.437  -4.653
  180   HE21  GLN  40          HE21      GLN  40 -12.088   7.153  -3.490
  181   HE22  GLN  40          HE22      GLN  40 -10.934   6.507  -4.602
  182    H    CYS  41           H        CYS  41  -9.994  10.469  -0.019
  183    HA   CYS  41           HA       CYS  41  -9.780   8.087   1.579
  184    HB2  CYS  41           HB1      CYS  41  -7.431   7.596   0.873
  185    HB3  CYS  41           HB2      CYS  41  -8.645   7.232  -0.355
  186    H    LEU  42           H        LEU  42  -8.355   8.324   3.344
  187    HA   LEU  42           HA       LEU  42  -7.585  11.114   3.849
  188    HB2  LEU  42           HB1      LEU  42  -8.904   9.106   5.410
  189    HB3  LEU  42           HB2      LEU  42  -7.390   9.571   6.208
  190    HG   LEU  42           HG       LEU  42  -8.674  11.967   5.447
  191   HD11  LEU  42          HD11      LEU  42 -10.842  11.850   6.290
  192   HD12  LEU  42          HD12      LEU  42 -10.557  10.296   7.075
  193   HD13  LEU  42          HD13      LEU  42 -10.690  10.386   5.318
  194   HD21  LEU  42          HD21      LEU  42  -7.215  11.726   7.353
  195   HD22  LEU  42          HD22      LEU  42  -8.338  10.599   8.113
  196   HD23  LEU  42          HD23      LEU  42  -8.797  12.288   7.894
  197    H    SER  43           H        SER  43  -6.386   7.855   3.650
  198    HA   SER  43           HA       SER  43  -3.666   8.830   3.641
  199    HB2  SER  43           HB1      SER  43  -4.532   6.784   5.707
  200    HB3  SER  43           HB2      SER  43  -2.875   7.340   5.418
  201    HG   SER  43           HG       SER  43  -5.032   8.721   6.574
  202    H    ASP  44           H        ASP  44  -2.116   6.909   3.319
  203    HA   ASP  44           HA       ASP  44  -2.791   5.574   0.976
  204    HB2  ASP  44           HB1      ASP  44  -0.750   4.333   1.227
  205    HB3  ASP  44           HB2      ASP  44  -0.470   5.971   1.832
  206    HD2  ASP  44           HD       ASP  44  -0.272   4.809   5.156
  207    H    THR  45           H        THR  45  -3.376   4.718   4.284
  208    HA   THR  45           HA       THR  45  -3.796   1.942   3.938
  209    HB   THR  45           HB       THR  45  -5.307   2.319   6.052
  210    HG1  THR  45           HG1      THR  45  -5.029   4.264   7.036
  211   HG21  THR  45          HG21      THR  45  -3.133   2.643   7.413
  212   HG22  THR  45          HG22      THR  45  -2.328   2.605   5.844
  213   HG23  THR  45          HG23      THR  45  -3.277   1.220   6.383
  214    H    ASP  46           H        ASP  46  -5.745   4.725   3.276
  215    HA   ASP  46           HA       ASP  46  -8.277   3.432   3.263
  216    HB2  ASP  46           HB1      ASP  46  -7.450   6.031   3.134
  217    HB3  ASP  46           HB2      ASP  46  -7.933   5.737   1.459
  218    HD2  ASP  46           HD       ASP  46 -11.287   5.581   2.281
  219    H    CYS  47           H        CYS  47  -5.697   3.738   0.952
  220    HA   CYS  47           HA       CYS  47  -7.320   2.812  -1.265
  221    HB2  CYS  47           HB1      CYS  47  -5.151   4.409  -1.180
  222    HB3  CYS  47           HB2      CYS  47  -4.360   2.860  -1.485
  223    H    ASN  48           H        ASN  48  -7.851   0.737  -1.382
  224    HA   ASN  48           HA       ASN  48  -6.713  -1.354   0.044
  225    HB2  ASN  48           HB1      ASN  48  -8.310  -1.316  -2.521
  226    HB3  ASN  48           HB2      ASN  48  -7.812  -2.822  -1.739
  227   HD21  ASN  48          HD21      ASN  48  -9.870  -0.047  -1.542
  228   HD22  ASN  48          HD22      ASN  48 -10.861  -0.615  -0.245
  229    H    THR  49           H        THR  49  -6.235  -0.579  -3.404
  230    HA   THR  49           HA       THR  49  -4.329  -2.517  -3.972
  231    HB   THR  49           HB       THR  49  -3.559  -0.314  -5.504
  232    HG1  THR  49           HG1      THR  49  -5.296   0.913  -4.779
  233   HG21  THR  49          HG21      THR  49  -4.901  -1.424  -7.274
  234   HG22  THR  49          HG22      THR  49  -5.617  -2.460  -6.040
  235   HG23  THR  49          HG23      THR  49  -3.886  -2.547  -6.372
  236    H    ARG  50           H        ARG  50  -1.997  -1.826  -4.698
  237    HA   ARG  50           HA       ARG  50  -0.653  -0.969  -2.287
  238    HB2  ARG  50           HB1      ARG  50   1.420  -1.537  -3.533
  239    HB3  ARG  50           HB2      ARG  50   0.255  -2.868  -3.464
  240    HG2  ARG  50           HG1      ARG  50  -0.140  -1.229  -5.824
  241    HG3  ARG  50           HG2      ARG  50   1.505  -1.878  -5.726
  242    HD2  ARG  50           HD1      ARG  50   0.458  -4.143  -5.261
  243    HD3  ARG  50           HD2      ARG  50  -1.087  -3.406  -5.706
  244    HE   ARG  50           HE       ARG  50   0.537  -2.833  -7.812
  245   HH11  ARG  50          HH11      ARG  50  -0.374  -5.757  -6.159
  246   HH12  ARG  50          HH12      ARG  50  -0.220  -6.756  -7.566
  247   HH21  ARG  50          HH21      ARG  50   0.744  -4.137  -9.673
  248   HH22  ARG  50          HH22      ARG  50   0.416  -5.833  -9.564
  249    H    LYS  51           H        LYS  51  -1.948   1.192  -2.930
  250    HA   LYS  51           HA       LYS  51   0.101   2.969  -4.055
  251    HB2  LYS  51           HB1      LYS  51  -2.865   3.148  -4.642
  252    HB3  LYS  51           HB2      LYS  51  -1.624   4.282  -5.199
  253    HG2  LYS  51           HG1      LYS  51  -0.862   2.892  -6.823
  254    HG3  LYS  51           HG2      LYS  51  -1.245   1.432  -5.895
  255    HD2  LYS  51           HD1      LYS  51  -2.900   1.247  -7.439
  256    HD3  LYS  51           HD2      LYS  51  -3.733   2.330  -6.311
  257    HE2  LYS  51           HE1      LYS  51  -3.480   4.181  -7.662
  258    HE3  LYS  51           HE2      LYS  51  -2.025   3.532  -8.435
  259    HZ1  LYS  51           HZ1      LYS  51  -3.960   3.562  -9.920
  260    HZ2  LYS  51           HZ2      LYS  51  -4.774   2.501  -8.885
  261    HZ3  LYS  51           HZ3      LYS  51  -3.369   1.995  -9.680
  262    H    PHE  52           H        PHE  52  -0.186   5.241  -3.405
  263    HA   PHE  52           HA       PHE  52  -1.253   5.383  -0.674
  264    HB2  PHE  52           HB1      PHE  52   0.286   7.146  -0.245
  265    HB3  PHE  52           HB2      PHE  52   1.183   5.897  -1.111
  266    HD1  PHE  52           HD1      PHE  52   1.815   6.198  -3.464
  267    HD2  PHE  52           HD2      PHE  52  -0.065   9.299  -1.235
  268    HE1  PHE  52           HE1      PHE  52   2.516   7.837  -5.159
  269    HE2  PHE  52           HE2      PHE  52   0.632  10.942  -2.927
  270    HZ   PHE  52           HZ       PHE  52   1.925  10.213  -4.893
  271    H    CYS  53           H        CYS  53  -2.244   7.429   0.008
  272    HA   CYS  53           HA       CYS  53  -4.194   8.290  -1.933
  273    HB2  CYS  53           HB1      CYS  53  -4.808   7.856   0.420
  274    HB3  CYS  53           HB2      CYS  53  -3.766   9.187   0.925
  275    H    LEU  54           H        LEU  54  -3.710   9.802  -3.376
  276    HA   LEU  54           HA       LEU  54  -1.834  11.936  -2.640
  277    HB2  LEU  54           HB1      LEU  54  -1.305  10.601  -4.642
  278    HB3  LEU  54           HB2      LEU  54  -2.846  11.105  -5.356
  279    HG   LEU  54           HG       LEU  54  -1.783  13.519  -4.928
  280   HD11  LEU  54          HD11      LEU  54   0.633  13.371  -5.593
  281   HD12  LEU  54          HD12      LEU  54   0.555  11.649  -5.226
  282   HD13  LEU  54          HD13      LEU  54   0.268  12.835  -3.952
  283   HD21  LEU  54          HD21      LEU  54  -1.588  13.646  -7.194
  284   HD22  LEU  54          HD22      LEU  54  -2.498  12.138  -7.075
  285   HD23  LEU  54          HD23      LEU  54  -0.751  12.099  -7.321
  286    H    GLN  55           H        GLN  55  -2.565  13.911  -2.236
  287    HA   GLN  55           HA       GLN  55  -5.190  14.689  -3.320
  288    HB2  GLN  55           HB1      GLN  55  -5.435  16.086  -1.215
  289    HB3  GLN  55           HB2      GLN  55  -5.577  14.331  -1.013
  290    HG2  GLN  55           HG1      GLN  55  -3.706  14.169   0.236
  291    HG3  GLN  55           HG2      GLN  55  -2.876  15.451  -0.657
  292   HE21  GLN  55          HE21      GLN  55  -2.251  15.963   1.618
  293   HE22  GLN  55          HE22      GLN  55  -3.277  17.038   2.500
  294    HA   PRO  56           HA       PRO  56  -2.145  17.750  -4.849
  295    HB2  PRO  56           HB1      PRO  56  -3.478  18.220  -7.195
  296    HB3  PRO  56           HB2      PRO  56  -2.362  16.876  -6.963
  297    HG2  PRO  56           HG1      PRO  56  -5.355  16.916  -6.773
  298    HG3  PRO  56           HG2      PRO  56  -4.280  15.723  -7.593
  299    HD2  PRO  56           HD1      PRO  56  -5.404  15.258  -5.167
  300    HD3  PRO  56           HD2      PRO  56  -3.802  14.645  -5.612
  301    H    ARG  57           H        ARG  57  -2.307  19.999  -5.039
  302    HA   ARG  57           HA       ARG  57  -4.613  21.151  -3.733
  303    HB2  ARG  57           HB1      ARG  57  -2.100  22.467  -4.794
  304    HB3  ARG  57           HB2      ARG  57  -3.317  23.236  -3.767
  305    HG2  ARG  57           HG1      ARG  57  -2.737  21.957  -1.893
  306    HG3  ARG  57           HG2      ARG  57  -1.851  20.779  -2.876
  307    HD2  ARG  57           HD1      ARG  57  -0.012  22.158  -3.138
  308    HD3  ARG  57           HD2      ARG  57  -0.961  23.627  -2.866
  309    HE   ARG  57           HE       ARG  57  -0.609  23.408  -0.609
  310   HH11  ARG  57          HH11      ARG  57   0.280  20.450  -2.215
  311   HH12  ARG  57          HH12      ARG  57   1.011  19.753  -0.807
  312   HH21  ARG  57          HH21      ARG  57   0.349  22.501   1.251
  313   HH22  ARG  57          HH22      ARG  57   1.048  20.920   1.164
  314    H    ASP  58           H        ASP  58  -3.347  20.869  -6.944
  315    HA   ASP  58           HA       ASP  58  -5.116  22.935  -7.990
  316    HB2  ASP  58           HB1      ASP  58  -2.703  21.583  -8.892
  317    HB3  ASP  58           HB2      ASP  58  -3.947  21.611 -10.148
  318    HD2  ASP  58           HD       ASP  58  -2.723  25.177  -8.886
  319    H    GLU  59           H        GLU  59  -4.995  19.513  -7.594
  320    HA   GLU  59           HA       GLU  59  -7.446  19.253  -9.209
  321    HB2  GLU  59           HB1      GLU  59  -4.973  17.806  -9.367
  322    HB3  GLU  59           HB2      GLU  59  -6.268  16.700  -8.881
  323    HG2  GLU  59           HG1      GLU  59  -7.513  17.986 -10.887
  324    HG3  GLU  59           HG2      GLU  59  -5.835  18.102 -11.435
  325    HE2  GLU  59           HE       GLU  59  -7.305  14.421 -11.081
  326    H    LYS  60           H        LYS  60  -8.480  16.958  -8.502
  327    HA   LYS  60           HA       LYS  60  -9.183  17.354  -5.710
  328    HB2  LYS  60           HB1      LYS  60 -10.424  16.150  -8.072
  329    HB3  LYS  60           HB2      LYS  60 -10.639  15.184  -6.603
  330    HG2  LYS  60           HG1      LYS  60 -11.245  17.651  -5.660
  331    HG3  LYS  60           HG2      LYS  60 -11.794  17.780  -7.341
  332    HD2  LYS  60           HD1      LYS  60 -12.733  15.302  -6.608
  333    HD3  LYS  60           HD2      LYS  60 -12.910  16.245  -5.117
  334    HE2  LYS  60           HE1      LYS  60 -14.945  16.549  -6.265
  335    HE3  LYS  60           HE2      LYS  60 -14.017  18.028  -6.556
  336    HZ1  LYS  60           HZ1      LYS  60 -13.259  16.853  -8.680
  337    HZ2  LYS  60           HZ2      LYS  60 -14.836  17.463  -8.635
  338    HZ3  LYS  60           HZ3      LYS  60 -14.563  15.807  -8.422
  339    HA   PRO  61           HA       PRO  61  -6.945  13.994  -3.994
  340    HB2  PRO  61           HB1      PRO  61  -8.725  12.952  -2.193
  341    HB3  PRO  61           HB2      PRO  61  -7.912  14.501  -1.973
  342    HG2  PRO  61           HG1      PRO  61 -10.657  13.927  -3.039
  343    HG3  PRO  61           HG2      PRO  61 -10.136  15.171  -1.843
  344    HD2  PRO  61           HD1      PRO  61 -10.635  15.760  -4.446
  345    HD3  PRO  61           HD2      PRO  61  -9.390  16.591  -3.498
  346    H    PHE  62           H        PHE  62  -6.477  11.929  -4.499
  347    HA   PHE  62           HA       PHE  62  -8.416   9.907  -4.935
  348    HB2  PHE  62           HB1      PHE  62  -8.275   9.574  -7.287
  349    HB3  PHE  62           HB2      PHE  62  -8.638  11.284  -7.045
  350    HD1  PHE  62           HD1      PHE  62  -6.430  12.798  -6.785
  351    HD2  PHE  62           HD2      PHE  62  -6.686   9.102  -8.880
  352    HE1  PHE  62           HE1      PHE  62  -4.474  13.432  -8.135
  353    HE2  PHE  62           HE2      PHE  62  -4.729   9.729 -10.233
  354    HZ   PHE  62           HZ       PHE  62  -3.620  11.896  -9.861
  355    H    CYS  63           H        CYS  63  -7.306   7.931  -6.042
  356    HA   CYS  63           HA       CYS  63  -4.809   7.527  -4.627
  357    HB2  CYS  63           HB1      CYS  63  -6.775   5.759  -6.041
  358    HB3  CYS  63           HB2      CYS  63  -5.144   5.161  -5.729
  359    H    ALA  64           H        ALA  64  -2.843   7.557  -5.506
  360    HA   ALA  64           HA       ALA  64  -2.612   7.409  -8.440
  361    HB1  ALA  64           HB1      ALA  64  -0.514   9.017  -7.332
  362    HB2  ALA  64           HB2      ALA  64  -1.716   9.436  -8.554
  363    HB3  ALA  64           HB3      ALA  64  -2.083   9.658  -6.844
  364    H    THR  65           H        THR  65  -0.820   6.353  -9.256
  365    HA   THR  65           HA       THR  65   0.231   4.226  -7.816
  366    HB   THR  65           HB       THR  65   2.079   5.114  -9.875
  367    HG1  THR  65           HG1      THR  65   0.681   5.352 -11.536
  368   HG21  THR  65          HG21      THR  65   1.296   2.751  -8.876
  369   HG22  THR  65          HG22      THR  65   1.997   2.926 -10.485
  370   HG23  THR  65          HG23      THR  65   0.247   2.825 -10.290
  371    H    CYS  66           H        CYS  66   2.093   3.865  -6.680
  372    HA   CYS  66           HA       CYS  66   3.238   5.974  -5.248
  373    HB2  CYS  66           HB1      CYS  66   4.964   4.299  -4.564
  374    HB3  CYS  66           HB2      CYS  66   3.301   3.754  -4.341
  375    H    ARG  67           H        ARG  67   5.753   6.208  -5.169
  376    HA   ARG  67           HA       ARG  67   6.535   7.189  -7.782
  377    HB2  ARG  67           HB1      ARG  67   7.806   7.385  -5.046
  378    HB3  ARG  67           HB2      ARG  67   8.534   8.061  -6.510
  379    HG2  ARG  67           HG1      ARG  67   5.848   8.829  -5.364
  380    HG3  ARG  67           HG2      ARG  67   7.347   9.766  -5.241
  381    HD2  ARG  67           HD1      ARG  67   6.930   9.135  -7.990
  382    HD3  ARG  67           HD2      ARG  67   5.419   9.774  -7.328
  383    HE   ARG  67           HE       ARG  67   7.864  11.220  -7.763
  384   HH11  ARG  67          HH11      ARG  67   4.899  11.094  -5.943
  385   HH12  ARG  67          HH12      ARG  67   4.881  12.793  -5.605
  386   HH21  ARG  67          HH21      ARG  67   7.852  13.458  -7.325
  387   HH22  ARG  67          HH22      ARG  67   6.560  14.137  -6.394
  388    H    GLY  68           H        GLY  68   7.841   6.167  -9.156
  389    HA2  GLY  68           HA2      GLY  68   8.802   3.550  -8.613
  390    HA3  GLY  68           HA3      GLY  68   9.164   4.508 -10.041
  391    HA1  GLY  68           HA1      GLY  68   8.957   4.123  -7.961
  392    H    LEU  69           H        LEU  69  11.197   3.085  -9.367
  393    HA   LEU  69           HA       LEU  69  12.868   4.004  -7.299
  394    HB2  LEU  69           HB1      LEU  69  13.139   2.291  -9.689
  395    HB3  LEU  69           HB2      LEU  69  14.635   3.039  -9.104
  396    HG   LEU  69           HG       LEU  69  12.812   1.251  -7.495
  397   HD11  LEU  69          HD11      LEU  69  13.991  -0.479  -8.224
  398   HD12  LEU  69          HD12      LEU  69  15.513   0.334  -7.861
  399   HD13  LEU  69          HD13      LEU  69  14.726   0.591  -9.418
  400   HD21  LEU  69          HD21      LEU  69  14.738   1.304  -5.885
  401   HD22  LEU  69          HD22      LEU  69  13.827   2.809  -6.013
  402   HD23  LEU  69          HD23      LEU  69  15.389   2.652  -6.817
  403    H    ARG  70           H        ARG  70  12.238   5.202 -10.489
  404    HA   ARG  70           HA       ARG  70  14.520   7.032 -10.349
  405    HB2  ARG  70           HB1      ARG  70  12.545   6.587 -12.602
  406    HB3  ARG  70           HB2      ARG  70  14.025   7.555 -12.678
  407    HG2  ARG  70           HG1      ARG  70  15.028   5.168 -11.865
  408    HG3  ARG  70           HG2      ARG  70  13.662   4.653 -12.870
  409    HD2  ARG  70           HD1      ARG  70  15.381   6.803 -13.978
  410    HD3  ARG  70           HD2      ARG  70  16.094   5.187 -13.862
  411    HE   ARG  70           HE       ARG  70  13.577   4.918 -15.030
  412   HH11  ARG  70          HH11      ARG  70  16.666   6.359 -15.743
  413   HH12  ARG  70          HH12      ARG  70  16.495   6.190 -17.459
  414   HH21  ARG  70          HH21      ARG  70  13.341   4.690 -17.288
  415   HH22  ARG  70          HH22      ARG  70  14.604   5.241 -18.337
  416    H    ARG  71           H        ARG  71  11.733   7.073  -8.930
  417    HA   ARG  71           HA       ARG  71  10.993   9.816  -9.692
  418    HB2  ARG  71           HB1      ARG  71   9.438   7.642  -8.276
  419    HB3  ARG  71           HB2      ARG  71   8.874   9.314  -8.415
  420    HG2  ARG  71           HG1      ARG  71   9.451   7.453 -10.723
  421    HG3  ARG  71           HG2      ARG  71   7.850   7.886 -10.101
  422    HD2  ARG  71           HD1      ARG  71   8.630  10.341 -10.533
  423    HD3  ARG  71           HD2      ARG  71   9.815   9.571 -11.597
  424    HE   ARG  71           HE       ARG  71   7.355   8.506 -12.275
  425   HH11  ARG  71          HH11      ARG  71   8.872  11.639 -12.236
  426   HH12  ARG  71          HH12      ARG  71   7.946  12.248 -13.567
  427   HH21  ARG  71          HH21      ARG  71   6.127   9.297 -14.028
  428   HH22  ARG  71          HH22      ARG  71   6.385  10.916 -14.585
  429    H    ARG  72           H        ARG  72  10.853  11.429  -8.157
  430    HA   ARG  72           HA       ARG  72  12.561  11.142  -5.881
  431    HB2  ARG  72           HB1      ARG  72  10.779  13.413  -6.792
  432    HB3  ARG  72           HB2      ARG  72  11.896  13.510  -5.421
  433    HG2  ARG  72           HG1      ARG  72  13.139  12.581  -7.910
  434    HG3  ARG  72           HG2      ARG  72  12.489  14.228  -7.976
  435    HD2  ARG  72           HD1      ARG  72  13.712  14.546  -5.701
  436    HD3  ARG  72           HD2      ARG  72  14.620  13.111  -6.197
  437    HE   ARG  72           HE       ARG  72  15.768  14.405  -7.685
  438   HH11  ARG  72          HH11      ARG  72  12.836  16.057  -6.793
  439   HH12  ARG  72          HH12      ARG  72  13.242  17.510  -7.645
  440   HH21  ARG  72          HH21      ARG  72  16.314  16.312  -8.809
  441   HH22  ARG  72          HH22      ARG  72  15.220  17.654  -8.792
  442    H    CYS  73           H        CYS  73  11.905  11.766  -3.675
  443    HA   CYS  73           HA       CYS  73   9.115  11.455  -2.977
  444    HB2  CYS  73           HB1      CYS  73   9.414   9.537  -1.529
  445    HB3  CYS  73           HB2      CYS  73   9.899   9.116  -3.172
  446    H    GLN  74           H        GLN  74   8.682  11.940  -0.744
  447    HA   GLN  74           HA       GLN  74  10.867  13.450   0.531
  448    HB2  GLN  74           HB1      GLN  74   7.945  14.022   0.220
  449    HB3  GLN  74           HB2      GLN  74   8.797  14.640   1.645
  450    HG2  GLN  74           HG1      GLN  74   9.961  15.125  -1.061
  451    HG3  GLN  74           HG2      GLN  74   8.577  16.085  -0.522
  452   HE21  GLN  74          HE21      GLN  74   8.930  16.707   1.961
  453   HE22  GLN  74          HE22      GLN  74  10.432  17.509   2.252
  454    H    ARG  75           H        ARG  75   8.350  11.093   0.935
  455    HA   ARG  75           HA       ARG  75   9.149  10.758   3.752
  456    HB2  ARG  75           HB1      ARG  75   6.583  11.175   2.661
  457    HB3  ARG  75           HB2      ARG  75   6.645   9.473   3.144
  458    HG2  ARG  75           HG1      ARG  75   7.489  10.253   5.395
  459    HG3  ARG  75           HG2      ARG  75   7.067  11.892   4.872
  460    HD2  ARG  75           HD1      ARG  75   5.010   9.738   4.619
  461    HD3  ARG  75           HD2      ARG  75   5.360  10.404   6.221
  462    HE   ARG  75           HE       ARG  75   4.930  12.484   4.340
  463   HH11  ARG  75          HH11      ARG  75   3.264  10.080   6.229
  464   HH12  ARG  75          HH12      ARG  75   1.784  10.978   6.305
  465   HH21  ARG  75          HH21      ARG  75   2.988  13.677   4.434
  466   HH22  ARG  75          HH22      ARG  75   1.628  13.024   5.284
  467    H    ASP  76           H        ASP  76   8.661   8.438   4.524
  468    HA   ASP  76           HA       ASP  76  10.148   6.661   2.812
  469    HB2  ASP  76           HB1      ASP  76   8.810   5.775   5.349
  470    HB3  ASP  76           HB2      ASP  76  10.358   5.265   4.664
  471    HD2  ASP  76           HD       ASP  76  12.046   7.956   6.090
  472    H    ALA  77           H        ALA  77   6.940   6.489   4.366
  473    HA   ALA  77           HA       ALA  77   6.104   4.211   2.900
  474    HB1  ALA  77           HB1      ALA  77   3.827   4.830   3.736
  475    HB2  ALA  77           HB2      ALA  77   5.057   4.671   4.991
  476    HB3  ALA  77           HB3      ALA  77   4.550   6.272   4.452
  477    H    MET  78           H        MET  78   6.122   7.603   2.213
  478    HA   MET  78           HA       MET  78   4.071   7.778   0.328
  479    HB2  MET  78           HB1      MET  78   6.482   9.331   1.023
  480    HB3  MET  78           HB2      MET  78   5.911   9.538  -0.641
  481    HG2  MET  78           HG1      MET  78   3.854   9.702   1.483
  482    HG3  MET  78           HG2      MET  78   5.036  11.011   1.409
  483    HE1  MET  78           HE1      MET  78   5.512  12.449  -0.679
  484    HE2  MET  78           HE2      MET  78   5.625  11.119  -1.831
  485    HE3  MET  78           HE3      MET  78   4.538  12.471  -2.150
  486    H    CYS  79           H        CYS  79   7.164   6.275   0.147
  487    HA   CYS  79           HA       CYS  79   7.272   6.238  -2.739
  488    HB2  CYS  79           HB1      CYS  79   9.066   5.687  -0.566
  489    HB3  CYS  79           HB2      CYS  79   9.028   4.295  -1.651
  490    H    CYS  80           H        CYS  80   7.953   3.810  -3.525
  491    HA   CYS  80           HA       CYS  80   5.487   2.377  -3.486
  492    HB2  CYS  80           HB1      CYS  80   8.188   1.907  -4.723
  493    HB3  CYS  80           HB2      CYS  80   6.957   0.645  -4.761
  494    HA   PRO  81           HA       PRO  81   6.083  -0.498  -0.226
  495    HB2  PRO  81           HB1      PRO  81   4.966  -2.775  -1.260
  496    HB3  PRO  81           HB2      PRO  81   4.025  -1.371  -0.759
  497    HG2  PRO  81           HG1      PRO  81   4.963  -2.152  -3.497
  498    HG3  PRO  81           HG2      PRO  81   3.342  -1.566  -2.973
  499    HD2  PRO  81           HD1      PRO  81   5.154   0.040  -4.199
  500    HD3  PRO  81           HD2      PRO  81   4.033   0.633  -2.962
  501    H    GLY  82           H        GLY  82   8.022  -1.252   0.351
  502    HA2  GLY  82           HA2      GLY  82   9.526  -3.138   0.367
  503    HA3  GLY  82           HA3      GLY  82   9.285  -3.285  -1.368
  504    HA1  GLY  82           HA1      GLY  82   9.506  -2.264   0.483
  505    H    THR  83           H        THR  83   9.521  -0.082  -0.889
  506    HA   THR  83           HA       THR  83  12.444  -0.101  -1.273
  507    HB   THR  83           HB       THR  83  11.739   2.262  -2.370
  508    HG1  THR  83           HG1      THR  83   9.694   2.278  -2.886
  509   HG21  THR  83          HG21      THR  83  11.986   1.194  -4.538
  510   HG22  THR  83          HG22      THR  83  11.657  -0.385  -3.824
  511   HG23  THR  83          HG23      THR  83  13.125   0.491  -3.391
  512    H    LEU  84           H        LEU  84  13.377   2.192  -0.845
  513    HA   LEU  84           HA       LEU  84  12.126   3.362   1.543
  514    HB2  LEU  84           HB1      LEU  84  14.549   1.860   1.437
  515    HB3  LEU  84           HB2      LEU  84  14.946   3.548   1.799
  516    HG   LEU  84           HG       LEU  84  12.767   2.343   3.396
  517   HD11  LEU  84          HD11      LEU  84  15.334   1.062   3.140
  518   HD12  LEU  84          HD12      LEU  84  13.914   0.563   4.058
  519   HD13  LEU  84          HD13      LEU  84  15.088   1.662   4.781
  520   HD21  LEU  84          HD21      LEU  84  15.148   3.823   4.425
  521   HD22  LEU  84          HD22      LEU  84  13.486   3.816   5.016
  522   HD23  LEU  84          HD23      LEU  84  13.894   4.691   3.538
  523    H    CYS  85           H        CYS  85  12.578   5.560   1.914
  524    HA   CYS  85           HA       CYS  85  13.180   7.040  -0.501
  525    HB2  CYS  85           HB1      CYS  85  11.310   7.510   1.259
  526    HB3  CYS  85           HB2      CYS  85  12.602   8.308   2.158
  527    H    VAL  86           H        VAL  86  15.296   7.197  -0.956
  528    HA   VAL  86           HA       VAL  86  17.070   8.206   1.170
  529    HB   VAL  86           HB       VAL  86  17.815   6.316  -1.066
  530   HG11  VAL  86          HG11      VAL  86  19.607   7.897  -0.572
  531   HG12  VAL  86          HG12      VAL  86  19.511   7.484   1.140
  532   HG13  VAL  86          HG13      VAL  86  20.031   6.273  -0.033
  533   HG21  VAL  86          HG21      VAL  86  18.489   5.122   1.306
  534   HG22  VAL  86          HG22      VAL  86  16.966   5.918   1.700
  535   HG23  VAL  86          HG23      VAL  86  17.041   4.774   0.361
  536    H    ASN  87           H        ASN  87  18.319   9.938   0.694
  537    HA   ASN  87           HA       ASN  87  19.050  11.797  -0.393
  538    HB2  ASN  87           HB1      ASN  87  20.019   9.764  -1.802
  539    HB3  ASN  87           HB2      ASN  87  18.930  10.412  -3.036
  540   HD21  ASN  87          HD21      ASN  87  21.622  10.368  -3.459
  541   HD22  ASN  87          HD22      ASN  87  22.243  11.981  -3.454
  542    H    ASP  88           H        ASP  88  16.202  11.389  -0.098
  543    HA   ASP  88           HA       ASP  88  14.260  12.423  -0.679
  544    HB2  ASP  88           HB1      ASP  88  15.958  14.363  -0.948
  545    HB3  ASP  88           HB2      ASP  88  15.766  14.083  -2.684
  546    HD2  ASP  88           HD       ASP  88  12.418  15.199  -0.868
  547    H    VAL  89           H        VAL  89  15.412  10.124  -2.220
  548    HA   VAL  89           HA       VAL  89  13.472  10.207  -4.391
  549    HB   VAL  89           HB       VAL  89  15.578  10.985  -5.421
  550   HG11  VAL  89          HG11      VAL  89  17.223   9.932  -4.055
  551   HG12  VAL  89          HG12      VAL  89  16.617   8.326  -4.461
  552   HG13  VAL  89          HG13      VAL  89  17.417   9.305  -5.691
  553   HG21  VAL  89          HG21      VAL  89  13.927   9.711  -6.724
  554   HG22  VAL  89          HG22      VAL  89  15.572   9.437  -7.294
  555   HG23  VAL  89          HG23      VAL  89  14.767   8.217  -6.309
  556    H    CYS  90           H        CYS  90  12.793   8.162  -5.098
  557    HA   CYS  90           HA       CYS  90  12.797   6.133  -3.148
  558    HB2  CYS  90           HB1      CYS  90  11.376   6.695  -5.475
  559    HB3  CYS  90           HB2      CYS  90  12.199   5.175  -5.835
  560    H    THR  91           H        THR  91  14.151   4.510  -2.745
  561    HA   THR  91           HA       THR  91  15.923   3.518  -4.837
  562    HB   THR  91           HB       THR  91  16.968   4.559  -2.198
  563    HG1  THR  91           HG1      THR  91  17.322   5.408  -4.894
  564   HG21  THR  91          HG21      THR  91  18.096   2.489  -2.883
  565   HG22  THR  91          HG22      THR  91  19.171   3.882  -3.014
  566   HG23  THR  91          HG23      THR  91  18.432   3.198  -4.462
  567    H    THR  92           H        THR  92  16.583   1.405  -4.545
  568    HA   THR  92           HA       THR  92  14.951  -0.330  -3.150
  569    HB   THR  92           HB       THR  92  16.738  -2.040  -3.453
  570    HG1  THR  92           HG1      THR  92  18.232   0.019  -4.718
  571   HG21  THR  92          HG21      THR  92  15.152  -0.925  -5.329
  572   HG22  THR  92          HG22      THR  92  16.244  -2.272  -5.652
  573   HG23  THR  92          HG23      THR  92  16.734  -0.624  -6.045
  574    H    MET  93           H        MET  93  15.260  -1.613  -1.273
  575    HA   MET  93           HA       MET  93  16.321  -0.169   0.941
  576    HB2  MET  93           HB1      MET  93  14.334  -1.859   0.824
  577    HB3  MET  93           HB2      MET  93  15.594  -3.074   1.082
  578    HG2  MET  93           HG1      MET  93  15.900  -0.918   2.966
  579    HG3  MET  93           HG2      MET  93  14.258  -1.562   3.015
  580    HE1  MET  93           HE1      MET  93  14.688  -1.896   5.325
  581    HE2  MET  93           HE2      MET  93  15.135  -3.483   5.952
  582    HE3  MET  93           HE3      MET  93  16.353  -2.213   5.813
  583    H    GLU  94           H        GLU  94  17.497  -2.732  -1.104
  584    HA   GLU  94           HA       GLU  94  19.521  -3.761   0.535
  585    HB2  GLU  94           HB1      GLU  94  19.089  -3.629  -2.430
  586    HB3  GLU  94           HB2      GLU  94  20.630  -4.222  -1.793
  587    HG2  GLU  94           HG1      GLU  94  19.045  -5.736  -0.315
  588    HG3  GLU  94           HG2      GLU  94  17.929  -5.440  -1.655
  589    HE2  GLU  94           HE       GLU  94  21.189  -7.581  -2.418
  590    H    ASP  95           H        ASP  95  19.496  -1.010  -1.678
  591    HA   ASP  95           HA       ASP  95  22.286  -0.418  -1.166
  592    HB2  ASP  95           HB1      ASP  95  21.162  -0.060  -3.401
  593    HB3  ASP  95           HB2      ASP  95  20.277   1.277  -2.656
  594    HD2  ASP  95           HD       ASP  95  23.093   3.317  -2.613
  595    H    ALA  96           H        ALA  96  19.138   0.665  -0.116
  596    HA   ALA  96           HA       ALA  96  19.990   3.085   1.109
  597    HB1  ALA  96           HB1      ALA  96  17.797   2.975   2.280
  598    HB2  ALA  96           HB2      ALA  96  17.681   2.819   0.527
  599    HB3  ALA  96           HB3      ALA  96  17.539   1.390   1.551
  600    H    THR  97           H        THR  97  21.779   2.658   2.398
  601    HA   THR  97           HA       THR  97  21.169   1.684   5.042
  602    HB   THR  97           HB       THR  97  23.537   0.352   3.796
  603    HG1  THR  97           HG1      THR  97  22.334  -1.117   2.797
  604   HG21  THR  97          HG21      THR  97  21.767  -1.075   5.658
  605   HG22  THR  97          HG22      THR  97  22.513   0.380   6.319
  606   HG23  THR  97          HG23      THR  97  23.522  -0.908   5.665
  607    H    GLU  98           H        GLU  98  23.935   2.404   2.903
  608    HA   GLU  98           HA       GLU  98  24.729   4.562   4.684
  609    HB2  GLU  98           HB1      GLU  98  26.131   1.990   4.468
  610    HB3  GLU  98           HB2      GLU  98  27.172   3.402   4.218
  611    HG2  GLU  98           HG1      GLU  98  27.070   4.045   6.368
  612    HG3  GLU  98           HG2      GLU  98  25.371   3.577   6.530
  613    HE2  GLU  98           HE       GLU  98  27.722   0.424   6.851
  614    H    ASN  99           H        ASN  99  26.545   5.847   3.747
  615    HA   ASN  99           HA       ASN  99  26.669   5.641   0.818
  616    HB2  ASN  99           HB1      ASN  99  25.587   7.839   2.455
  617    HB3  ASN  99           HB2      ASN  99  26.750   8.350   1.228
  618   HD21  ASN  99          HD21      ASN  99  23.752   6.587   1.723
  619   HD22  ASN  99          HD22      ASN  99  23.131   6.829   0.130
  620    H    LEU 100           H        LEU 100  28.619   6.098  -0.087
  621    HA   LEU 100           HA       LEU 100  30.860   6.443  -0.247
  622    HB2  LEU 100           HB1      LEU 100  29.846   8.628   1.092
  623    HB3  LEU 100           HB2      LEU 100  31.154   8.077   2.151
  624    HG   LEU 100           HG       LEU 100  32.416   8.081  -0.252
  625   HD11  LEU 100          HD11      LEU 100  30.917  10.641  -0.394
  626   HD12  LEU 100          HD12      LEU 100  30.153   9.191  -1.043
  627   HD13  LEU 100          HD13      LEU 100  31.714   9.721  -1.670
  628   HD21  LEU 100          HD21      LEU 100  32.933   9.160   2.044
  629   HD22  LEU 100          HD22      LEU 100  32.220  10.611   1.337
  630   HD23  LEU 100          HD23      LEU 100  33.633   9.865   0.587
  631    H    TYR 101           H        TYR 101  32.978   6.389   1.159
  632    HA   TYR 101           HA       TYR 101  32.824   3.938   2.687
  633    HB2  TYR 101           HB1      TYR 101  34.907   5.486   1.314
  634    HB3  TYR 101           HB2      TYR 101  35.443   4.781   2.842
  635    HD1  TYR 101           HD1      TYR 101  36.567   2.791   2.599
  636    HD2  TYR 101           HD2      TYR 101  33.303   3.618  -0.003
  637    HE1  TYR 101           HE1      TYR 101  36.889   0.608   1.512
  638    HE2  TYR 101           HE2      TYR 101  33.615   1.436  -1.096
  639    HH   TYR 101           HH       TYR 101  35.645  -0.197  -1.399
  640    H    PHE 102           H        PHE 102  33.406   3.671   4.835
  641    HA   PHE 102           HA       PHE 102  33.471   6.151   6.424
  642    HB2  PHE 102           HB1      PHE 102  32.333   5.016   8.192
  643    HB3  PHE 102           HB2      PHE 102  31.446   4.683   6.704
  644    HD1  PHE 102           HD1      PHE 102  31.718   2.478   5.562
  645    HD2  PHE 102           HD2      PHE 102  33.266   3.246   9.452
  646    HE1  PHE 102           HE1      PHE 102  31.897   0.057   5.965
  647    HE2  PHE 102           HE2      PHE 102  33.449   0.827   9.861
  648    HZ   PHE 102           HZ       PHE 102  32.765  -0.771   8.116
  649    H    GLN 103           H        GLN 103  34.995   3.109   5.772
  650    HA   GLN 103           HA       GLN 103  37.060   3.748   7.774
  651    HB2  GLN 103           HB1      GLN 103  35.442   1.489   7.726
  652    HB3  GLN 103           HB2      GLN 103  36.966   0.942   7.007
  653    HG2  GLN 103           HG1      GLN 103  38.201   1.419   8.928
  654    HG3  GLN 103           HG2      GLN 103  36.936   2.467   9.582
  655   HE21  GLN 103          HE21      GLN 103  36.913   1.336  11.530
  656   HE22  GLN 103          HE22      GLN 103  36.194  -0.228  11.671
  657    H    SER 104           H        SER 104  39.134   2.369   7.197
  658    HA   SER 104           HA       SER 104  39.642   2.727   4.315
  659    HB2  SER 104           HB1      SER 104  41.805   3.007   6.394
  660    HB3  SER 104           HB2      SER 104  41.751   3.651   4.743
  661    HG   SER 104           HG       SER 104  40.645   4.664   7.079
  662    H    LEU 105           H        LEU 105  38.795   0.321   5.754
  663    HA   LEU 105           HA       LEU 105  39.263  -1.902   5.852
  664    HB2  LEU 105           HB1      LEU 105  41.323  -1.127   3.778
  665    HB3  LEU 105           HB2      LEU 105  40.824  -2.784   4.158
  666    HG   LEU 105           HG       LEU 105  38.939  -0.683   3.099
  667   HD11  LEU 105          HD11      LEU 105  39.910  -0.921   1.118
  668   HD12  LEU 105          HD12      LEU 105  39.402  -2.610   1.137
  669   HD13  LEU 105          HD13      LEU 105  40.999  -2.164   1.736
  670   HD21  LEU 105          HD21      LEU 105  37.678  -2.799   2.457
  671   HD22  LEU 105          HD22      LEU 105  37.706  -2.373   4.168
  672   HD23  LEU 105          HD23      LEU 105  38.762  -3.647   3.558
  673    H    GLU 106           H        GLU 106  40.058  -1.397   8.056
  674    HA   GLU 106           HA       GLU 106  41.525  -1.756   9.756
  675    HB2  GLU 106           HB1      GLU 106  42.304  -3.569   7.651
  676    HB3  GLU 106           HB2      GLU 106  43.730  -3.022   8.547
  677    HG2  GLU 106           HG1      GLU 106  42.450  -3.630  10.665
  678    HG3  GLU 106           HG2      GLU 106  41.327  -4.478   9.592
  679    HE2  GLU 106           HE       GLU 106  44.959  -6.008  10.061
  680    H    HIS 107           H        HIS 107  43.735  -1.213  10.550
  681    HA   HIS 107           HA       HIS 107  45.411   0.299  10.835
  682    HB2  HIS 107           HB1      HIS 107  45.982  -0.872   8.535
  683    HB3  HIS 107           HB2      HIS 107  45.622   0.730   7.883
  684    HD1  HIS 107           HD1      HIS 107  47.607   2.172   7.678
  685    HD2  HIS 107           HD2      HIS 107  47.994  -0.529  10.811
  686    HE1  HIS 107           HE1      HIS 107  49.891   2.588   8.645
  687    HE2  HIS 107           HE2      HIS 107  50.127   0.939  10.562
  688    H    HIS 108           H        HIS 108  44.075   1.873  11.769
  689    HA   HIS 108           HA       HIS 108  43.437   4.132   9.988
  690    HB2  HIS 108           HB1      HIS 108  41.410   2.930  10.819
  691    HB3  HIS 108           HB2      HIS 108  41.898   3.339  12.468
  692    HD1  HIS 108           HD1      HIS 108  42.232   5.849   9.705
  693    HD2  HIS 108           HD2      HIS 108  39.713   5.014  12.902
  694    HE1  HIS 108           HE1      HIS 108  40.760   7.872   9.947
  695    HE2  HIS 108           HE2      HIS 108  39.219   7.363  11.901
  696    H    HIS 109           H        HIS 109  43.844   3.377  13.454
  697    HA   HIS 109           HA       HIS 109  45.847   5.464  13.686
  698    HB2  HIS 109           HB1      HIS 109  43.285   6.231  14.128
  699    HB3  HIS 109           HB2      HIS 109  43.733   5.679  15.745
  700    HD1  HIS 109           HD1      HIS 109  45.756   7.677  13.213
  701    HD2  HIS 109           HD2      HIS 109  44.370   7.913  17.122
  702    HE1  HIS 109           HE1      HIS 109  46.716   9.809  14.139
  703    HE2  HIS 109           HE2      HIS 109  45.871   9.954  16.529
  704    H    HIS 110           H        HIS 110  45.676   2.540  13.985
  705    HA   HIS 110           HA       HIS 110  46.902   2.381  16.627
  706    HB2  HIS 110           HB1      HIS 110  44.743   0.456  15.729
  707    HB3  HIS 110           HB2      HIS 110  45.642   0.384  17.248
  708    HD1  HIS 110           HD1      HIS 110  45.368   2.842  18.656
  709    HD2  HIS 110           HD2      HIS 110  42.317   1.581  16.134
  710    HE1  HIS 110           HE1      HIS 110  43.315   4.080  19.414
  711    HE2  HIS 110           HE2      HIS 110  41.449   3.309  17.873
  712    H    HIS 111           H        HIS 111  48.809   2.243  15.294
  713    HA   HIS 111           HA       HIS 111  49.113  -0.305  13.860
  714    HB2  HIS 111           HB1      HIS 111  51.104   0.717  12.823
  715    HB3  HIS 111           HB2      HIS 111  49.642   1.661  12.524
  716    HD1  HIS 111           HD1      HIS 111  49.417   3.952  13.767
  717    HD2  HIS 111           HD2      HIS 111  53.072   2.045  14.281
  718    HE1  HIS 111           HE1      HIS 111  50.957   5.696  14.722
  719    HE2  HIS 111           HE2      HIS 111  53.191   4.532  15.036
  720    H    HIS 112           H        HIS 112  50.465   1.675  16.430
  721    HA   HIS 112           HA       HIS 112  52.297  -0.523  17.119
  722    HB2  HIS 112           HB1      HIS 112  53.149   1.884  16.652
  723    HB3  HIS 112           HB2      HIS 112  52.488   2.258  18.247
  724    HD1  HIS 112           HD1      HIS 112  54.316   2.298  19.897
  725    HD2  HIS 112           HD2      HIS 112  54.832  -0.739  17.109
  726    HE1  HIS 112           HE1      HIS 112  56.405   1.088  20.600
  727    HE2  HIS 112           HE2      HIS 112  56.723  -0.768  18.895
  Start of MODEL   33
    1    H1   MET  18           H        MET  18 -52.775  19.000  32.627
    2    HA   MET  18           HA       MET  18 -53.736  17.087  31.677
    3    HB2  MET  18           HB1      MET  18 -50.965  17.448  30.533
    4    HB3  MET  18           HB2      MET  18 -52.142  16.322  29.842
    5    HG2  MET  18           HG1      MET  18 -53.472  18.797  30.146
    6    HG3  MET  18           HG2      MET  18 -51.891  19.133  29.435
    7    HE1  MET  18           HE1      MET  18 -51.067  18.048  27.041
    8    HE2  MET  18           HE2      MET  18 -52.328  18.424  25.866
    9    HE3  MET  18           HE3      MET  18 -51.910  19.595  27.118
   10    H    LEU  19           H        LEU  19 -52.477  16.432  34.226
   11    HA   LEU  19           HA       LEU  19 -50.837  14.186  34.129
   12    HB2  LEU  19           HB1      LEU  19 -52.233  15.645  36.089
   13    HB3  LEU  19           HB2      LEU  19 -52.738  13.956  36.269
   14    HG   LEU  19           HG       LEU  19 -49.875  14.114  36.014
   15   HD11  LEU  19          HD11      LEU  19 -51.088  15.725  38.254
   16   HD12  LEU  19          HD12      LEU  19 -50.140  16.367  36.913
   17   HD13  LEU  19          HD13      LEU  19 -49.388  15.290  38.089
   18   HD21  LEU  19          HD21      LEU  19 -51.466  13.338  38.440
   19   HD22  LEU  19          HD22      LEU  19 -49.914  12.708  37.888
   20   HD23  LEU  19          HD23      LEU  19 -51.390  12.314  37.005
   21    H    VAL  20           H        VAL  20 -54.286  14.499  33.670
   22    HA   VAL  20           HA       VAL  20 -54.714  11.628  33.704
   23    HB   VAL  20           HB       VAL  20 -56.650  13.829  32.970
   24   HG11  VAL  20          HG11      VAL  20 -56.832  11.074  32.596
   25   HG12  VAL  20          HG12      VAL  20 -57.789  11.403  34.042
   26   HG13  VAL  20          HG13      VAL  20 -58.149  12.244  32.533
   27   HG21  VAL  20          HG21      VAL  20 -57.536  13.533  35.245
   28   HG22  VAL  20          HG22      VAL  20 -56.220  12.414  35.602
   29   HG23  VAL  20          HG23      VAL  20 -55.868  14.107  35.253
   30    H    LEU  21           H        LEU  21 -54.283  10.415  31.992
   31    HA   LEU  21           HA       LEU  21 -53.619  11.401  29.455
   32    HB2  LEU  21           HB1      LEU  21 -53.654   9.103  28.708
   33    HB3  LEU  21           HB2      LEU  21 -52.903   9.220  30.308
   34    HG   LEU  21           HG       LEU  21 -55.611   8.665  30.784
   35   HD11  LEU  21          HD11      LEU  21 -54.482   6.980  28.556
   36   HD12  LEU  21          HD12      LEU  21 -55.933   7.979  28.507
   37   HD13  LEU  21          HD13      LEU  21 -55.886   6.544  29.530
   38   HD21  LEU  21          HD21      LEU  21 -52.985   7.376  31.129
   39   HD22  LEU  21          HD22      LEU  21 -54.382   6.300  31.187
   40   HD23  LEU  21          HD23      LEU  21 -54.273   7.666  32.298
   41    H    ASP  22           H        ASP  22 -54.778  11.905  27.700
   42    HA   ASP  22           HA       ASP  22 -57.607  11.113  27.605
   43    HB2  ASP  22           HB1      ASP  22 -57.173  13.540  28.377
   44    HB3  ASP  22           HB2      ASP  22 -56.702  13.836  26.699
   45    HD2  ASP  22           HD       ASP  22 -60.528  13.361  27.531
   46    H    PHE  23           H        PHE  23 -55.914   9.607  26.269
   47    HA   PHE  23           HA       PHE  23 -55.369   8.774  24.224
   48    HB2  PHE  23           HB1      PHE  23 -57.571  10.661  23.349
   49    HB3  PHE  23           HB2      PHE  23 -56.851   9.420  22.323
   50    HD1  PHE  23           HD1      PHE  23 -59.619  10.093  24.219
   51    HD2  PHE  23           HD2      PHE  23 -56.742   7.014  23.616
   52    HE1  PHE  23           HE1      PHE  23 -61.222   8.432  25.070
   53    HE2  PHE  23           HE2      PHE  23 -58.342   5.348  24.464
   54    HZ   PHE  23           HZ       PHE  23 -60.585   6.056  25.191
   55    H    ASN  24           H        ASN  24 -53.289   9.835  24.448
   56    HA   ASN  24           HA       ASN  24 -52.892  11.849  22.349
   57    HB2  ASN  24           HB1      ASN  24 -51.320  13.085  23.728
   58    HB3  ASN  24           HB2      ASN  24 -52.883  12.989  24.549
   59   HD21  ASN  24          HD21      ASN  24 -49.938  13.202  25.384
   60   HD22  ASN  24          HD22      ASN  24 -49.802  12.041  26.657
   61    H    ASN  25           H        ASN  25 -51.452  11.179  20.911
   62    HA   ASN  25           HA       ASN  25 -49.393   9.255  21.776
   63    HB2  ASN  25           HB1      ASN  25 -51.148   8.284  20.280
   64    HB3  ASN  25           HB2      ASN  25 -50.651   9.432  19.030
   65   HD21  ASN  25          HD21      ASN  25 -49.770   6.587  20.809
   66   HD22  ASN  25          HD22      ASN  25 -48.445   6.121  19.803
   67    H    ILE  26           H        ILE  26 -47.343   9.384  20.732
   68    HA   ILE  26           HA       ILE  26 -46.667  11.395  18.864
   69    HB   ILE  26           HB       ILE  26 -47.031  12.937  20.699
   70   HG12  ILE  26          HG11      ILE  26 -44.057  12.778  20.672
   71   HG13  ILE  26          HG12      ILE  26 -44.877  12.921  19.109
   72   HG21  ILE  26          HG21      ILE  26 -44.903  12.244  22.464
   73   HG22  ILE  26          HG22      ILE  26 -46.626  12.385  22.808
   74   HG23  ILE  26          HG23      ILE  26 -45.959  10.846  22.265
   75   HD11  ILE  26          HD11      ILE  26 -46.133  14.892  20.282
   76   HD12  ILE  26          HD12      ILE  26 -44.720  14.879  21.338
   77   HD13  ILE  26          HD13      ILE  26 -44.523  15.121  19.602
   78    H    ARG  27           H        ARG  27 -44.698  11.002  17.993
   79    HA   ARG  27           HA       ARG  27 -42.518   9.840  19.356
   80    HB2  ARG  27           HB1      ARG  27 -44.391   7.949  18.886
   81    HB3  ARG  27           HB2      ARG  27 -43.478   7.864  17.373
   82    HG2  ARG  27           HG1      ARG  27 -41.387   7.668  18.825
   83    HG3  ARG  27           HG2      ARG  27 -42.506   7.357  20.163
   84    HD2  ARG  27           HD1      ARG  27 -42.654   5.792  17.593
   85    HD3  ARG  27           HD2      ARG  27 -41.549   5.340  18.898
   86    HE   ARG  27           HE       ARG  27 -44.387   4.972  18.843
   87   HH11  ARG  27          HH11      ARG  27 -41.627   5.428  20.916
   88   HH12  ARG  27          HH12      ARG  27 -42.361   4.652  22.281
   89   HH21  ARG  27          HH21      ARG  27 -45.364   3.949  20.634
   90   HH22  ARG  27          HH22      ARG  27 -44.485   3.812  22.119
   91    H    SER  28           H        SER  28 -40.654   9.826  18.113
   92    HA   SER  28           HA       SER  28 -40.794  10.230  15.253
   93    HB2  SER  28           HB1      SER  28 -41.149  12.515  16.300
   94    HB3  SER  28           HB2      SER  28 -39.499  12.383  16.933
   95    HG   SER  28           HG       SER  28 -40.200  13.241  14.568
   96    H    SER  29           H        SER  29 -38.842   9.847  14.204
   97    HA   SER  29           HA       SER  29 -36.568   9.080  15.903
   98    HB2  SER  29           HB1      SER  29 -36.316   7.278  13.898
   99    HB3  SER  29           HB2      SER  29 -37.157   6.935  15.419
  100    HG   SER  29           HG       SER  29 -38.223   6.623  13.169
  101    H    ALA  30           H        ALA  30 -35.843  11.233  15.235
  102    HA   ALA  30           HA       ALA  30 -34.140  11.051  12.922
  103    HB1  ALA  30           HB1      ALA  30 -36.041  11.781  11.726
  104    HB2  ALA  30           HB2      ALA  30 -36.447  12.980  12.956
  105    HB3  ALA  30           HB3      ALA  30 -35.023  13.206  11.940
  106    H    ASP  31           H        ASP  31 -32.316  11.573  13.966
  107    HA   ASP  31           HA       ASP  31 -32.062  14.257  15.035
  108    HB2  ASP  31           HB1      ASP  31 -32.771  12.529  16.889
  109    HB3  ASP  31           HB2      ASP  31 -31.069  12.054  16.805
  110    HD2  ASP  31           HD       ASP  31 -30.114  14.753  18.667
  111    H    LEU  32           H        LEU  32 -30.487  11.117  14.534
  112    HA   LEU  32           HA       LEU  32 -27.852  12.201  14.423
  113    HB2  LEU  32           HB1      LEU  32 -28.989   9.557  13.502
  114    HB3  LEU  32           HB2      LEU  32 -27.264   9.964  13.476
  115    HG   LEU  32           HG       LEU  32 -28.593  10.273  16.089
  116   HD11  LEU  32          HD11      LEU  32 -28.080   7.530  14.951
  117   HD12  LEU  32          HD12      LEU  32 -29.676   8.239  15.198
  118   HD13  LEU  32          HD13      LEU  32 -28.631   7.916  16.583
  119   HD21  LEU  32          HD21      LEU  32 -26.148  10.567  15.607
  120   HD22  LEU  32          HD22      LEU  32 -26.067   8.832  15.301
  121   HD23  LEU  32          HD23      LEU  32 -26.522   9.427  16.899
  122    H    HIS  33           H        HIS  33 -26.501  11.565  12.355
  123    HA   HIS  33           HA       HIS  33 -27.864  11.946   9.849
  124    HB2  HIS  33           HB1      HIS  33 -27.006  14.240  11.269
  125    HB3  HIS  33           HB2      HIS  33 -25.870  14.016   9.934
  126    HD1  HIS  33           HD1      HIS  33 -26.608  14.768   7.671
  127    HD2  HIS  33           HD2      HIS  33 -29.777  14.454  10.339
  128    HE1  HIS  33           HE1      HIS  33 -28.600  15.718   6.465
  129    HE2  HIS  33           HE2      HIS  33 -30.538  15.525   8.094
  130    H    GLY  34           H        GLY  34 -26.807  10.811   8.359
  131    HA2  GLY  34           HA2      GLY  34 -23.909  10.762   8.297
  132    HA3  GLY  34           HA3      GLY  34 -24.660   9.224   8.695
  133    HA1  GLY  34           HA1      GLY  34 -24.549  11.170   7.847
  134    H    ALA  35           H        ALA  35 -24.234  11.659   6.217
  135    HA   ALA  35           HA       ALA  35 -24.460   9.687   4.153
  136    HB1  ALA  35           HB1      ALA  35 -26.516  10.031   3.360
  137    HB2  ALA  35           HB2      ALA  35 -26.856  10.812   4.905
  138    HB3  ALA  35           HB3      ALA  35 -26.374  11.782   3.514
  139    H    ARG  36           H        ARG  36 -23.845  10.496   2.071
  140    HA   ARG  36           HA       ARG  36 -22.579  11.751   0.660
  141    HB2  ARG  36           HB1      ARG  36 -24.221  13.669   2.136
  142    HB3  ARG  36           HB2      ARG  36 -22.706  14.368   1.542
  143    HG2  ARG  36           HG1      ARG  36 -24.111  12.743  -0.450
  144    HG3  ARG  36           HG2      ARG  36 -25.017  14.159   0.109
  145    HD2  ARG  36           HD1      ARG  36 -23.454  15.662  -0.692
  146    HD3  ARG  36           HD2      ARG  36 -22.142  14.477  -0.616
  147    HE   ARG  36           HE       ARG  36 -24.093  13.715  -2.535
  148   HH11  ARG  36          HH11      ARG  36 -21.439  15.903  -1.999
  149   HH12  ARG  36          HH12      ARG  36 -21.044  16.044  -3.680
  150   HH21  ARG  36          HH21      ARG  36 -23.583  13.892  -4.751
  151   HH22  ARG  36          HH22      ARG  36 -22.265  14.899  -5.244
  152    H    LYS  37           H        LYS  37 -20.586  10.929   1.231
  153    HA   LYS  37           HA       LYS  37 -19.117  12.137   3.432
  154    HB2  LYS  37           HB1      LYS  37 -19.072   9.629   2.066
  155    HB3  LYS  37           HB2      LYS  37 -17.473  10.377   1.917
  156    HG2  LYS  37           HG1      LYS  37 -18.494  10.603   4.618
  157    HG3  LYS  37           HG2      LYS  37 -18.433   8.918   4.070
  158    HD2  LYS  37           HD1      LYS  37 -16.124   8.986   3.686
  159    HD3  LYS  37           HD2      LYS  37 -16.097  10.758   3.663
  160    HE2  LYS  37           HE1      LYS  37 -15.507  10.729   5.812
  161    HE3  LYS  37           HE2      LYS  37 -17.104  10.060   6.180
  162    HZ1  LYS  37           HZ1      LYS  37 -16.260   7.860   6.025
  163    HZ2  LYS  37           HZ2      LYS  37 -15.207   8.724   7.027
  164    HZ3  LYS  37           HZ3      LYS  37 -14.770   8.391   5.427
  165    H    GLY  38           H        GLY  38 -18.349  14.119   2.971
  166    HA2  GLY  38           HA2      GLY  38 -17.682  15.132   0.470
  167    HA3  GLY  38           HA3      GLY  38 -17.053  15.741   1.994
  168    HA1  GLY  38           HA1      GLY  38 -17.501  14.269   0.526
  169    H    SER  39           H        SER  39 -15.590  13.532   2.846
  170    HA   SER  39           HA       SER  39 -13.289  13.771   1.100
  171    HB2  SER  39           HB1      SER  39 -13.549  12.259   3.717
  172    HB3  SER  39           HB2      SER  39 -12.045  12.711   2.895
  173    HG   SER  39           HG       SER  39 -13.102  14.099   4.712
  174    H    GLN  40           H        GLN  40 -12.245  12.094   0.057
  175    HA   GLN  40           HA       GLN  40 -13.913   9.751  -0.463
  176    HB2  GLN  40           HB1      GLN  40 -12.017  11.342  -1.996
  177    HB3  GLN  40           HB2      GLN  40 -11.682   9.607  -2.121
  178    HG2  GLN  40           HG1      GLN  40 -13.152   9.719  -3.817
  179    HG3  GLN  40           HG2      GLN  40 -14.332   9.573  -2.509
  180   HE21  GLN  40          HE21      GLN  40 -15.946  10.936  -2.667
  181   HE22  GLN  40          HE22      GLN  40 -15.880  12.533  -3.323
  182    H    CYS  41           H        CYS  41 -10.472  10.465   0.156
  183    HA   CYS  41           HA       CYS  41 -10.293   7.899   1.583
  184    HB2  CYS  41           HB1      CYS  41  -8.120   7.455   0.639
  185    HB3  CYS  41           HB2      CYS  41  -9.268   7.711  -0.676
  186    H    LEU  42           H        LEU  42  -8.917   7.846   3.359
  187    HA   LEU  42           HA       LEU  42  -8.226  10.479   4.424
  188    HB2  LEU  42           HB1      LEU  42  -9.328   8.135   5.532
  189    HB3  LEU  42           HB2      LEU  42  -7.713   8.314   6.238
  190    HG   LEU  42           HG       LEU  42  -9.648  10.604   6.245
  191   HD11  LEU  42          HD11      LEU  42 -10.950   9.715   7.810
  192   HD12  LEU  42          HD12      LEU  42  -9.562   9.137   8.733
  193   HD13  LEU  42          HD13      LEU  42 -10.219   8.157   7.422
  194   HD21  LEU  42          HD21      LEU  42  -8.220  10.671   8.551
  195   HD22  LEU  42          HD22      LEU  42  -7.762  11.507   7.066
  196   HD23  LEU  42          HD23      LEU  42  -7.054   9.936   7.448
  197    H    SER  43           H        SER  43  -6.780   7.451   3.442
  198    HA   SER  43           HA       SER  43  -4.188   8.667   3.284
  199    HB2  SER  43           HB1      SER  43  -4.873   7.346   5.705
  200    HB3  SER  43           HB2      SER  43  -3.734   6.300   4.838
  201    HG   SER  43           HG       SER  43  -3.308   9.065   5.316
  202    H    ASP  44           H        ASP  44  -2.512   6.789   2.778
  203    HA   ASP  44           HA       ASP  44  -3.261   5.666   0.343
  204    HB2  ASP  44           HB1      ASP  44  -1.195   4.245   0.607
  205    HB3  ASP  44           HB2      ASP  44  -0.939   5.984   0.805
  206    HD2  ASP  44           HD       ASP  44  -0.046   3.638   3.780
  207    H    THR  45           H        THR  45  -3.642   4.476   3.578
  208    HA   THR  45           HA       THR  45  -3.911   1.740   3.122
  209    HB   THR  45           HB       THR  45  -5.474   1.802   5.142
  210    HG1  THR  45           HG1      THR  45  -5.144   3.979   6.235
  211   HG21  THR  45          HG21      THR  45  -2.996   3.264   5.872
  212   HG22  THR  45          HG22      THR  45  -2.809   1.742   5.002
  213   HG23  THR  45          HG23      THR  45  -3.673   1.780   6.539
  214    H    ASP  46           H        ASP  46  -6.051   4.363   2.385
  215    HA   ASP  46           HA       ASP  46  -8.429   2.807   2.117
  216    HB2  ASP  46           HB1      ASP  46  -7.873   5.497   2.215
  217    HB3  ASP  46           HB2      ASP  46  -8.271   5.258   0.507
  218    HD2  ASP  46           HD       ASP  46 -11.170   5.229   3.113
  219    H    CYS  47           H        CYS  47  -5.725   3.524   0.070
  220    HA   CYS  47           HA       CYS  47  -7.092   2.558  -2.316
  221    HB2  CYS  47           HB1      CYS  47  -4.407   3.812  -1.789
  222    HB3  CYS  47           HB2      CYS  47  -4.739   3.002  -3.320
  223    H    ASN  48           H        ASN  48  -5.392   1.162  -3.727
  224    HA   ASN  48           HA       ASN  48  -5.432  -1.401  -2.668
  225    HB2  ASN  48           HB1      ASN  48  -5.009  -0.461  -5.120
  226    HB3  ASN  48           HB2      ASN  48  -3.320  -0.721  -4.663
  227   HD21  ASN  48          HD21      ASN  48  -4.293  -2.126  -6.728
  228   HD22  ASN  48          HD22      ASN  48  -4.501  -3.787  -6.297
  229    H    THR  49           H        THR  49  -3.391  -2.807  -2.467
  230    HA   THR  49           HA       THR  49  -1.914  -1.880  -0.231
  231    HB   THR  49           HB       THR  49  -0.932  -4.205  -1.824
  232    HG1  THR  49           HG1      THR  49  -2.647  -5.471  -1.093
  233   HG21  THR  49          HG21      THR  49  -1.187  -3.447   1.064
  234   HG22  THR  49          HG22      THR  49   0.242  -3.964   0.167
  235   HG23  THR  49          HG23      THR  49  -1.000  -5.139   0.601
  236    H    ARG  50           H        ARG  50  -1.215  -2.126  -3.668
  237    HA   ARG  50           HA       ARG  50   1.480  -1.058  -3.196
  238    HB2  ARG  50           HB1      ARG  50   0.276  -2.279  -5.693
  239    HB3  ARG  50           HB2      ARG  50   1.946  -1.719  -5.523
  240    HG2  ARG  50           HG1      ARG  50   2.363  -3.879  -5.069
  241    HG3  ARG  50           HG2      ARG  50   1.810  -3.429  -3.448
  242    HD2  ARG  50           HD1      ARG  50  -0.217  -4.480  -3.682
  243    HD3  ARG  50           HD2      ARG  50  -0.240  -4.250  -5.435
  244    HE   ARG  50           HE       ARG  50   1.812  -6.059  -4.591
  245   HH11  ARG  50          HH11      ARG  50  -1.574  -5.770  -5.348
  246   HH12  ARG  50          HH12      ARG  50  -1.757  -7.441  -5.767
  247   HH21  ARG  50          HH21      ARG  50   1.584  -8.261  -5.140
  248   HH22  ARG  50          HH22      ARG  50   0.040  -8.857  -5.648
  249    H    LYS  51           H        LYS  51  -0.928   0.559  -2.987
  250    HA   LYS  51           HA       LYS  51  -0.168   2.636  -4.887
  251    HB2  LYS  51           HB1      LYS  51  -2.799   1.247  -4.818
  252    HB3  LYS  51           HB2      LYS  51  -2.818   3.004  -5.037
  253    HG2  LYS  51           HG1      LYS  51  -2.559   2.613  -7.209
  254    HG3  LYS  51           HG2      LYS  51  -0.888   2.166  -6.817
  255    HD2  LYS  51           HD1      LYS  51  -1.967  -0.176  -6.276
  256    HD3  LYS  51           HD2      LYS  51  -3.242   0.414  -7.355
  257    HE2  LYS  51           HE1      LYS  51  -1.127   1.043  -8.868
  258    HE3  LYS  51           HE2      LYS  51  -0.427  -0.302  -7.956
  259    HZ1  LYS  51           HZ1      LYS  51  -1.715  -1.797  -8.998
  260    HZ2  LYS  51           HZ2      LYS  51  -1.851  -0.603 -10.189
  261    HZ3  LYS  51           HZ3      LYS  51  -3.072  -0.789  -9.034
  262    H    PHE  52           H        PHE  52  -0.713   4.745  -4.219
  263    HA   PHE  52           HA       PHE  52  -1.688   4.955  -1.448
  264    HB2  PHE  52           HB1      PHE  52  -0.074   6.654  -0.959
  265    HB3  PHE  52           HB2      PHE  52   0.792   5.283  -1.651
  266    HD1  PHE  52           HD1      PHE  52   1.672   5.374  -3.942
  267    HD2  PHE  52           HD2      PHE  52  -0.141   8.757  -2.102
  268    HE1  PHE  52           HE1      PHE  52   2.671   6.835  -5.651
  269    HE2  PHE  52           HE2      PHE  52   0.855  10.223  -3.808
  270    HZ   PHE  52           HZ       PHE  52   2.262   9.264  -5.585
  271    H    CYS  53           H        CYS  53  -2.543   7.115  -0.894
  272    HA   CYS  53           HA       CYS  53  -4.113   8.152  -3.129
  273    HB2  CYS  53           HB1      CYS  53  -4.710   7.585  -0.455
  274    HB3  CYS  53           HB2      CYS  53  -4.689   9.346  -0.546
  275    H    LEU  54           H        LEU  54  -2.945   9.624  -4.235
  276    HA   LEU  54           HA       LEU  54  -1.172  11.478  -2.962
  277    HB2  LEU  54           HB1      LEU  54  -0.681  10.700  -5.189
  278    HB3  LEU  54           HB2      LEU  54  -2.238  11.310  -5.775
  279    HG   LEU  54           HG       LEU  54  -1.054  13.580  -4.785
  280   HD11  LEU  54          HD11      LEU  54   1.052  11.736  -5.857
  281   HD12  LEU  54          HD12      LEU  54   1.084  12.734  -4.403
  282   HD13  LEU  54          HD13      LEU  54   1.205  13.488  -5.991
  283   HD21  LEU  54          HD21      LEU  54  -1.979  13.991  -6.786
  284   HD22  LEU  54          HD22      LEU  54  -1.604  12.383  -7.404
  285   HD23  LEU  54          HD23      LEU  54  -0.370  13.642  -7.417
  286    H    GLN  55           H        GLN  55  -1.731  13.298  -1.981
  287    HA   GLN  55           HA       GLN  55  -4.314  14.529  -2.660
  288    HB2  GLN  55           HB1      GLN  55  -4.335  13.896  -0.380
  289    HB3  GLN  55           HB2      GLN  55  -2.699  14.517  -0.119
  290    HG2  GLN  55           HG1      GLN  55  -3.424  16.565   0.354
  291    HG3  GLN  55           HG2      GLN  55  -4.514  16.580  -1.038
  292   HE21  GLN  55          HE21      GLN  55  -4.204  15.172   2.197
  293   HE22  GLN  55          HE22      GLN  55  -5.884  15.260   2.586
  294    HA   PRO  56           HA       PRO  56  -1.291  17.515  -4.367
  295    HB2  PRO  56           HB1      PRO  56  -2.961  18.395  -6.350
  296    HB3  PRO  56           HB2      PRO  56  -1.965  16.946  -6.489
  297    HG2  PRO  56           HG1      PRO  56  -4.857  17.201  -5.739
  298    HG3  PRO  56           HG2      PRO  56  -4.072  16.044  -6.877
  299    HD2  PRO  56           HD1      PRO  56  -4.794  15.354  -4.351
  300    HD3  PRO  56           HD2      PRO  56  -3.366  14.680  -5.157
  301    H    ARG  57           H        ARG  57  -1.219  19.751  -4.184
  302    HA   ARG  57           HA       ARG  57  -3.171  20.907  -2.396
  303    HB2  ARG  57           HB1      ARG  57  -0.657  21.242  -2.246
  304    HB3  ARG  57           HB2      ARG  57  -0.813  22.304  -3.653
  305    HG2  ARG  57           HG1      ARG  57  -2.327  23.767  -2.411
  306    HG3  ARG  57           HG2      ARG  57  -2.185  22.701  -1.002
  307    HD2  ARG  57           HD1      ARG  57   0.413  23.137  -1.398
  308    HD3  ARG  57           HD2      ARG  57  -0.219  24.611  -2.148
  309    HE   ARG  57           HE       ARG  57  -1.489  24.418   0.287
  310   HH11  ARG  57          HH11      ARG  57   1.797  24.636  -0.841
  311   HH12  ARG  57          HH12      ARG  57   2.367  25.457   0.575
  312   HH21  ARG  57          HH21      ARG  57  -0.752  25.497   2.156
  313   HH22  ARG  57          HH22      ARG  57   0.916  25.945   2.279
  314    H    ASP  58           H        ASP  58  -2.360  21.045  -5.773
  315    HA   ASP  58           HA       ASP  58  -4.022  23.382  -6.246
  316    HB2  ASP  58           HB1      ASP  58  -2.033  21.826  -7.775
  317    HB3  ASP  58           HB2      ASP  58  -3.386  22.447  -8.728
  318    HD2  ASP  58           HD       ASP  58  -1.899  25.514  -8.833
  319    H    GLU  59           H        GLU  59  -4.262  19.944  -6.329
  320    HA   GLU  59           HA       GLU  59  -6.938  20.179  -7.540
  321    HB2  GLU  59           HB1      GLU  59  -4.722  18.597  -8.376
  322    HB3  GLU  59           HB2      GLU  59  -5.971  17.504  -7.764
  323    HG2  GLU  59           HG1      GLU  59  -6.854  17.624  -9.802
  324    HG3  GLU  59           HG2      GLU  59  -7.425  19.224  -9.308
  325    HE2  GLU  59           HE       GLU  59  -5.264  19.258 -12.375
  326    H    LYS  60           H        LYS  60  -8.119  17.907  -7.007
  327    HA   LYS  60           HA       LYS  60  -8.320  17.900  -4.106
  328    HB2  LYS  60           HB1      LYS  60 -10.054  17.186  -6.375
  329    HB3  LYS  60           HB2      LYS  60 -10.182  16.095  -4.985
  330    HG2  LYS  60           HG1      LYS  60 -10.953  17.768  -3.565
  331    HG3  LYS  60           HG2      LYS  60 -10.347  19.059  -4.616
  332    HD2  LYS  60           HD1      LYS  60 -12.322  17.279  -5.884
  333    HD3  LYS  60           HD2      LYS  60 -12.939  18.224  -4.516
  334    HE2  LYS  60           HE1      LYS  60 -12.983  20.099  -5.726
  335    HE3  LYS  60           HE2      LYS  60 -11.299  19.868  -6.221
  336    HZ1  LYS  60           HZ1      LYS  60 -11.898  18.904  -8.159
  337    HZ2  LYS  60           HZ2      LYS  60 -13.300  19.822  -7.933
  338    HZ3  LYS  60           HZ3      LYS  60 -13.289  18.182  -7.522
  339    HA   PRO  61           HA       PRO  61  -6.293  14.085  -3.340
  340    HB2  PRO  61           HB1      PRO  61  -7.885  12.939  -1.429
  341    HB3  PRO  61           HB2      PRO  61  -6.855  14.338  -1.127
  342    HG2  PRO  61           HG1      PRO  61  -9.784  14.236  -1.763
  343    HG3  PRO  61           HG2      PRO  61  -8.924  15.199  -0.505
  344    HD2  PRO  61           HD1      PRO  61  -9.748  16.268  -2.860
  345    HD3  PRO  61           HD2      PRO  61  -8.272  16.796  -2.033
  346    H    PHE  62           H        PHE  62  -6.168  12.248  -4.457
  347    HA   PHE  62           HA       PHE  62  -8.540  10.626  -4.904
  348    HB2  PHE  62           HB1      PHE  62  -7.949  10.425  -7.370
  349    HB3  PHE  62           HB2      PHE  62  -8.688  11.946  -6.865
  350    HD1  PHE  62           HD1      PHE  62  -5.285  10.465  -7.251
  351    HD2  PHE  62           HD2      PHE  62  -7.764  13.905  -7.616
  352    HE1  PHE  62           HE1      PHE  62  -3.397  11.719  -8.207
  353    HE2  PHE  62           HE2      PHE  62  -5.880  15.165  -8.574
  354    HZ   PHE  62           HZ       PHE  62  -3.694  14.073  -8.871
  355    H    CYS  63           H        CYS  63  -7.817   8.618  -6.300
  356    HA   CYS  63           HA       CYS  63  -5.501   7.518  -4.916
  357    HB2  CYS  63           HB1      CYS  63  -7.810   6.377  -5.149
  358    HB3  CYS  63           HB2      CYS  63  -7.297   6.000  -6.795
  359    H    ALA  64           H        ALA  64  -3.567   7.444  -5.831
  360    HA   ALA  64           HA       ALA  64  -3.399   7.439  -8.774
  361    HB1  ALA  64           HB1      ALA  64  -1.144   8.483  -7.140
  362    HB2  ALA  64           HB2      ALA  64  -1.680   8.945  -8.756
  363    HB3  ALA  64           HB3      ALA  64  -2.577   9.493  -7.341
  364    H    THR  65           H        THR  65  -1.190   6.601  -9.529
  365    HA   THR  65           HA       THR  65  -0.871   3.949  -8.459
  366    HB   THR  65           HB       THR  65   1.052   3.950 -10.252
  367    HG1  THR  65           HG1      THR  65   0.678   5.510 -11.872
  368   HG21  THR  65          HG21      THR  65  -1.193   4.077 -11.925
  369   HG22  THR  65          HG22      THR  65  -1.797   3.530 -10.361
  370   HG23  THR  65          HG23      THR  65  -0.505   2.642 -11.168
  371    H    CYS  66           H        CYS  66   1.428   3.085  -8.192
  372    HA   CYS  66           HA       CYS  66   2.736   4.711  -6.185
  373    HB2  CYS  66           HB1      CYS  66   2.389   1.959  -6.608
  374    HB3  CYS  66           HB2      CYS  66   4.115   2.247  -6.825
  375    H    ARG  67           H        ARG  67   5.158   4.821  -6.173
  376    HA   ARG  67           HA       ARG  67   6.083   5.606  -8.843
  377    HB2  ARG  67           HB1      ARG  67   6.613   6.538  -6.084
  378    HB3  ARG  67           HB2      ARG  67   8.001   6.542  -7.182
  379    HG2  ARG  67           HG1      ARG  67   6.849   8.709  -7.138
  380    HG3  ARG  67           HG2      ARG  67   6.817   7.959  -8.741
  381    HD2  ARG  67           HD1      ARG  67   4.553   7.432  -8.606
  382    HD3  ARG  67           HD2      ARG  67   4.550   7.525  -6.840
  383    HE   ARG  67           HE       ARG  67   5.096  10.063  -7.546
  384   HH11  ARG  67          HH11      ARG  67   2.643   7.812  -8.564
  385   HH12  ARG  67          HH12      ARG  67   1.469   9.041  -8.899
  386   HH21  ARG  67          HH21      ARG  67   3.559  11.692  -7.983
  387   HH22  ARG  67          HH22      ARG  67   1.991  11.247  -8.569
  388    H    GLY  68           H        GLY  68   8.401   5.227  -9.341
  389    HA2  GLY  68           HA2      GLY  68   9.149   2.519  -8.464
  390    HA3  GLY  68           HA3      GLY  68   9.644   3.274  -9.972
  391    HA1  GLY  68           HA1      GLY  68   9.158   3.202  -7.904
  392    H    LEU  69           H        LEU  69  11.747   2.365  -9.092
  393    HA   LEU  69           HA       LEU  69  12.999   3.670  -6.896
  394    HB2  LEU  69           HB1      LEU  69  14.137   2.066  -9.189
  395    HB3  LEU  69           HB2      LEU  69  15.077   2.631  -7.796
  396    HG   LEU  69           HG       LEU  69  12.829   0.621  -7.769
  397   HD11  LEU  69          HD11      LEU  69  15.384   0.183  -8.454
  398   HD12  LEU  69          HD12      LEU  69  14.394  -0.997  -7.595
  399   HD13  LEU  69          HD13      LEU  69  15.516   0.029  -6.702
  400   HD21  LEU  69          HD21      LEU  69  14.256   2.049  -5.558
  401   HD22  LEU  69          HD22      LEU  69  13.629   0.417  -5.320
  402   HD23  LEU  69          HD23      LEU  69  12.532   1.730  -5.752
  403    H    ARG  70           H        ARG  70  12.660   4.387 -10.267
  404    HA   ARG  70           HA       ARG  70  14.741   6.433 -10.173
  405    HB2  ARG  70           HB1      ARG  70  12.967   5.472 -12.431
  406    HB3  ARG  70           HB2      ARG  70  14.210   6.723 -12.589
  407    HG2  ARG  70           HG1      ARG  70  15.731   4.793 -11.555
  408    HG3  ARG  70           HG2      ARG  70  14.497   3.791 -12.337
  409    HD2  ARG  70           HD1      ARG  70  15.828   6.044 -13.822
  410    HD3  ARG  70           HD2      ARG  70  16.591   4.454 -13.690
  411    HE   ARG  70           HE       ARG  70  13.918   4.192 -14.585
  412   HH11  ARG  70          HH11      ARG  70  17.084   5.178 -15.644
  413   HH12  ARG  70          HH12      ARG  70  16.791   4.792 -17.307
  414   HH21  ARG  70          HH21      ARG  70  13.520   3.679 -16.772
  415   HH22  ARG  70          HH22      ARG  70  14.763   3.940 -17.948
  416    H    ARG  71           H        ARG  71  11.875   6.393  -8.914
  417    HA   ARG  71           HA       ARG  71  10.967   8.968 -10.005
  418    HB2  ARG  71           HB1      ARG  71   9.589   6.683  -8.665
  419    HB3  ARG  71           HB2      ARG  71   8.917   8.307  -8.464
  420    HG2  ARG  71           HG1      ARG  71   9.513   7.113 -11.165
  421    HG3  ARG  71           HG2      ARG  71   7.954   6.934 -10.342
  422    HD2  ARG  71           HD1      ARG  71   8.542   9.668 -10.188
  423    HD3  ARG  71           HD2      ARG  71   9.001   9.178 -11.826
  424    HE   ARG  71           HE       ARG  71   6.467   8.119 -11.221
  425   HH11  ARG  71          HH11      ARG  71   8.030  11.160 -11.873
  426   HH12  ARG  71          HH12      ARG  71   6.609  11.897 -12.535
  427   HH21  ARG  71          HH21      ARG  71   4.589   9.078 -12.092
  428   HH22  ARG  71          HH22      ARG  71   4.651  10.712 -12.659
  429    H    ARG  72           H        ARG  72  10.573  10.717  -8.654
  430    HA   ARG  72           HA       ARG  72  12.212  10.830  -6.299
  431    HB2  ARG  72           HB1      ARG  72  10.407  12.821  -7.675
  432    HB3  ARG  72           HB2      ARG  72  11.255  13.190  -6.166
  433    HG2  ARG  72           HG1      ARG  72  13.338  12.315  -7.598
  434    HG3  ARG  72           HG2      ARG  72  12.310  12.917  -8.910
  435    HD2  ARG  72           HD1      ARG  72  13.034  14.533  -6.459
  436    HD3  ARG  72           HD2      ARG  72  13.920  14.596  -7.988
  437    HE   ARG  72           HE       ARG  72  11.172  15.068  -8.444
  438   HH11  ARG  72          HH11      ARG  72  14.017  16.571  -7.115
  439   HH12  ARG  72          HH12      ARG  72  13.480  18.184  -7.450
  440   HH21  ARG  72          HH21      ARG  72  10.454  17.186  -8.892
  441   HH22  ARG  72          HH22      ARG  72  11.454  18.532  -8.460
  442    H    CYS  73           H        CYS  73  11.434  11.582  -4.205
  443    HA   CYS  73           HA       CYS  73   8.617  11.143  -3.621
  444    HB2  CYS  73           HB1      CYS  73   8.957   9.467  -1.960
  445    HB3  CYS  73           HB2      CYS  73   9.763   8.912  -3.427
  446    H    GLN  74           H        GLN  74   7.956  11.993  -1.597
  447    HA   GLN  74           HA       GLN  74   9.901  13.866  -0.421
  448    HB2  GLN  74           HB1      GLN  74   7.430  14.402  -1.595
  449    HB3  GLN  74           HB2      GLN  74   7.120  14.483   0.148
  450    HG2  GLN  74           HG1      GLN  74   8.160  16.436   0.353
  451    HG3  GLN  74           HG2      GLN  74   9.555  15.868  -0.576
  452   HE21  GLN  74          HE21      GLN  74   9.479  16.011  -2.876
  453   HE22  GLN  74          HE22      GLN  74   8.484  17.196  -3.645
  454    H    ARG  75           H        ARG  75   7.547  11.384   0.193
  455    HA   ARG  75           HA       ARG  75   8.290  11.448   3.039
  456    HB2  ARG  75           HB1      ARG  75   5.560  11.069   1.811
  457    HB3  ARG  75           HB2      ARG  75   5.936  10.532   3.455
  458    HG2  ARG  75           HG1      ARG  75   6.120  12.669   4.279
  459    HG3  ARG  75           HG2      ARG  75   6.534  13.348   2.696
  460    HD2  ARG  75           HD1      ARG  75   3.945  12.230   2.449
  461    HD3  ARG  75           HD2      ARG  75   3.975  13.151   3.960
  462    HE   ARG  75           HE       ARG  75   4.002  14.212   1.317
  463   HH11  ARG  75          HH11      ARG  75   5.143  14.765   4.559
  464   HH12  ARG  75          HH12      ARG  75   5.249  16.484   4.368
  465   HH21  ARG  75          HH21      ARG  75   4.139  16.473   1.052
  466   HH22  ARG  75          HH22      ARG  75   4.676  17.454   2.373
  467    H    ASP  76           H        ASP  76   8.558   9.468   4.048
  468    HA   ASP  76           HA       ASP  76   9.481   7.340   2.480
  469    HB2  ASP  76           HB1      ASP  76   8.492   7.023   5.314
  470    HB3  ASP  76           HB2      ASP  76   9.805   6.156   4.505
  471    HD2  ASP  76           HD       ASP  76  11.690   9.296   4.722
  472    H    ALA  77           H        ALA  77   6.312   8.102   3.681
  473    HA   ALA  77           HA       ALA  77   5.235   5.467   3.195
  474    HB1  ALA  77           HB1      ALA  77   4.047   6.427   4.886
  475    HB2  ALA  77           HB2      ALA  77   4.169   8.050   4.203
  476    HB3  ALA  77           HB3      ALA  77   3.030   6.888   3.521
  477    H    MET  78           H        MET  78   5.492   8.505   1.494
  478    HA   MET  78           HA       MET  78   3.517   8.185  -0.440
  479    HB2  MET  78           HB1      MET  78   5.974   9.768  -0.135
  480    HB3  MET  78           HB2      MET  78   5.528   9.442  -1.817
  481    HG2  MET  78           HG1      MET  78   3.331  10.417  -1.470
  482    HG3  MET  78           HG2      MET  78   3.705  10.671   0.237
  483    HE1  MET  78           HE1      MET  78   5.181  13.029  -3.366
  484    HE2  MET  78           HE2      MET  78   6.120  11.573  -3.033
  485    HE3  MET  78           HE3      MET  78   4.387  11.453  -3.344
  486    H    CYS  79           H        CYS  79   6.673   6.721  -0.155
  487    HA   CYS  79           HA       CYS  79   6.515   5.579  -2.832
  488    HB2  CYS  79           HB1      CYS  79   8.616   6.077  -0.869
  489    HB3  CYS  79           HB2      CYS  79   8.716   4.456  -1.560
  490    H    CYS  80           H        CYS  80   6.327   3.397  -3.270
  491    HA   CYS  80           HA       CYS  80   4.643   1.865  -1.703
  492    HB2  CYS  80           HB1      CYS  80   6.350   1.417  -4.054
  493    HB3  CYS  80           HB2      CYS  80   6.046  -0.039  -3.103
  494    HA   PRO  81           HA       PRO  81   7.006  -0.014   1.478
  495    HB2  PRO  81           HB1      PRO  81   5.991  -2.555   1.551
  496    HB3  PRO  81           HB2      PRO  81   5.101  -1.137   2.102
  497    HG2  PRO  81           HG1      PRO  81   4.965  -2.560  -0.535
  498    HG3  PRO  81           HG2      PRO  81   3.622  -1.966   0.510
  499    HD2  PRO  81           HD1      PRO  81   4.462  -0.627  -1.698
  500    HD3  PRO  81           HD2      PRO  81   3.855   0.197  -0.252
  501    H    GLY  82           H        GLY  82   8.854  -1.192   1.849
  502    HA2  GLY  82           HA2      GLY  82  10.340  -3.022   1.353
  503    HA3  GLY  82           HA3      GLY  82   9.785  -2.964  -0.314
  504    HA1  GLY  82           HA1      GLY  82  10.343  -2.170   1.579
  505    H    THR  83           H        THR  83   9.989   0.087  -0.066
  506    HA   THR  83           HA       THR  83  12.907   0.234  -0.465
  507    HB   THR  83           HB       THR  83  12.403   2.154  -2.026
  508    HG1  THR  83           HG1      THR  83  10.268   2.591  -1.435
  509   HG21  THR  83          HG21      THR  83  13.007   0.342  -3.265
  510   HG22  THR  83          HG22      THR  83  11.322   0.448  -3.778
  511   HG23  THR  83          HG23      THR  83  11.795  -0.704  -2.528
  512    H    LEU  84           H        LEU  84  13.692   2.593  -0.314
  513    HA   LEU  84           HA       LEU  84  12.330   3.964   1.907
  514    HB2  LEU  84           HB1      LEU  84  14.983   2.801   1.822
  515    HB3  LEU  84           HB2      LEU  84  15.045   4.540   2.161
  516    HG   LEU  84           HG       LEU  84  15.032   3.128   4.196
  517   HD11  LEU  84          HD11      LEU  84  13.820   5.495   3.785
  518   HD12  LEU  84          HD12      LEU  84  13.906   4.697   5.354
  519   HD13  LEU  84          HD13      LEU  84  12.455   4.543   4.365
  520   HD21  LEU  84          HD21      LEU  84  13.327   1.710   4.761
  521   HD22  LEU  84          HD22      LEU  84  13.336   1.504   3.009
  522   HD23  LEU  84          HD23      LEU  84  12.141   2.558   3.768
  523    H    CYS  85           H        CYS  85  12.945   6.258   2.124
  524    HA   CYS  85           HA       CYS  85  13.170   7.473  -0.522
  525    HB2  CYS  85           HB1      CYS  85  12.023   8.265   2.094
  526    HB3  CYS  85           HB2      CYS  85  12.723   9.567   1.133
  527    H    VAL  86           H        VAL  86  15.300   7.530  -1.058
  528    HA   VAL  86           HA       VAL  86  17.132   8.858   0.831
  529    HB   VAL  86           HB       VAL  86  17.845   7.025  -1.462
  530   HG11  VAL  86          HG11      VAL  86  19.919   7.329   0.461
  531   HG12  VAL  86          HG12      VAL  86  19.924   7.769  -1.248
  532   HG13  VAL  86          HG13      VAL  86  19.380   8.932  -0.039
  533   HG21  VAL  86          HG21      VAL  86  16.835   5.681   0.199
  534   HG22  VAL  86          HG22      VAL  86  18.575   5.504   0.425
  535   HG23  VAL  86          HG23      VAL  86  17.649   6.549   1.502
  536    H    ASN  87           H        ASN  87  17.963  10.771   0.289
  537    HA   ASN  87           HA       ASN  87  18.343  12.696  -0.865
  538    HB2  ASN  87           HB1      ASN  87  18.813  10.727  -3.123
  539    HB3  ASN  87           HB2      ASN  87  19.294  12.428  -3.141
  540   HD21  ASN  87          HD21      ASN  87  20.996  10.140  -3.399
  541   HD22  ASN  87          HD22      ASN  87  22.121  10.197  -2.089
  542    H    ASP  88           H        ASP  88  15.635  11.929  -0.649
  543    HA   ASP  88           HA       ASP  88  13.580  12.532  -1.418
  544    HB2  ASP  88           HB1      ASP  88  14.976  14.192  -3.522
  545    HB3  ASP  88           HB2      ASP  88  13.390  14.463  -2.788
  546    HD2  ASP  88           HD       ASP  88  14.803  15.893   0.069
  547    H    VAL  89           H        VAL  89  15.075  10.261  -2.586
  548    HA   VAL  89           HA       VAL  89  13.371   9.897  -4.938
  549    HB   VAL  89           HB       VAL  89  16.333   9.297  -4.929
  550   HG11  VAL  89          HG11      VAL  89  15.971   8.605  -7.265
  551   HG12  VAL  89          HG12      VAL  89  15.098   7.584  -6.120
  552   HG13  VAL  89          HG13      VAL  89  14.235   8.816  -7.042
  553   HG21  VAL  89          HG21      VAL  89  14.688  11.500  -6.046
  554   HG22  VAL  89          HG22      VAL  89  16.331  11.526  -5.407
  555   HG23  VAL  89          HG23      VAL  89  16.025  10.897  -7.025
  556    H    CYS  90           H        CYS  90  12.666   7.818  -5.255
  557    HA   CYS  90           HA       CYS  90  12.665   6.081  -3.027
  558    HB2  CYS  90           HB1      CYS  90  11.167   6.357  -5.336
  559    HB3  CYS  90           HB2      CYS  90  11.997   4.818  -5.581
  560    H    THR  91           H        THR  91  14.439   5.061  -2.362
  561    HA   THR  91           HA       THR  91  16.056   3.639  -4.377
  562    HB   THR  91           HB       THR  91  17.076   4.843  -1.798
  563    HG1  THR  91           HG1      THR  91  17.253   5.687  -4.509
  564   HG21  THR  91          HG21      THR  91  19.297   4.361  -3.092
  565   HG22  THR  91          HG22      THR  91  18.315   3.171  -3.944
  566   HG23  THR  91          HG23      THR  91  18.503   3.068  -2.194
  567    H    THR  92           H        THR  92  16.329   1.515  -4.075
  568    HA   THR  92           HA       THR  92  14.828   0.050  -2.257
  569    HB   THR  92           HB       THR  92  17.031  -1.575  -2.833
  570    HG1  THR  92           HG1      THR  92  17.111  -1.131  -5.195
  571   HG21  THR  92          HG21      THR  92  14.445  -1.876  -3.018
  572   HG22  THR  92          HG22      THR  92  15.510  -2.806  -4.072
  573   HG23  THR  92          HG23      THR  92  14.693  -1.371  -4.688
  574    H    MET  93           H        MET  93  15.112  -0.642  -0.215
  575    HA   MET  93           HA       MET  93  16.879   0.580   1.527
  576    HB2  MET  93           HB1      MET  93  14.773  -1.195   1.750
  577    HB3  MET  93           HB2      MET  93  16.151  -2.124   2.362
  578    HG2  MET  93           HG1      MET  93  16.382   0.410   3.538
  579    HG3  MET  93           HG2      MET  93  14.670  -0.010   3.619
  580    HE1  MET  93           HE1      MET  93  16.626  -0.802   7.105
  581    HE2  MET  93           HE2      MET  93  16.928   0.454   5.904
  582    HE3  MET  93           HE3      MET  93  15.286   0.156   6.474
  583    H    GLU  94           H        GLU  94  17.295  -2.301  -0.409
  584    HA   GLU  94           HA       GLU  94  19.556  -3.359   0.895
  585    HB2  GLU  94           HB1      GLU  94  18.271  -3.680  -1.768
  586    HB3  GLU  94           HB2      GLU  94  19.957  -4.201  -1.618
  587    HG2  GLU  94           HG1      GLU  94  19.268  -6.119  -0.765
  588    HG3  GLU  94           HG2      GLU  94  18.615  -5.233   0.620
  589    HE2  GLU  94           HE       GLU  94  15.369  -5.668  -0.439
  590    H    ASP  95           H        ASP  95  19.175  -0.849  -1.518
  591    HA   ASP  95           HA       ASP  95  21.997  -0.645  -2.063
  592    HB2  ASP  95           HB1      ASP  95  19.526   0.497  -3.108
  593    HB3  ASP  95           HB2      ASP  95  20.805   1.710  -2.944
  594    HD2  ASP  95           HD       ASP  95  21.187  -1.076  -5.708
  595    H    ALA  96           H        ALA  96  19.687   0.862   0.072
  596    HA   ALA  96           HA       ALA  96  21.256   3.121   0.774
  597    HB1  ALA  96           HB1      ALA  96  19.655   2.700   2.948
  598    HB2  ALA  96           HB2      ALA  96  19.192   3.596   1.500
  599    HB3  ALA  96           HB3      ALA  96  18.756   1.895   1.662
  600    H    THR  97           H        THR  97  22.853   3.362   2.219
  601    HA   THR  97           HA       THR  97  24.453   2.874   3.765
  602    HB   THR  97           HB       THR  97  22.588   0.743   4.811
  603    HG1  THR  97           HG1      THR  97  21.374   2.578   4.863
  604   HG21  THR  97          HG21      THR  97  24.896   0.745   5.698
  605   HG22  THR  97          HG22      THR  97  23.701   1.152   6.930
  606   HG23  THR  97          HG23      THR  97  24.681   2.422   6.198
  607    H    GLU  98           H        GLU  98  25.501   2.011   1.734
  608    HA   GLU  98           HA       GLU  98  25.598  -0.749   1.186
  609    HB2  GLU  98           HB1      GLU  98  26.380   1.259  -0.247
  610    HB3  GLU  98           HB2      GLU  98  27.897   1.112   0.657
  611    HG2  GLU  98           HG1      GLU  98  26.909  -1.414  -0.463
  612    HG3  GLU  98           HG2      GLU  98  27.330  -0.183  -1.662
  613    HE2  GLU  98           HE       GLU  98  30.555  -1.312  -1.318
  614    H    ASN  99           H        ASN  99  26.282  -2.277   2.524
  615    HA   ASN  99           HA       ASN  99  28.531  -1.676   4.326
  616    HB2  ASN  99           HB1      ASN  99  26.443  -2.252   5.483
  617    HB3  ASN  99           HB2      ASN  99  26.372  -3.780   4.597
  618   HD21  ASN  99          HD21      ASN  99  28.150  -1.963   7.001
  619   HD22  ASN  99          HD22      ASN  99  28.916  -3.323   7.740
  620    H    LEU 100           H        LEU 100  30.232  -3.138   4.523
  621    HA   LEU 100           HA       LEU 100  30.364  -5.645   3.254
  622    HB2  LEU 100           HB1      LEU 100  30.902  -3.334   1.583
  623    HB3  LEU 100           HB2      LEU 100  32.305  -4.410   1.690
  624    HG   LEU 100           HG       LEU 100  29.788  -5.803   1.138
  625   HD11  LEU 100          HD11      LEU 100  30.814  -3.675  -0.715
  626   HD12  LEU 100          HD12      LEU 100  29.164  -3.950  -0.156
  627   HD13  LEU 100          HD13      LEU 100  29.906  -5.072  -1.298
  628   HD21  LEU 100          HD21      LEU 100  32.065  -5.929  -0.715
  629   HD22  LEU 100          HD22      LEU 100  31.162  -7.225   0.070
  630   HD23  LEU 100          HD23      LEU 100  32.430  -6.371   0.953
  631    H    TYR 101           H        TYR 101  32.317  -6.719   3.655
  632    HA   TYR 101           HA       TYR 101  34.364  -5.215   5.129
  633    HB2  TYR 101           HB1      TYR 101  32.594  -6.585   6.542
  634    HB3  TYR 101           HB2      TYR 101  33.622  -7.946   6.089
  635    HD1  TYR 101           HD1      TYR 101  34.039  -4.474   7.421
  636    HD2  TYR 101           HD2      TYR 101  35.306  -8.533   7.546
  637    HE1  TYR 101           HE1      TYR 101  35.602  -3.923   9.238
  638    HE2  TYR 101           HE2      TYR 101  36.872  -7.994   9.365
  639    HH   TYR 101           HH       TYR 101  37.289  -4.668  10.504
  640    H    PHE 102           H        PHE 102  36.416  -6.406   5.331
  641    HA   PHE 102           HA       PHE 102  36.801  -8.519   3.344
  642    HB2  PHE 102           HB1      PHE 102  38.657  -7.427   2.291
  643    HB3  PHE 102           HB2      PHE 102  37.292  -6.312   2.267
  644    HD1  PHE 102           HD1      PHE 102  40.691  -6.755   3.225
  645    HD2  PHE 102           HD2      PHE 102  37.173  -4.515   4.072
  646    HE1  PHE 102           HE1      PHE 102  42.059  -5.028   4.320
  647    HE2  PHE 102           HE2      PHE 102  38.535  -2.784   5.168
  648    HZ   PHE 102           HZ       PHE 102  40.982  -3.038   5.293
  649    H    GLN 103           H        GLN 103  39.252  -9.208   3.454
  650    HA   GLN 103           HA       GLN 103  40.869 -10.248   4.669
  651    HB2  GLN 103           HB1      GLN 103  41.015  -7.694   5.403
  652    HB3  GLN 103           HB2      GLN 103  40.529  -8.380   6.962
  653    HG2  GLN 103           HG1      GLN 103  42.520 -10.084   6.266
  654    HG3  GLN 103           HG2      GLN 103  43.080  -8.577   5.527
  655   HE21  GLN 103          HE21      GLN 103  44.027  -7.099   6.771
  656   HE22  GLN 103          HE22      GLN 103  44.110  -7.150   8.496
  657    H    SER 104           H        SER 104  38.211 -11.195   4.931
  658    HA   SER 104           HA       SER 104  37.422 -11.666   7.582
  659    HB2  SER 104           HB1      SER 104  36.497 -12.353   5.010
  660    HB3  SER 104           HB2      SER 104  36.732 -13.887   5.868
  661    HG   SER 104           HG       SER 104  34.636 -12.932   6.193
  662    H    LEU 105           H        LEU 105  38.177 -12.972   9.116
  663    HA   LEU 105           HA       LEU 105  40.568 -14.444   8.755
  664    HB2  LEU 105           HB1      LEU 105  38.853 -13.656  10.924
  665    HB3  LEU 105           HB2      LEU 105  39.295 -15.364  11.087
  666    HG   LEU 105           HG       LEU 105  41.416 -13.303  10.620
  667   HD11  LEU 105          HD11      LEU 105  41.303 -13.845  13.371
  668   HD12  LEU 105          HD12      LEU 105  39.668 -13.395  12.889
  669   HD13  LEU 105          HD13      LEU 105  41.015 -12.306  12.558
  670   HD21  LEU 105          HD21      LEU 105  41.253 -16.071  11.754
  671   HD22  LEU 105          HD22      LEU 105  42.610 -15.011  12.137
  672   HD23  LEU 105          HD23      LEU 105  42.282 -15.455  10.462
  673    H    GLU 106           H        GLU 106  40.697 -16.796   9.557
  674    HA   GLU 106           HA       GLU 106  38.456 -18.497   9.078
  675    HB2  GLU 106           HB1      GLU 106  39.408 -19.679   7.113
  676    HB3  GLU 106           HB2      GLU 106  38.919 -18.014   6.760
  677    HG2  GLU 106           HG1      GLU 106  41.533 -17.670   7.447
  678    HG3  GLU 106           HG2      GLU 106  41.565 -19.259   6.669
  679    HE2  GLU 106           HE       GLU 106  40.289 -17.707   3.662
  680    H    HIS 107           H        HIS 107  39.880 -18.415  11.294
  681    HA   HIS 107           HA       HIS 107  42.139 -20.179  11.291
  682    HB2  HIS 107           HB1      HIS 107  41.213 -18.274  13.016
  683    HB3  HIS 107           HB2      HIS 107  40.726 -19.756  13.844
  684    HD1  HIS 107           HD1      HIS 107  43.671 -17.672  13.121
  685    HD2  HIS 107           HD2      HIS 107  42.903 -21.495  14.555
  686    HE1  HIS 107           HE1      HIS 107  45.825 -18.444  14.162
  687    HE2  HIS 107           HE2      HIS 107  45.358 -20.782  15.038
  688    H    HIS 108           H        HIS 108  42.147 -22.326  11.383
  689    HA   HIS 108           HA       HIS 108  40.257 -23.864  12.829
  690    HB2  HIS 108           HB1      HIS 108  39.223 -23.068  10.446
  691    HB3  HIS 108           HB2      HIS 108  39.998 -24.584   9.974
  692    HD1  HIS 108           HD1      HIS 108  39.279 -26.723  11.541
  693    HD2  HIS 108           HD2      HIS 108  36.746 -23.430  11.516
  694    HE1  HIS 108           HE1      HIS 108  37.073 -27.566  12.406
  695    HE2  HIS 108           HE2      HIS 108  35.523 -25.554  12.392
  696    H    HIS 109           H        HIS 109  41.225 -25.702  13.405
  697    HA   HIS 109           HA       HIS 109  43.711 -26.437  12.068
  698    HB2  HIS 109           HB1      HIS 109  42.458 -27.433  14.641
  699    HB3  HIS 109           HB2      HIS 109  44.035 -27.937  14.023
  700    HD1  HIS 109           HD1      HIS 109  43.496 -26.385  16.762
  701    HD2  HIS 109           HD2      HIS 109  44.934 -24.746  13.224
  702    HE1  HIS 109           HE1      HIS 109  44.744 -24.310  17.440
  703    HE2  HIS 109           HE2      HIS 109  45.622 -23.308  15.280
  704    H    HIS 110           H        HIS 110  44.044 -29.014  12.297
  705    HA   HIS 110           HA       HIS 110  41.784 -30.206  10.831
  706    HB2  HIS 110           HB1      HIS 110  44.734 -30.883  10.701
  707    HB3  HIS 110           HB2      HIS 110  43.460 -31.718   9.807
  708    HD1  HIS 110           HD1      HIS 110  45.468 -28.584   9.802
  709    HD2  HIS 110           HD2      HIS 110  42.376 -30.301   7.623
  710    HE1  HIS 110           HE1      HIS 110  45.276 -27.205   7.708
  711    HE2  HIS 110           HE2      HIS 110  43.387 -28.255   6.375
  712    H    HIS 111           H        HIS 111  44.253 -30.793  13.286
  713    HA   HIS 111           HA       HIS 111  42.683 -33.113  14.202
  714    HB2  HIS 111           HB1      HIS 111  45.422 -32.965  13.474
  715    HB3  HIS 111           HB2      HIS 111  45.361 -33.184  15.226
  716    HD1  HIS 111           HD1      HIS 111  43.754 -34.808  12.177
  717    HD2  HIS 111           HD2      HIS 111  45.173 -35.774  15.961
  718    HE1  HIS 111           HE1      HIS 111  43.516 -37.305  12.369
  719    HE2  HIS 111           HE2      HIS 111  44.384 -37.896  14.679
  720    H    HIS 112           H        HIS 112  42.754 -33.521  16.528
  721    HA   HIS 112           HA       HIS 112  42.373 -31.085  18.003
  722    HB2  HIS 112           HB1      HIS 112  41.543 -33.799  18.225
  723    HB3  HIS 112           HB2      HIS 112  42.379 -33.370  19.721
  724    HD1  HIS 112           HD1      HIS 112  39.699 -31.758  17.542
  725    HD2  HIS 112           HD2      HIS 112  40.713 -32.279  21.536
  726    HE1  HIS 112           HE1      HIS 112  37.845 -30.677  18.852
  727    HE2  HIS 112           HE2      HIS 112  38.464 -30.993  21.293
  Start of MODEL   34
    1    H1   MET  18           H        MET  18  25.096 -27.553   7.344
    2    HA   MET  18           HA       MET  18  24.674 -28.657   5.376
    3    HB2  MET  18           HB1      MET  18  22.265 -27.571   6.522
    4    HB3  MET  18           HB2      MET  18  22.107 -27.661   4.763
    5    HG2  MET  18           HG1      MET  18  21.802 -29.858   4.820
    6    HG3  MET  18           HG2      MET  18  23.278 -30.079   5.765
    7    HE1  MET  18           HE1      MET  18  23.159 -31.435   7.656
    8    HE2  MET  18           HE2      MET  18  21.723 -31.825   8.602
    9    HE3  MET  18           HE3      MET  18  21.811 -32.285   6.901
   10    H    LEU  19           H        LEU  19  24.350 -28.531   3.078
   11    HA   LEU  19           HA       LEU  19  25.304 -26.024   1.995
   12    HB2  LEU  19           HB1      LEU  19  26.012 -28.452   1.362
   13    HB3  LEU  19           HB2      LEU  19  24.565 -28.402   0.340
   14    HG   LEU  19           HG       LEU  19  25.946 -26.065  -0.288
   15   HD11  LEU  19          HD11      LEU  19  27.838 -27.360   0.976
   16   HD12  LEU  19          HD12      LEU  19  28.178 -26.523  -0.538
   17   HD13  LEU  19          HD13      LEU  19  27.936 -28.270  -0.532
   18   HD21  LEU  19          HD21      LEU  19  25.338 -28.666  -1.557
   19   HD22  LEU  19          HD22      LEU  19  26.579 -27.679  -2.326
   20   HD23  LEU  19          HD23      LEU  19  24.958 -27.027  -2.085
   21    H    VAL  20           H        VAL  20  22.400 -28.018   1.826
   22    HA   VAL  20           HA       VAL  20  21.108 -26.045   0.091
   23    HB   VAL  20           HB       VAL  20  20.897 -28.462  -0.461
   24   HG11  VAL  20          HG11      VAL  20  18.897 -28.866   1.678
   25   HG12  VAL  20          HG12      VAL  20  20.009 -30.014   0.931
   26   HG13  VAL  20          HG13      VAL  20  20.591 -28.896   2.166
   27   HG21  VAL  20          HG21      VAL  20  18.815 -28.181  -1.325
   28   HG22  VAL  20          HG22      VAL  20  18.134 -27.622   0.202
   29   HG23  VAL  20          HG23      VAL  20  19.094 -26.523  -0.789
   30    H    LEU  21           H        LEU  21  19.249 -24.938   0.670
   31    HA   LEU  21           HA       LEU  21  18.995 -24.249   3.409
   32    HB2  LEU  21           HB1      LEU  21  18.169 -23.203   0.944
   33    HB3  LEU  21           HB2      LEU  21  16.679 -23.538   1.845
   34    HG   LEU  21           HG       LEU  21  17.447 -21.223   2.127
   35   HD11  LEU  21          HD11      LEU  21  17.280 -21.140   4.544
   36   HD12  LEU  21          HD12      LEU  21  17.658 -22.859   4.650
   37   HD13  LEU  21          HD13      LEU  21  16.155 -22.332   3.894
   38   HD21  LEU  21          HD21      LEU  21  19.495 -20.621   2.973
   39   HD22  LEU  21          HD22      LEU  21  19.932 -22.043   2.025
   40   HD23  LEU  21          HD23      LEU  21  19.744 -22.172   3.774
   41    H    ASP  22           H        ASP  22  17.892 -25.230   4.960
   42    HA   ASP  22           HA       ASP  22  16.237 -27.501   4.394
   43    HB2  ASP  22           HB1      ASP  22  17.786 -26.905   6.484
   44    HB3  ASP  22           HB2      ASP  22  16.259 -26.262   7.103
   45    HD2  ASP  22           HD       ASP  22  14.908 -29.422   7.514
   46    H    PHE  23           H        PHE  23  15.713 -24.134   5.091
   47    HA   PHE  23           HA       PHE  23  12.882 -24.496   5.603
   48    HB2  PHE  23           HB1      PHE  23  14.850 -22.371   5.945
   49    HB3  PHE  23           HB2      PHE  23  13.342 -21.773   5.246
   50    HD1  PHE  23           HD1      PHE  23  14.742 -23.606   8.134
   51    HD2  PHE  23           HD2      PHE  23  11.401 -21.506   6.541
   52    HE1  PHE  23           HE1      PHE  23  13.695 -23.589  10.360
   53    HE2  PHE  23           HE2      PHE  23  10.348 -21.485   8.764
   54    HZ   PHE  23           HZ       PHE  23  11.496 -22.528  10.679
   55    H    ASN  24           H        ASN  24  11.230 -23.466   4.329
   56    HA   ASN  24           HA       ASN  24  11.991 -23.070   1.511
   57    HB2  ASN  24           HB1      ASN  24   9.336 -24.239   2.319
   58    HB3  ASN  24           HB2      ASN  24  10.150 -24.315   0.751
   59   HD21  ASN  24          HD21      ASN  24   9.094 -26.403   2.615
   60   HD22  ASN  24          HD22      ASN  24  10.409 -27.505   2.825
   61    H    ASN  25           H        ASN  25  10.979 -21.434   0.404
   62    HA   ASN  25           HA       ASN  25   9.813 -19.352   1.998
   63    HB2  ASN  25           HB1      ASN  25  10.701 -19.667  -0.829
   64    HB3  ASN  25           HB2      ASN  25   9.504 -18.409  -0.490
   65   HD21  ASN  25          HD21      ASN  25  10.170 -16.523   0.289
   66   HD22  ASN  25          HD22      ASN  25  11.768 -16.183   0.851
   67    H    ILE  26           H        ILE  26   7.768 -19.512   2.650
   68    HA   ILE  26           HA       ILE  26   5.785 -20.777   0.913
   69    HB   ILE  26           HB       ILE  26   4.301 -20.756   2.842
   70   HG12  ILE  26          HG11      ILE  26   5.834 -20.092   5.029
   71   HG13  ILE  26          HG12      ILE  26   6.302 -18.859   3.845
   72   HG21  ILE  26          HG21      ILE  26   5.988 -22.571   2.525
   73   HG22  ILE  26          HG22      ILE  26   7.019 -21.739   3.688
   74   HG23  ILE  26          HG23      ILE  26   5.446 -22.360   4.190
   75   HD11  ILE  26          HD11      ILE  26   3.410 -19.351   4.136
   76   HD12  ILE  26          HD12      ILE  26   4.226 -18.569   5.489
   77   HD13  ILE  26          HD13      ILE  26   4.289 -17.845   3.882
   78    H    ARG  27           H        ARG  27   3.746 -19.766   0.492
   79    HA   ARG  27           HA       ARG  27   4.015 -16.896   0.090
   80    HB2  ARG  27           HB1      ARG  27   2.320 -19.066  -1.039
   81    HB3  ARG  27           HB2      ARG  27   1.643 -17.432  -1.023
   82    HG2  ARG  27           HG1      ARG  27   2.636 -17.362  -3.059
   83    HG3  ARG  27           HG2      ARG  27   4.011 -16.849  -2.068
   84    HD2  ARG  27           HD1      ARG  27   5.186 -18.561  -2.877
   85    HD3  ARG  27           HD2      ARG  27   4.065 -19.652  -2.052
   86    HE   ARG  27           HE       ARG  27   3.084 -20.132  -4.068
   87   HH11  ARG  27          HH11      ARG  27   5.108 -17.319  -4.405
   88   HH12  ARG  27          HH12      ARG  27   4.977 -17.272  -6.133
   89   HH21  ARG  27          HH21      ARG  27   2.904 -20.079  -6.342
   90   HH22  ARG  27          HH22      ARG  27   3.722 -18.841  -7.233
   91    H    SER  28           H        SER  28   2.144 -15.478   0.528
   92    HA   SER  28           HA       SER  28   0.598 -16.341   2.878
   93    HB2  SER  28           HB1      SER  28   2.687 -14.663   3.143
   94    HB3  SER  28           HB2      SER  28   1.421 -13.490   2.741
   95    HG   SER  28           HG       SER  28   1.099 -15.446   4.762
   96    H    SER  29           H        SER  29  -1.495 -15.643   2.990
   97    HA   SER  29           HA       SER  29  -2.545 -14.397   0.560
   98    HB2  SER  29           HB1      SER  29  -4.022 -15.766   2.831
   99    HB3  SER  29           HB2      SER  29  -4.729 -15.220   1.301
  100    HG   SER  29           HG       SER  29  -4.212 -17.123   0.592
  101    H    ALA  30           H        ALA  30  -4.485 -12.929   0.907
  102    HA   ALA  30           HA       ALA  30  -4.316 -11.314   3.332
  103    HB1  ALA  30           HB1      ALA  30  -4.406  -9.643   0.939
  104    HB2  ALA  30           HB2      ALA  30  -3.455  -9.466   2.414
  105    HB3  ALA  30           HB3      ALA  30  -2.894 -10.534   1.127
  106    H    ASP  31           H        ASP  31  -6.391 -11.820   3.907
  107    HA   ASP  31           HA       ASP  31  -8.572 -11.721   2.048
  108    HB2  ASP  31           HB1      ASP  31  -8.481 -11.939   5.068
  109    HB3  ASP  31           HB2      ASP  31  -9.972 -12.004   4.119
  110    HD2  ASP  31           HD       ASP  31  -9.331 -15.231   3.033
  111    H    LEU  32           H        LEU  32  -9.668  -9.990   1.420
  112    HA   LEU  32           HA       LEU  32  -9.292  -7.477   2.878
  113    HB2  LEU  32           HB1      LEU  32 -10.442  -7.975   0.126
  114    HB3  LEU  32           HB2      LEU  32 -10.133  -6.393   0.860
  115    HG   LEU  32           HG       LEU  32  -7.967  -8.399   0.251
  116   HD11  LEU  32          HD11      LEU  32  -8.694  -5.970  -1.368
  117   HD12  LEU  32          HD12      LEU  32  -9.206  -7.606  -1.779
  118   HD13  LEU  32          HD13      LEU  32  -7.490  -7.203  -1.743
  119   HD21  LEU  32          HD21      LEU  32  -6.825  -5.948   0.262
  120   HD22  LEU  32          HD22      LEU  32  -6.888  -7.018   1.662
  121   HD23  LEU  32          HD23      LEU  32  -8.081  -5.730   1.481
  122    H    HIS  33           H        HIS  33 -11.240  -5.978   2.837
  123    HA   HIS  33           HA       HIS  33 -13.853  -7.102   2.749
  124    HB2  HIS  33           HB1      HIS  33 -13.052  -8.124   4.851
  125    HB3  HIS  33           HB2      HIS  33 -12.723  -6.513   5.494
  126    HD1  HIS  33           HD1      HIS  33 -15.859  -7.511   3.626
  127    HD2  HIS  33           HD2      HIS  33 -14.645  -6.391   7.438
  128    HE1  HIS  33           HE1      HIS  33 -17.978  -7.215   4.946
  129    HE2  HIS  33           HE2      HIS  33 -17.238  -6.531   7.276
  130    H    GLY  34           H        GLY  34 -15.439  -5.538   2.785
  131    HA2  GLY  34           HA2      GLY  34 -16.371  -3.427   2.886
  132    HA3  GLY  34           HA3      GLY  34 -14.958  -2.893   3.786
  133    HA1  GLY  34           HA1      GLY  34 -16.008  -3.880   2.222
  134    H    ALA  35           H        ALA  35 -13.737  -1.435   2.807
  135    HA   ALA  35           HA       ALA  35 -12.815  -0.110   1.201
  136    HB1  ALA  35           HB1      ALA  35 -11.529  -1.913   0.474
  137    HB2  ALA  35           HB2      ALA  35 -12.923  -2.761  -0.196
  138    HB3  ALA  35           HB3      ALA  35 -12.291  -1.324  -1.003
  139    H    ARG  36           H        ARG  36 -15.655  -0.024   1.504
  140    HA   ARG  36           HA       ARG  36 -16.432   0.754  -1.230
  141    HB2  ARG  36           HB1      ARG  36 -18.370  -0.186   0.885
  142    HB3  ARG  36           HB2      ARG  36 -18.666   0.040  -0.845
  143    HG2  ARG  36           HG1      ARG  36 -16.839  -1.800  -1.133
  144    HG3  ARG  36           HG2      ARG  36 -17.246  -2.179   0.550
  145    HD2  ARG  36           HD1      ARG  36 -19.713  -2.136  -0.306
  146    HD3  ARG  36           HD2      ARG  36 -18.962  -2.349  -1.894
  147    HE   ARG  36           HE       ARG  36 -18.018  -4.234   0.050
  148   HH11  ARG  36          HH11      ARG  36 -20.545  -3.532  -2.241
  149   HH12  ARG  36          HH12      ARG  36 -20.980  -5.193  -2.466
  150   HH21  ARG  36          HH21      ARG  36 -18.584  -6.425  -0.238
  151   HH22  ARG  36          HH22      ARG  36 -19.866  -6.838  -1.326
  152    H    LYS  37           H        LYS  37 -16.163   2.912  -1.182
  153    HA   LYS  37           HA       LYS  37 -17.878   4.440   0.596
  154    HB2  LYS  37           HB1      LYS  37 -16.050   5.976   1.259
  155    HB3  LYS  37           HB2      LYS  37 -15.839   4.335   1.896
  156    HG2  LYS  37           HG1      LYS  37 -14.531   4.563  -0.653
  157    HG3  LYS  37           HG2      LYS  37 -13.998   5.858   0.435
  158    HD2  LYS  37           HD1      LYS  37 -14.182   3.140   1.610
  159    HD3  LYS  37           HD2      LYS  37 -12.898   3.410   0.417
  160    HE2  LYS  37           HE1      LYS  37 -11.740   4.828   1.764
  161    HE3  LYS  37           HE2      LYS  37 -13.212   5.500   2.479
  162    HZ1  LYS  37           HZ1      LYS  37 -11.599   3.256   3.348
  163    HZ2  LYS  37           HZ2      LYS  37 -13.270   3.012   3.441
  164    HZ3  LYS  37           HZ3      LYS  37 -12.561   4.315   4.253
  165    H    GLY  38           H        GLY  38 -17.419   6.930   0.048
  166    HA2  GLY  38           HA2      GLY  38 -18.048   7.175  -2.742
  167    HA3  GLY  38           HA3      GLY  38 -17.939   8.487  -1.577
  168    HA1  GLY  38           HA1      GLY  38 -17.319   6.710  -2.565
  169    H    SER  39           H        SER  39 -15.652   9.027  -0.874
  170    HA   SER  39           HA       SER  39 -14.166   9.843  -3.086
  171    HB2  SER  39           HB1      SER  39 -14.065  10.224  -0.305
  172    HB3  SER  39           HB2      SER  39 -12.485   9.550  -0.746
  173    HG   SER  39           HG       SER  39 -12.700  11.243  -2.545
  174    H    GLN  40           H        GLN  40 -12.106   9.186  -3.865
  175    HA   GLN  40           HA       GLN  40 -11.842   6.473  -4.400
  176    HB2  GLN  40           HB1      GLN  40 -10.666   8.731  -5.338
  177    HB3  GLN  40           HB2      GLN  40  -9.336   8.035  -4.401
  178    HG2  GLN  40           HG1      GLN  40  -8.932   6.470  -5.925
  179    HG3  GLN  40           HG2      GLN  40 -10.646   6.048  -6.046
  180   HE21  GLN  40          HE21      GLN  40  -8.049   7.332  -7.658
  181   HE22  GLN  40          HE22      GLN  40  -8.885   8.106  -8.957
  182    H    CYS  41           H        CYS  41  -9.904   8.446  -2.149
  183    HA   CYS  41           HA       CYS  41  -9.710   6.255  -0.295
  184    HB2  CYS  41           HB1      CYS  41  -7.226   6.196  -0.294
  185    HB3  CYS  41           HB2      CYS  41  -7.937   5.583  -1.788
  186    H    LEU  42           H        LEU  42  -9.044   6.899   1.757
  187    HA   LEU  42           HA       LEU  42  -8.964   9.804   2.139
  188    HB2  LEU  42           HB1      LEU  42 -10.338   7.719   3.435
  189    HB3  LEU  42           HB2      LEU  42  -9.118   8.301   4.582
  190    HG   LEU  42           HG       LEU  42 -10.963  10.226   3.212
  191   HD11  LEU  42          HD11      LEU  42 -11.659   9.178   5.902
  192   HD12  LEU  42          HD12      LEU  42 -12.088   8.206   4.494
  193   HD13  LEU  42          HD13      LEU  42 -12.694   9.855   4.645
  194   HD21  LEU  42          HD21      LEU  42  -9.122  11.217   4.370
  195   HD22  LEU  42          HD22      LEU  42  -9.412  10.220   5.796
  196   HD23  LEU  42          HD23      LEU  42 -10.573  11.469   5.342
  197    H    SER  43           H        SER  43  -7.090   6.918   2.535
  198    HA   SER  43           HA       SER  43  -4.775   8.511   3.256
  199    HB2  SER  43           HB1      SER  43  -6.018   7.696   5.394
  200    HB3  SER  43           HB2      SER  43  -5.357   6.107   4.966
  201    HG   SER  43           HG       SER  43  -4.084   7.637   6.397
  202    H    ASP  44           H        ASP  44  -2.823   6.892   3.544
  203    HA   ASP  44           HA       ASP  44  -2.512   5.576   1.065
  204    HB2  ASP  44           HB1      ASP  44  -0.837   6.422   3.141
  205    HB3  ASP  44           HB2      ASP  44  -0.628   4.666   3.074
  206    HD2  ASP  44           HD       ASP  44   1.244   6.727   0.448
  207    H    THR  45           H        THR  45  -3.625   4.520   4.169
  208    HA   THR  45           HA       THR  45  -3.207   1.725   3.760
  209    HB   THR  45           HB       THR  45  -5.120   1.679   5.609
  210    HG1  THR  45           HG1      THR  45  -5.426   3.575   6.595
  211   HG21  THR  45          HG21      THR  45  -2.743   1.025   5.889
  212   HG22  THR  45          HG22      THR  45  -3.403   1.844   7.305
  213   HG23  THR  45          HG23      THR  45  -2.345   2.715   6.195
  214    H    ASP  46           H        ASP  46  -5.666   3.988   2.852
  215    HA   ASP  46           HA       ASP  46  -7.777   2.137   2.434
  216    HB2  ASP  46           HB1      ASP  46  -7.226   4.929   1.432
  217    HB3  ASP  46           HB2      ASP  46  -8.646   4.017   0.903
  218    HD2  ASP  46           HD       ASP  46  -9.955   5.687   3.692
  219    H    CYS  47           H        CYS  47  -5.010   3.090   0.573
  220    HA   CYS  47           HA       CYS  47  -6.035   1.755  -1.821
  221    HB2  CYS  47           HB1      CYS  47  -3.693   3.562  -1.271
  222    HB3  CYS  47           HB2      CYS  47  -3.761   2.597  -2.747
  223    H    ASN  48           H        ASN  48  -5.953  -0.398  -1.104
  224    HA   ASN  48           HA       ASN  48  -3.668  -1.603   0.033
  225    HB2  ASN  48           HB1      ASN  48  -5.841  -2.952  -1.592
  226    HB3  ASN  48           HB2      ASN  48  -4.769  -3.718  -0.412
  227   HD21  ASN  48          HD21      ASN  48  -5.295  -3.708   1.691
  228   HD22  ASN  48          HD22      ASN  48  -6.700  -2.944   2.347
  229    H    THR  49           H        THR  49  -4.714  -1.114  -3.281
  230    HA   THR  49           HA       THR  49  -2.979  -2.862  -4.592
  231    HB   THR  49           HB       THR  49  -3.276  -0.397  -6.078
  232    HG1  THR  49           HG1      THR  49  -5.097   0.134  -5.034
  233   HG21  THR  49          HG21      THR  49  -3.732  -1.845  -7.736
  234   HG22  THR  49          HG22      THR  49  -4.962  -2.682  -6.789
  235   HG23  THR  49          HG23      THR  49  -3.259  -3.089  -6.580
  236    H    ARG  50           H        ARG  50  -1.297  -1.744  -6.246
  237    HA   ARG  50           HA       ARG  50   0.841  -0.822  -4.540
  238    HB2  ARG  50           HB1      ARG  50   0.908  -1.141  -7.544
  239    HB3  ARG  50           HB2      ARG  50   2.275  -1.154  -6.419
  240    HG2  ARG  50           HG1      ARG  50   0.103  -3.250  -6.529
  241    HG3  ARG  50           HG2      ARG  50   1.714  -3.395  -7.253
  242    HD2  ARG  50           HD1      ARG  50   2.303  -2.667  -4.668
  243    HD3  ARG  50           HD2      ARG  50   0.876  -3.693  -4.469
  244    HE   ARG  50           HE       ARG  50   2.173  -5.499  -4.968
  245   HH11  ARG  50          HH11      ARG  50   3.724  -2.641  -6.213
  246   HH12  ARG  50          HH12      ARG  50   5.151  -3.480  -6.725
  247   HH21  ARG  50          HH21      ARG  50   4.046  -6.615  -5.638
  248   HH22  ARG  50          HH22      ARG  50   5.332  -5.741  -6.398
  249    H    LYS  51           H        LYS  51  -0.821   1.136  -4.262
  250    HA   LYS  51           HA       LYS  51   0.425   3.345  -5.660
  251    HB2  LYS  51           HB1      LYS  51  -2.456   2.584  -6.012
  252    HB3  LYS  51           HB2      LYS  51  -1.987   4.292  -6.053
  253    HG2  LYS  51           HG1      LYS  51  -1.608   4.010  -8.225
  254    HG3  LYS  51           HG2      LYS  51  -0.166   3.098  -7.741
  255    HD2  LYS  51           HD1      LYS  51  -1.085   1.434  -8.950
  256    HD3  LYS  51           HD2      LYS  51  -2.081   1.188  -7.504
  257    HE2  LYS  51           HE1      LYS  51  -3.380   3.221  -8.915
  258    HE3  LYS  51           HE2      LYS  51  -2.853   2.070 -10.151
  259    HZ1  LYS  51           HZ1      LYS  51  -4.784   1.083  -9.584
  260    HZ2  LYS  51           HZ2      LYS  51  -4.811   1.737  -8.025
  261    HZ3  LYS  51           HZ3      LYS  51  -3.841   0.392  -8.361
  262    H    PHE  52           H        PHE  52   0.245   5.314  -4.570
  263    HA   PHE  52           HA       PHE  52  -0.751   5.070  -1.818
  264    HB2  PHE  52           HB1      PHE  52   0.820   6.743  -1.177
  265    HB3  PHE  52           HB2      PHE  52   1.683   5.612  -2.219
  266    HD1  PHE  52           HD1      PHE  52   2.474   6.248  -4.399
  267    HD2  PHE  52           HD2      PHE  52   0.296   8.989  -1.978
  268    HE1  PHE  52           HE1      PHE  52   3.174   8.095  -5.866
  269    HE2  PHE  52           HE2      PHE  52   0.992  10.841  -3.441
  270    HZ   PHE  52           HZ       PHE  52   2.432  10.394  -5.389
  271    H    CYS  53           H        CYS  53  -2.016   6.692  -0.890
  272    HA   CYS  53           HA       CYS  53  -3.807   8.000  -2.697
  273    HB2  CYS  53           HB1      CYS  53  -4.258   7.012  -0.326
  274    HB3  CYS  53           HB2      CYS  53  -3.691   8.583   0.246
  275    H    LEU  54           H        LEU  54  -3.118   9.725  -3.799
  276    HA   LEU  54           HA       LEU  54  -1.365  11.672  -2.508
  277    HB2  LEU  54           HB1      LEU  54  -0.852  10.789  -4.785
  278    HB3  LEU  54           HB2      LEU  54  -2.330  11.579  -5.362
  279    HG   LEU  54           HG       LEU  54  -0.583  13.447  -3.994
  280   HD11  LEU  54          HD11      LEU  54   1.380  12.660  -4.725
  281   HD12  LEU  54          HD12      LEU  54   0.865  13.271  -6.297
  282   HD13  LEU  54          HD13      LEU  54   0.623  11.572  -5.889
  283   HD21  LEU  54          HD21      LEU  54  -1.053  13.792  -6.847
  284   HD22  LEU  54          HD22      LEU  54  -1.484  14.836  -5.492
  285   HD23  LEU  54          HD23      LEU  54  -2.531  13.486  -5.933
  286    H    GLN  55           H        GLN  55  -2.123  13.483  -1.649
  287    HA   GLN  55           HA       GLN  55  -4.835  14.354  -2.386
  288    HB2  GLN  55           HB1      GLN  55  -4.792  13.829  -0.079
  289    HB3  GLN  55           HB2      GLN  55  -3.245  14.659   0.154
  290    HG2  GLN  55           HG1      GLN  55  -4.222  16.621   0.534
  291    HG3  GLN  55           HG2      GLN  55  -5.294  16.438  -0.861
  292   HE21  GLN  55          HE21      GLN  55  -4.841  15.155   2.413
  293   HE22  GLN  55          HE22      GLN  55  -6.522  15.080   2.802
  294    HA   PRO  56           HA       PRO  56  -2.193  17.608  -4.229
  295    HB2  PRO  56           HB1      PRO  56  -3.945  18.183  -6.253
  296    HB3  PRO  56           HB2      PRO  56  -2.778  16.863  -6.322
  297    HG2  PRO  56           HG1      PRO  56  -5.685  16.793  -5.585
  298    HG3  PRO  56           HG2      PRO  56  -4.755  15.690  -6.668
  299    HD2  PRO  56           HD1      PRO  56  -5.402  15.035  -4.114
  300    HD3  PRO  56           HD2      PRO  56  -3.898  14.505  -4.887
  301    H    ARG  57           H        ARG  57  -2.399  19.842  -4.155
  302    HA   ARG  57           HA       ARG  57  -4.492  20.831  -2.423
  303    HB2  ARG  57           HB1      ARG  57  -3.241  22.977  -2.553
  304    HB3  ARG  57           HB2      ARG  57  -2.251  21.612  -2.013
  305    HG2  ARG  57           HG1      ARG  57  -0.789  21.963  -3.635
  306    HG3  ARG  57           HG2      ARG  57  -2.070  21.821  -4.852
  307    HD2  ARG  57           HD1      ARG  57  -2.621  24.290  -3.999
  308    HD3  ARG  57           HD2      ARG  57  -0.897  24.241  -3.601
  309    HE   ARG  57           HE       ARG  57  -2.050  24.426  -6.207
  310   HH11  ARG  57          HH11      ARG  57   0.699  23.255  -4.421
  311   HH12  ARG  57          HH12      ARG  57   1.774  23.324  -5.778
  312   HH21  ARG  57          HH21      ARG  57  -0.644  24.521  -8.002
  313   HH22  ARG  57          HH22      ARG  57   1.009  24.044  -7.814
  314    H    ASP  58           H        ASP  58  -3.706  20.871  -5.801
  315    HA   ASP  58           HA       ASP  58  -5.627  22.978  -6.386
  316    HB2  ASP  58           HB1      ASP  58  -3.306  21.967  -7.658
  317    HB3  ASP  58           HB2      ASP  58  -4.666  21.643  -8.741
  318    HD2  ASP  58           HD       ASP  58  -5.000  24.958  -9.564
  319    H    GLU  59           H        GLU  59  -5.444  19.537  -6.304
  320    HA   GLU  59           HA       GLU  59  -8.124  19.382  -7.518
  321    HB2  GLU  59           HB1      GLU  59  -5.689  17.943  -8.158
  322    HB3  GLU  59           HB2      GLU  59  -6.993  16.835  -7.708
  323    HG2  GLU  59           HG1      GLU  59  -7.996  17.091  -9.664
  324    HG3  GLU  59           HG2      GLU  59  -7.984  18.852  -9.491
  325    HE2  GLU  59           HE       GLU  59  -5.578  19.112 -11.897
  326    H    LYS  60           H        LYS  60  -9.014  17.007  -6.884
  327    HA   LYS  60           HA       LYS  60  -9.255  17.113  -3.995
  328    HB2  LYS  60           HB1      LYS  60 -10.789  15.961  -6.242
  329    HB3  LYS  60           HB2      LYS  60 -10.814  15.016  -4.742
  330    HG2  LYS  60           HG1      LYS  60 -12.007  16.576  -3.596
  331    HG3  LYS  60           HG2      LYS  60 -11.333  17.925  -4.527
  332    HD2  LYS  60           HD1      LYS  60 -12.684  17.183  -6.489
  333    HD3  LYS  60           HD2      LYS  60 -13.438  15.966  -5.444
  334    HE2  LYS  60           HE1      LYS  60 -13.507  18.607  -4.231
  335    HE3  LYS  60           HE2      LYS  60 -14.279  18.589  -5.823
  336    HZ1  LYS  60           HZ1      LYS  60 -14.945  16.871  -3.498
  337    HZ2  LYS  60           HZ2      LYS  60 -15.579  16.634  -5.049
  338    HZ3  LYS  60           HZ3      LYS  60 -15.917  18.061  -4.206
  339    HA   PRO  61           HA       PRO  61  -6.686  13.705  -2.974
  340    HB2  PRO  61           HB1      PRO  61  -8.127  12.438  -1.020
  341    HB3  PRO  61           HB2      PRO  61  -7.330  13.993  -0.788
  342    HG2  PRO  61           HG1      PRO  61 -10.194  13.406  -1.458
  343    HG3  PRO  61           HG2      PRO  61  -9.520  14.560  -0.248
  344    HD2  PRO  61           HD1      PRO  61 -10.445  15.353  -2.673
  345    HD3  PRO  61           HD2      PRO  61  -9.085  16.149  -1.859
  346    H    PHE  62           H        PHE  62  -6.268  11.903  -4.072
  347    HA   PHE  62           HA       PHE  62  -8.240   9.809  -4.318
  348    HB2  PHE  62           HB1      PHE  62  -8.347   9.712  -6.691
  349    HB3  PHE  62           HB2      PHE  62  -8.682  11.386  -6.244
  350    HD1  PHE  62           HD1      PHE  62  -6.458  12.888  -6.065
  351    HD2  PHE  62           HD2      PHE  62  -6.934   9.416  -8.481
  352    HE1  PHE  62           HE1      PHE  62  -4.654  13.673  -7.543
  353    HE2  PHE  62           HE2      PHE  62  -5.129  10.194  -9.961
  354    HZ   PHE  62           HZ       PHE  62  -3.986  12.324  -9.492
  355    H    CYS  63           H        CYS  63  -7.252   7.967  -5.733
  356    HA   CYS  63           HA       CYS  63  -4.602   7.471  -4.649
  357    HB2  CYS  63           HB1      CYS  63  -6.713   5.853  -4.829
  358    HB3  CYS  63           HB2      CYS  63  -5.987   5.490  -6.395
  359    H    ALA  64           H        ALA  64  -2.850   8.008  -5.754
  360    HA   ALA  64           HA       ALA  64  -2.988   8.072  -8.694
  361    HB1  ALA  64           HB1      ALA  64  -2.326  10.189  -8.198
  362    HB2  ALA  64           HB2      ALA  64  -1.545   9.712  -6.690
  363    HB3  ALA  64           HB3      ALA  64  -0.741   9.414  -8.231
  364    H    THR  65           H        THR  65  -0.940   7.513  -9.827
  365    HA   THR  65           HA       THR  65  -0.130   4.908  -9.226
  366    HB   THR  65           HB       THR  65   1.944   5.948 -10.761
  367    HG1  THR  65           HG1      THR  65   0.776   7.242 -12.303
  368   HG21  THR  65          HG21      THR  65   0.528   5.013 -12.680
  369   HG22  THR  65          HG22      THR  65  -0.670   4.627 -11.444
  370   HG23  THR  65          HG23      THR  65   0.939   3.910 -11.366
  371    H    CYS  66           H        CYS  66   1.906   4.075  -8.554
  372    HA   CYS  66           HA       CYS  66   3.083   5.605  -6.402
  373    HB2  CYS  66           HB1      CYS  66   2.668   2.889  -6.908
  374    HB3  CYS  66           HB2      CYS  66   4.417   3.095  -7.016
  375    H    ARG  67           H        ARG  67   5.538   5.496  -6.162
  376    HA   ARG  67           HA       ARG  67   6.717   6.429  -8.680
  377    HB2  ARG  67           HB1      ARG  67   7.776   6.780  -5.867
  378    HB3  ARG  67           HB2      ARG  67   8.349   7.590  -7.330
  379    HG2  ARG  67           HG1      ARG  67   5.715   8.288  -7.336
  380    HG3  ARG  67           HG2      ARG  67   6.076   8.222  -5.602
  381    HD2  ARG  67           HD1      ARG  67   7.763   9.854  -5.762
  382    HD3  ARG  67           HD2      ARG  67   7.873   9.671  -7.518
  383    HE   ARG  67           HE       ARG  67   6.074  11.358  -6.082
  384   HH11  ARG  67          HH11      ARG  67   6.449   9.480  -8.988
  385   HH12  ARG  67          HH12      ARG  67   5.321  10.427  -9.902
  386   HH21  ARG  67          HH21      ARG  67   4.588  12.612  -7.273
  387   HH22  ARG  67          HH22      ARG  67   4.264  12.209  -8.925
  388    H    GLY  68           H        GLY  68   8.426   5.440  -9.609
  389    HA2  GLY  68           HA2      GLY  68   9.132   2.809  -8.682
  390    HA3  GLY  68           HA3      GLY  68   9.746   3.609 -10.121
  391    HA1  GLY  68           HA1      GLY  68   9.188   3.450  -8.076
  392    H    LEU  69           H        LEU  69  11.661   2.335  -9.089
  393    HA   LEU  69           HA       LEU  69  12.967   3.482  -6.843
  394    HB2  LEU  69           HB1      LEU  69  13.719   1.550  -8.996
  395    HB3  LEU  69           HB2      LEU  69  14.990   2.249  -7.977
  396    HG   LEU  69           HG       LEU  69  12.635   0.640  -6.988
  397   HD11  LEU  69          HD11      LEU  69  13.930  -1.208  -6.982
  398   HD12  LEU  69          HD12      LEU  69  15.411  -0.305  -6.669
  399   HD13  LEU  69          HD13      LEU  69  14.746  -0.368  -8.301
  400   HD21  LEU  69          HD21      LEU  69  14.946   1.961  -5.590
  401   HD22  LEU  69          HD22      LEU  69  14.034   0.634  -4.870
  402   HD23  LEU  69          HD23      LEU  69  13.221   2.147  -5.274
  403    H    ARG  70           H        ARG  70  12.904   4.223 -10.228
  404    HA   ARG  70           HA       ARG  70  15.206   6.010  -9.991
  405    HB2  ARG  70           HB1      ARG  70  13.621   4.901 -12.284
  406    HB3  ARG  70           HB2      ARG  70  14.592   6.364 -12.510
  407    HG2  ARG  70           HG1      ARG  70  16.389   4.718 -11.287
  408    HG3  ARG  70           HG2      ARG  70  15.433   3.576 -12.247
  409    HD2  ARG  70           HD1      ARG  70  15.816   5.625 -14.029
  410    HD3  ARG  70           HD2      ARG  70  17.329   5.635 -13.109
  411    HE   ARG  70           HE       ARG  70  16.539   3.015 -13.990
  412   HH11  ARG  70          HH11      ARG  70  18.222   5.940 -14.846
  413   HH12  ARG  70          HH12      ARG  70  19.229   5.170 -16.027
  414   HH21  ARG  70          HH21      ARG  70  17.858   1.989 -15.542
  415   HH22  ARG  70          HH22      ARG  70  19.021   2.923 -16.423
  416    H    ARG  71           H        ARG  71  12.260   6.310  -8.974
  417    HA   ARG  71           HA       ARG  71  11.675   8.908 -10.206
  418    HB2  ARG  71           HB1      ARG  71  10.057   6.839  -8.802
  419    HB3  ARG  71           HB2      ARG  71   9.554   8.528  -8.629
  420    HG2  ARG  71           HG1      ARG  71  10.052   7.280 -11.320
  421    HG3  ARG  71           HG2      ARG  71   8.484   7.186 -10.499
  422    HD2  ARG  71           HD1      ARG  71   8.772   9.785 -10.270
  423    HD3  ARG  71           HD2      ARG  71   9.901   9.566 -11.614
  424    HE   ARG  71           HE       ARG  71   7.045   9.422 -11.727
  425   HH11  ARG  71          HH11      ARG  71   9.997   8.291 -13.186
  426   HH12  ARG  71          HH12      ARG  71   9.271   7.982 -14.728
  427   HH21  ARG  71          HH21      ARG  71   6.077   9.020 -13.753
  428   HH22  ARG  71          HH22      ARG  71   7.040   8.398 -15.049
  429    H    ARG  72           H        ARG  72  11.413  10.773  -8.975
  430    HA   ARG  72           HA       ARG  72  12.962  10.824  -6.533
  431    HB2  ARG  72           HB1      ARG  72  11.529  13.079  -7.958
  432    HB3  ARG  72           HB2      ARG  72  12.738  13.247  -6.676
  433    HG2  ARG  72           HG1      ARG  72  13.897  11.669  -8.726
  434    HG3  ARG  72           HG2      ARG  72  13.138  13.080  -9.482
  435    HD2  ARG  72           HD1      ARG  72  14.941  13.311  -7.072
  436    HD3  ARG  72           HD2      ARG  72  15.554  13.341  -8.731
  437    HE   ARG  72           HE       ARG  72  14.269  15.471  -7.361
  438   HH11  ARG  72          HH11      ARG  72  14.619  14.009 -10.500
  439   HH12  ARG  72          HH12      ARG  72  14.302  15.477 -11.364
  440   HH21  ARG  72          HH21      ARG  72  13.850  17.411  -8.486
  441   HH22  ARG  72          HH22      ARG  72  13.866  17.412 -10.216
  442    H    CYS  73           H        CYS  73  12.228  11.320  -4.499
  443    HA   CYS  73           HA       CYS  73   9.332  11.662  -4.145
  444    HB2  CYS  73           HB1      CYS  73   9.436  10.112  -2.186
  445    HB3  CYS  73           HB2      CYS  73   9.702   9.323  -3.742
  446    H    GLN  74           H        GLN  74   8.716  12.633  -2.129
  447    HA   GLN  74           HA       GLN  74  10.855  14.312  -1.013
  448    HB2  GLN  74           HB1      GLN  74   7.860  14.732  -1.106
  449    HB3  GLN  74           HB2      GLN  74   9.000  15.813  -0.287
  450    HG2  GLN  74           HG1      GLN  74   9.818  16.680  -2.230
  451    HG3  GLN  74           HG2      GLN  74   9.492  15.202  -3.145
  452   HE21  GLN  74          HE21      GLN  74   7.711  17.713  -1.379
  453   HE22  GLN  74          HE22      GLN  74   6.441  17.870  -2.540
  454    H    ARG  75           H        ARG  75   8.259  12.106  -0.205
  455    HA   ARG  75           HA       ARG  75   9.165  12.154   2.599
  456    HB2  ARG  75           HB1      ARG  75   6.382  11.616   1.533
  457    HB3  ARG  75           HB2      ARG  75   6.867  11.471   3.229
  458    HG2  ARG  75           HG1      ARG  75   7.345  13.840   3.352
  459    HG3  ARG  75           HG2      ARG  75   6.985  14.017   1.628
  460    HD2  ARG  75           HD1      ARG  75   4.691  12.863   2.431
  461    HD3  ARG  75           HD2      ARG  75   5.150  13.693   3.924
  462    HE   ARG  75           HE       ARG  75   4.137  14.899   1.560
  463   HH11  ARG  75          HH11      ARG  75   6.352  15.405   4.198
  464   HH12  ARG  75          HH12      ARG  75   6.239  17.133   4.134
  465   HH21  ARG  75          HH21      ARG  75   3.979  17.172   1.465
  466   HH22  ARG  75          HH22      ARG  75   4.888  18.136   2.579
  467    H    ASP  76           H        ASP  76   8.874  10.100   3.761
  468    HA   ASP  76           HA       ASP  76   9.872   7.916   2.196
  469    HB2  ASP  76           HB1      ASP  76   8.957   7.814   5.078
  470    HB3  ASP  76           HB2      ASP  76  10.118   6.751   4.270
  471    HD2  ASP  76           HD       ASP  76  12.557   9.360   4.326
  472    H    ALA  77           H        ALA  77   6.817   8.714   3.760
  473    HA   ALA  77           HA       ALA  77   5.594   6.183   3.276
  474    HB1  ALA  77           HB1      ALA  77   3.534   7.249   3.979
  475    HB2  ALA  77           HB2      ALA  77   4.851   7.702   5.063
  476    HB3  ALA  77           HB3      ALA  77   4.284   8.840   3.841
  477    H    MET  78           H        MET  78   5.989   9.105   1.437
  478    HA   MET  78           HA       MET  78   3.898   8.890  -0.384
  479    HB2  MET  78           HB1      MET  78   6.544  10.199  -0.319
  480    HB3  MET  78           HB2      MET  78   5.888   9.901  -1.936
  481    HG2  MET  78           HG1      MET  78   3.817  11.087  -1.299
  482    HG3  MET  78           HG2      MET  78   4.540  11.435   0.273
  483    HE1  MET  78           HE1      MET  78   4.233  12.236  -3.379
  484    HE2  MET  78           HE2      MET  78   5.511  13.397  -3.739
  485    HE3  MET  78           HE3      MET  78   5.900  11.687  -3.550
  486    H    CYS  79           H        CYS  79   6.969   7.204  -0.239
  487    HA   CYS  79           HA       CYS  79   6.656   6.000  -2.842
  488    HB2  CYS  79           HB1      CYS  79   8.702   6.062  -0.723
  489    HB3  CYS  79           HB2      CYS  79   8.595   4.527  -1.587
  490    H    CYS  80           H        CYS  80   6.419   3.735  -3.222
  491    HA   CYS  80           HA       CYS  80   4.326   2.537  -1.812
  492    HB2  CYS  80           HB1      CYS  80   6.175   1.762  -3.976
  493    HB3  CYS  80           HB2      CYS  80   5.520   0.411  -3.049
  494    HA   PRO  81           HA       PRO  81   6.121   0.437   1.596
  495    HB2  PRO  81           HB1      PRO  81   4.755  -1.936   1.617
  496    HB3  PRO  81           HB2      PRO  81   4.031  -0.393   2.065
  497    HG2  PRO  81           HG1      PRO  81   3.925  -1.856  -0.550
  498    HG3  PRO  81           HG2      PRO  81   2.592  -1.054   0.362
  499    HD2  PRO  81           HD1      PRO  81   3.796   0.093  -1.784
  500    HD3  PRO  81           HD2      PRO  81   3.190   1.034  -0.411
  501    H    GLY  82           H        GLY  82   8.133  -0.336   1.654
  502    HA2  GLY  82           HA2      GLY  82   9.287  -2.592   1.483
  503    HA3  GLY  82           HA3      GLY  82   8.858  -2.499  -0.219
  504    HA1  GLY  82           HA1      GLY  82   9.366  -1.741   1.701
  505    H    THR  83           H        THR  83   9.369   0.481  -0.103
  506    HA   THR  83           HA       THR  83  12.312   0.328  -0.206
  507    HB   THR  83           HB       THR  83  12.256   2.052  -1.956
  508    HG1  THR  83           HG1      THR  83  10.259   3.029  -1.429
  509   HG21  THR  83          HG21      THR  83  11.951  -0.536  -2.346
  510   HG22  THR  83          HG22      THR  83  11.835   0.601  -3.690
  511   HG23  THR  83          HG23      THR  83  10.370  -0.036  -2.944
  512    H    LEU  84           H        LEU  84  13.285   2.642  -0.139
  513    HA   LEU  84           HA       LEU  84  11.861   4.279   1.843
  514    HB2  LEU  84           HB1      LEU  84  14.605   3.105   1.999
  515    HB3  LEU  84           HB2      LEU  84  14.300   4.690   2.730
  516    HG   LEU  84           HG       LEU  84  12.433   2.518   3.472
  517   HD11  LEU  84          HD11      LEU  84  14.408   1.225   3.585
  518   HD12  LEU  84          HD12      LEU  84  14.074   1.762   5.230
  519   HD13  LEU  84          HD13      LEU  84  15.328   2.560   4.282
  520   HD21  LEU  84          HD21      LEU  84  12.188   3.728   5.391
  521   HD22  LEU  84          HD22      LEU  84  12.668   5.019   4.289
  522   HD23  LEU  84          HD23      LEU  84  13.856   4.301   5.378
  523    H    CYS  85           H        CYS  85  12.212   6.486   1.729
  524    HA   CYS  85           HA       CYS  85  13.075   7.468  -0.826
  525    HB2  CYS  85           HB1      CYS  85  11.151   8.338   0.676
  526    HB3  CYS  85           HB2      CYS  85  12.422   9.204   1.541
  527    H    VAL  86           H        VAL  86  15.231   7.356  -1.153
  528    HA   VAL  86           HA       VAL  86  16.976   8.628   0.855
  529    HB   VAL  86           HB       VAL  86  17.743   6.542  -1.193
  530   HG11  VAL  86          HG11      VAL  86  19.607   6.861   0.951
  531   HG12  VAL  86          HG12      VAL  86  19.861   7.068  -0.782
  532   HG13  VAL  86          HG13      VAL  86  19.310   8.427   0.197
  533   HG21  VAL  86          HG21      VAL  86  18.180   5.247   1.028
  534   HG22  VAL  86          HG22      VAL  86  17.004   6.376   1.698
  535   HG23  VAL  86          HG23      VAL  86  16.549   5.321   0.361
  536    H    ASN  87           H        ASN  87  18.120  10.367   0.266
  537    HA   ASN  87           HA       ASN  87  18.825  12.140  -0.974
  538    HB2  ASN  87           HB1      ASN  87  19.302   9.867  -2.912
  539    HB3  ASN  87           HB2      ASN  87  19.830  11.523  -3.226
  540   HD21  ASN  87          HD21      ASN  87  21.724   9.668  -3.206
  541   HD22  ASN  87          HD22      ASN  87  22.691   9.767  -1.777
  542    H    ASP  88           H        ASP  88  16.042  11.738  -0.962
  543    HA   ASP  88           HA       ASP  88  14.155  12.515  -1.967
  544    HB2  ASP  88           HB1      ASP  88  16.236  14.204  -2.832
  545    HB3  ASP  88           HB2      ASP  88  15.282  13.833  -4.272
  546    HD2  ASP  88           HD       ASP  88  13.609  16.010  -1.423
  547    H    VAL  89           H        VAL  89  15.448   9.983  -2.810
  548    HA   VAL  89           HA       VAL  89  13.878   9.595  -5.244
  549    HB   VAL  89           HB       VAL  89  16.756   8.705  -5.000
  550   HG11  VAL  89          HG11      VAL  89  16.481   7.846  -7.265
  551   HG12  VAL  89          HG12      VAL  89  15.352   7.067  -6.155
  552   HG13  VAL  89          HG13      VAL  89  14.786   8.327  -7.252
  553   HG21  VAL  89          HG21      VAL  89  16.886  10.172  -7.133
  554   HG22  VAL  89          HG22      VAL  89  15.415  10.916  -6.507
  555   HG23  VAL  89          HG23      VAL  89  16.897  10.953  -5.551
  556    H    CYS  90           H        CYS  90  12.944   7.603  -5.410
  557    HA   CYS  90           HA       CYS  90  12.676   6.052  -3.069
  558    HB2  CYS  90           HB1      CYS  90  11.276   6.311  -5.412
  559    HB3  CYS  90           HB2      CYS  90  11.990   4.708  -5.593
  560    H    THR  91           H        THR  91  14.246   4.844  -2.239
  561    HA   THR  91           HA       THR  91  15.853   3.188  -4.075
  562    HB   THR  91           HB       THR  91  16.750   4.349  -1.430
  563    HG1  THR  91           HG1      THR  91  16.582   5.826  -3.286
  564   HG21  THR  91          HG21      THR  91  18.282   2.779  -3.508
  565   HG22  THR  91          HG22      THR  91  17.761   2.167  -1.938
  566   HG23  THR  91          HG23      THR  91  18.947   3.468  -2.027
  567    H    THR  92           H        THR  92  15.757   1.060  -3.768
  568    HA   THR  92           HA       THR  92  13.979  -0.160  -2.014
  569    HB   THR  92           HB       THR  92  16.083  -2.009  -2.563
  570    HG1  THR  92           HG1      THR  92  16.583  -1.603  -4.627
  571   HG21  THR  92          HG21      THR  92  13.660  -2.488  -2.436
  572   HG22  THR  92          HG22      THR  92  14.389  -3.085  -3.928
  573   HG23  THR  92          HG23      THR  92  13.429  -1.606  -3.944
  574    H    MET  93           H        MET  93  14.401  -1.615  -0.219
  575    HA   MET  93           HA       MET  93  16.008  -0.408   1.779
  576    HB2  MET  93           HB1      MET  93  13.938  -2.308   1.678
  577    HB3  MET  93           HB2      MET  93  15.317  -3.137   2.416
  578    HG2  MET  93           HG1      MET  93  15.401  -0.830   3.795
  579    HG3  MET  93           HG2      MET  93  13.674  -0.918   3.442
  580    HE1  MET  93           HE1      MET  93  13.902  -2.156   7.163
  581    HE2  MET  93           HE2      MET  93  14.913  -0.930   6.399
  582    HE3  MET  93           HE3      MET  93  13.181  -0.980   6.064
  583    H    GLU  94           H        GLU  94  16.458  -3.160  -0.358
  584    HA   GLU  94           HA       GLU  94  18.653  -4.356   0.877
  585    HB2  GLU  94           HB1      GLU  94  17.556  -4.284  -1.891
  586    HB3  GLU  94           HB2      GLU  94  19.210  -4.880  -1.683
  587    HG2  GLU  94           HG1      GLU  94  18.206  -6.406   0.142
  588    HG3  GLU  94           HG2      GLU  94  16.658  -6.020  -0.625
  589    HE2  GLU  94           HE       GLU  94  19.239  -8.078  -2.847
  590    H    ASP  95           H        ASP  95  18.475  -1.623  -1.339
  591    HA   ASP  95           HA       ASP  95  21.294  -1.368  -1.687
  592    HB2  ASP  95           HB1      ASP  95  19.014   0.567  -2.159
  593    HB3  ASP  95           HB2      ASP  95  20.696   0.901  -2.593
  594    HD2  ASP  95           HD       ASP  95  19.841  -2.222  -4.680
  595    H    ALA  96           H        ALA  96  18.925   0.509   0.203
  596    HA   ALA  96           HA       ALA  96  20.781   2.195   1.457
  597    HB1  ALA  96           HB1      ALA  96  18.361   2.624   1.390
  598    HB2  ALA  96           HB2      ALA  96  18.106   1.291   2.517
  599    HB3  ALA  96           HB3      ALA  96  19.010   2.718   3.027
  600    H    THR  97           H        THR  97  21.223   2.218   3.838
  601    HA   THR  97           HA       THR  97  22.223   1.303   5.666
  602    HB   THR  97           HB       THR  97  20.629  -1.197   5.104
  603    HG1  THR  97           HG1      THR  97  19.249   0.646   5.116
  604   HG21  THR  97          HG21      THR  97  22.397  -0.384   7.196
  605   HG22  THR  97          HG22      THR  97  21.510  -1.898   7.025
  606   HG23  THR  97          HG23      THR  97  20.766  -0.527   7.849
  607    H    GLU  98           H        GLU  98  24.275   1.258   4.665
  608    HA   GLU  98           HA       GLU  98  25.128  -1.111   3.248
  609    HB2  GLU  98           HB1      GLU  98  26.193   1.578   3.784
  610    HB3  GLU  98           HB2      GLU  98  27.419   0.300   3.765
  611    HG2  GLU  98           HG1      GLU  98  27.286   0.014   1.548
  612    HG3  GLU  98           HG2      GLU  98  25.524   0.169   1.543
  613    HE2  GLU  98           HE       GLU  98  27.548   3.182   0.291
  614    H    ASN  99           H        ASN  99  24.866  -2.741   4.814
  615    HA   ASN  99           HA       ASN  99  27.156  -3.273   6.379
  616    HB2  ASN  99           HB1      ASN  99  26.077  -1.557   7.835
  617    HB3  ASN  99           HB2      ASN  99  24.672  -2.621   7.977
  618   HD21  ASN  99          HD21      ASN  99  25.078  -2.553  10.261
  619   HD22  ASN  99          HD22      ASN  99  26.267  -3.598  10.953
  620    H    LEU 100           H        LEU 100  27.321  -5.375   5.998
  621    HA   LEU 100           HA       LEU 100  25.082  -7.031   5.395
  622    HB2  LEU 100           HB1      LEU 100  27.891  -7.889   6.104
  623    HB3  LEU 100           HB2      LEU 100  26.673  -8.827   5.223
  624    HG   LEU 100           HG       LEU 100  28.133  -6.379   4.239
  625   HD11  LEU 100          HD11      LEU 100  28.661  -8.210   2.421
  626   HD12  LEU 100          HD12      LEU 100  28.356  -9.307   3.767
  627   HD13  LEU 100          HD13      LEU 100  29.617  -8.082   3.897
  628   HD21  LEU 100          HD21      LEU 100  25.888  -6.253   3.419
  629   HD22  LEU 100          HD22      LEU 100  25.894  -7.964   2.988
  630   HD23  LEU 100          HD23      LEU 100  26.919  -6.829   2.108
  631    H    TYR 101           H        TYR 101  24.632  -9.089   6.548
  632    HA   TYR 101           HA       TYR 101  24.530  -8.582   9.432
  633    HB2  TYR 101           HB1      TYR 101  22.691  -9.661   7.514
  634    HB3  TYR 101           HB2      TYR 101  23.020 -10.887   8.741
  635    HD1  TYR 101           HD1      TYR 101  22.626  -7.169   8.903
  636    HD2  TYR 101           HD2      TYR 101  21.321 -10.972  10.297
  637    HE1  TYR 101           HE1      TYR 101  21.074  -6.061  10.455
  638    HE2  TYR 101           HE2      TYR 101  19.764  -9.874  11.851
  639    HH   TYR 101           HH       TYR 101  19.876  -7.188  12.975
  640    H    PHE 102           H        PHE 102  25.627  -9.778  10.855
  641    HA   PHE 102           HA       PHE 102  26.730 -12.358   9.994
  642    HB2  PHE 102           HB1      PHE 102  28.201  -9.937  10.817
  643    HB3  PHE 102           HB2      PHE 102  28.714 -11.421  11.624
  644    HD1  PHE 102           HD1      PHE 102  29.757 -13.226  10.411
  645    HD2  PHE 102           HD2      PHE 102  28.510  -9.679   8.418
  646    HE1  PHE 102           HE1      PHE 102  31.098 -13.862   8.448
  647    HE2  PHE 102           HE2      PHE 102  29.847 -10.309   6.451
  648    HZ   PHE 102           HZ       PHE 102  31.142 -12.403   6.464
  649    H    GLN 103           H        GLN 103  26.418 -13.939  11.426
  650    HA   GLN 103           HA       GLN 103  25.964 -13.237  14.240
  651    HB2  GLN 103           HB1      GLN 103  24.056 -14.648  14.421
  652    HB3  GLN 103           HB2      GLN 103  23.792 -13.602  13.017
  653    HG2  GLN 103           HG1      GLN 103  24.719 -15.525  11.614
  654    HG3  GLN 103           HG2      GLN 103  24.493 -16.514  13.065
  655   HE21  GLN 103          HE21      GLN 103  22.761 -14.289  10.929
  656   HE22  GLN 103          HE22      GLN 103  21.232 -15.082  11.053
  657    H    SER 104           H        SER 104  25.602 -15.622  15.374
  658    HA   SER 104           HA       SER 104  28.167 -16.939  14.904
  659    HB2  SER 104           HB1      SER 104  26.286 -17.602  17.162
  660    HB3  SER 104           HB2      SER 104  28.054 -17.734  17.107
  661    HG   SER 104           HG       SER 104  28.192 -15.486  17.180
  662    H    LEU 105           H        LEU 105  28.122 -19.394  15.373
  663    HA   LEU 105           HA       LEU 105  25.780 -20.856  14.687
  664    HB2  LEU 105           HB1      LEU 105  26.703 -21.800  12.548
  665    HB3  LEU 105           HB2      LEU 105  26.140 -20.121  12.471
  666    HG   LEU 105           HG       LEU 105  28.992 -20.336  13.042
  667   HD11  LEU 105          HD11      LEU 105  29.770 -21.398  11.187
  668   HD12  LEU 105          HD12      LEU 105  28.326 -21.045  10.240
  669   HD13  LEU 105          HD13      LEU 105  28.296 -22.332  11.445
  670   HD21  LEU 105          HD21      LEU 105  29.130 -18.523  11.606
  671   HD22  LEU 105          HD22      LEU 105  27.519 -18.343  12.298
  672   HD23  LEU 105          HD23      LEU 105  27.714 -19.017  10.679
  673    H    GLU 106           H        GLU 106  26.287 -22.109  16.456
  674    HA   GLU 106           HA       GLU 106  28.875 -23.308  16.777
  675    HB2  GLU 106           HB1      GLU 106  27.997 -24.341  18.735
  676    HB3  GLU 106           HB2      GLU 106  27.329 -22.704  18.667
  677    HG2  GLU 106           HG1      GLU 106  25.269 -23.708  17.603
  678    HG3  GLU 106           HG2      GLU 106  25.937 -25.288  18.034
  679    HE2  GLU 106           HE       GLU 106  25.683 -23.960  21.515
  680    H    HIS 107           H        HIS 107  28.790 -25.811  17.304
  681    HA   HIS 107           HA       HIS 107  27.587 -27.104  14.947
  682    HB2  HIS 107           HB1      HIS 107  30.260 -27.082  15.923
  683    HB3  HIS 107           HB2      HIS 107  29.635 -28.723  16.114
  684    HD1  HIS 107           HD1      HIS 107  31.309 -26.717  13.711
  685    HD2  HIS 107           HD2      HIS 107  28.340 -29.617  13.521
  686    HE1  HIS 107           HE1      HIS 107  31.314 -27.528  11.330
  687    HE2  HIS 107           HE2      HIS 107  29.499 -29.301  11.214
  688    H    HIS 108           H        HIS 108  28.750 -28.046  18.188
  689    HA   HIS 108           HA       HIS 108  27.911 -29.477  19.747
  690    HB2  HIS 108           HB1      HIS 108  26.021 -27.699  19.435
  691    HB3  HIS 108           HB2      HIS 108  25.155 -29.023  18.648
  692    HD1  HIS 108           HD1      HIS 108  26.449 -27.954  21.999
  693    HD2  HIS 108           HD2      HIS 108  24.197 -31.022  20.334
  694    HE1  HIS 108           HE1      HIS 108  25.446 -29.186  23.949
  695    HE2  HIS 108           HE2      HIS 108  24.072 -31.062  22.932
  696    H    HIS 109           H        HIS 109  28.990 -31.122  18.328
  697    HA   HIS 109           HA       HIS 109  27.032 -32.946  17.104
  698    HB2  HIS 109           HB1      HIS 109  29.692 -32.075  16.339
  699    HB3  HIS 109           HB2      HIS 109  29.603 -33.837  16.443
  700    HD1  HIS 109           HD1      HIS 109  27.437 -31.100  14.903
  701    HD2  HIS 109           HD2      HIS 109  28.830 -34.933  14.107
  702    HE1  HIS 109           HE1      HIS 109  26.544 -31.681  12.625
  703    HE2  HIS 109           HE2      HIS 109  27.394 -34.023  12.137
  704    H    HIS 110           H        HIS 110  26.384 -34.378  18.588
  705    HA   HIS 110           HA       HIS 110  28.397 -36.061  19.845
  706    HB2  HIS 110           HB1      HIS 110  27.115 -33.985  21.277
  707    HB3  HIS 110           HB2      HIS 110  26.384 -35.498  21.821
  708    HD1  HIS 110           HD1      HIS 110  27.582 -36.642  23.652
  709    HD2  HIS 110           HD2      HIS 110  30.113 -34.196  21.444
  710    HE1  HIS 110           HE1      HIS 110  29.812 -36.763  24.809
  711    HE2  HIS 110           HE2      HIS 110  31.360 -35.268  23.460
  712    H    HIS 111           H        HIS 111  27.585 -38.088  20.562
  713    HA   HIS 111           HA       HIS 111  24.950 -38.758  19.423
  714    HB2  HIS 111           HB1      HIS 111  27.575 -39.999  19.162
  715    HB3  HIS 111           HB2      HIS 111  26.347 -41.149  19.701
  716    HD1  HIS 111           HD1      HIS 111  24.826 -42.089  17.963
  717    HD2  HIS 111           HD2      HIS 111  26.841 -38.709  16.632
  718    HE1  HIS 111           HE1      HIS 111  24.270 -41.894  15.519
  719    HE2  HIS 111           HE2      HIS 111  25.499 -39.826  14.704
  720    H    HIS 112           H        HIS 112  24.022 -40.817  20.454
  721    HA   HIS 112           HA       HIS 112  24.203 -40.502  23.370
  722    HB2  HIS 112           HB1      HIS 112  21.997 -40.207  21.995
  723    HB3  HIS 112           HB2      HIS 112  21.982 -41.973  21.989
  724    HD1  HIS 112           HD1      HIS 112  23.130 -42.246  24.956
  725    HD2  HIS 112           HD2      HIS 112  19.856 -39.985  23.763
  726    HE1  HIS 112           HE1      HIS 112  21.711 -41.980  27.015
  727    HE2  HIS 112           HE2      HIS 112  19.709 -40.600  26.287
  Start of MODEL   35
    1    H1   MET  18           H        MET  18 -25.705  35.302  31.355
    2    HA   MET  18           HA       MET  18 -23.779  33.738  29.995
    3    HB2  MET  18           HB1      MET  18 -23.591  35.674  32.304
    4    HB3  MET  18           HB2      MET  18 -22.172  34.865  31.622
    5    HG2  MET  18           HG1      MET  18 -22.360  35.971  29.570
    6    HG3  MET  18           HG2      MET  18 -24.033  36.438  29.886
    7    HE1  MET  18           HE1      MET  18 -20.666  37.202  29.642
    8    HE2  MET  18           HE2      MET  18 -21.237  38.813  29.207
    9    HE3  MET  18           HE3      MET  18 -20.253  38.586  30.654
   10    H    LEU  19           H        LEU  19 -25.272  31.826  31.070
   11    HA   LEU  19           HA       LEU  19 -23.728  30.830  33.372
   12    HB2  LEU  19           HB1      LEU  19 -25.701  29.364  33.816
   13    HB3  LEU  19           HB2      LEU  19 -25.996  31.100  34.015
   14    HG   LEU  19           HG       LEU  19 -26.705  30.381  31.353
   15   HD11  LEU  19          HD11      LEU  19 -28.368  28.714  31.668
   16   HD12  LEU  19          HD12      LEU  19 -28.123  28.708  33.415
   17   HD13  LEU  19          HD13      LEU  19 -26.867  28.084  32.346
   18   HD21  LEU  19          HD21      LEU  19 -28.261  31.238  33.787
   19   HD22  LEU  19          HD22      LEU  19 -28.955  31.107  32.172
   20   HD23  LEU  19          HD23      LEU  19 -27.654  32.257  32.482
   21    H    VAL  20           H        VAL  20 -24.962  30.126  30.181
   22    HA   VAL  20           HA       VAL  20 -23.940  27.404  30.228
   23    HB   VAL  20           HB       VAL  20 -26.065  27.884  29.073
   24   HG11  VAL  20          HG11      VAL  20 -25.687  30.093  28.248
   25   HG12  VAL  20          HG12      VAL  20 -24.316  29.554  27.276
   26   HG13  VAL  20          HG13      VAL  20 -25.951  29.038  26.859
   27   HG21  VAL  20          HG21      VAL  20 -25.703  26.405  27.336
   28   HG22  VAL  20          HG22      VAL  20 -24.125  27.087  26.942
   29   HG23  VAL  20          HG23      VAL  20 -24.317  26.083  28.378
   30    H    LEU  21           H        LEU  21 -22.223  26.648  29.020
   31    HA   LEU  21           HA       LEU  21 -20.258  28.661  28.275
   32    HB2  LEU  21           HB1      LEU  21 -20.187  25.705  28.768
   33    HB3  LEU  21           HB2      LEU  21 -18.869  26.496  27.886
   34    HG   LEU  21           HG       LEU  21 -19.388  27.930  30.314
   35   HD11  LEU  21          HD11      LEU  21 -20.190  25.449  30.782
   36   HD12  LEU  21          HD12      LEU  21 -19.280  26.378  31.973
   37   HD13  LEU  21          HD13      LEU  21 -18.455  25.190  30.964
   38   HD21  LEU  21          HD21      LEU  21 -17.300  28.120  29.232
   39   HD22  LEU  21          HD22      LEU  21 -17.082  26.371  29.175
   40   HD23  LEU  21          HD23      LEU  21 -16.990  27.222  30.717
   41    H    ASP  22           H        ASP  22 -19.271  28.789  26.250
   42    HA   ASP  22           HA       ASP  22 -19.165  28.767  23.978
   43    HB2  ASP  22           HB1      ASP  22 -20.578  26.097  24.082
   44    HB3  ASP  22           HB2      ASP  22 -19.478  26.697  22.834
   45    HD2  ASP  22           HD       ASP  22 -17.946  25.050  26.066
   46    H    PHE  23           H        PHE  23 -20.472  30.370  23.299
   47    HA   PHE  23           HA       PHE  23 -23.236  30.510  23.545
   48    HB2  PHE  23           HB1      PHE  23 -21.155  32.012  22.254
   49    HB3  PHE  23           HB2      PHE  23 -22.527  31.864  21.156
   50    HD1  PHE  23           HD1      PHE  23 -23.780  33.781  21.156
   51    HD2  PHE  23           HD2      PHE  23 -22.275  32.304  24.853
   52    HE1  PHE  23           HE1      PHE  23 -24.963  35.578  22.351
   53    HE2  PHE  23           HE2      PHE  23 -23.456  34.097  26.054
   54    HZ   PHE  23           HZ       PHE  23 -24.802  35.737  24.804
   55    H    ASN  24           H        ASN  24 -24.887  30.398  21.862
   56    HA   ASN  24           HA       ASN  24 -24.923  27.895  20.577
   57    HB2  ASN  24           HB1      ASN  24 -26.683  30.310  20.592
   58    HB3  ASN  24           HB2      ASN  24 -26.931  29.109  19.319
   59   HD21  ASN  24          HD21      ASN  24 -28.288  29.997  21.979
   60   HD22  ASN  24          HD22      ASN  24 -28.735  28.487  22.690
   61    H    ASN  25           H        ASN  25 -25.622  27.817  18.138
   62    HA   ASN  25           HA       ASN  25 -24.532  29.675  16.323
   63    HB2  ASN  25           HB1      ASN  25 -22.537  28.240  17.535
   64    HB3  ASN  25           HB2      ASN  25 -22.852  27.271  16.091
   65   HD21  ASN  25          HD21      ASN  25 -21.226  27.716  14.766
   66   HD22  ASN  25          HD22      ASN  25 -20.751  29.298  14.262
   67    H    ILE  26           H        ILE  26 -24.420  28.745  14.067
   68    HA   ILE  26           HA       ILE  26 -26.749  27.083  13.660
   69    HB   ILE  26           HB       ILE  26 -26.368  27.497  11.258
   70   HG12  ILE  26          HG11      ILE  26 -24.389  29.579  11.528
   71   HG13  ILE  26          HG12      ILE  26 -23.737  28.036  12.110
   72   HG21  ILE  26          HG21      ILE  26 -26.083  30.179  12.494
   73   HG22  ILE  26          HG22      ILE  26 -27.261  29.590  11.322
   74   HG23  ILE  26          HG23      ILE  26 -27.423  29.165  13.027
   75   HD11  ILE  26          HD11      ILE  26 -24.527  27.022   9.938
   76   HD12  ILE  26          HD12      ILE  26 -24.796  28.673   9.379
   77   HD13  ILE  26          HD13      ILE  26 -23.176  28.150   9.834
   78    H    ARG  27           H        ARG  27 -26.551  25.419  11.792
   79    HA   ARG  27           HA       ARG  27 -24.096  24.019  11.489
   80    HB2  ARG  27           HB1      ARG  27 -24.661  23.398  13.828
   81    HB3  ARG  27           HB2      ARG  27 -26.173  22.690  13.237
   82    HG2  ARG  27           HG1      ARG  27 -24.712  21.222  11.737
   83    HG3  ARG  27           HG2      ARG  27 -23.367  21.751  12.764
   84    HD2  ARG  27           HD1      ARG  27 -24.888  21.017  14.737
   85    HD3  ARG  27           HD2      ARG  27 -25.766  20.115  13.494
   86    HE   ARG  27           HE       ARG  27 -23.066  19.499  13.216
   87   HH11  ARG  27          HH11      ARG  27 -25.612  19.094  15.554
   88   HH12  ARG  27          HH12      ARG  27 -24.956  17.630  16.209
   89   HH21  ARG  27          HH21      ARG  27 -22.192  17.572  14.068
   90   HH22  ARG  27          HH22      ARG  27 -23.009  16.766  15.363
   91    H    SER  28           H        SER  28 -27.631  23.684  11.498
   92    HA   SER  28           HA       SER  28 -29.089  22.819   9.981
   93    HB2  SER  28           HB1      SER  28 -26.811  23.553   8.119
   94    HB3  SER  28           HB2      SER  28 -28.399  22.998   7.559
   95    HG   SER  28           HG       SER  28 -29.306  24.835   8.212
   96    H    SER  29           H        SER  29 -28.810  20.748  11.053
   97    HA   SER  29           HA       SER  29 -27.759  18.742   9.195
   98    HB2  SER  29           HB1      SER  29 -27.097  18.934  12.144
   99    HB3  SER  29           HB2      SER  29 -26.867  17.457  11.191
  100    HG   SER  29           HG       SER  29 -24.984  18.855  11.351
  101    H    ALA  30           H        ALA  30 -28.883  16.821   9.157
  102    HA   ALA  30           HA       ALA  30 -31.574  16.893  10.059
  103    HB1  ALA  30           HB1      ALA  30 -30.108  14.460   9.065
  104    HB2  ALA  30           HB2      ALA  30 -31.839  14.794   8.991
  105    HB3  ALA  30           HB3      ALA  30 -30.718  15.724   7.997
  106    H    ASP  31           H        ASP  31 -32.439  14.750  11.141
  107    HA   ASP  31           HA       ASP  31 -30.941  14.461  13.653
  108    HB2  ASP  31           HB1      ASP  31 -33.548  15.196  13.273
  109    HB3  ASP  31           HB2      ASP  31 -33.707  13.457  13.561
  110    HD2  ASP  31           HD       ASP  31 -33.186  15.707  16.632
  111    H    LEU  32           H        LEU  32 -32.923  12.562  11.385
  112    HA   LEU  32           HA       LEU  32 -32.330  10.045  12.482
  113    HB2  LEU  32           HB1      LEU  32 -33.393  11.045   9.885
  114    HB3  LEU  32           HB2      LEU  32 -32.830   9.366   9.968
  115    HG   LEU  32           HG       LEU  32 -34.418   9.207  12.024
  116   HD11  LEU  32          HD11      LEU  32 -36.063  10.755  12.286
  117   HD12  LEU  32          HD12      LEU  32 -36.031  11.245  10.593
  118   HD13  LEU  32          HD13      LEU  32 -34.779  11.810  11.698
  119   HD21  LEU  32          HD21      LEU  32 -36.365   8.874  10.343
  120   HD22  LEU  32          HD22      LEU  32 -34.934   7.850  10.222
  121   HD23  LEU  32          HD23      LEU  32 -35.139   9.213   9.122
  122    H    HIS  33           H        HIS  33 -30.953   8.373  11.679
  123    HA   HIS  33           HA       HIS  33 -28.382   9.400  10.793
  124    HB2  HIS  33           HB1      HIS  33 -27.584   7.081  11.258
  125    HB3  HIS  33           HB2      HIS  33 -28.321   7.873  12.652
  126    HD1  HIS  33           HD1      HIS  33 -30.469   6.877  13.608
  127    HD2  HIS  33           HD2      HIS  33 -29.112   4.929  10.199
  128    HE1  HIS  33           HE1      HIS  33 -31.828   4.767  13.455
  129    HE2  HIS  33           HE2      HIS  33 -30.999   3.576  11.371
  130    H    GLY  34           H        GLY  34 -27.201   7.519   9.371
  131    HA2  GLY  34           HA2      GLY  34 -27.384   6.126   7.445
  132    HA3  GLY  34           HA3      GLY  34 -28.980   6.797   7.149
  133    HA1  GLY  34           HA1      GLY  34 -26.937   6.829   7.733
  134    H    ALA  35           H        ALA  35 -25.717   8.170   7.588
  135    HA   ALA  35           HA       ALA  35 -25.889   9.342   4.917
  136    HB1  ALA  35           HB1      ALA  35 -24.835  11.281   6.791
  137    HB2  ALA  35           HB2      ALA  35 -26.088  11.463   5.563
  138    HB3  ALA  35           HB3      ALA  35 -26.503  10.847   7.162
  139    H    ARG  36           H        ARG  36 -23.819  10.195   4.158
  140    HA   ARG  36           HA       ARG  36 -21.498   9.108   5.596
  141    HB2  ARG  36           HB1      ARG  36 -22.452   7.770   3.516
  142    HB3  ARG  36           HB2      ARG  36 -21.535   8.989   2.617
  143    HG2  ARG  36           HG1      ARG  36 -19.702   8.201   4.478
  144    HG3  ARG  36           HG2      ARG  36 -20.592   6.700   4.172
  145    HD2  ARG  36           HD1      ARG  36 -19.554   8.428   1.929
  146    HD3  ARG  36           HD2      ARG  36 -18.566   7.178   2.697
  147    HE   ARG  36           HE       ARG  36 -20.944   5.959   1.985
  148   HH11  ARG  36          HH11      ARG  36 -18.312   7.581   0.385
  149   HH12  ARG  36          HH12      ARG  36 -18.473   6.674  -1.082
  150   HH21  ARG  36          HH21      ARG  36 -21.166   4.758   0.058
  151   HH22  ARG  36          HH22      ARG  36 -20.097   5.070  -1.267
  152    H    LYS  37           H        LYS  37 -19.589  10.255   5.388
  153    HA   LYS  37           HA       LYS  37 -19.417  12.518   3.600
  154    HB2  LYS  37           HB1      LYS  37 -20.464  12.906   6.186
  155    HB3  LYS  37           HB2      LYS  37 -18.800  13.509   6.237
  156    HG2  LYS  37           HG1      LYS  37 -19.231  14.989   4.366
  157    HG3  LYS  37           HG2      LYS  37 -20.876  14.344   4.221
  158    HD2  LYS  37           HD1      LYS  37 -20.657  15.108   6.898
  159    HD3  LYS  37           HD2      LYS  37 -19.851  16.396   5.985
  160    HE2  LYS  37           HE1      LYS  37 -21.906  17.241   5.666
  161    HE3  LYS  37           HE2      LYS  37 -22.098  15.937   4.485
  162    HZ1  LYS  37           HZ1      LYS  37 -23.759  16.303   6.508
  163    HZ2  LYS  37           HZ2      LYS  37 -22.661  15.259   7.261
  164    HZ3  LYS  37           HZ3      LYS  37 -23.452  14.776   5.846
  165    H    GLY  38           H        GLY  38 -17.313  13.869   4.535
  166    HA2  GLY  38           HA2      GLY  38 -15.081  13.716   5.271
  167    HA3  GLY  38           HA3      GLY  38 -15.264  11.973   5.391
  168    HA1  GLY  38           HA1      GLY  38 -15.513  13.897   4.523
  169    H    SER  39           H        SER  39 -13.474  11.403   4.223
  170    HA   SER  39           HA       SER  39 -13.350  12.340   1.436
  171    HB2  SER  39           HB1      SER  39 -11.094  10.857   2.746
  172    HB3  SER  39           HB2      SER  39 -11.043  12.093   1.477
  173    HG   SER  39           HG       SER  39 -11.686  12.547   4.206
  174    H    GLN  40           H        GLN  40 -12.509  10.707  -0.141
  175    HA   GLN  40           HA       GLN  40 -14.175   8.428  -0.145
  176    HB2  GLN  40           HB1      GLN  40 -12.171   9.639  -1.915
  177    HB3  GLN  40           HB2      GLN  40 -12.253   7.874  -2.027
  178    HG2  GLN  40           HG1      GLN  40 -14.794   9.432  -2.115
  179    HG3  GLN  40           HG2      GLN  40 -13.748   9.404  -3.542
  180   HE21  GLN  40          HE21      GLN  40 -13.903   7.742  -4.887
  181   HE22  GLN  40          HE22      GLN  40 -14.741   6.266  -4.568
  182    H    CYS  41           H        CYS  41 -10.875   8.964   0.856
  183    HA   CYS  41           HA       CYS  41 -10.751   6.164   1.751
  184    HB2  CYS  41           HB1      CYS  41  -8.379   6.070   1.212
  185    HB3  CYS  41           HB2      CYS  41  -9.319   6.443  -0.234
  186    H    LEU  42           H        LEU  42  -9.917   5.819   3.764
  187    HA   LEU  42           HA       LEU  42  -9.568   8.187   5.424
  188    HB2  LEU  42           HB1      LEU  42 -10.556   5.513   5.801
  189    HB3  LEU  42           HB2      LEU  42  -9.270   5.857   6.970
  190    HG   LEU  42           HG       LEU  42 -11.134   8.051   6.859
  191   HD11  LEU  42          HD11      LEU  42 -12.308   5.360   7.543
  192   HD12  LEU  42          HD12      LEU  42 -12.722   6.330   6.130
  193   HD13  LEU  42          HD13      LEU  42 -13.090   6.927   7.747
  194   HD21  LEU  42          HD21      LEU  42 -11.211   7.671   9.252
  195   HD22  LEU  42          HD22      LEU  42  -9.547   7.567   8.675
  196   HD23  LEU  42          HD23      LEU  42 -10.444   6.095   9.049
  197    H    SER  43           H        SER  43  -7.734   5.534   4.119
  198    HA   SER  43           HA       SER  43  -5.286   6.763   5.134
  199    HB2  SER  43           HB1      SER  43  -6.342   4.530   6.389
  200    HB3  SER  43           HB2      SER  43  -5.153   3.844   5.267
  201    HG   SER  43           HG       SER  43  -4.083   4.338   7.150
  202    H    ASP  44           H        ASP  44  -3.325   5.551   4.146
  203    HA   ASP  44           HA       ASP  44  -3.595   5.689   1.322
  204    HB2  ASP  44           HB1      ASP  44  -1.213   4.911   1.304
  205    HB3  ASP  44           HB2      ASP  44  -1.504   6.327   2.324
  206    HD2  ASP  44           HD       ASP  44  -0.373   2.959   4.048
  207    H    THR  45           H        THR  45  -3.775   3.112   3.628
  208    HA   THR  45           HA       THR  45  -3.342   0.988   1.746
  209    HB   THR  45           HB       THR  45  -4.851   0.374   4.209
  210    HG1  THR  45           HG1      THR  45  -2.873   0.676   5.459
  211   HG21  THR  45          HG21      THR  45  -3.279  -1.002   2.397
  212   HG22  THR  45          HG22      THR  45  -3.827  -1.602   3.962
  213   HG23  THR  45          HG23      THR  45  -2.240  -0.848   3.813
  214    H    ASP  46           H        ASP  46  -6.050   2.869   2.795
  215    HA   ASP  46           HA       ASP  46  -8.103   1.056   2.040
  216    HB2  ASP  46           HB1      ASP  46  -8.042   3.403   3.426
  217    HB3  ASP  46           HB2      ASP  46  -8.711   3.938   1.880
  218    HD2  ASP  46           HD       ASP  46 -10.981   1.828   4.277
  219    H    CYS  47           H        CYS  47  -6.141   3.340   0.315
  220    HA   CYS  47           HA       CYS  47  -7.668   3.886  -1.920
  221    HB2  CYS  47           HB1      CYS  47  -5.546   4.970  -1.583
  222    HB3  CYS  47           HB2      CYS  47  -4.690   3.431  -1.687
  223    H    ASN  48           H        ASN  48  -5.332   1.212  -1.571
  224    HA   ASN  48           HA       ASN  48  -7.046  -0.544  -3.092
  225    HB2  ASN  48           HB1      ASN  48  -4.747   0.815  -4.309
  226    HB3  ASN  48           HB2      ASN  48  -4.697  -0.946  -4.478
  227   HD21  ASN  48          HD21      ASN  48  -6.045  -1.947  -5.866
  228   HD22  ASN  48          HD22      ASN  48  -7.189  -1.130  -6.869
  229    H    THR  49           H        THR  49  -3.531  -0.504  -2.559
  230    HA   THR  49           HA       THR  49  -3.460  -2.119  -0.287
  231    HB   THR  49           HB       THR  49  -4.426  -3.931  -1.471
  232    HG1  THR  49           HG1      THR  49  -2.894  -5.343  -0.990
  233   HG21  THR  49          HG21      THR  49  -3.050  -2.778  -3.725
  234   HG22  THR  49          HG22      THR  49  -4.382  -3.934  -3.701
  235   HG23  THR  49          HG23      THR  49  -2.717  -4.507  -3.615
  236    H    ARG  50           H        ARG  50  -1.961  -1.222  -3.327
  237    HA   ARG  50           HA       ARG  50   0.633  -1.112  -1.939
  238    HB2  ARG  50           HB1      ARG  50   1.738  -1.732  -4.067
  239    HB3  ARG  50           HB2      ARG  50   0.705  -3.018  -3.427
  240    HG2  ARG  50           HG1      ARG  50  -0.043  -3.138  -5.539
  241    HG3  ARG  50           HG2      ARG  50  -1.046  -1.762  -5.046
  242    HD2  ARG  50           HD1      ARG  50  -0.042  -0.426  -6.521
  243    HD3  ARG  50           HD2      ARG  50   1.542  -0.824  -5.840
  244    HE   ARG  50           HE       ARG  50   0.383  -1.883  -8.236
  245   HH11  ARG  50          HH11      ARG  50   2.624  -2.510  -5.647
  246   HH12  ARG  50          HH12      ARG  50   3.575  -3.628  -6.566
  247   HH21  ARG  50          HH21      ARG  50   1.627  -3.354  -9.456
  248   HH22  ARG  50          HH22      ARG  50   3.009  -4.108  -8.733
  249    H    LYS  51           H        LYS  51  -1.434   0.926  -2.451
  250    HA   LYS  51           HA       LYS  51   0.292   2.858  -3.823
  251    HB2  LYS  51           HB1      LYS  51  -2.696   2.644  -4.272
  252    HB3  LYS  51           HB2      LYS  51  -1.605   3.834  -5.001
  253    HG2  LYS  51           HG1      LYS  51  -0.625   2.282  -6.421
  254    HG3  LYS  51           HG2      LYS  51  -1.151   0.910  -5.429
  255    HD2  LYS  51           HD1      LYS  51  -2.989   0.683  -6.664
  256    HD3  LYS  51           HD2      LYS  51  -3.463   2.346  -6.276
  257    HE2  LYS  51           HE1      LYS  51  -1.879   3.096  -8.117
  258    HE3  LYS  51           HE2      LYS  51  -1.782   1.393  -8.582
  259    HZ1  LYS  51           HZ1      LYS  51  -4.311   2.940  -8.420
  260    HZ2  LYS  51           HZ2      LYS  51  -4.133   1.357  -8.987
  261    HZ3  LYS  51           HZ3      LYS  51  -3.455   2.644  -9.850
  262    H    PHE  52           H        PHE  52  -0.319   5.124  -3.338
  263    HA   PHE  52           HA       PHE  52  -1.496   5.336  -0.645
  264    HB2  PHE  52           HB1      PHE  52   0.031   7.079  -0.109
  265    HB3  PHE  52           HB2      PHE  52   0.986   5.779  -0.829
  266    HD1  PHE  52           HD1      PHE  52   2.036   6.021  -2.982
  267    HD2  PHE  52           HD2      PHE  52  -0.311   9.162  -1.328
  268    HE1  PHE  52           HE1      PHE  52   2.961   7.582  -4.644
  269    HE2  PHE  52           HE2      PHE  52   0.607  10.727  -2.988
  270    HZ   PHE  52           HZ       PHE  52   2.245   9.939  -4.649
  271    H    CYS  53           H        CYS  53  -2.866   7.053  -0.198
  272    HA   CYS  53           HA       CYS  53  -4.336   8.066  -2.434
  273    HB2  CYS  53           HB1      CYS  53  -4.673   7.869   0.432
  274    HB3  CYS  53           HB2      CYS  53  -5.113   9.482  -0.132
  275    H    LEU  54           H        LEU  54  -3.227   9.497  -3.666
  276    HA   LEU  54           HA       LEU  54  -1.641  11.598  -2.488
  277    HB2  LEU  54           HB1      LEU  54  -0.952  10.523  -4.575
  278    HB3  LEU  54           HB2      LEU  54  -2.439  11.094  -5.352
  279    HG   LEU  54           HG       LEU  54  -1.218  13.405  -4.380
  280   HD11  LEU  54          HD11      LEU  54   0.896  12.568  -4.006
  281   HD12  LEU  54          HD12      LEU  54   1.015  13.108  -5.680
  282   HD13  LEU  54          HD13      LEU  54   0.782  11.398  -5.321
  283   HD21  LEU  54          HD21      LEU  54  -1.102  12.249  -7.163
  284   HD22  LEU  54          HD22      LEU  54  -0.963  13.950  -6.717
  285   HD23  LEU  54          HD23      LEU  54  -2.488  13.096  -6.477
  286    H    GLN  55           H        GLN  55  -2.251  13.627  -2.068
  287    HA   GLN  55           HA       GLN  55  -4.785  14.598  -3.201
  288    HB2  GLN  55           HB1      GLN  55  -3.908  15.095  -0.350
  289    HB3  GLN  55           HB2      GLN  55  -5.456  15.527  -1.093
  290    HG2  GLN  55           HG1      GLN  55  -5.869  13.063  -1.429
  291    HG3  GLN  55           HG2      GLN  55  -4.451  12.781  -0.408
  292   HE21  GLN  55          HE21      GLN  55  -4.572  13.128   1.775
  293   HE22  GLN  55          HE22      GLN  55  -6.054  13.456   2.600
  294    HA   PRO  56           HA       PRO  56  -1.516  17.681  -4.091
  295    HB2  PRO  56           HB1      PRO  56  -2.616  18.473  -6.472
  296    HB3  PRO  56           HB2      PRO  56  -1.569  17.065  -6.304
  297    HG2  PRO  56           HG1      PRO  56  -4.563  17.211  -6.370
  298    HG3  PRO  56           HG2      PRO  56  -3.459  16.074  -7.228
  299    HD2  PRO  56           HD1      PRO  56  -4.813  15.381  -4.980
  300    HD3  PRO  56           HD2      PRO  56  -3.196  14.757  -5.356
  301    H    ARG  57           H        ARG  57  -1.604  19.966  -4.135
  302    HA   ARG  57           HA       ARG  57  -3.939  21.057  -2.828
  303    HB2  ARG  57           HB1      ARG  57  -2.578  23.153  -2.735
  304    HB3  ARG  57           HB2      ARG  57  -1.808  21.751  -1.979
  305    HG2  ARG  57           HG1      ARG  57  -0.101  21.710  -3.445
  306    HG3  ARG  57           HG2      ARG  57  -1.137  22.165  -4.809
  307    HD2  ARG  57           HD1      ARG  57  -1.227  24.489  -3.573
  308    HD3  ARG  57           HD2      ARG  57   0.270  23.902  -2.834
  309    HE   ARG  57           HE       ARG  57   0.245  23.668  -5.697
  310   HH11  ARG  57          HH11      ARG  57   0.897  25.778  -3.007
  311   HH12  ARG  57          HH12      ARG  57   2.002  26.778  -3.891
  312   HH21  ARG  57          HH21      ARG  57   1.697  24.975  -6.872
  313   HH22  ARG  57          HH22      ARG  57   2.456  26.321  -6.090
  314    H    ASP  58           H        ASP  58  -2.495  21.083  -5.988
  315    HA   ASP  58           HA       ASP  58  -4.210  23.247  -6.913
  316    HB2  ASP  58           HB1      ASP  58  -1.724  22.068  -7.766
  317    HB3  ASP  58           HB2      ASP  58  -2.882  22.053  -9.101
  318    HD2  ASP  58           HD       ASP  58  -2.616  25.438  -9.558
  319    H    GLU  59           H        GLU  59  -4.110  19.802  -6.861
  320    HA   GLU  59           HA       GLU  59  -6.431  19.709  -8.674
  321    HB2  GLU  59           HB1      GLU  59  -3.988  18.153  -8.611
  322    HB3  GLU  59           HB2      GLU  59  -5.411  17.113  -8.457
  323    HG2  GLU  59           HG1      GLU  59  -5.039  17.194 -10.746
  324    HG3  GLU  59           HG2      GLU  59  -6.328  18.376 -10.482
  325    HE2  GLU  59           HE       GLU  59  -4.411  20.684 -12.117
  326    H    LYS  60           H        LYS  60  -7.571  17.401  -8.208
  327    HA   LYS  60           HA       LYS  60  -8.448  17.610  -5.431
  328    HB2  LYS  60           HB1      LYS  60 -10.294  16.080  -6.196
  329    HB3  LYS  60           HB2      LYS  60 -10.237  17.653  -7.009
  330    HG2  LYS  60           HG1      LYS  60  -8.708  15.557  -8.373
  331    HG3  LYS  60           HG2      LYS  60 -10.449  15.244  -8.261
  332    HD2  LYS  60           HD1      LYS  60 -11.014  17.069  -9.542
  333    HD3  LYS  60           HD2      LYS  60  -9.545  17.956  -9.100
  334    HE2  LYS  60           HE1      LYS  60  -8.287  16.128 -10.427
  335    HE3  LYS  60           HE2      LYS  60  -9.876  15.751 -11.106
  336    HZ1  LYS  60           HZ1      LYS  60  -9.568  18.507 -11.265
  337    HZ2  LYS  60           HZ2      LYS  60  -9.580  17.394 -12.538
  338    HZ3  LYS  60           HZ3      LYS  60  -8.116  17.833 -11.813
  339    HA   PRO  61           HA       PRO  61  -6.520  13.917  -4.048
  340    HB2  PRO  61           HB1      PRO  61  -8.378  12.966  -2.273
  341    HB3  PRO  61           HB2      PRO  61  -7.376  14.384  -1.968
  342    HG2  PRO  61           HG1      PRO  61 -10.192  14.229  -2.991
  343    HG3  PRO  61           HG2      PRO  61  -9.496  15.308  -1.723
  344    HD2  PRO  61           HD1      PRO  61  -9.974  16.146  -4.262
  345    HD3  PRO  61           HD2      PRO  61  -8.616  16.747  -3.294
  346    H    PHE  62           H        PHE  62  -6.332  11.836  -4.678
  347    HA   PHE  62           HA       PHE  62  -8.522  10.122  -5.224
  348    HB2  PHE  62           HB1      PHE  62  -8.434   9.933  -7.594
  349    HB3  PHE  62           HB2      PHE  62  -8.568  11.654  -7.234
  350    HD1  PHE  62           HD1      PHE  62  -6.215  12.880  -6.939
  351    HD2  PHE  62           HD2      PHE  62  -6.889   9.332  -9.193
  352    HE1  PHE  62           HE1      PHE  62  -4.196  13.344  -8.267
  353    HE2  PHE  62           HE2      PHE  62  -4.871   9.790 -10.523
  354    HZ   PHE  62           HZ       PHE  62  -3.521  11.798 -10.060
  355    H    CYS  63           H        CYS  63  -7.703   8.085  -6.435
  356    HA   CYS  63           HA       CYS  63  -5.381   7.173  -5.024
  357    HB2  CYS  63           HB1      CYS  63  -7.481   5.980  -6.742
  358    HB3  CYS  63           HB2      CYS  63  -5.924   5.147  -6.739
  359    H    ALA  64           H        ALA  64  -3.339   7.062  -5.707
  360    HA   ALA  64           HA       ALA  64  -2.775   7.202  -8.580
  361    HB1  ALA  64           HB1      ALA  64  -2.115   9.238  -6.576
  362    HB2  ALA  64           HB2      ALA  64  -0.767   8.749  -7.603
  363    HB3  ALA  64           HB3      ALA  64  -2.249   9.369  -8.331
  364    H    THR  65           H        THR  65  -0.906   6.166  -9.228
  365    HA   THR  65           HA       THR  65  -0.024   3.984  -7.747
  366    HB   THR  65           HB       THR  65   2.093   4.684  -9.488
  367    HG1  THR  65           HG1      THR  65   0.895   5.126 -11.406
  368   HG21  THR  65          HG21      THR  65  -0.077   2.951 -10.501
  369   HG22  THR  65          HG22      THR  65   0.622   2.494  -8.947
  370   HG23  THR  65          HG23      THR  65   1.654   2.642 -10.369
  371    H    CYS  66           H        CYS  66   2.260   3.553  -7.073
  372    HA   CYS  66           HA       CYS  66   3.145   5.709  -5.332
  373    HB2  CYS  66           HB1      CYS  66   4.525   4.035  -4.244
  374    HB3  CYS  66           HB2      CYS  66   2.876   3.433  -4.417
  375    H    ARG  67           H        ARG  67   5.168   6.643  -5.373
  376    HA   ARG  67           HA       ARG  67   6.392   7.022  -7.851
  377    HB2  ARG  67           HB1      ARG  67   7.451   7.473  -5.055
  378    HB3  ARG  67           HB2      ARG  67   8.263   8.036  -6.522
  379    HG2  ARG  67           HG1      ARG  67   5.479   8.841  -5.676
  380    HG3  ARG  67           HG2      ARG  67   6.947   9.796  -5.414
  381    HD2  ARG  67           HD1      ARG  67   6.913  10.593  -7.502
  382    HD3  ARG  67           HD2      ARG  67   6.720   8.968  -8.173
  383    HE   ARG  67           HE       ARG  67   4.461   9.332  -8.347
  384   HH11  ARG  67          HH11      ARG  67   5.883  11.794  -6.337
  385   HH12  ARG  67          HH12      ARG  67   4.446  12.761  -6.282
  386   HH21  ARG  67          HH21      ARG  67   2.564  10.596  -8.281
  387   HH22  ARG  67          HH22      ARG  67   2.559  12.079  -7.386
  388    H    GLY  68           H        GLY  68   7.476   5.581  -9.016
  389    HA2  GLY  68           HA2      GLY  68   8.497   3.154  -8.029
  390    HA3  GLY  68           HA3      GLY  68   8.879   3.858  -9.592
  391    HA1  GLY  68           HA1      GLY  68   8.646   3.828  -7.480
  392    H    LEU  69           H        LEU  69  10.889   2.550  -8.618
  393    HA   LEU  69           HA       LEU  69  12.538   3.807  -6.727
  394    HB2  LEU  69           HB1      LEU  69  13.006   1.850  -8.949
  395    HB3  LEU  69           HB2      LEU  69  14.379   2.544  -8.069
  396    HG   LEU  69           HG       LEU  69  12.142   0.929  -6.846
  397   HD11  LEU  69          HD11      LEU  69  13.968  -0.163  -8.361
  398   HD12  LEU  69          HD12      LEU  69  13.537  -0.896  -6.817
  399   HD13  LEU  69          HD13      LEU  69  14.999   0.082  -6.953
  400   HD21  LEU  69          HD21      LEU  69  14.556   2.289  -5.686
  401   HD22  LEU  69          HD22      LEU  69  13.770   0.928  -4.885
  402   HD23  LEU  69          HD23      LEU  69  12.870   2.415  -5.183
  403    H    ARG  70           H        ARG  70  11.907   4.511 -10.047
  404    HA   ARG  70           HA       ARG  70  14.226   6.288 -10.226
  405    HB2  ARG  70           HB1      ARG  70  12.178   5.618 -12.352
  406    HB3  ARG  70           HB2      ARG  70  13.716   6.463 -12.587
  407    HG2  ARG  70           HG1      ARG  70  14.534   4.124 -11.425
  408    HG3  ARG  70           HG2      ARG  70  13.158   3.604 -12.412
  409    HD2  ARG  70           HD1      ARG  70  14.412   5.240 -14.169
  410    HD3  ARG  70           HD2      ARG  70  15.791   4.644 -13.233
  411    HE   ARG  70           HE       ARG  70  14.363   2.397 -13.837
  412   HH11  ARG  70          HH11      ARG  70  15.771   4.992 -15.682
  413   HH12  ARG  70          HH12      ARG  70  16.069   4.012 -17.080
  414   HH21  ARG  70          HH21      ARG  70  14.750   1.096 -15.671
  415   HH22  ARG  70          HH22      ARG  70  15.486   1.796 -17.072
  416    H    ARG  71           H        ARG  71  11.479   6.605  -8.760
  417    HA   ARG  71           HA       ARG  71  10.812   9.247  -9.876
  418    HB2  ARG  71           HB1      ARG  71   9.201   7.220  -8.342
  419    HB3  ARG  71           HB2      ARG  71   8.705   8.918  -8.412
  420    HG2  ARG  71           HG1      ARG  71   9.151   7.163 -10.828
  421    HG3  ARG  71           HG2      ARG  71   7.577   7.499 -10.088
  422    HD2  ARG  71           HD1      ARG  71   8.323  10.013 -10.399
  423    HD3  ARG  71           HD2      ARG  71   9.371   9.306 -11.637
  424    HE   ARG  71           HE       ARG  71   6.517   9.610 -11.756
  425   HH11  ARG  71          HH11      ARG  71   9.255   7.818 -12.943
  426   HH12  ARG  71          HH12      ARG  71   8.471   7.341 -14.413
  427   HH21  ARG  71          HH21      ARG  71   5.475   8.991 -13.688
  428   HH22  ARG  71          HH22      ARG  71   6.321   8.011 -14.836
  429    H    ARG  72           H        ARG  72  10.662  11.034  -8.524
  430    HA   ARG  72           HA       ARG  72  12.388  10.987  -6.241
  431    HB2  ARG  72           HB1      ARG  72  11.749  13.403  -6.043
  432    HB3  ARG  72           HB2      ARG  72  12.416  12.945  -7.616
  433    HG2  ARG  72           HG1      ARG  72   9.491  12.757  -7.447
  434    HG3  ARG  72           HG2      ARG  72  10.148  14.391  -7.252
  435    HD2  ARG  72           HD1      ARG  72  11.618  13.508  -9.362
  436    HD3  ARG  72           HD2      ARG  72  10.095  12.642  -9.618
  437    HE   ARG  72           HE       ARG  72   9.287  15.183  -9.160
  438   HH11  ARG  72          HH11      ARG  72  11.605  13.760 -11.333
  439   HH12  ARG  72          HH12      ARG  72  11.394  14.968 -12.557
  440   HH21  ARG  72          HH21      ARG  72   9.000  16.780 -10.764
  441   HH22  ARG  72          HH22      ARG  72   9.913  16.686 -12.232
  442    H    CYS  73           H        CYS  73  11.835  11.571  -4.087
  443    HA   CYS  73           HA       CYS  73   9.050  11.632  -3.310
  444    HB2  CYS  73           HB1      CYS  73   9.061   9.690  -1.926
  445    HB3  CYS  73           HB2      CYS  73   9.629   9.191  -3.520
  446    H    GLN  74           H        GLN  74   8.743  12.212  -1.086
  447    HA   GLN  74           HA       GLN  74  11.145  13.417   0.123
  448    HB2  GLN  74           HB1      GLN  74   8.861  14.707  -0.742
  449    HB3  GLN  74           HB2      GLN  74   8.585  14.522   0.997
  450    HG2  GLN  74           HG1      GLN  74   9.977  16.178   1.469
  451    HG3  GLN  74           HG2      GLN  74  11.265  15.417   0.527
  452   HE21  GLN  74          HE21      GLN  74   8.156  16.962  -0.225
  453   HE22  GLN  74          HE22      GLN  74   8.783  18.024  -1.434
  454    H    ARG  75           H        ARG  75   8.368  11.405   0.591
  455    HA   ARG  75           HA       ARG  75   9.236  10.915   3.361
  456    HB2  ARG  75           HB1      ARG  75   6.425  11.173   2.284
  457    HB3  ARG  75           HB2      ARG  75   6.790  10.409   3.840
  458    HG2  ARG  75           HG1      ARG  75   7.482  12.399   4.820
  459    HG3  ARG  75           HG2      ARG  75   7.753  13.177   3.251
  460    HD2  ARG  75           HD1      ARG  75   4.982  12.283   3.784
  461    HD3  ARG  75           HD2      ARG  75   5.581  13.615   4.784
  462    HE   ARG  75           HE       ARG  75   6.244  14.329   2.232
  463   HH11  ARG  75          HH11      ARG  75   3.296  13.453   3.864
  464   HH12  ARG  75          HH12      ARG  75   2.290  14.434   2.850
  465   HH21  ARG  75          HH21      ARG  75   4.930  15.624   0.891
  466   HH22  ARG  75          HH22      ARG  75   3.221  15.667   1.159
  467    H    ASP  76           H        ASP  76   9.409   8.818   3.974
  468    HA   ASP  76           HA       ASP  76   9.599   6.821   1.995
  469    HB2  ASP  76           HB1      ASP  76  10.461   7.104   4.598
  470    HB3  ASP  76           HB2      ASP  76   9.240   5.832   4.731
  471    HD2  ASP  76           HD       ASP  76  11.148   3.636   2.765
  472    H    ALA  77           H        ALA  77   6.945   7.997   3.801
  473    HA   ALA  77           HA       ALA  77   5.339   5.643   3.775
  474    HB1  ALA  77           HB1      ALA  77   3.622   7.843   3.867
  475    HB2  ALA  77           HB2      ALA  77   4.241   6.911   5.231
  476    HB3  ALA  77           HB3      ALA  77   5.092   8.359   4.695
  477    H    MET  78           H        MET  78   5.519   8.519   1.701
  478    HA   MET  78           HA       MET  78   3.427   7.665  -0.042
  479    HB2  MET  78           HB1      MET  78   4.101   9.518  -1.468
  480    HB3  MET  78           HB2      MET  78   4.038  10.035   0.223
  481    HG2  MET  78           HG1      MET  78   6.343  10.202   0.413
  482    HG3  MET  78           HG2      MET  78   6.623   9.131  -0.962
  483    HE1  MET  78           HE1      MET  78   6.112  11.219  -4.048
  484    HE2  MET  78           HE2      MET  78   6.051   9.623  -3.300
  485    HE3  MET  78           HE3      MET  78   4.609  10.639  -3.331
  486    H    CYS  79           H        CYS  79   6.794   6.991   0.207
  487    HA   CYS  79           HA       CYS  79   7.370   6.319  -2.462
  488    HB2  CYS  79           HB1      CYS  79   8.955   6.612  -0.432
  489    HB3  CYS  79           HB2      CYS  79   8.610   4.911  -0.113
  490    H    CYS  80           H        CYS  80   7.724   4.154  -3.340
  491    HA   CYS  80           HA       CYS  80   5.430   2.560  -3.216
  492    HB2  CYS  80           HB1      CYS  80   8.183   2.186  -4.347
  493    HB3  CYS  80           HB2      CYS  80   7.064   0.823  -4.323
  494    HA   PRO  81           HA       PRO  81   5.968  -0.168   0.175
  495    HB2  PRO  81           HB1      PRO  81   5.006  -2.530  -0.823
  496    HB3  PRO  81           HB2      PRO  81   3.982  -1.152  -0.429
  497    HG2  PRO  81           HG1      PRO  81   5.098  -1.996  -3.081
  498    HG3  PRO  81           HG2      PRO  81   3.427  -1.460  -2.666
  499    HD2  PRO  81           HD1      PRO  81   5.234   0.174  -3.860
  500    HD3  PRO  81           HD2      PRO  81   4.024   0.766  -2.709
  501    H    GLY  82           H        GLY  82   7.905  -0.815   0.882
  502    HA2  GLY  82           HA2      GLY  82   9.593  -2.447   1.113
  503    HA3  GLY  82           HA3      GLY  82   9.261  -2.989  -0.525
  504    HA1  GLY  82           HA1      GLY  82   9.529  -1.571   1.036
  505    H    THR  83           H        THR  83   9.877   0.318   0.560
  506    HA   THR  83           HA       THR  83  12.562   0.282  -0.540
  507    HB   THR  83           HB       THR  83  12.076   2.276  -2.008
  508    HG1  THR  83           HG1      THR  83   9.395   1.423  -2.075
  509   HG21  THR  83          HG21      THR  83  10.501  -0.067  -3.000
  510   HG22  THR  83          HG22      THR  83  12.231  -0.234  -2.702
  511   HG23  THR  83          HG23      THR  83  11.648   0.958  -3.863
  512    H    LEU  84           H        LEU  84  13.549   2.549  -0.376
  513    HA   LEU  84           HA       LEU  84  12.446   3.989   1.940
  514    HB2  LEU  84           HB1      LEU  84  14.346   2.449   2.539
  515    HB3  LEU  84           HB2      LEU  84  15.377   3.455   1.509
  516    HG   LEU  84           HG       LEU  84  14.372   5.348   3.141
  517   HD11  LEU  84          HD11      LEU  84  13.301   3.223   4.343
  518   HD12  LEU  84          HD12      LEU  84  13.840   4.650   5.229
  519   HD13  LEU  84          HD13      LEU  84  14.876   3.224   5.140
  520   HD21  LEU  84          HD21      LEU  84  16.692   3.689   4.059
  521   HD22  LEU  84          HD22      LEU  84  16.490   5.441   4.095
  522   HD23  LEU  84          HD23      LEU  84  16.776   4.617   2.561
  523    H    CYS  85           H        CYS  85  12.729   6.202   1.957
  524    HA   CYS  85           HA       CYS  85  13.238   7.409  -0.611
  525    HB2  CYS  85           HB1      CYS  85  12.118   8.275   2.002
  526    HB3  CYS  85           HB2      CYS  85  12.861   9.530   1.007
  527    H    VAL  86           H        VAL  86  15.370   7.382  -1.126
  528    HA   VAL  86           HA       VAL  86  17.232   8.636   0.784
  529    HB   VAL  86           HB       VAL  86  17.858   6.673  -1.426
  530   HG11  VAL  86          HG11      VAL  86  20.139   6.697  -0.495
  531   HG12  VAL  86          HG12      VAL  86  19.662   8.268  -1.142
  532   HG13  VAL  86          HG13      VAL  86  19.661   7.993   0.600
  533   HG21  VAL  86          HG21      VAL  86  17.635   5.030   0.057
  534   HG22  VAL  86          HG22      VAL  86  18.613   5.887   1.248
  535   HG23  VAL  86          HG23      VAL  86  16.881   6.200   1.140
  536    H    ASN  87           H        ASN  87  18.435  10.353   0.146
  537    HA   ASN  87           HA       ASN  87  18.993  12.211  -1.046
  538    HB2  ASN  87           HB1      ASN  87  19.890  10.046  -2.440
  539    HB3  ASN  87           HB2      ASN  87  18.898  10.849  -3.662
  540   HD21  ASN  87          HD21      ASN  87  20.265  11.841  -4.972
  541   HD22  ASN  87          HD22      ASN  87  21.524  12.917  -4.485
  542    H    ASP  88           H        ASP  88  16.215  11.806  -0.601
  543    HA   ASP  88           HA       ASP  88  14.213  12.716  -1.185
  544    HB2  ASP  88           HB1      ASP  88  16.047  14.570  -1.930
  545    HB3  ASP  88           HB2      ASP  88  15.274  14.239  -3.487
  546    HD2  ASP  88           HD       ASP  88  12.930  16.550  -2.503
  547    H    VAL  89           H        VAL  89  15.331  10.302  -2.541
  548    HA   VAL  89           HA       VAL  89  13.346  10.191  -4.684
  549    HB   VAL  89           HB       VAL  89  16.198   9.276  -5.083
  550   HG11  VAL  89          HG11      VAL  89  15.474   8.852  -7.398
  551   HG12  VAL  89          HG12      VAL  89  14.602   7.854  -6.231
  552   HG13  VAL  89          HG13      VAL  89  13.822   9.268  -6.942
  553   HG21  VAL  89          HG21      VAL  89  16.421  11.073  -6.669
  554   HG22  VAL  89          HG22      VAL  89  14.744  11.558  -6.417
  555   HG23  VAL  89          HG23      VAL  89  15.920  11.741  -5.116
  556    H    CYS  90           H        CYS  90  12.512   8.141  -5.076
  557    HA   CYS  90           HA       CYS  90  12.540   6.345  -2.890
  558    HB2  CYS  90           HB1      CYS  90  11.317   6.395  -5.611
  559    HB3  CYS  90           HB2      CYS  90  11.404   4.841  -4.782
  560    H    THR  91           H        THR  91  14.307   5.217  -2.384
  561    HA   THR  91           HA       THR  91  15.626   3.689  -4.530
  562    HB   THR  91           HB       THR  91  16.970   4.977  -2.147
  563    HG1  THR  91           HG1      THR  91  16.863   6.562  -3.606
  564   HG21  THR  91          HG21      THR  91  17.720   2.699  -3.686
  565   HG22  THR  91          HG22      THR  91  18.620   3.506  -2.401
  566   HG23  THR  91          HG23      THR  91  18.819   4.022  -4.075
  567    H    THR  92           H        THR  92  15.779   1.560  -4.201
  568    HA   THR  92           HA       THR  92  14.419   0.214  -2.215
  569    HB   THR  92           HB       THR  92  16.500  -1.521  -2.900
  570    HG1  THR  92           HG1      THR  92  16.576  -1.177  -5.215
  571   HG21  THR  92          HG21      THR  92  14.142  -2.106  -2.837
  572   HG22  THR  92          HG22      THR  92  14.819  -2.510  -4.415
  573   HG23  THR  92          HG23      THR  92  13.824  -1.066  -4.226
  574    H    MET  93           H        MET  93  15.110  -1.012  -0.391
  575    HA   MET  93           HA       MET  93  17.014   0.372   1.238
  576    HB2  MET  93           HB1      MET  93  14.793  -1.111   1.764
  577    HB3  MET  93           HB2      MET  93  16.074  -2.271   2.147
  578    HG2  MET  93           HG1      MET  93  16.093   0.519   3.268
  579    HG3  MET  93           HG2      MET  93  15.190  -0.792   4.031
  580    HE1  MET  93           HE1      MET  93  18.298   0.829   5.374
  581    HE2  MET  93           HE2      MET  93  16.629   0.436   5.789
  582    HE3  MET  93           HE3      MET  93  17.954  -0.492   6.492
  583    H    GLU  94           H        GLU  94  16.992  -2.584  -0.634
  584    HA   GLU  94           HA       GLU  94  19.149  -3.943   0.429
  585    HB2  GLU  94           HB1      GLU  94  18.422  -3.680  -2.498
  586    HB3  GLU  94           HB2      GLU  94  19.435  -4.949  -1.791
  587    HG2  GLU  94           HG1      GLU  94  17.544  -5.751  -0.470
  588    HG3  GLU  94           HG2      GLU  94  16.529  -4.478  -1.164
  589    HE2  GLU  94           HE       GLU  94  16.125  -7.560  -3.090
  590    H    ASP  95           H        ASP  95  19.132  -1.240  -1.841
  591    HA   ASP  95           HA       ASP  95  22.033  -1.253  -2.024
  592    HB2  ASP  95           HB1      ASP  95  19.846   0.367  -3.322
  593    HB3  ASP  95           HB2      ASP  95  21.541   0.857  -3.438
  594    HD2  ASP  95           HD       ASP  95  21.833  -1.219  -6.134
  595    H    ALA  96           H        ALA  96  19.497   1.005  -0.946
  596    HA   ALA  96           HA       ALA  96  21.139   3.009   0.049
  597    HB1  ALA  96           HB1      ALA  96  18.518   2.200   1.288
  598    HB2  ALA  96           HB2      ALA  96  19.256   3.802   1.257
  599    HB3  ALA  96           HB3      ALA  96  18.641   3.085  -0.232
  600    H    THR  97           H        THR  97  21.763   3.547   2.211
  601    HA   THR  97           HA       THR  97  21.802   1.383   4.165
  602    HB   THR  97           HB       THR  97  24.399   2.406   4.316
  603    HG1  THR  97           HG1      THR  97  25.168   2.471   2.302
  604   HG21  THR  97          HG21      THR  97  23.296   0.014   4.542
  605   HG22  THR  97          HG22      THR  97  25.015   0.199   4.190
  606   HG23  THR  97          HG23      THR  97  23.882  -0.156   2.888
  607    H    GLU  98           H        GLU  98  23.585   4.444   3.777
  608    HA   GLU  98           HA       GLU  98  23.787   6.257   5.140
  609    HB2  GLU  98           HB1      GLU  98  21.301   6.272   4.353
  610    HB3  GLU  98           HB2      GLU  98  20.957   5.828   6.033
  611    HG2  GLU  98           HG1      GLU  98  22.672   7.941   6.339
  612    HG3  GLU  98           HG2      GLU  98  21.751   8.393   4.897
  613    HE2  GLU  98           HE       GLU  98  18.830   8.835   6.715
  614    H    ASN  99           H        ASN  99  24.684   3.880   6.278
  615    HA   ASN  99           HA       ASN  99  23.902   4.187   9.102
  616    HB2  ASN  99           HB1      ASN  99  24.750   1.869   9.422
  617    HB3  ASN  99           HB2      ASN  99  23.382   1.961   8.305
  618   HD21  ASN  99          HD21      ASN  99  24.338  -0.210   7.790
  619   HD22  ASN  99          HD22      ASN  99  25.520  -0.263   6.532
  620    H    LEU 100           H        LEU 100  25.609   6.051   8.370
  621    HA   LEU 100           HA       LEU 100  27.608   7.003   8.890
  622    HB2  LEU 100           HB1      LEU 100  27.151   5.073  10.867
  623    HB3  LEU 100           HB2      LEU 100  28.829   4.831  10.347
  624    HG   LEU 100           HG       LEU 100  28.612   6.317  12.311
  625   HD11  LEU 100          HD11      LEU 100  29.600   8.056  10.112
  626   HD12  LEU 100          HD12      LEU 100  30.370   6.489  10.354
  627   HD13  LEU 100          HD13      LEU 100  30.336   7.666  11.667
  628   HD21  LEU 100          HD21      LEU 100  26.429   7.321  11.496
  629   HD22  LEU 100          HD22      LEU 100  27.406   8.335  10.434
  630   HD23  LEU 100          HD23      LEU 100  27.603   8.443  12.184
  631    H    TYR 101           H        TYR 101  29.837   6.977   8.297
  632    HA   TYR 101           HA       TYR 101  30.367   5.155   6.099
  633    HB2  TYR 101           HB1      TYR 101  31.102   7.845   6.788
  634    HB3  TYR 101           HB2      TYR 101  32.564   6.898   6.511
  635    HD1  TYR 101           HD1      TYR 101  33.390   6.776   4.362
  636    HD2  TYR 101           HD2      TYR 101  29.223   7.431   4.918
  637    HE1  TYR 101           HE1      TYR 101  33.105   6.993   1.928
  638    HE2  TYR 101           HE2      TYR 101  28.926   7.648   2.487
  639    HH   TYR 101           HH       TYR 101  31.171   8.307   0.412
  640    H    PHE 102           H        PHE 102  31.735   3.487   6.154
  641    HA   PHE 102           HA       PHE 102  33.258   3.047   8.625
  642    HB2  PHE 102           HB1      PHE 102  31.888   1.284   6.679
  643    HB3  PHE 102           HB2      PHE 102  33.422   0.679   7.307
  644    HD1  PHE 102           HD1      PHE 102  29.950   1.319   8.053
  645    HD2  PHE 102           HD2      PHE 102  33.733   0.347   9.744
  646    HE1  PHE 102           HE1      PHE 102  28.832   0.562  10.110
  647    HE2  PHE 102           HE2      PHE 102  32.621  -0.413  11.804
  648    HZ   PHE 102           HZ       PHE 102  30.168  -0.307  11.988
  649    H    GLN 103           H        GLN 103  35.316   3.637   8.522
  650    HA   GLN 103           HA       GLN 103  36.876   2.893   6.155
  651    HB2  GLN 103           HB1      GLN 103  36.771   5.620   7.448
  652    HB3  GLN 103           HB2      GLN 103  38.106   5.105   6.406
  653    HG2  GLN 103           HG1      GLN 103  35.752   4.526   4.985
  654    HG3  GLN 103           HG2      GLN 103  35.534   6.135   5.686
  655   HE21  GLN 103          HE21      GLN 103  37.932   7.268   5.614
  656   HE22  GLN 103          HE22      GLN 103  38.529   7.386   3.998
  657    H    SER 104           H        SER 104  39.326   3.511   6.721
  658    HA   SER 104           HA       SER 104  40.010   3.075   9.490
  659    HB2  SER 104           HB1      SER 104  39.903   0.857   7.579
  660    HB3  SER 104           HB2      SER 104  41.493   1.036   8.343
  661    HG   SER 104           HG       SER 104  40.671   0.530  10.241
  662    H    LEU 105           H        LEU 105  41.127   5.026   9.247
  663    HA   LEU 105           HA       LEU 105  43.304   5.130   7.306
  664    HB2  LEU 105           HB1      LEU 105  41.739   7.081   8.852
  665    HB3  LEU 105           HB2      LEU 105  43.469   7.449   8.731
  666    HG   LEU 105           HG       LEU 105  42.058   8.556   7.006
  667   HD11  LEU 105          HD11      LEU 105  44.520   7.204   6.709
  668   HD12  LEU 105          HD12      LEU 105  43.937   8.621   5.836
  669   HD13  LEU 105          HD13      LEU 105  43.623   7.006   5.203
  670   HD21  LEU 105          HD21      LEU 105  41.835   5.939   5.595
  671   HD22  LEU 105          HD22      LEU 105  40.878   7.408   5.403
  672   HD23  LEU 105          HD23      LEU 105  40.629   6.370   6.808
  673    H    GLU 106           H        GLU 106  45.471   5.612   7.930
  674    HA   GLU 106           HA       GLU 106  46.134   5.126  10.743
  675    HB2  GLU 106           HB1      GLU 106  47.329   3.662   8.379
  676    HB3  GLU 106           HB2      GLU 106  47.990   3.615  10.022
  677    HG2  GLU 106           HG1      GLU 106  46.701   1.859  10.417
  678    HG3  GLU 106           HG2      GLU 106  45.310   2.950  10.326
  679    HE2  GLU 106           HE       GLU 106  44.226   0.987   7.727
  680    H    HIS 107           H        HIS 107  47.539   6.572  11.481
  681    HA   HIS 107           HA       HIS 107  48.784   8.427   9.646
  682    HB2  HIS 107           HB1      HIS 107  47.990   8.432  12.406
  683    HB3  HIS 107           HB2      HIS 107  49.693   8.884  12.294
  684    HD1  HIS 107           HD1      HIS 107  49.568  11.356  12.665
  685    HD2  HIS 107           HD2      HIS 107  46.917  10.054   9.743
  686    HE1  HIS 107           HE1      HIS 107  48.612  13.446  11.644
  687    HE2  HIS 107           HE2      HIS 107  46.991  12.651   9.859
  688    H    HIS 108           H        HIS 108  51.135   9.124  10.478
  689    HA   HIS 108           HA       HIS 108  52.754   6.679  10.727
  690    HB2  HIS 108           HB1      HIS 108  53.280   9.031   8.892
  691    HB3  HIS 108           HB2      HIS 108  54.400   7.691   9.163
  692    HD1  HIS 108           HD1      HIS 108  53.965   5.499   7.946
  693    HD2  HIS 108           HD2      HIS 108  50.977   8.326   7.360
  694    HE1  HIS 108           HE1      HIS 108  52.527   4.585   6.097
  695    HE2  HIS 108           HE2      HIS 108  50.701   6.312   5.737
  696    H    HIS 109           H        HIS 109  54.021   6.745  12.451
  697    HA   HIS 109           HA       HIS 109  55.552   9.063  13.138
  698    HB2  HIS 109           HB1      HIS 109  54.629   9.382  15.396
  699    HB3  HIS 109           HB2      HIS 109  53.434   9.735  14.145
  700    HD1  HIS 109           HD1      HIS 109  54.057   7.523  17.031
  701    HD2  HIS 109           HD2      HIS 109  51.351   7.789  13.889
  702    HE1  HIS 109           HE1      HIS 109  52.152   6.002  17.653
  703    HE2  HIS 109           HE2      HIS 109  50.499   6.165  15.732
  704    H    HIS 110           H        HIS 110  57.430   8.351  13.892
  705    HA   HIS 110           HA       HIS 110  57.614   6.212  15.793
  706    HB2  HIS 110           HB1      HIS 110  59.016   4.727  14.420
  707    HB3  HIS 110           HB2      HIS 110  57.386   4.881  13.760
  708    HD1  HIS 110           HD1      HIS 110  60.937   5.842  13.043
  709    HD2  HIS 110           HD2      HIS 110  57.197   6.068  11.249
  710    HE1  HIS 110           HE1      HIS 110  61.373   6.529  10.664
  711    HE2  HIS 110           HE2      HIS 110  59.087   6.669   9.566
  712    H    HIS 111           H        HIS 111  59.947   5.737  16.329
  713    HA   HIS 111           HA       HIS 111  61.494   8.228  16.110
  714    HB2  HIS 111           HB1      HIS 111  60.747   6.707  18.346
  715    HB3  HIS 111           HB2      HIS 111  62.470   6.387  18.121
  716    HD1  HIS 111           HD1      HIS 111  60.591   8.442  20.114
  717    HD2  HIS 111           HD2      HIS 111  63.682   9.247  17.457
  718    HE1  HIS 111           HE1      HIS 111  61.537  10.658  20.834
  719    HE2  HIS 111           HE2      HIS 111  63.425  11.152  19.211
  720    H    HIS 112           H        HIS 112  62.971   8.089  14.549
  721    HA   HIS 112           HA       HIS 112  64.696   7.346  13.266
  722    HB2  HIS 112           HB1      HIS 112  65.461   6.908  15.800
  723    HB3  HIS 112           HB2      HIS 112  65.464   5.241  15.218
  724    HD1  HIS 112           HD1      HIS 112  66.451   6.069  12.271
  725    HD2  HIS 112           HD2      HIS 112  68.255   7.040  15.885
  726    HE1  HIS 112           HE1      HIS 112  68.862   6.526  11.718
  727    HE2  HIS 112           HE2      HIS 112  69.964   7.121  13.927
  Start of MODEL   36
    1    H1   MET  18           H        MET  18 -46.987 -29.752 -35.006
    2    HA   MET  18           HA       MET  18 -44.864 -31.147 -34.968
    3    HB2  MET  18           HB1      MET  18 -43.762 -28.357 -34.552
    4    HB3  MET  18           HB2      MET  18 -42.839 -29.856 -34.370
    5    HG2  MET  18           HG1      MET  18 -42.928 -30.336 -36.675
    6    HG3  MET  18           HG2      MET  18 -44.199 -29.140 -36.943
    7    HE1  MET  18           HE1      MET  18 -40.526 -28.331 -34.965
    8    HE2  MET  18           HE2      MET  18 -40.749 -29.857 -35.819
    9    HE3  MET  18           HE3      MET  18 -39.739 -28.593 -36.521
   10    H    LEU  19           H        LEU  19 -43.609 -31.417 -32.864
   11    HA   LEU  19           HA       LEU  19 -45.475 -31.000 -30.679
   12    HB2  LEU  19           HB1      LEU  19 -42.999 -32.653 -31.069
   13    HB3  LEU  19           HB2      LEU  19 -43.659 -32.377 -29.448
   14    HG   LEU  19           HG       LEU  19 -45.866 -33.303 -30.457
   15   HD11  LEU  19          HD11      LEU  19 -43.832 -34.017 -32.518
   16   HD12  LEU  19          HD12      LEU  19 -45.509 -33.511 -32.718
   17   HD13  LEU  19          HD13      LEU  19 -45.142 -35.144 -32.162
   18   HD21  LEU  19          HD21      LEU  19 -43.531 -35.155 -29.998
   19   HD22  LEU  19          HD22      LEU  19 -45.242 -35.536 -29.804
   20   HD23  LEU  19          HD23      LEU  19 -44.467 -34.379 -28.721
   21    H    VAL  20           H        VAL  20 -44.875 -30.095 -28.651
   22    HA   VAL  20           HA       VAL  20 -42.756 -28.066 -28.887
   23    HB   VAL  20           HB       VAL  20 -45.113 -28.070 -26.998
   24   HG11  VAL  20          HG11      VAL  20 -44.395 -25.553 -26.992
   25   HG12  VAL  20          HG12      VAL  20 -43.562 -26.722 -25.964
   26   HG13  VAL  20          HG13      VAL  20 -42.836 -26.208 -27.487
   27   HG21  VAL  20          HG21      VAL  20 -44.741 -26.956 -29.737
   28   HG22  VAL  20          HG22      VAL  20 -46.159 -27.712 -29.013
   29   HG23  VAL  20          HG23      VAL  20 -45.720 -26.063 -28.575
   30    H    LEU  21           H        LEU  21 -41.074 -28.079 -27.522
   31    HA   LEU  21           HA       LEU  21 -40.895 -30.243 -25.588
   32    HB2  LEU  21           HB1      LEU  21 -38.773 -28.206 -26.252
   33    HB3  LEU  21           HB2      LEU  21 -38.566 -29.804 -25.514
   34    HG   LEU  21           HG       LEU  21 -39.447 -29.343 -28.363
   35   HD11  LEU  21          HD11      LEU  21 -36.992 -28.755 -27.474
   36   HD12  LEU  21          HD12      LEU  21 -37.303 -29.442 -29.068
   37   HD13  LEU  21          HD13      LEU  21 -36.797 -30.487 -27.740
   38   HD21  LEU  21          HD21      LEU  21 -38.497 -31.850 -26.981
   39   HD22  LEU  21          HD22      LEU  21 -39.057 -31.702 -28.648
   40   HD23  LEU  21          HD23      LEU  21 -40.186 -31.462 -27.312
   41    H    ASP  22           H        ASP  22 -40.377 -29.951 -23.397
   42    HA   ASP  22           HA       ASP  22 -41.629 -27.695 -22.177
   43    HB2  ASP  22           HB1      ASP  22 -41.120 -28.744 -20.075
   44    HB3  ASP  22           HB2      ASP  22 -41.618 -30.002 -21.210
   45    HD2  ASP  22           HD       ASP  22 -38.174 -30.392 -19.535
   46    H    PHE  23           H        PHE  23 -40.745 -25.957 -21.143
   47    HA   PHE  23           HA       PHE  23 -37.825 -25.721 -21.067
   48    HB2  PHE  23           HB1      PHE  23 -39.749 -23.888 -22.479
   49    HB3  PHE  23           HB2      PHE  23 -38.233 -23.260 -21.829
   50    HD1  PHE  23           HD1      PHE  23 -36.056 -24.376 -22.564
   51    HD2  PHE  23           HD2      PHE  23 -39.769 -24.926 -24.571
   52    HE1  PHE  23           HE1      PHE  23 -34.853 -25.120 -24.577
   53    HE2  PHE  23           HE2      PHE  23 -38.572 -25.672 -26.588
   54    HZ   PHE  23           HZ       PHE  23 -36.112 -25.771 -26.592
   55    H    ASN  24           H        ASN  24 -37.020 -24.325 -19.481
   56    HA   ASN  24           HA       ASN  24 -39.011 -23.482 -17.480
   57    HB2  ASN  24           HB1      ASN  24 -37.059 -23.668 -15.851
   58    HB3  ASN  24           HB2      ASN  24 -37.692 -25.188 -16.496
   59   HD21  ASN  24          HD21      ASN  24 -36.185 -26.581 -17.008
   60   HD22  ASN  24          HD22      ASN  24 -34.612 -26.212 -17.621
   61    H    ASN  25           H        ASN  25 -38.314 -21.627 -16.108
   62    HA   ASN  25           HA       ASN  25 -36.834 -19.658 -17.727
   63    HB2  ASN  25           HB1      ASN  25 -39.346 -19.460 -16.122
   64    HB3  ASN  25           HB2      ASN  25 -38.283 -18.049 -16.176
   65   HD21  ASN  25          HD21      ASN  25 -40.740 -17.779 -17.187
   66   HD22  ASN  25          HD22      ASN  25 -40.693 -17.691 -18.912
   67    H    ILE  26           H        ILE  26 -36.095 -17.751 -16.242
   68    HA   ILE  26           HA       ILE  26 -35.164 -18.686 -13.638
   69    HB   ILE  26           HB       ILE  26 -33.363 -19.332 -15.152
   70   HG12  ILE  26          HG11      ILE  26 -31.514 -18.033 -14.103
   71   HG13  ILE  26          HG12      ILE  26 -32.724 -16.917 -13.445
   72   HG21  ILE  26          HG21      ILE  26 -33.945 -17.553 -16.859
   73   HG22  ILE  26          HG22      ILE  26 -33.024 -16.431 -15.858
   74   HG23  ILE  26          HG23      ILE  26 -32.226 -17.831 -16.574
   75   HD11  ILE  26          HD11      ILE  26 -33.638 -18.571 -12.035
   76   HD12  ILE  26          HD12      ILE  26 -32.748 -19.858 -12.848
   77   HD13  ILE  26          HD13      ILE  26 -31.886 -18.677 -11.860
   78    H    ARG  27           H        ARG  27 -35.252 -17.121 -12.156
   79    HA   ARG  27           HA       ARG  27 -36.399 -14.650 -12.602
   80    HB2  ARG  27           HB1      ARG  27 -34.622 -15.683 -10.402
   81    HB3  ARG  27           HB2      ARG  27 -35.247 -14.027 -10.376
   82    HG2  ARG  27           HG1      ARG  27 -37.562 -14.986 -10.572
   83    HG3  ARG  27           HG2      ARG  27 -36.832 -16.580 -10.316
   84    HD2  ARG  27           HD1      ARG  27 -37.117 -16.203  -8.126
   85    HD3  ARG  27           HD2      ARG  27 -35.752 -15.088  -8.277
   86    HE   ARG  27           HE       ARG  27 -37.193 -13.344  -7.976
   87   HH11  ARG  27          HH11      ARG  27 -39.019 -16.169  -8.873
   88   HH12  ARG  27          HH12      ARG  27 -40.558 -15.417  -8.614
   89   HH21  ARG  27          HH21      ARG  27 -39.214 -12.343  -7.631
   90   HH22  ARG  27          HH22      ARG  27 -40.668 -13.240  -7.909
   91    H    SER  28           H        SER  28 -35.619 -12.542 -12.779
   92    HA   SER  28           HA       SER  28 -32.866 -11.876 -12.848
   93    HB2  SER  28           HB1      SER  28 -33.784 -13.113 -15.194
   94    HB3  SER  28           HB2      SER  28 -33.740 -11.381 -15.568
   95    HG   SER  28           HG       SER  28 -31.712 -12.962 -15.605
   96    H    SER  29           H        SER  29 -32.940  -9.888 -12.061
   97    HA   SER  29           HA       SER  29 -34.542  -7.857 -13.352
   98    HB2  SER  29           HB1      SER  29 -36.093  -7.464 -11.747
   99    HB3  SER  29           HB2      SER  29 -35.761  -9.143 -11.282
  100    HG   SER  29           HG       SER  29 -35.598  -7.304  -9.642
  101    H    ALA  30           H        ALA  30 -33.385  -6.052 -13.457
  102    HA   ALA  30           HA       ALA  30 -31.247  -5.646 -11.467
  103    HB1  ALA  30           HB1      ALA  30 -31.250  -5.447 -14.406
  104    HB2  ALA  30           HB2      ALA  30 -30.395  -4.165 -13.548
  105    HB3  ALA  30           HB3      ALA  30 -29.942  -5.850 -13.293
  106    H    ASP  31           H        ASP  31 -31.115  -3.715 -10.450
  107    HA   ASP  31           HA       ASP  31 -32.590  -1.419 -11.440
  108    HB2  ASP  31           HB1      ASP  31 -33.877  -3.100  -9.675
  109    HB3  ASP  31           HB2      ASP  31 -33.174  -1.881  -8.604
  110    HD2  ASP  31           HD       ASP  31 -36.437  -0.866 -10.165
  111    H    LEU  32           H        LEU  32 -30.935  -0.026 -11.479
  112    HA   LEU  32           HA       LEU  32 -29.695   0.712  -8.964
  113    HB2  LEU  32           HB1      LEU  32 -28.374  -1.031 -10.731
  114    HB3  LEU  32           HB2      LEU  32 -27.621   0.559 -10.952
  115    HG   LEU  32           HG       LEU  32 -27.906  -0.085  -8.144
  116   HD11  LEU  32          HD11      LEU  32 -26.096  -1.922  -9.684
  117   HD12  LEU  32          HD12      LEU  32 -27.715  -2.395  -9.169
  118   HD13  LEU  32          HD13      LEU  32 -26.499  -1.962  -7.967
  119   HD21  LEU  32          HD21      LEU  32 -26.366   1.542  -9.560
  120   HD22  LEU  32          HD22      LEU  32 -25.288   0.147  -9.527
  121   HD23  LEU  32          HD23      LEU  32 -25.841   0.870  -8.016
  122    H    HIS  33           H        HIS  33 -29.314   2.850  -8.855
  123    HA   HIS  33           HA       HIS  33 -28.807   4.442 -11.194
  124    HB2  HIS  33           HB1      HIS  33 -31.436   4.010 -10.774
  125    HB3  HIS  33           HB2      HIS  33 -31.196   5.413  -9.729
  126    HD1  HIS  33           HD1      HIS  33 -32.526   4.947 -12.808
  127    HD2  HIS  33           HD2      HIS  33 -29.327   7.286 -11.559
  128    HE1  HIS  33           HE1      HIS  33 -32.263   6.723 -14.569
  129    HE2  HIS  33           HE2      HIS  33 -30.310   8.154 -13.807
  130    H    GLY  34           H        GLY  34 -27.207   5.689 -10.488
  131    HA2  GLY  34           HA2      GLY  34 -27.550   7.575  -8.412
  132    HA3  GLY  34           HA3      GLY  34 -26.602   6.221  -7.816
  133    HA1  GLY  34           HA1      GLY  34 -27.414   7.528  -9.283
  134    H    ALA  35           H        ALA  35 -26.018   9.141  -8.473
  135    HA   ALA  35           HA       ALA  35 -23.351   8.780  -9.301
  136    HB1  ALA  35           HB1      ALA  35 -24.829  10.254 -11.426
  137    HB2  ALA  35           HB2      ALA  35 -23.290   9.396 -11.508
  138    HB3  ALA  35           HB3      ALA  35 -24.803   8.491 -11.467
  139    H    ARG  36           H        ARG  36 -22.125  10.652  -9.079
  140    HA   ARG  36           HA       ARG  36 -23.162  13.263  -8.958
  141    HB2  ARG  36           HB1      ARG  36 -23.689  11.731  -6.643
  142    HB3  ARG  36           HB2      ARG  36 -22.390  12.857  -6.221
  143    HG2  ARG  36           HG1      ARG  36 -23.790  14.575  -6.112
  144    HG3  ARG  36           HG2      ARG  36 -24.461  14.197  -7.708
  145    HD2  ARG  36           HD1      ARG  36 -26.054  12.685  -6.801
  146    HD3  ARG  36           HD2      ARG  36 -25.239  12.683  -5.230
  147    HE   ARG  36           HE       ARG  36 -26.070  15.302  -5.851
  148   HH11  ARG  36          HH11      ARG  36 -27.355  12.198  -4.935
  149   HH12  ARG  36          HH12      ARG  36 -28.749  12.862  -4.149
  150   HH21  ARG  36          HH21      ARG  36 -27.901  16.187  -4.818
  151   HH22  ARG  36          HH22      ARG  36 -29.059  15.131  -4.083
  152    H    LYS  37           H        LYS  37 -21.522  14.675  -7.513
  153    HA   LYS  37           HA       LYS  37 -18.813  13.694  -8.139
  154    HB2  LYS  37           HB1      LYS  37 -19.815  16.547  -8.305
  155    HB3  LYS  37           HB2      LYS  37 -18.171  15.998  -8.663
  156    HG2  LYS  37           HG1      LYS  37 -18.705  15.444 -10.748
  157    HG3  LYS  37           HG2      LYS  37 -20.127  14.535 -10.206
  158    HD2  LYS  37           HD1      LYS  37 -21.258  16.142 -11.327
  159    HD3  LYS  37           HD2      LYS  37 -21.011  17.054  -9.828
  160    HE2  LYS  37           HE1      LYS  37 -19.403  18.409 -10.734
  161    HE3  LYS  37           HE2      LYS  37 -18.859  17.165 -11.869
  162    HZ1  LYS  37           HZ1      LYS  37 -19.922  18.762 -13.175
  163    HZ2  LYS  37           HZ2      LYS  37 -21.215  18.936 -12.100
  164    HZ3  LYS  37           HZ3      LYS  37 -21.068  17.528 -13.026
  165    H    GLY  38           H        GLY  38 -17.359  13.745  -6.530
  166    HA2  GLY  38           HA2      GLY  38 -17.677  15.582  -4.302
  167    HA3  GLY  38           HA3      GLY  38 -17.865  13.880  -3.905
  168    HA1  GLY  38           HA1      GLY  38 -17.171  15.550  -5.021
  169    H    SER  39           H        SER  39 -16.088  12.601  -3.701
  170    HA   SER  39           HA       SER  39 -13.481  13.731  -4.429
  171    HB2  SER  39           HB1      SER  39 -12.531  13.095  -2.254
  172    HB3  SER  39           HB2      SER  39 -13.847  14.267  -2.055
  173    HG   SER  39           HG       SER  39 -13.762  12.224  -0.686
  174    H    GLN  40           H        GLN  40 -11.959  12.252  -5.049
  175    HA   GLN  40           HA       GLN  40 -12.813   9.772  -6.022
  176    HB2  GLN  40           HB1      GLN  40 -10.876  11.005  -6.910
  177    HB3  GLN  40           HB2      GLN  40  -9.989  10.664  -5.415
  178    HG2  GLN  40           HG1      GLN  40  -9.272   8.746  -6.243
  179    HG3  GLN  40           HG2      GLN  40 -10.943   8.200  -6.440
  180   HE21  GLN  40          HE21      GLN  40 -11.244   7.437  -8.398
  181   HE22  GLN  40          HE22      GLN  40 -10.638   8.118  -9.865
  182    H    CYS  41           H        CYS  41 -10.645  10.444  -3.269
  183    HA   CYS  41           HA       CYS  41 -11.689   8.058  -1.935
  184    HB2  CYS  41           HB1      CYS  41  -9.493   7.226  -1.382
  185    HB3  CYS  41           HB2      CYS  41  -9.620   7.387  -3.134
  186    H    LEU  42           H        LEU  42 -11.752   8.192   0.276
  187    HA   LEU  42           HA       LEU  42 -11.375  10.839   1.391
  188    HB2  LEU  42           HB1      LEU  42 -12.819   8.371   2.134
  189    HB3  LEU  42           HB2      LEU  42 -12.194   9.338   3.482
  190    HG   LEU  42           HG       LEU  42 -13.418  11.310   2.385
  191   HD11  LEU  42          HD11      LEU  42 -13.849   9.521   0.369
  192   HD12  LEU  42          HD12      LEU  42 -14.775  10.997   0.638
  193   HD13  LEU  42          HD13      LEU  42 -15.373   9.456   1.255
  194   HD21  LEU  42          HD21      LEU  42 -15.380   9.282   3.313
  195   HD22  LEU  42          HD22      LEU  42 -15.176  10.967   3.796
  196   HD23  LEU  42          HD23      LEU  42 -14.072   9.732   4.408
  197    H    SER  43           H        SER  43  -9.808   7.751   1.433
  198    HA   SER  43           HA       SER  43  -7.528   8.846   2.782
  199    HB2  SER  43           HB1      SER  43  -7.614   7.809   4.822
  200    HB3  SER  43           HB2      SER  43  -9.356   7.980   4.538
  201    HG   SER  43           HG       SER  43  -8.506   5.812   5.151
  202    H    ASP  44           H        ASP  44  -5.732   7.301   2.890
  203    HA   ASP  44           HA       ASP  44  -5.348   5.929   0.509
  204    HB2  ASP  44           HB1      ASP  44  -3.456   4.758   1.815
  205    HB3  ASP  44           HB2      ASP  44  -3.396   6.520   1.665
  206    HD2  ASP  44           HD       ASP  44  -4.153   4.995   5.250
  207    H    THR  45           H        THR  45  -6.842   4.890   3.457
  208    HA   THR  45           HA       THR  45  -6.626   2.099   3.116
  209    HB   THR  45           HB       THR  45  -8.954   3.459   4.462
  210    HG1  THR  45           HG1      THR  45  -6.266   3.189   5.317
  211   HG21  THR  45          HG21      THR  45  -8.950   1.512   5.886
  212   HG22  THR  45          HG22      THR  45  -7.474   0.913   5.128
  213   HG23  THR  45          HG23      THR  45  -8.975   0.985   4.205
  214    H    ASP  46           H        ASP  46  -8.668   4.480   1.653
  215    HA   ASP  46           HA       ASP  46 -10.762   2.759   0.815
  216    HB2  ASP  46           HB1      ASP  46 -10.329   5.477   0.779
  217    HB3  ASP  46           HB2      ASP  46 -10.207   5.049  -0.933
  218    HD2  ASP  46           HD       ASP  46 -13.590   4.562  -1.202
  219    H    CYS  47           H        CYS  47  -7.599   3.480  -0.424
  220    HA   CYS  47           HA       CYS  47  -8.175   2.066  -2.926
  221    HB2  CYS  47           HB1      CYS  47  -6.254   4.120  -2.078
  222    HB3  CYS  47           HB2      CYS  47  -5.539   2.845  -3.067
  223    H    ASN  48           H        ASN  48  -6.153   0.733  -3.691
  224    HA   ASN  48           HA       ASN  48  -6.012  -1.575  -2.185
  225    HB2  ASN  48           HB1      ASN  48  -4.870  -0.597  -4.603
  226    HB3  ASN  48           HB2      ASN  48  -3.568  -1.319  -3.649
  227   HD21  ASN  48          HD21      ASN  48  -3.262  -3.401  -3.907
  228   HD22  ASN  48          HD22      ASN  48  -4.436  -4.547  -4.450
  229    H    THR  49           H        THR  49  -4.070  -2.565  -1.176
  230    HA   THR  49           HA       THR  49  -3.125  -0.939   0.945
  231    HB   THR  49           HB       THR  49  -3.422  -3.313   1.302
  232    HG1  THR  49           HG1      THR  49  -1.865  -2.694   2.664
  233   HG21  THR  49          HG21      THR  49  -1.090  -4.307  -0.080
  234   HG22  THR  49          HG22      THR  49  -2.231  -3.580  -1.212
  235   HG23  THR  49          HG23      THR  49  -2.757  -4.878  -0.142
  236    H    ARG  50           H        ARG  50  -1.877  -1.732  -2.191
  237    HA   ARG  50           HA       ARG  50   0.743  -0.604  -1.514
  238    HB2  ARG  50           HB1      ARG  50   1.431  -1.450  -3.754
  239    HB3  ARG  50           HB2      ARG  50   0.871  -2.717  -2.654
  240    HG2  ARG  50           HG1      ARG  50  -1.381  -1.801  -4.122
  241    HG3  ARG  50           HG2      ARG  50  -0.057  -2.099  -5.260
  242    HD2  ARG  50           HD1      ARG  50   0.267  -4.334  -4.052
  243    HD3  ARG  50           HD2      ARG  50  -1.312  -4.017  -3.319
  244    HE   ARG  50           HE       ARG  50  -1.580  -3.712  -6.080
  245   HH11  ARG  50          HH11      ARG  50  -0.902  -6.217  -3.759
  246   HH12  ARG  50          HH12      ARG  50  -1.584  -7.480  -4.728
  247   HH21  ARG  50          HH21      ARG  50  -2.484  -5.366  -7.364
  248   HH22  ARG  50          HH22      ARG  50  -2.484  -6.996  -6.780
  249    H    LYS  51           H        LYS  51  -1.734   0.978  -1.825
  250    HA   LYS  51           HA       LYS  51  -0.737   2.812  -3.891
  251    HB2  LYS  51           HB1      LYS  51  -3.324   1.454  -3.803
  252    HB3  LYS  51           HB2      LYS  51  -3.475   3.214  -3.921
  253    HG2  LYS  51           HG1      LYS  51  -2.693   3.288  -6.033
  254    HG3  LYS  51           HG2      LYS  51  -1.518   1.993  -5.746
  255    HD2  LYS  51           HD1      LYS  51  -2.939   0.359  -6.400
  256    HD3  LYS  51           HD2      LYS  51  -4.345   1.164  -5.680
  257    HE2  LYS  51           HE1      LYS  51  -4.105   2.872  -7.602
  258    HE3  LYS  51           HE2      LYS  51  -3.068   1.649  -8.353
  259    HZ1  LYS  51           HZ1      LYS  51  -4.824   0.144  -8.510
  260    HZ2  LYS  51           HZ2      LYS  51  -5.521   1.622  -8.946
  261    HZ3  LYS  51           HZ3      LYS  51  -5.787   0.985  -7.402
  262    H    PHE  52           H        PHE  52  -1.217   5.027  -3.534
  263    HA   PHE  52           HA       PHE  52  -2.085   5.647  -0.788
  264    HB2  PHE  52           HB1      PHE  52  -0.495   7.568  -0.847
  265    HB3  PHE  52           HB2      PHE  52   0.298   5.993  -0.908
  266    HD1  PHE  52           HD1      PHE  52  -0.815   8.797  -3.062
  267    HD2  PHE  52           HD2      PHE  52   1.769   5.444  -2.629
  268    HE1  PHE  52           HE1      PHE  52   0.375   9.453  -5.115
  269    HE2  PHE  52           HE2      PHE  52   2.963   6.094  -4.679
  270    HZ   PHE  52           HZ       PHE  52   2.267   8.101  -5.924
  271    H    CYS  53           H        CYS  53  -2.989   7.803  -0.493
  272    HA   CYS  53           HA       CYS  53  -4.561   8.593  -2.835
  273    HB2  CYS  53           HB1      CYS  53  -4.927   8.822   0.126
  274    HB3  CYS  53           HB2      CYS  53  -5.727   9.999  -0.916
  275    H    LEU  54           H        LEU  54  -3.163   9.902  -3.970
  276    HA   LEU  54           HA       LEU  54  -1.626  11.968  -2.743
  277    HB2  LEU  54           HB1      LEU  54  -1.351  10.706  -5.041
  278    HB3  LEU  54           HB2      LEU  54  -2.356  12.042  -5.631
  279    HG   LEU  54           HG       LEU  54   0.023  12.463  -6.000
  280   HD11  LEU  54          HD11      LEU  54  -1.519  14.339  -5.615
  281   HD12  LEU  54          HD12      LEU  54   0.116  14.689  -5.055
  282   HD13  LEU  54          HD13      LEU  54  -1.144  14.276  -3.893
  283   HD21  LEU  54          HD21      LEU  54   1.584  12.030  -4.483
  284   HD22  LEU  54          HD22      LEU  54   0.323  11.339  -3.462
  285   HD23  LEU  54          HD23      LEU  54   0.774  13.035  -3.281
  286    H    GLN  55           H        GLN  55  -2.571  13.655  -1.799
  287    HA   GLN  55           HA       GLN  55  -4.920  14.861  -3.097
  288    HB2  GLN  55           HB1      GLN  55  -5.507  14.190  -0.905
  289    HB3  GLN  55           HB2      GLN  55  -4.001  14.830  -0.229
  290    HG2  GLN  55           HG1      GLN  55  -4.861  16.859   0.071
  291    HG3  GLN  55           HG2      GLN  55  -5.560  16.883  -1.554
  292   HE21  GLN  55          HE21      GLN  55  -7.646  17.260  -1.468
  293   HE22  GLN  55          HE22      GLN  55  -8.758  16.606  -0.320
  294    HA   PRO  56           HA       PRO  56  -1.617  17.917  -3.944
  295    HB2  PRO  56           HB1      PRO  56  -2.745  18.806  -6.275
  296    HB3  PRO  56           HB2      PRO  56  -1.720  17.374  -6.174
  297    HG2  PRO  56           HG1      PRO  56  -4.713  17.575  -6.179
  298    HG3  PRO  56           HG2      PRO  56  -3.644  16.447  -7.094
  299    HD2  PRO  56           HD1      PRO  56  -4.969  15.706  -4.845
  300    HD3  PRO  56           HD2      PRO  56  -3.373  15.066  -5.269
  301    H    ARG  57           H        ARG  57  -1.632  20.148  -3.714
  302    HA   ARG  57           HA       ARG  57  -4.001  21.248  -2.475
  303    HB2  ARG  57           HB1      ARG  57  -2.590  23.216  -2.029
  304    HB3  ARG  57           HB2      ARG  57  -1.827  21.715  -1.486
  305    HG2  ARG  57           HG1      ARG  57  -0.950  22.106  -4.127
  306    HG3  ARG  57           HG2      ARG  57  -0.848  23.680  -3.321
  307    HD2  ARG  57           HD1      ARG  57   0.185  21.222  -1.944
  308    HD3  ARG  57           HD2      ARG  57   1.157  22.027  -3.183
  309    HE   ARG  57           HE       ARG  57   0.717  22.925  -0.518
  310   HH11  ARG  57          HH11      ARG  57   1.238  24.021  -3.781
  311   HH12  ARG  57          HH12      ARG  57   1.933  25.534  -3.301
  312   HH21  ARG  57          HH21      ARG  57   1.629  24.913   0.127
  313   HH22  ARG  57          HH22      ARG  57   2.155  26.040  -1.078
  314    H    ASP  58           H        ASP  58  -2.376  21.418  -5.533
  315    HA   ASP  58           HA       ASP  58  -3.883  23.760  -6.383
  316    HB2  ASP  58           HB1      ASP  58  -1.398  23.082  -6.992
  317    HB3  ASP  58           HB2      ASP  58  -2.204  22.151  -8.260
  318    HD2  ASP  58           HD       ASP  58  -2.629  24.952 -10.160
  319    H    GLU  59           H        GLU  59  -4.037  20.322  -6.572
  320    HA   GLU  59           HA       GLU  59  -6.318  20.544  -8.424
  321    HB2  GLU  59           HB1      GLU  59  -3.939  19.094  -8.792
  322    HB3  GLU  59           HB2      GLU  59  -5.175  17.895  -8.384
  323    HG2  GLU  59           HG1      GLU  59  -6.292  18.164 -10.318
  324    HG3  GLU  59           HG2      GLU  59  -5.978  19.904 -10.373
  325    HE2  GLU  59           HE       GLU  59  -3.266  17.500 -12.004
  326    H    LYS  60           H        LYS  60  -7.547  18.243  -8.255
  327    HA   LYS  60           HA       LYS  60  -8.525  18.187  -5.528
  328    HB2  LYS  60           HB1      LYS  60  -9.483  17.273  -8.181
  329    HB3  LYS  60           HB2      LYS  60 -10.010  16.316  -6.786
  330    HG2  LYS  60           HG1      LYS  60 -11.584  17.802  -6.332
  331    HG3  LYS  60           HG2      LYS  60 -10.348  19.060  -6.144
  332    HD2  LYS  60           HD1      LYS  60 -10.661  19.893  -8.242
  333    HD3  LYS  60           HD2      LYS  60 -11.086  18.309  -8.916
  334    HE2  LYS  60           HE1      LYS  60 -13.138  19.340  -8.992
  335    HE3  LYS  60           HE2      LYS  60 -13.212  18.588  -7.393
  336    HZ1  LYS  60           HZ1      LYS  60 -12.583  20.668  -6.386
  337    HZ2  LYS  60           HZ2      LYS  60 -13.935  20.913  -7.373
  338    HZ3  LYS  60           HZ3      LYS  60 -12.402  21.400  -7.901
  339    HA   PRO  61           HA       PRO  61  -6.587  14.496  -4.161
  340    HB2  PRO  61           HB1      PRO  61  -8.587  13.257  -2.759
  341    HB3  PRO  61           HB2      PRO  61  -7.764  14.713  -2.200
  342    HG2  PRO  61           HG1      PRO  61 -10.384  14.442  -3.635
  343    HG3  PRO  61           HG2      PRO  61  -9.969  15.453  -2.200
  344    HD2  PRO  61           HD1      PRO  61 -10.154  16.476  -4.708
  345    HD3  PRO  61           HD2      PRO  61  -9.003  17.086  -3.507
  346    H    PHE  62           H        PHE  62  -6.053  12.658  -5.153
  347    HA   PHE  62           HA       PHE  62  -8.118  10.930  -6.261
  348    HB2  PHE  62           HB1      PHE  62  -7.208  10.825  -8.460
  349    HB3  PHE  62           HB2      PHE  62  -7.406  12.536  -8.073
  350    HD1  PHE  62           HD1      PHE  62  -5.256  13.606  -6.881
  351    HD2  PHE  62           HD2      PHE  62  -5.234  10.237  -9.483
  352    HE1  PHE  62           HE1      PHE  62  -2.886  14.022  -7.396
  353    HE2  PHE  62           HE2      PHE  62  -2.864  10.648 -10.001
  354    HZ   PHE  62           HZ       PHE  62  -1.687  12.543  -8.957
  355    H    CYS  63           H        CYS  63  -7.064   8.876  -7.175
  356    HA   CYS  63           HA       CYS  63  -5.050   8.007  -5.235
  357    HB2  CYS  63           HB1      CYS  63  -7.322   6.818  -5.672
  358    HB3  CYS  63           HB2      CYS  63  -6.524   6.179  -7.111
  359    H    ALA  64           H        ALA  64  -3.012   8.131  -5.891
  360    HA   ALA  64           HA       ALA  64  -2.396   7.701  -8.733
  361    HB1  ALA  64           HB1      ALA  64  -0.126   8.681  -7.985
  362    HB2  ALA  64           HB2      ALA  64  -1.511   9.763  -8.141
  363    HB3  ALA  64           HB3      ALA  64  -1.005   9.202  -6.547
  364    H    THR  65           H        THR  65  -1.346   5.931  -9.368
  365    HA   THR  65           HA       THR  65  -0.927   3.717  -7.779
  366    HB   THR  65           HB       THR  65  -0.966   3.401 -10.134
  367    HG1  THR  65           HG1      THR  65   0.483   2.005  -8.974
  368   HG21  THR  65          HG21      THR  65   0.810   4.289 -11.617
  369   HG22  THR  65          HG22      THR  65   1.462   5.193 -10.250
  370   HG23  THR  65          HG23      THR  65  -0.150   5.560 -10.863
  371    H    CYS  66           H        CYS  66   1.088   2.643  -7.164
  372    HA   CYS  66           HA       CYS  66   2.673   4.181  -5.481
  373    HB2  CYS  66           HB1      CYS  66   2.318   1.598  -5.633
  374    HB3  CYS  66           HB2      CYS  66   3.721   1.647  -6.700
  375    H    ARG  67           H        ARG  67   5.023   4.541  -5.593
  376    HA   ARG  67           HA       ARG  67   5.760   5.520  -8.254
  377    HB2  ARG  67           HB1      ARG  67   6.809   6.144  -5.489
  378    HB3  ARG  67           HB2      ARG  67   7.554   6.755  -6.973
  379    HG2  ARG  67           HG1      ARG  67   5.161   7.646  -7.500
  380    HG3  ARG  67           HG2      ARG  67   4.928   7.465  -5.753
  381    HD2  ARG  67           HD1      ARG  67   7.090   8.800  -5.477
  382    HD3  ARG  67           HD2      ARG  67   6.924   9.188  -7.194
  383    HE   ARG  67           HE       ARG  67   5.438  10.316  -5.037
  384   HH11  ARG  67          HH11      ARG  67   5.270   9.443  -8.403
  385   HH12  ARG  67          HH12      ARG  67   4.050  10.614  -8.780
  386   HH21  ARG  67          HH21      ARG  67   3.832  11.861  -5.520
  387   HH22  ARG  67          HH22      ARG  67   3.233  11.989  -7.140
  388    H    GLY  68           H        GLY  68   7.871   5.155  -9.107
  389    HA2  GLY  68           HA2      GLY  68   8.912   2.524  -8.356
  390    HA3  GLY  68           HA3      GLY  68   9.250   3.384  -9.852
  391    HA1  GLY  68           HA1      GLY  68   8.924   3.175  -7.762
  392    H    LEU  69           H        LEU  69  11.410   2.381  -8.903
  393    HA   LEU  69           HA       LEU  69  12.732   3.778  -6.835
  394    HB2  LEU  69           HB1      LEU  69  13.964   2.310  -9.172
  395    HB3  LEU  69           HB2      LEU  69  14.751   2.712  -7.635
  396    HG   LEU  69           HG       LEU  69  12.534   0.716  -8.074
  397   HD11  LEU  69          HD11      LEU  69  15.400   0.413  -7.190
  398   HD12  LEU  69          HD12      LEU  69  14.726  -0.075  -8.745
  399   HD13  LEU  69          HD13      LEU  69  14.207  -0.884  -7.266
  400   HD21  LEU  69          HD21      LEU  69  13.464   0.416  -5.496
  401   HD22  LEU  69          HD22      LEU  69  11.931   1.149  -5.970
  402   HD23  LEU  69          HD23      LEU  69  13.347   2.165  -5.688
  403    H    ARG  70           H        ARG  70  12.221   4.464 -10.188
  404    HA   ARG  70           HA       ARG  70  14.266   6.545 -10.219
  405    HB2  ARG  70           HB1      ARG  70  12.371   5.554 -12.361
  406    HB3  ARG  70           HB2      ARG  70  13.582   6.825 -12.597
  407    HG2  ARG  70           HG1      ARG  70  15.053   4.740 -11.537
  408    HG3  ARG  70           HG2      ARG  70  13.892   3.942 -12.612
  409    HD2  ARG  70           HD1      ARG  70  15.368   6.368 -13.574
  410    HD3  ARG  70           HD2      ARG  70  16.183   4.796 -13.542
  411    HE   ARG  70           HE       ARG  70  13.699   4.492 -14.809
  412   HH11  ARG  70          HH11      ARG  70  16.792   6.007 -15.320
  413   HH12  ARG  70          HH12      ARG  70  16.703   5.905 -17.047
  414   HH21  ARG  70          HH21      ARG  70  13.570   4.352 -17.082
  415   HH22  ARG  70          HH22      ARG  70  14.870   4.964 -18.049
  416    H    ARG  71           H        ARG  71  11.484   6.468  -8.785
  417    HA   ARG  71           HA       ARG  71  10.483   9.033  -9.816
  418    HB2  ARG  71           HB1      ARG  71   9.190   6.796  -8.275
  419    HB3  ARG  71           HB2      ARG  71   8.478   8.416  -8.298
  420    HG2  ARG  71           HG1      ARG  71   9.081   6.788 -10.768
  421    HG3  ARG  71           HG2      ARG  71   7.502   6.875  -9.970
  422    HD2  ARG  71           HD1      ARG  71   8.230   9.539 -10.281
  423    HD3  ARG  71           HD2      ARG  71   8.776   8.760 -11.773
  424    HE   ARG  71           HE       ARG  71   6.240   7.828 -11.440
  425   HH11  ARG  71          HH11      ARG  71   7.679  10.995 -11.579
  426   HH12  ARG  71          HH12      ARG  71   6.272  11.748 -12.254
  427   HH21  ARG  71          HH21      ARG  71   4.382   8.807 -12.329
  428   HH22  ARG  71          HH22      ARG  71   4.397  10.502 -12.679
  429    H    ARG  72           H        ARG  72  10.060  10.749  -8.396
  430    HA   ARG  72           HA       ARG  72  11.871  10.916  -6.176
  431    HB2  ARG  72           HB1      ARG  72   9.776  12.858  -7.182
  432    HB3  ARG  72           HB2      ARG  72  10.987  13.219  -5.942
  433    HG2  ARG  72           HG1      ARG  72  12.153  12.173  -8.408
  434    HG3  ARG  72           HG2      ARG  72  11.259  13.688  -8.626
  435    HD2  ARG  72           HD1      ARG  72  12.610  14.337  -6.407
  436    HD3  ARG  72           HD2      ARG  72  13.731  13.147  -7.082
  437    HE   ARG  72           HE       ARG  72  13.203  15.779  -8.087
  438   HH11  ARG  72          HH11      ARG  72  14.258  12.571  -8.930
  439   HH12  ARG  72          HH12      ARG  72  15.162  13.090 -10.314
  440   HH21  ARG  72          HH21      ARG  72  14.389  16.476  -9.906
  441   HH22  ARG  72          HH22      ARG  72  15.236  15.312 -10.868
  442    H    CYS  73           H        CYS  73  11.333  11.310  -3.996
  443    HA   CYS  73           HA       CYS  73   8.567  10.849  -3.183
  444    HB2  CYS  73           HB1      CYS  73   9.197   9.134  -1.560
  445    HB3  CYS  73           HB2      CYS  73   9.587   8.620  -3.202
  446    H    GLN  74           H        GLN  74   8.237  11.279  -0.851
  447    HA   GLN  74           HA       GLN  74  10.147  13.302   0.118
  448    HB2  GLN  74           HB1      GLN  74   7.146  13.192   0.189
  449    HB3  GLN  74           HB2      GLN  74   8.039  14.154   1.378
  450    HG2  GLN  74           HG1      GLN  74   9.176  15.293  -0.578
  451    HG3  GLN  74           HG2      GLN  74   7.969  14.502  -1.602
  452   HE21  GLN  74          HE21      GLN  74   5.676  14.870  -0.963
  453   HE22  GLN  74          HE22      GLN  74   5.247  16.450  -0.409
  454    H    ARG  75           H        ARG  75   8.312  10.463   0.864
  455    HA   ARG  75           HA       ARG  75   9.651  10.325   3.470
  456    HB2  ARG  75           HB1      ARG  75   7.049  11.011   3.364
  457    HB3  ARG  75           HB2      ARG  75   6.892   9.249   3.354
  458    HG2  ARG  75           HG1      ARG  75   8.571   9.410   5.380
  459    HG3  ARG  75           HG2      ARG  75   7.905  11.047   5.491
  460    HD2  ARG  75           HD1      ARG  75   5.596   9.815   5.299
  461    HD3  ARG  75           HD2      ARG  75   6.534   8.417   5.840
  462    HE   ARG  75           HE       ARG  75   7.137  10.486   7.579
  463   HH11  ARG  75          HH11      ARG  75   4.329   8.665   6.621
  464   HH12  ARG  75          HH12      ARG  75   3.539   8.828   8.154
  465   HH21  ARG  75          HH21      ARG  75   6.106  10.708   9.602
  466   HH22  ARG  75          HH22      ARG  75   4.550   9.991   9.848
  467    H    ASP  76           H        ASP  76   9.608   8.098   4.384
  468    HA   ASP  76           HA       ASP  76  10.298   6.209   2.320
  469    HB2  ASP  76           HB1      ASP  76  11.730   6.164   4.196
  470    HB3  ASP  76           HB2      ASP  76  10.373   6.139   5.330
  471    HD2  ASP  76           HD       ASP  76  10.627   2.740   5.463
  472    H    ALA  77           H        ALA  77   7.574   6.858   4.352
  473    HA   ALA  77           HA       ALA  77   6.372   4.268   4.129
  474    HB1  ALA  77           HB1      ALA  77   5.914   5.855   5.987
  475    HB2  ALA  77           HB2      ALA  77   5.038   6.873   4.844
  476    HB3  ALA  77           HB3      ALA  77   4.460   5.245   5.196
  477    H    MET  78           H        MET  78   5.893   7.397   2.522
  478    HA   MET  78           HA       MET  78   3.731   6.632   0.903
  479    HB2  MET  78           HB1      MET  78   4.138   8.608  -0.363
  480    HB3  MET  78           HB2      MET  78   4.535   8.980   1.322
  481    HG2  MET  78           HG1      MET  78   6.473   9.777   0.588
  482    HG3  MET  78           HG2      MET  78   6.930   8.101   0.270
  483    HE1  MET  78           HE1      MET  78   5.465  11.302  -2.537
  484    HE2  MET  78           HE2      MET  78   4.185  10.110  -2.314
  485    HE3  MET  78           HE3      MET  78   4.875  10.937  -0.916
  486    H    CYS  79           H        CYS  79   7.104   5.950   0.690
  487    HA   CYS  79           HA       CYS  79   7.054   5.266  -2.116
  488    HB2  CYS  79           HB1      CYS  79   9.075   6.178  -0.926
  489    HB3  CYS  79           HB2      CYS  79   9.194   4.636  -0.076
  490    H    CYS  80           H        CYS  80   7.260   3.183  -2.983
  491    HA   CYS  80           HA       CYS  80   5.670   1.198  -1.910
  492    HB2  CYS  80           HB1      CYS  80   7.598   1.417  -4.108
  493    HB3  CYS  80           HB2      CYS  80   7.455  -0.219  -3.464
  494    HA   PRO  81           HA       PRO  81   7.973  -0.971   1.128
  495    HB2  PRO  81           HB1      PRO  81   7.299  -3.579   0.634
  496    HB3  PRO  81           HB2      PRO  81   6.186  -2.401   1.327
  497    HG2  PRO  81           HG1      PRO  81   6.471  -3.301  -1.520
  498    HG3  PRO  81           HG2      PRO  81   4.975  -3.075  -0.540
  499    HD2  PRO  81           HD1      PRO  81   5.820  -1.253  -2.368
  500    HD3  PRO  81           HD2      PRO  81   4.985  -0.795  -0.875
  501    H    GLY  82           H        GLY  82   9.769  -2.374   1.521
  502    HA2  GLY  82           HA2      GLY  82  11.724  -3.484   1.008
  503    HA3  GLY  82           HA3      GLY  82  11.101  -3.731  -0.617
  504    HA1  GLY  82           HA1      GLY  82  11.558  -2.628   1.143
  505    H    THR  83           H        THR  83  11.175  -0.505   0.577
  506    HA   THR  83           HA       THR  83  13.791   0.071  -0.546
  507    HB   THR  83           HB       THR  83  12.570   2.022  -1.866
  508    HG1  THR  83           HG1      THR  83  10.471   1.104  -1.111
  509   HG21  THR  83          HG21      THR  83  13.664  -0.513  -2.538
  510   HG22  THR  83          HG22      THR  83  13.571   0.939  -3.534
  511   HG23  THR  83          HG23      THR  83  12.259  -0.237  -3.566
  512    H    LEU  84           H        LEU  84  14.220   2.513  -0.407
  513    HA   LEU  84           HA       LEU  84  12.822   3.700   1.887
  514    HB2  LEU  84           HB1      LEU  84  15.657   2.932   1.660
  515    HB3  LEU  84           HB2      LEU  84  15.365   4.568   2.276
  516    HG   LEU  84           HG       LEU  84  13.641   3.021   3.773
  517   HD11  LEU  84          HD11      LEU  84  16.262   1.549   3.595
  518   HD12  LEU  84          HD12      LEU  84  14.772   1.009   2.821
  519   HD13  LEU  84          HD13      LEU  84  14.856   1.135   4.577
  520   HD21  LEU  84          HD21      LEU  84  16.454   3.649   4.613
  521   HD22  LEU  84          HD22      LEU  84  14.984   3.650   5.588
  522   HD23  LEU  84          HD23      LEU  84  15.245   4.912   4.383
  523    H    CYS  85           H        CYS  85  13.127   6.027   2.083
  524    HA   CYS  85           HA       CYS  85  13.312   7.269  -0.555
  525    HB2  CYS  85           HB1      CYS  85  11.354   7.606   1.078
  526    HB3  CYS  85           HB2      CYS  85  12.459   8.634   1.993
  527    H    VAL  86           H        VAL  86  15.255   7.977  -1.130
  528    HA   VAL  86           HA       VAL  86  16.812   9.526   0.824
  529    HB   VAL  86           HB       VAL  86  18.045   7.560  -1.109
  530   HG11  VAL  86          HG11      VAL  86  19.105   9.580   0.782
  531   HG12  VAL  86          HG12      VAL  86  19.968   8.046   0.666
  532   HG13  VAL  86          HG13      VAL  86  19.737   9.040  -0.773
  533   HG21  VAL  86          HG21      VAL  86  17.628   7.323   1.870
  534   HG22  VAL  86          HG22      VAL  86  16.839   6.356   0.623
  535   HG23  VAL  86          HG23      VAL  86  18.578   6.214   0.882
  536    H    ASN  87           H        ASN  87  17.766  11.341   0.042
  537    HA   ASN  87           HA       ASN  87  18.118  13.109  -1.346
  538    HB2  ASN  87           HB1      ASN  87  19.406  10.952  -2.439
  539    HB3  ASN  87           HB2      ASN  87  18.405  11.495  -3.790
  540   HD21  ASN  87          HD21      ASN  87  21.360  11.606  -3.150
  541   HD22  ASN  87          HD22      ASN  87  21.792  13.251  -3.457
  542    H    ASP  88           H        ASP  88  15.403  12.205  -1.007
  543    HA   ASP  88           HA       ASP  88  13.322  12.682  -1.790
  544    HB2  ASP  88           HB1      ASP  88  14.557  14.255  -4.042
  545    HB3  ASP  88           HB2      ASP  88  13.036  14.549  -3.187
  546    HD2  ASP  88           HD       ASP  88  14.749  16.030  -0.478
  547    H    VAL  89           H        VAL  89  14.919  10.417  -2.845
  548    HA   VAL  89           HA       VAL  89  13.208   9.838  -5.148
  549    HB   VAL  89           HB       VAL  89  16.194   9.374  -5.146
  550   HG11  VAL  89          HG11      VAL  89  15.486   8.819  -7.645
  551   HG12  VAL  89          HG12      VAL  89  15.492   7.591  -6.377
  552   HG13  VAL  89          HG13      VAL  89  13.980   8.368  -6.845
  553   HG21  VAL  89          HG21      VAL  89  16.290  10.975  -6.940
  554   HG22  VAL  89          HG22      VAL  89  14.536  11.159  -6.926
  555   HG23  VAL  89          HG23      VAL  89  15.493  11.721  -5.555
  556    H    CYS  90           H        CYS  90  12.583   7.720  -5.323
  557    HA   CYS  90           HA       CYS  90  12.788   6.106  -2.990
  558    HB2  CYS  90           HB1      CYS  90  11.519   5.835  -5.683
  559    HB3  CYS  90           HB2      CYS  90  11.729   4.379  -4.710
  560    H    THR  91           H        THR  91  14.604   5.093  -2.450
  561    HA   THR  91           HA       THR  91  16.166   3.781  -4.579
  562    HB   THR  91           HB       THR  91  17.369   5.593  -3.359
  563    HG1  THR  91           HG1      THR  91  18.552   3.112  -2.687
  564   HG21  THR  91          HG21      THR  91  17.059   3.728  -1.003
  565   HG22  THR  91          HG22      THR  91  16.355   5.337  -1.163
  566   HG23  THR  91          HG23      THR  91  18.104   5.146  -1.047
  567    H    THR  92           H        THR  92  17.447   1.858  -3.748
  568    HA   THR  92           HA       THR  92  15.595   0.090  -2.363
  569    HB   THR  92           HB       THR  92  17.073  -1.728  -3.068
  570    HG1  THR  92           HG1      THR  92  19.079  -1.291  -3.549
  571   HG21  THR  92          HG21      THR  92  15.408  -0.365  -4.657
  572   HG22  THR  92          HG22      THR  92  16.339  -1.751  -5.223
  573   HG23  THR  92          HG23      THR  92  16.908  -0.113  -5.548
  574    H    MET  93           H        MET  93  16.409  -1.420  -0.718
  575    HA   MET  93           HA       MET  93  17.694  -0.050   1.393
  576    HB2  MET  93           HB1      MET  93  16.203  -2.407   1.088
  577    HB3  MET  93           HB2      MET  93  17.773  -2.919   1.725
  578    HG2  MET  93           HG1      MET  93  16.513  -0.587   3.045
  579    HG3  MET  93           HG2      MET  93  15.737  -2.156   3.276
  580    HE1  MET  93           HE1      MET  93  17.215   0.077   4.995
  581    HE2  MET  93           HE2      MET  93  18.332  -0.666   6.140
  582    HE3  MET  93           HE3      MET  93  18.940   0.015   4.631
  583    H    GLU  94           H        GLU  94  18.859  -2.081  -1.164
  584    HA   GLU  94           HA       GLU  94  21.379  -2.691   0.063
  585    HB2  GLU  94           HB1      GLU  94  20.508  -2.861  -2.832
  586    HB3  GLU  94           HB2      GLU  94  22.000  -3.545  -2.167
  587    HG2  GLU  94           HG1      GLU  94  20.915  -5.424  -1.745
  588    HG3  GLU  94           HG2      GLU  94  19.925  -4.544  -0.574
  589    HE2  GLU  94           HE       GLU  94  18.254  -5.753  -3.880
  590    H    ASP  95           H        ASP  95  20.128  -0.180  -2.016
  591    HA   ASP  95           HA       ASP  95  22.709   0.887  -2.698
  592    HB2  ASP  95           HB1      ASP  95  19.872   1.579  -3.237
  593    HB3  ASP  95           HB2      ASP  95  21.028   2.917  -3.273
  594    HD2  ASP  95           HD       ASP  95  22.061   2.011  -6.393
  595    H    ALA  96           H        ALA  96  20.127   1.727  -0.427
  596    HA   ALA  96           HA       ALA  96  21.228   4.114   0.545
  597    HB1  ALA  96           HB1      ALA  96  18.978   2.539   1.091
  598    HB2  ALA  96           HB2      ALA  96  19.837   2.702   2.623
  599    HB3  ALA  96           HB3      ALA  96  19.350   4.141   1.728
  600    H    THR  97           H        THR  97  21.803   4.246   3.023
  601    HA   THR  97           HA       THR  97  23.406   3.934   4.609
  602    HB   THR  97           HB       THR  97  23.375   1.012   3.855
  603    HG1  THR  97           HG1      THR  97  21.455   2.596   5.144
  604   HG21  THR  97          HG21      THR  97  24.344   0.604   5.876
  605   HG22  THR  97          HG22      THR  97  23.567   1.985   6.650
  606   HG23  THR  97          HG23      THR  97  24.974   2.230   5.616
  607    H    GLU  98           H        GLU  98  24.813   5.124   3.087
  608    HA   GLU  98           HA       GLU  98  26.551   3.947   1.270
  609    HB2  GLU  98           HB1      GLU  98  28.056   5.930   1.778
  610    HB3  GLU  98           HB2      GLU  98  26.403   6.305   1.271
  611    HG2  GLU  98           HG1      GLU  98  26.558   6.061   4.142
  612    HG3  GLU  98           HG2      GLU  98  27.729   7.240   3.534
  613    HE2  GLU  98           HE       GLU  98  25.120   9.473   3.533
  614    H    ASN  99           H        ASN  99  27.762   2.215   1.714
  615    HA   ASN  99           HA       ASN  99  29.153   2.050   4.284
  616    HB2  ASN  99           HB1      ASN  99  27.744   0.154   2.990
  617    HB3  ASN  99           HB2      ASN  99  29.349  -0.167   2.322
  618   HD21  ASN  99          HD21      ASN  99  29.927  -1.986   3.323
  619   HD22  ASN  99          HD22      ASN  99  30.037  -2.183   5.036
  620    H    LEU 100           H        LEU 100  30.040   3.919   2.280
  621    HA   LEU 100           HA       LEU 100  31.935   4.639   1.246
  622    HB2  LEU 100           HB1      LEU 100  32.712   3.158   3.584
  623    HB3  LEU 100           HB2      LEU 100  33.925   2.958   2.308
  624    HG   LEU 100           HG       LEU 100  34.530   4.782   3.786
  625   HD11  LEU 100          HD11      LEU 100  34.720   6.589   2.095
  626   HD12  LEU 100          HD12      LEU 100  33.646   5.665   1.043
  627   HD13  LEU 100          HD13      LEU 100  35.218   5.005   1.499
  628   HD21  LEU 100          HD21      LEU 100  33.189   6.688   4.154
  629   HD22  LEU 100          HD22      LEU 100  32.128   5.301   4.401
  630   HD23  LEU 100          HD23      LEU 100  32.043   6.220   2.898
  631    H    TYR 101           H        TYR 101  34.145   3.639   0.227
  632    HA   TYR 101           HA       TYR 101  33.865   1.071  -0.981
  633    HB2  TYR 101           HB1      TYR 101  32.205   2.604  -2.225
  634    HB3  TYR 101           HB2      TYR 101  33.640   3.365  -2.918
  635    HD1  TYR 101           HD1      TYR 101  31.278   0.797  -3.362
  636    HD2  TYR 101           HD2      TYR 101  35.383   1.714  -4.005
  637    HE1  TYR 101           HE1      TYR 101  31.390  -0.946  -5.094
  638    HE2  TYR 101           HE2      TYR 101  35.506  -0.026  -5.739
  639    HH   TYR 101           HH       TYR 101  33.843  -2.381  -6.101
  640    H    PHE 102           H        PHE 102  35.907   0.428  -0.937
  641    HA   PHE 102           HA       PHE 102  38.065   2.351  -1.258
  642    HB2  PHE 102           HB1      PHE 102  37.802  -0.417  -0.199
  643    HB3  PHE 102           HB2      PHE 102  39.360   0.021  -0.902
  644    HD1  PHE 102           HD1      PHE 102  36.856   1.496   1.442
  645    HD2  PHE 102           HD2      PHE 102  40.959   0.860   0.505
  646    HE1  PHE 102           HE1      PHE 102  37.504   2.624   3.530
  647    HE2  PHE 102           HE2      PHE 102  41.613   1.987   2.592
  648    HZ   PHE 102           HZ       PHE 102  39.885   2.869   4.108
  649    H    GLN 103           H        GLN 103  39.907   1.844  -2.669
  650    HA   GLN 103           HA       GLN 103  39.112   0.348  -5.075
  651    HB2  GLN 103           HB1      GLN 103  40.230   3.121  -4.832
  652    HB3  GLN 103           HB2      GLN 103  40.570   2.155  -6.276
  653    HG2  GLN 103           HG1      GLN 103  38.533   2.472  -7.120
  654    HG3  GLN 103           HG2      GLN 103  37.754   2.154  -5.564
  655   HE21  GLN 103          HE21      GLN 103  37.013   3.813  -4.382
  656   HE22  GLN 103          HE22      GLN 103  37.196   5.478  -4.801
  657    H    SER 104           H        SER 104  41.024  -0.174  -6.489
  658    HA   SER 104           HA       SER 104  43.457  -0.614  -4.895
  659    HB2  SER 104           HB1      SER 104  41.652  -2.618  -5.679
  660    HB3  SER 104           HB2      SER 104  43.018  -2.750  -6.799
  661    HG   SER 104           HG       SER 104  42.953  -3.107  -4.028
  662    H    LEU 105           H        LEU 105  45.339  -1.255  -6.316
  663    HA   LEU 105           HA       LEU 105  45.169  -0.075  -8.996
  664    HB2  LEU 105           HB1      LEU 105  47.485   0.925  -8.507
  665    HB3  LEU 105           HB2      LEU 105  46.053   1.740  -7.858
  666    HG   LEU 105           HG       LEU 105  47.059  -0.127  -5.924
  667   HD11  LEU 105          HD11      LEU 105  49.237  -0.010  -6.645
  668   HD12  LEU 105          HD12      LEU 105  49.172   1.356  -5.533
  669   HD13  LEU 105          HD13      LEU 105  49.057   1.630  -7.270
  670   HD21  LEU 105          HD21      LEU 105  47.353   2.779  -5.522
  671   HD22  LEU 105          HD22      LEU 105  46.577   1.561  -4.507
  672   HD23  LEU 105          HD23      LEU 105  45.729   2.212  -5.911
  673    H    GLU 106           H        GLU 106  45.562  -1.822 -10.216
  674    HA   GLU 106           HA       GLU 106  47.142  -4.020  -9.488
  675    HB2  GLU 106           HB1      GLU 106  46.095  -2.977 -12.103
  676    HB3  GLU 106           HB2      GLU 106  47.198  -4.361 -12.073
  677    HG2  GLU 106           HG1      GLU 106  45.367  -5.612 -11.872
  678    HG3  GLU 106           HG2      GLU 106  45.354  -5.065 -10.188
  679    HE2  GLU 106           HE       GLU 106  42.714  -3.454 -12.681
  680    H    HIS 107           H        HIS 107  49.086  -4.739 -10.837
  681    HA   HIS 107           HA       HIS 107  50.855  -2.604 -11.676
  682    HB2  HIS 107           HB1      HIS 107  52.683  -3.375 -10.137
  683    HB3  HIS 107           HB2      HIS 107  51.342  -2.553  -9.334
  684    HD1  HIS 107           HD1      HIS 107  49.849  -3.936  -7.756
  685    HD2  HIS 107           HD2      HIS 107  52.925  -6.114  -9.505
  686    HE1  HIS 107           HE1      HIS 107  49.945  -6.105  -6.486
  687    HE2  HIS 107           HE2      HIS 107  51.825  -7.436  -7.555
  688    H    HIS 108           H        HIS 108  52.624  -3.325 -12.904
  689    HA   HIS 108           HA       HIS 108  52.519  -6.175 -13.645
  690    HB2  HIS 108           HB1      HIS 108  53.335  -5.401 -15.913
  691    HB3  HIS 108           HB2      HIS 108  51.674  -4.966 -15.507
  692    HD1  HIS 108           HD1      HIS 108  55.115  -3.384 -15.613
  693    HD2  HIS 108           HD2      HIS 108  51.104  -2.300 -15.639
  694    HE1  HIS 108           HE1      HIS 108  55.091  -0.909 -16.053
  695    HE2  HIS 108           HE2      HIS 108  52.640  -0.244 -16.070
  696    H    HIS 109           H        HIS 109  54.181  -4.891 -11.615
  697    HA   HIS 109           HA       HIS 109  56.334  -4.871 -10.877
  698    HB2  HIS 109           HB1      HIS 109  56.831  -6.806 -13.153
  699    HB3  HIS 109           HB2      HIS 109  57.798  -6.625 -11.685
  700    HD1  HIS 109           HD1      HIS 109  56.509  -9.338 -12.477
  701    HD2  HIS 109           HD2      HIS 109  54.848  -6.606  -9.825
  702    HE1  HIS 109           HE1      HIS 109  54.956 -10.674 -11.020
  703    HE2  HIS 109           HE2      HIS 109  53.941  -9.006  -9.397
  704    H    HIS 110           H        HIS 110  58.777  -4.860 -11.915
  705    HA   HIS 110           HA       HIS 110  58.733  -2.523 -13.686
  706    HB2  HIS 110           HB1      HIS 110  60.922  -3.630 -11.910
  707    HB3  HIS 110           HB2      HIS 110  61.087  -2.200 -12.933
  708    HD1  HIS 110           HD1      HIS 110  59.204  -3.390  -9.886
  709    HD2  HIS 110           HD2      HIS 110  60.110   0.141 -11.877
  710    HE1  HIS 110           HE1      HIS 110  58.437  -1.542  -8.362
  711    HE2  HIS 110           HE2      HIS 110  58.989   0.616  -9.579
  712    H    HIS 111           H        HIS 111  61.045  -2.469 -14.922
  713    HA   HIS 111           HA       HIS 111  61.524  -5.062 -16.185
  714    HB2  HIS 111           HB1      HIS 111  60.088  -2.862 -17.395
  715    HB3  HIS 111           HB2      HIS 111  61.559  -3.219 -18.304
  716    HD1  HIS 111           HD1      HIS 111  61.808  -5.747 -19.168
  717    HD2  HIS 111           HD2      HIS 111  58.034  -4.632 -17.836
  718    HE1  HIS 111           HE1      HIS 111  60.235  -7.488 -20.072
  719    HE2  HIS 111           HE2      HIS 111  57.927  -6.807 -19.259
  720    H    HIS 112           H        HIS 112  63.389  -4.821 -17.833
  721    HA   HIS 112           HA       HIS 112  65.640  -3.820 -16.429
  722    HB2  HIS 112           HB1      HIS 112  66.957  -4.607 -18.275
  723    HB3  HIS 112           HB2      HIS 112  65.674  -5.784 -17.979
  724    HD1  HIS 112           HD1      HIS 112  67.242  -5.172 -20.749
  725    HD2  HIS 112           HD2      HIS 112  63.342  -4.136 -19.757
  726    HE1  HIS 112           HE1      HIS 112  66.044  -4.889 -22.941
  727    HE2  HIS 112           HE2      HIS 112  63.661  -4.254 -22.337
  Start of MODEL   37
    1    H1   MET  18           H        MET  18 -34.479 -39.510  -8.686
    2    HA   MET  18           HA       MET  18 -36.476 -40.105 -10.769
    3    HB2  MET  18           HB1      MET  18 -35.442 -41.888  -8.559
    4    HB3  MET  18           HB2      MET  18 -36.937 -42.222  -9.445
    5    HG2  MET  18           HG1      MET  18 -35.587 -43.450 -10.757
    6    HG3  MET  18           HG2      MET  18 -35.259 -41.887 -11.509
    7    HE1  MET  18           HE1      MET  18 -33.097 -40.586 -11.379
    8    HE2  MET  18           HE2      MET  18 -31.612 -41.533 -11.284
    9    HE3  MET  18           HE3      MET  18 -32.882 -41.997 -12.417
   10    H    LEU  19           H        LEU  19 -36.635 -37.830  -9.206
   11    HA   LEU  19           HA       LEU  19 -38.840 -38.491  -7.365
   12    HB2  LEU  19           HB1      LEU  19 -36.496 -36.741  -7.065
   13    HB3  LEU  19           HB2      LEU  19 -38.034 -36.006  -6.585
   14    HG   LEU  19           HG       LEU  19 -36.890 -38.568  -5.473
   15   HD11  LEU  19          HD11      LEU  19 -37.308 -36.334  -3.662
   16   HD12  LEU  19          HD12      LEU  19 -36.122 -35.984  -4.920
   17   HD13  LEU  19          HD13      LEU  19 -35.904 -37.382  -3.867
   18   HD21  LEU  19          HD21      LEU  19 -39.161 -38.860  -5.232
   19   HD22  LEU  19          HD22      LEU  19 -39.478 -37.130  -5.089
   20   HD23  LEU  19          HD23      LEU  19 -38.759 -38.011  -3.739
   21    H    VAL  20           H        VAL  20 -40.708 -37.302  -7.493
   22    HA   VAL  20           HA       VAL  20 -41.210 -35.975  -9.985
   23    HB   VAL  20           HB       VAL  20 -42.930 -37.363  -8.913
   24   HG11  VAL  20          HG11      VAL  20 -43.607 -35.281  -6.930
   25   HG12  VAL  20          HG12      VAL  20 -43.756 -37.037  -6.832
   26   HG13  VAL  20          HG13      VAL  20 -42.188 -36.268  -6.580
   27   HG21  VAL  20          HG21      VAL  20 -44.045 -34.595  -8.887
   28   HG22  VAL  20          HG22      VAL  20 -43.369 -35.242 -10.381
   29   HG23  VAL  20          HG23      VAL  20 -44.712 -36.068  -9.590
   30    H    LEU  21           H        LEU  21 -41.723 -33.821 -10.340
   31    HA   LEU  21           HA       LEU  21 -40.374 -31.933  -8.691
   32    HB2  LEU  21           HB1      LEU  21 -41.407 -32.027 -11.313
   33    HB3  LEU  21           HB2      LEU  21 -42.229 -30.689 -10.492
   34    HG   LEU  21           HG       LEU  21 -39.248 -30.886 -10.374
   35   HD11  LEU  21          HD11      LEU  21 -39.993 -31.140 -12.760
   36   HD12  LEU  21          HD12      LEU  21 -38.988 -29.729 -12.428
   37   HD13  LEU  21          HD13      LEU  21 -40.731 -29.544 -12.622
   38   HD21  LEU  21          HD21      LEU  21 -39.806 -28.299 -10.603
   39   HD22  LEU  21          HD22      LEU  21 -39.864 -29.141  -9.054
   40   HD23  LEU  21          HD23      LEU  21 -41.353 -28.841  -9.951
   41    H    ASP  22           H        ASP  22 -41.110 -30.744  -7.052
   42    HA   ASP  22           HA       ASP  22 -43.916 -30.097  -6.799
   43    HB2  ASP  22           HB1      ASP  22 -44.000 -31.004  -4.434
   44    HB3  ASP  22           HB2      ASP  22 -44.019 -32.215  -5.721
   45    HD2  ASP  22           HD       ASP  22 -41.553 -33.627  -3.717
   46    H    PHE  23           H        PHE  23 -41.609 -28.529  -7.209
   47    HA   PHE  23           HA       PHE  23 -41.499 -27.043  -4.666
   48    HB2  PHE  23           HB1      PHE  23 -39.339 -27.819  -6.566
   49    HB3  PHE  23           HB2      PHE  23 -39.227 -26.223  -5.821
   50    HD1  PHE  23           HD1      PHE  23 -38.876 -25.954  -3.442
   51    HD2  PHE  23           HD2      PHE  23 -39.111 -29.819  -5.210
   52    HE1  PHE  23           HE1      PHE  23 -37.925 -26.943  -1.400
   53    HE2  PHE  23           HE2      PHE  23 -38.161 -30.813  -3.170
   54    HZ   PHE  23           HZ       PHE  23 -37.568 -29.375  -1.261
   55    H    ASN  24           H        ASN  24 -41.989 -24.925  -4.735
   56    HA   ASN  24           HA       ASN  24 -42.924 -23.845  -7.267
   57    HB2  ASN  24           HB1      ASN  24 -43.400 -23.309  -4.407
   58    HB3  ASN  24           HB2      ASN  24 -43.349 -21.865  -5.425
   59   HD21  ASN  24          HD21      ASN  24 -44.674 -25.155  -5.632
   60   HD22  ASN  24          HD22      ASN  24 -46.229 -24.672  -6.210
   61    H    ASN  25           H        ASN  25 -40.690 -22.879  -4.668
   62    HA   ASN  25           HA       ASN  25 -38.878 -21.505  -4.647
   63    HB2  ASN  25           HB1      ASN  25 -38.797 -22.049  -7.627
   64    HB3  ASN  25           HB2      ASN  25 -37.460 -21.468  -6.627
   65   HD21  ASN  25          HD21      ASN  25 -38.135 -24.000  -8.258
   66   HD22  ASN  25          HD22      ASN  25 -37.639 -25.279  -7.209
   67    H    ILE  26           H        ILE  26 -40.382 -19.762  -4.144
   68    HA   ILE  26           HA       ILE  26 -40.186 -17.633  -6.128
   69    HB   ILE  26           HB       ILE  26 -42.566 -16.950  -5.644
   70   HG12  ILE  26          HG11      ILE  26 -43.198 -19.784  -5.007
   71   HG13  ILE  26          HG12      ILE  26 -42.522 -18.802  -3.696
   72   HG21  ILE  26          HG21      ILE  26 -41.875 -17.968  -7.762
   73   HG22  ILE  26          HG22      ILE  26 -42.171 -19.569  -7.085
   74   HG23  ILE  26          HG23      ILE  26 -43.511 -18.446  -7.315
   75   HD11  ILE  26          HD11      ILE  26 -45.193 -18.847  -4.719
   76   HD12  ILE  26          HD12      ILE  26 -44.550 -18.024  -3.297
   77   HD13  ILE  26          HD13      ILE  26 -44.515 -17.227  -4.869
   78    H    ARG  27           H        ARG  27 -39.891 -15.642  -5.253
   79    HA   ARG  27           HA       ARG  27 -40.556 -15.071  -2.511
   80    HB2  ARG  27           HB1      ARG  27 -38.211 -14.494  -1.872
   81    HB3  ARG  27           HB2      ARG  27 -38.495 -16.227  -2.094
   82    HG2  ARG  27           HG1      ARG  27 -37.171 -16.368  -3.941
   83    HG3  ARG  27           HG2      ARG  27 -37.493 -14.695  -4.426
   84    HD2  ARG  27           HD1      ARG  27 -35.263 -14.631  -3.738
   85    HD3  ARG  27           HD2      ARG  27 -36.157 -14.037  -2.332
   86    HE   ARG  27           HE       ARG  27 -35.892 -16.778  -2.008
   87   HH11  ARG  27          HH11      ARG  27 -33.821 -13.990  -2.237
   88   HH12  ARG  27          HH12      ARG  27 -32.576 -14.670  -1.242
   89   HH21  ARG  27          HH21      ARG  27 -34.261 -17.686  -0.697
   90   HH22  ARG  27          HH22      ARG  27 -32.828 -16.773  -0.368
   91    H    SER  28           H        SER  28 -40.284 -12.844  -1.965
   92    HA   SER  28           HA       SER  28 -39.438 -11.028  -4.076
   93    HB2  SER  28           HB1      SER  28 -41.475  -9.921  -4.376
   94    HB3  SER  28           HB2      SER  28 -41.962 -11.623  -4.291
   95    HG   SER  28           HG       SER  28 -43.236 -10.207  -2.956
   96    H    SER  29           H        SER  29 -38.440  -9.296  -3.261
   97    HA   SER  29           HA       SER  29 -39.120  -8.300  -0.616
   98    HB2  SER  29           HB1      SER  29 -36.771  -8.372   0.169
   99    HB3  SER  29           HB2      SER  29 -37.433  -9.993  -0.113
  100    HG   SER  29           HG       SER  29 -35.492  -8.590  -1.558
  101    H    ALA  30           H        ALA  30 -37.732  -6.319  -0.099
  102    HA   ALA  30           HA       ALA  30 -37.498  -4.726  -2.557
  103    HB1  ALA  30           HB1      ALA  30 -39.125  -3.949  -0.875
  104    HB2  ALA  30           HB2      ALA  30 -37.808  -3.764   0.284
  105    HB3  ALA  30           HB3      ALA  30 -37.845  -2.773  -1.175
  106    H    ASP  31           H        ASP  31 -35.660  -3.602  -3.045
  107    HA   ASP  31           HA       ASP  31 -33.334  -4.091  -1.303
  108    HB2  ASP  31           HB1      ASP  31 -32.073  -3.671  -3.573
  109    HB3  ASP  31           HB2      ASP  31 -32.773  -5.256  -3.219
  110    HD2  ASP  31           HD       ASP  31 -34.414  -3.079  -6.089
  111    H    LEU  32           H        LEU  32 -31.772  -2.431  -1.110
  112    HA   LEU  32           HA       LEU  32 -32.378   0.185  -2.214
  113    HB2  LEU  32           HB1      LEU  32 -32.757  -0.558   0.637
  114    HB3  LEU  32           HB2      LEU  32 -31.991   1.004   0.299
  115    HG   LEU  32           HG       LEU  32 -34.210   1.030  -1.339
  116   HD11  LEU  32          HD11      LEU  32 -36.088   0.338  -0.054
  117   HD12  LEU  32          HD12      LEU  32 -35.071  -0.062   1.331
  118   HD13  LEU  32          HD13      LEU  32 -34.979  -1.031  -0.140
  119   HD21  LEU  32          HD21      LEU  32 -35.019   2.731   0.145
  120   HD22  LEU  32          HD22      LEU  32 -33.261   2.846   0.069
  121   HD23  LEU  32          HD23      LEU  32 -34.038   2.107   1.471
  122    H    HIS  33           H        HIS  33 -30.544   1.139  -2.793
  123    HA   HIS  33           HA       HIS  33 -28.058   0.335  -1.427
  124    HB2  HIS  33           HB1      HIS  33 -28.169  -0.515  -3.730
  125    HB3  HIS  33           HB2      HIS  33 -28.422   1.129  -4.325
  126    HD1  HIS  33           HD1      HIS  33 -26.320   1.581  -5.588
  127    HD2  HIS  33           HD2      HIS  33 -25.583   0.041  -1.801
  128    HE1  HIS  33           HE1      HIS  33 -23.828   1.715  -5.280
  129    HE2  HIS  33           HE2      HIS  33 -23.376   0.776  -2.966
  130    H    GLY  34           H        GLY  34 -26.787   1.903  -0.617
  131    HA2  GLY  34           HA2      GLY  34 -26.352   4.449  -1.521
  132    HA3  GLY  34           HA3      GLY  34 -27.801   4.588  -0.536
  133    HA1  GLY  34           HA1      GLY  34 -25.970   3.726  -1.189
  134    H    ALA  35           H        ALA  35 -27.461   5.140   1.501
  135    HA   ALA  35           HA       ALA  35 -26.419   5.544   3.486
  136    HB1  ALA  35           HB1      ALA  35 -24.727   3.145   3.367
  137    HB2  ALA  35           HB2      ALA  35 -25.878   3.666   4.598
  138    HB3  ALA  35           HB3      ALA  35 -26.452   2.861   3.137
  139    H    ARG  36           H        ARG  36 -25.175   6.619   1.117
  140    HA   ARG  36           HA       ARG  36 -22.321   6.499   1.795
  141    HB2  ARG  36           HB1      ARG  36 -23.655   6.450  -0.658
  142    HB3  ARG  36           HB2      ARG  36 -22.973   8.078  -0.550
  143    HG2  ARG  36           HG1      ARG  36 -20.804   6.750   0.183
  144    HG3  ARG  36           HG2      ARG  36 -21.595   5.458  -0.734
  145    HD2  ARG  36           HD1      ARG  36 -21.834   7.055  -2.654
  146    HD3  ARG  36           HD2      ARG  36 -20.853   8.203  -1.731
  147    HE   ARG  36           HE       ARG  36 -18.980   6.968  -2.227
  148   HH11  ARG  36          HH11      ARG  36 -21.832   5.136  -3.024
  149   HH12  ARG  36          HH12      ARG  36 -20.958   3.891  -3.854
  150   HH21  ARG  36          HH21      ARG  36 -17.820   5.334  -3.316
  151   HH22  ARG  36          HH22      ARG  36 -18.676   4.005  -4.018
  152    H    LYS  37           H        LYS  37 -21.125   8.607   1.555
  153    HA   LYS  37           HA       LYS  37 -22.744  10.900   2.423
  154    HB2  LYS  37           HB1      LYS  37 -20.890   9.428   4.023
  155    HB3  LYS  37           HB2      LYS  37 -20.221  11.040   3.726
  156    HG2  LYS  37           HG1      LYS  37 -21.416  11.378   5.663
  157    HG3  LYS  37           HG2      LYS  37 -22.581  11.868   4.421
  158    HD2  LYS  37           HD1      LYS  37 -23.631   9.649   4.517
  159    HD3  LYS  37           HD2      LYS  37 -22.469   9.168   5.766
  160    HE2  LYS  37           HE1      LYS  37 -23.613  10.201   7.393
  161    HE3  LYS  37           HE2      LYS  37 -23.832  11.656   6.409
  162    HZ1  LYS  37           HZ1      LYS  37 -25.937  11.075   6.152
  163    HZ2  LYS  37           HZ2      LYS  37 -25.696   9.618   6.974
  164    HZ3  LYS  37           HZ3      LYS  37 -25.453   9.695   5.302
  165    H    GLY  38           H        GLY  38 -19.339  10.077   1.712
  166    HA2  GLY  38           HA2      GLY  38 -18.919  11.238  -0.668
  167    HA3  GLY  38           HA3      GLY  38 -18.982  12.638   0.391
  168    HA1  GLY  38           HA1      GLY  38 -18.678  10.597  -0.114
  169    H    SER  39           H        SER  39 -17.345   9.516  -0.024
  170    HA   SER  39           HA       SER  39 -14.825  10.788   0.694
  171    HB2  SER  39           HB1      SER  39 -16.158   9.516   2.685
  172    HB3  SER  39           HB2      SER  39 -15.239   8.163   2.001
  173    HG   SER  39           HG       SER  39 -13.446   9.925   2.125
  174    H    GLN  40           H        GLN  40 -13.052   9.862  -0.263
  175    HA   GLN  40           HA       GLN  40 -13.636   7.776  -2.239
  176    HB2  GLN  40           HB1      GLN  40 -11.509   9.898  -2.036
  177    HB3  GLN  40           HB2      GLN  40 -11.343   8.528  -3.145
  178    HG2  GLN  40           HG1      GLN  40 -12.234  10.225  -4.469
  179    HG3  GLN  40           HG2      GLN  40 -13.621   9.206  -4.061
  180   HE21  GLN  40          HE21      GLN  40 -15.022  10.940  -4.475
  181   HE22  GLN  40          HE22      GLN  40 -15.212  12.237  -3.349
  182    H    CYS  41           H        CYS  41 -11.266   8.654   0.249
  183    HA   CYS  41           HA       CYS  41 -10.820   5.879   0.869
  184    HB2  CYS  41           HB1      CYS  41  -8.341   6.022   0.536
  185    HB3  CYS  41           HB2      CYS  41  -9.277   6.011  -0.960
  186    H    LEU  42           H        LEU  42 -10.047   5.588   2.921
  187    HA   LEU  42           HA       LEU  42  -9.832   8.008   4.545
  188    HB2  LEU  42           HB1      LEU  42 -10.985   5.447   4.917
  189    HB3  LEU  42           HB2      LEU  42  -9.662   5.610   6.086
  190    HG   LEU  42           HG       LEU  42 -11.555   7.879   5.910
  191   HD11  LEU  42          HD11      LEU  42 -13.332   6.864   6.995
  192   HD12  LEU  42          HD12      LEU  42 -12.373   5.464   7.475
  193   HD13  LEU  42          HD13      LEU  42 -12.870   5.657   5.795
  194   HD21  LEU  42          HD21      LEU  42  -9.936   6.467   7.988
  195   HD22  LEU  42          HD22      LEU  42 -11.285   7.498   8.466
  196   HD23  LEU  42          HD23      LEU  42  -9.944   8.172   7.539
  197    H    SER  43           H        SER  43  -7.969   5.250   3.491
  198    HA   SER  43           HA       SER  43  -5.593   6.448   4.735
  199    HB2  SER  43           HB1      SER  43  -6.009   3.455   4.615
  200    HB3  SER  43           HB2      SER  43  -4.787   4.359   5.527
  201    HG   SER  43           HG       SER  43  -7.550   4.682   6.022
  202    H    ASP  44           H        ASP  44  -3.545   5.554   3.772
  203    HA   ASP  44           HA       ASP  44  -3.585   5.888   0.975
  204    HB2  ASP  44           HB1      ASP  44  -1.215   5.349   1.035
  205    HB3  ASP  44           HB2      ASP  44  -1.626   6.405   2.392
  206    HD2  ASP  44           HD       ASP  44  -0.638   4.070   4.698
  207    H    THR  45           H        THR  45  -3.859   3.086   3.000
  208    HA   THR  45           HA       THR  45  -3.341   1.224   0.840
  209    HB   THR  45           HB       THR  45  -2.654   0.652   3.137
  210    HG1  THR  45           HG1      THR  45  -3.173  -1.039   1.666
  211   HG21  THR  45          HG21      THR  45  -5.055  -0.215   4.298
  212   HG22  THR  45          HG22      THR  45  -5.366   1.425   3.725
  213   HG23  THR  45          HG23      THR  45  -4.027   1.115   4.831
  214    H    ASP  46           H        ASP  46  -5.837   3.176   1.449
  215    HA   ASP  46           HA       ASP  46  -7.956   1.225   0.959
  216    HB2  ASP  46           HB1      ASP  46  -7.858   3.566   2.452
  217    HB3  ASP  46           HB2      ASP  46  -8.768   4.026   1.006
  218    HD2  ASP  46           HD       ASP  46 -11.287   1.632   1.810
  219    H    CYS  47           H        CYS  47  -5.786   2.475  -0.949
  220    HA   CYS  47           HA       CYS  47  -7.520   3.545  -3.028
  221    HB2  CYS  47           HB1      CYS  47  -5.420   4.683  -2.706
  222    HB3  CYS  47           HB2      CYS  47  -4.525   3.172  -2.869
  223    H    ASN  48           H        ASN  48  -4.922   1.099  -3.047
  224    HA   ASN  48           HA       ASN  48  -6.670  -0.726  -4.509
  225    HB2  ASN  48           HB1      ASN  48  -4.138   0.492  -5.572
  226    HB3  ASN  48           HB2      ASN  48  -4.604  -1.141  -6.064
  227   HD21  ASN  48          HD21      ASN  48  -6.774  -1.402  -6.980
  228   HD22  ASN  48          HD22      ASN  48  -7.414  -0.124  -7.951
  229    H    THR  49           H        THR  49  -3.159  -0.613  -3.955
  230    HA   THR  49           HA       THR  49  -3.273  -2.576  -1.858
  231    HB   THR  49           HB       THR  49  -2.064  -3.393  -4.507
  232    HG1  THR  49           HG1      THR  49  -3.755  -4.882  -4.569
  233   HG21  THR  49          HG21      THR  49  -1.458  -4.210  -1.870
  234   HG22  THR  49          HG22      THR  49  -0.895  -4.920  -3.382
  235   HG23  THR  49          HG23      THR  49  -2.367  -5.521  -2.621
  236    H    ARG  50           H        ARG  50  -0.922  -1.708  -4.399
  237    HA   ARG  50           HA       ARG  50   0.961  -0.962  -2.263
  238    HB2  ARG  50           HB1      ARG  50   1.452  -1.904  -5.096
  239    HB3  ARG  50           HB2      ARG  50   2.724  -1.316  -4.014
  240    HG2  ARG  50           HG1      ARG  50   2.315  -3.124  -2.461
  241    HG3  ARG  50           HG2      ARG  50   0.959  -3.689  -3.451
  242    HD2  ARG  50           HD1      ARG  50   2.308  -4.820  -4.827
  243    HD3  ARG  50           HD2      ARG  50   3.361  -3.414  -5.031
  244    HE   ARG  50           HE       ARG  50   4.785  -4.277  -3.451
  245   HH11  ARG  50          HH11      ARG  50   1.759  -5.995  -3.352
  246   HH12  ARG  50          HH12      ARG  50   2.341  -7.224  -2.278
  247   HH21  ARG  50          HH21      ARG  50   5.564  -5.889  -2.037
  248   HH22  ARG  50          HH22      ARG  50   4.506  -7.162  -1.531
  249    H    LYS  51           H        LYS  51  -0.766   0.985  -2.684
  250    HA   LYS  51           HA       LYS  51   0.838   3.019  -4.019
  251    HB2  LYS  51           HB1      LYS  51  -2.122   2.803  -4.584
  252    HB3  LYS  51           HB2      LYS  51  -0.946   3.884  -5.347
  253    HG2  LYS  51           HG1      LYS  51   0.153   1.977  -6.406
  254    HG3  LYS  51           HG2      LYS  51  -1.011   0.887  -5.633
  255    HD2  LYS  51           HD1      LYS  51  -2.827   1.768  -6.886
  256    HD3  LYS  51           HD2      LYS  51  -1.852   3.136  -7.449
  257    HE2  LYS  51           HE1      LYS  51  -1.191   1.975  -9.232
  258    HE3  LYS  51           HE2      LYS  51  -0.523   0.722  -8.176
  259    HZ1  LYS  51           HZ1      LYS  51  -3.174   0.843  -9.449
  260    HZ2  LYS  51           HZ2      LYS  51  -2.969  -0.053  -8.029
  261    HZ3  LYS  51           HZ3      LYS  51  -2.065  -0.433  -9.408
  262    H    PHE  52           H        PHE  52  -0.244   5.250  -3.642
  263    HA   PHE  52           HA       PHE  52  -1.474   5.307  -0.970
  264    HB2  PHE  52           HB1      PHE  52  -0.089   7.150  -0.300
  265    HB3  PHE  52           HB2      PHE  52   0.963   5.857  -0.878
  266    HD1  PHE  52           HD1      PHE  52  -0.358   9.189  -1.624
  267    HD2  PHE  52           HD2      PHE  52   2.263   6.081  -2.885
  268    HE1  PHE  52           HE1      PHE  52   0.709  10.738  -3.211
  269    HE2  PHE  52           HE2      PHE  52   3.335   7.626  -4.474
  270    HZ   PHE  52           HZ       PHE  52   2.558   9.957  -4.638
  271    H    CYS  53           H        CYS  53  -3.023   6.856  -0.621
  272    HA   CYS  53           HA       CYS  53  -4.273   7.958  -2.951
  273    HB2  CYS  53           HB1      CYS  53  -4.969   7.465  -0.192
  274    HB3  CYS  53           HB2      CYS  53  -5.438   9.102  -0.654
  275    H    LEU  54           H        LEU  54  -3.108   9.556  -3.897
  276    HA   LEU  54           HA       LEU  54  -1.808  11.617  -2.382
  277    HB2  LEU  54           HB1      LEU  54  -0.830  10.918  -4.461
  278    HB3  LEU  54           HB2      LEU  54  -2.332  11.284  -5.330
  279    HG   LEU  54           HG       LEU  54  -1.651  13.710  -4.207
  280   HD11  LEU  54          HD11      LEU  54   0.823  12.197  -4.982
  281   HD12  LEU  54          HD12      LEU  54   0.510  13.116  -3.511
  282   HD13  LEU  54          HD13      LEU  54   0.738  13.958  -5.044
  283   HD21  LEU  54          HD21      LEU  54  -0.679  13.988  -6.673
  284   HD22  LEU  54          HD22      LEU  54  -2.407  13.873  -6.339
  285   HD23  LEU  54          HD23      LEU  54  -1.518  12.451  -6.883
  286    H    GLN  55           H        GLN  55  -2.781  13.321  -1.528
  287    HA   GLN  55           HA       GLN  55  -5.207  14.359  -2.837
  288    HB2  GLN  55           HB1      GLN  55  -5.890  15.143  -0.538
  289    HB3  GLN  55           HB2      GLN  55  -5.905  13.388  -0.780
  290    HG2  GLN  55           HG1      GLN  55  -4.445  13.050   0.854
  291    HG3  GLN  55           HG2      GLN  55  -3.346  14.277   0.207
  292   HE21  GLN  55          HE21      GLN  55  -2.835  15.621   1.775
  293   HE22  GLN  55          HE22      GLN  55  -3.933  16.339   2.899
  294    HA   PRO  56           HA       PRO  56  -2.127  17.745  -3.009
  295    HB2  PRO  56           HB1      PRO  56  -3.093  18.791  -5.350
  296    HB3  PRO  56           HB2      PRO  56  -1.957  17.445  -5.280
  297    HG2  PRO  56           HG1      PRO  56  -4.940  17.402  -5.592
  298    HG3  PRO  56           HG2      PRO  56  -3.685  16.474  -6.495
  299    HD2  PRO  56           HD1      PRO  56  -5.155  15.383  -4.489
  300    HD3  PRO  56           HD2      PRO  56  -3.471  14.925  -4.800
  301    H    ARG  57           H        ARG  57  -2.409  20.046  -2.881
  302    HA   ARG  57           HA       ARG  57  -4.870  20.780  -1.554
  303    HB2  ARG  57           HB1      ARG  57  -2.392  21.466  -0.990
  304    HB3  ARG  57           HB2      ARG  57  -2.703  22.746  -2.171
  305    HG2  ARG  57           HG1      ARG  57  -4.857  23.158  -0.749
  306    HG3  ARG  57           HG2      ARG  57  -3.938  22.305   0.503
  307    HD2  ARG  57           HD1      ARG  57  -2.907  24.222   0.982
  308    HD3  ARG  57           HD2      ARG  57  -2.145  24.138  -0.612
  309    HE   ARG  57           HE       ARG  57  -3.557  25.789  -1.347
  310   HH11  ARG  57          HH11      ARG  57  -4.737  24.521   1.673
  311   HH12  ARG  57          HH12      ARG  57  -5.951  25.742   1.861
  312   HH21  ARG  57          HH21      ARG  57  -5.151  27.402  -1.111
  313   HH22  ARG  57          HH22      ARG  57  -6.186  27.380   0.277
  314    H    ASP  58           H        ASP  58  -3.086  21.792  -4.452
  315    HA   ASP  58           HA       ASP  58  -5.095  23.667  -5.260
  316    HB2  ASP  58           HB1      ASP  58  -2.443  22.891  -6.111
  317    HB3  ASP  58           HB2      ASP  58  -3.533  22.994  -7.501
  318    HD2  ASP  58           HD       ASP  58  -2.705  26.336  -5.535
  319    H    GLU  59           H        GLU  59  -4.571  20.286  -5.679
  320    HA   GLU  59           HA       GLU  59  -6.733  20.192  -7.681
  321    HB2  GLU  59           HB1      GLU  59  -4.150  18.912  -7.585
  322    HB3  GLU  59           HB2      GLU  59  -5.434  17.695  -7.613
  323    HG2  GLU  59           HG1      GLU  59  -6.144  18.263  -9.705
  324    HG3  GLU  59           HG2      GLU  59  -5.609  19.941  -9.542
  325    HE2  GLU  59           HE       GLU  59  -2.613  17.453 -10.280
  326    H    LYS  60           H        LYS  60  -7.658  17.747  -7.586
  327    HA   LYS  60           HA       LYS  60  -8.715  17.502  -4.864
  328    HB2  LYS  60           HB1      LYS  60 -10.440  16.028  -5.981
  329    HB3  LYS  60           HB2      LYS  60 -10.451  17.730  -6.468
  330    HG2  LYS  60           HG1      LYS  60  -9.724  17.290  -8.586
  331    HG3  LYS  60           HG2      LYS  60  -8.850  15.830  -8.092
  332    HD2  LYS  60           HD1      LYS  60 -10.665  14.488  -8.318
  333    HD3  LYS  60           HD2      LYS  60 -11.785  15.748  -7.774
  334    HE2  LYS  60           HE1      LYS  60 -10.629  16.559 -10.267
  335    HE3  LYS  60           HE2      LYS  60 -11.245  14.908 -10.421
  336    HZ1  LYS  60           HZ1      LYS  60 -13.393  15.611  -9.703
  337    HZ2  LYS  60           HZ2      LYS  60 -12.901  16.650 -10.943
  338    HZ3  LYS  60           HZ3      LYS  60 -12.834  17.165  -9.333
  339    HA   PRO  61           HA       PRO  61  -6.679  13.705  -4.023
  340    HB2  PRO  61           HB1      PRO  61  -8.567  12.390  -2.539
  341    HB3  PRO  61           HB2      PRO  61  -7.653  13.774  -1.944
  342    HG2  PRO  61           HG1      PRO  61 -10.407  13.679  -3.128
  343    HG3  PRO  61           HG2      PRO  61  -9.826  14.553  -1.662
  344    HD2  PRO  61           HD1      PRO  61 -10.226  15.794  -4.044
  345    HD3  PRO  61           HD2      PRO  61  -8.947  16.275  -2.916
  346    H    PHE  62           H        PHE  62  -6.468  11.606  -4.743
  347    HA   PHE  62           HA       PHE  62  -8.587  10.089  -5.863
  348    HB2  PHE  62           HB1      PHE  62  -7.656  10.072  -8.224
  349    HB3  PHE  62           HB2      PHE  62  -8.513  11.537  -7.742
  350    HD1  PHE  62           HD1      PHE  62  -7.570  13.564  -8.247
  351    HD2  PHE  62           HD2      PHE  62  -5.035  10.185  -7.722
  352    HE1  PHE  62           HE1      PHE  62  -5.621  14.936  -8.854
  353    HE2  PHE  62           HE2      PHE  62  -3.082  11.552  -8.327
  354    HZ   PHE  62           HZ       PHE  62  -3.372  13.931  -8.893
  355    H    CYS  63           H        CYS  63  -7.508   8.253  -7.334
  356    HA   CYS  63           HA       CYS  63  -5.521   7.039  -5.616
  357    HB2  CYS  63           HB1      CYS  63  -7.496   6.141  -7.559
  358    HB3  CYS  63           HB2      CYS  63  -5.941   5.336  -7.781
  359    H    ALA  64           H        ALA  64  -3.403   7.003  -5.977
  360    HA   ALA  64           HA       ALA  64  -2.396   7.311  -8.710
  361    HB1  ALA  64           HB1      ALA  64  -2.021   9.486  -8.218
  362    HB2  ALA  64           HB2      ALA  64  -1.998   9.204  -6.477
  363    HB3  ALA  64           HB3      ALA  64  -0.578   8.822  -7.451
  364    H    THR  65           H        THR  65  -0.798   5.933  -9.152
  365    HA   THR  65           HA       THR  65  -0.001   3.923  -7.400
  366    HB   THR  65           HB       THR  65   0.253   3.521  -9.728
  367    HG1  THR  65           HG1      THR  65   2.935   3.864  -8.873
  368   HG21  THR  65          HG21      THR  65   2.066   5.932  -9.746
  369   HG22  THR  65          HG22      THR  65   0.522   5.747 -10.576
  370   HG23  THR  65          HG23      THR  65   1.918   4.801 -11.091
  371    H    CYS  66           H        CYS  66   2.165   3.458  -6.573
  372    HA   CYS  66           HA       CYS  66   3.240   5.754  -5.191
  373    HB2  CYS  66           HB1      CYS  66   4.610   4.155  -3.978
  374    HB3  CYS  66           HB2      CYS  66   2.937   3.594  -4.033
  375    H    ARG  67           H        ARG  67   5.193   6.715  -5.493
  376    HA   ARG  67           HA       ARG  67   6.365   6.783  -7.991
  377    HB2  ARG  67           HB1      ARG  67   7.593   7.413  -5.297
  378    HB3  ARG  67           HB2      ARG  67   8.315   7.851  -6.852
  379    HG2  ARG  67           HG1      ARG  67   5.583   8.766  -5.958
  380    HG3  ARG  67           HG2      ARG  67   7.074   9.694  -5.728
  381    HD2  ARG  67           HD1      ARG  67   7.423   9.882  -8.090
  382    HD3  ARG  67           HD2      ARG  67   6.121   8.730  -8.417
  383    HE   ARG  67           HE       ARG  67   5.846  11.528  -7.938
  384   HH11  ARG  67          HH11      ARG  67   4.270   8.448  -7.544
  385   HH12  ARG  67          HH12      ARG  67   2.673   9.119  -7.537
  386   HH21  ARG  67          HH21      ARG  67   3.748  12.423  -7.929
  387   HH22  ARG  67          HH22      ARG  67   2.377  11.380  -7.756
  388    H    GLY  68           H        GLY  68   7.486   5.324  -9.091
  389    HA2  GLY  68           HA2      GLY  68   8.360   2.876  -8.037
  390    HA3  GLY  68           HA3      GLY  68   8.847   3.545  -9.588
  391    HA1  GLY  68           HA1      GLY  68   8.517   3.549  -7.488
  392    H    LEU  69           H        LEU  69  10.810   2.249  -8.722
  393    HA   LEU  69           HA       LEU  69  12.417   3.442  -6.704
  394    HB2  LEU  69           HB1      LEU  69  12.739   1.303  -8.739
  395    HB3  LEU  69           HB2      LEU  69  14.217   2.045  -8.101
  396    HG   LEU  69           HG       LEU  69  12.088   0.679  -6.453
  397   HD11  LEU  69          HD11      LEU  69  13.625  -0.705  -7.995
  398   HD12  LEU  69          HD12      LEU  69  13.477  -1.172  -6.302
  399   HD13  LEU  69          HD13      LEU  69  14.896  -0.280  -6.849
  400   HD21  LEU  69          HD21      LEU  69  13.908   0.841  -4.690
  401   HD22  LEU  69          HD22      LEU  69  13.061   2.336  -5.091
  402   HD23  LEU  69          HD23      LEU  69  14.675   2.035  -5.738
  403    H    ARG  70           H        ARG  70  11.986   4.010 -10.092
  404    HA   ARG  70           HA       ARG  70  14.377   5.695 -10.214
  405    HB2  ARG  70           HB1      ARG  70  12.630   4.355 -12.210
  406    HB3  ARG  70           HB2      ARG  70  13.359   5.895 -12.690
  407    HG2  ARG  70           HG1      ARG  70  15.538   4.689 -11.695
  408    HG3  ARG  70           HG2      ARG  70  14.620   3.269 -12.224
  409    HD2  ARG  70           HD1      ARG  70  14.416   5.189 -14.296
  410    HD3  ARG  70           HD2      ARG  70  16.113   5.136 -13.796
  411    HE   ARG  70           HE       ARG  70  14.687   3.117 -15.219
  412   HH11  ARG  70          HH11      ARG  70  17.253   3.649 -12.928
  413   HH12  ARG  70          HH12      ARG  70  18.097   2.191 -13.338
  414   HH21  ARG  70          HH21      ARG  70  15.788   1.197 -15.768
  415   HH22  ARG  70          HH22      ARG  70  17.263   0.798 -14.954
  416    H    ARG  71           H        ARG  71  11.556   6.180  -8.946
  417    HA   ARG  71           HA       ARG  71  11.008   8.751 -10.264
  418    HB2  ARG  71           HB1      ARG  71   9.328   6.876  -8.625
  419    HB3  ARG  71           HB2      ARG  71   8.883   8.583  -8.769
  420    HG2  ARG  71           HG1      ARG  71   9.365   6.841 -11.176
  421    HG3  ARG  71           HG2      ARG  71   7.785   6.976 -10.388
  422    HD2  ARG  71           HD1      ARG  71   8.907   9.599 -10.823
  423    HD3  ARG  71           HD2      ARG  71   8.874   8.676 -12.332
  424    HE   ARG  71           HE       ARG  71   6.404   8.531 -10.889
  425   HH11  ARG  71          HH11      ARG  71   8.287  10.438 -13.111
  426   HH12  ARG  71          HH12      ARG  71   6.908  11.226 -13.806
  427   HH21  ARG  71          HH21      ARG  71   4.582   9.562 -11.794
  428   HH22  ARG  71          HH22      ARG  71   4.802  10.727 -13.055
  429    H    ARG  72           H        ARG  72  10.879  10.651  -9.071
  430    HA   ARG  72           HA       ARG  72  12.608  10.806  -6.815
  431    HB2  ARG  72           HB1      ARG  72  10.735  12.867  -8.004
  432    HB3  ARG  72           HB2      ARG  72  11.979  13.200  -6.787
  433    HG2  ARG  72           HG1      ARG  72  12.928  11.848  -9.232
  434    HG3  ARG  72           HG2      ARG  72  12.345  13.509  -9.435
  435    HD2  ARG  72           HD1      ARG  72  13.846  14.213  -7.567
  436    HD3  ARG  72           HD2      ARG  72  14.495  12.567  -7.543
  437    HE   ARG  72           HE       ARG  72  15.753  13.081  -9.378
  438   HH11  ARG  72          HH11      ARG  72  13.177  15.407  -9.093
  439   HH12  ARG  72          HH12      ARG  72  13.767  16.411 -10.375
  440   HH21  ARG  72          HH21      ARG  72  16.539  14.396 -11.068
  441   HH22  ARG  72          HH22      ARG  72  15.679  15.835 -11.499
  442    H    CYS  73           H        CYS  73  12.041  11.690  -4.716
  443    HA   CYS  73           HA       CYS  73   9.268  11.547  -3.890
  444    HB2  CYS  73           HB1      CYS  73   9.660   9.895  -2.126
  445    HB3  CYS  73           HB2      CYS  73   9.962   9.205  -3.721
  446    H    GLN  74           H        GLN  74   8.961  12.269  -1.658
  447    HA   GLN  74           HA       GLN  74  11.160  14.020  -0.776
  448    HB2  GLN  74           HB1      GLN  74   8.346  14.546  -1.296
  449    HB3  GLN  74           HB2      GLN  74   8.818  15.025   0.343
  450    HG2  GLN  74           HG1      GLN  74  10.099  16.733  -0.361
  451    HG3  GLN  74           HG2      GLN  74  10.667  15.849  -1.785
  452   HE21  GLN  74          HE21      GLN  74   9.319  18.574  -1.137
  453   HE22  GLN  74          HE22      GLN  74   8.146  18.724  -2.397
  454    H    ARG  75           H        ARG  75   8.838  11.614   0.120
  455    HA   ARG  75           HA       ARG  75  10.027  11.516   2.800
  456    HB2  ARG  75           HB1      ARG  75   7.277  12.150   2.141
  457    HB3  ARG  75           HB2      ARG  75   7.376  10.693   3.139
  458    HG2  ARG  75           HG1      ARG  75   8.634  11.887   4.838
  459    HG3  ARG  75           HG2      ARG  75   8.629  13.342   3.828
  460    HD2  ARG  75           HD1      ARG  75   6.384  13.763   4.179
  461    HD3  ARG  75           HD2      ARG  75   6.029  12.067   4.538
  462    HE   ARG  75           HE       ARG  75   7.735  13.254   6.499
  463   HH11  ARG  75          HH11      ARG  75   4.428  12.925   5.466
  464   HH12  ARG  75          HH12      ARG  75   3.770  13.203   7.046
  465   HH21  ARG  75          HH21      ARG  75   6.882  13.621   8.583
  466   HH22  ARG  75          HH22      ARG  75   5.167  13.599   8.817
  467    H    ASP  76           H        ASP  76   9.924   9.441   3.818
  468    HA   ASP  76           HA       ASP  76  10.154   7.279   1.927
  469    HB2  ASP  76           HB1      ASP  76  10.226   6.904   4.908
  470    HB3  ASP  76           HB2      ASP  76  11.135   6.051   3.651
  471    HD2  ASP  76           HD       ASP  76  12.570   9.482   5.003
  472    H    ALA  77           H        ALA  77   7.771   8.467   4.135
  473    HA   ALA  77           HA       ALA  77   6.267   6.051   4.367
  474    HB1  ALA  77           HB1      ALA  77   4.460   7.989   4.928
  475    HB2  ALA  77           HB2      ALA  77   5.626   7.350   6.087
  476    HB3  ALA  77           HB3      ALA  77   5.972   8.847   5.221
  477    H    MET  78           H        MET  78   6.384   8.671   2.079
  478    HA   MET  78           HA       MET  78   3.882   7.924   0.819
  479    HB2  MET  78           HB1      MET  78   4.337   9.744  -0.737
  480    HB3  MET  78           HB2      MET  78   4.535  10.289   0.936
  481    HG2  MET  78           HG1      MET  78   6.785  10.591   0.738
  482    HG3  MET  78           HG2      MET  78   6.950   9.314  -0.469
  483    HE1  MET  78           HE1      MET  78   6.387  10.643  -3.733
  484    HE2  MET  78           HE2      MET  78   5.886   9.364  -2.628
  485    HE3  MET  78           HE3      MET  78   4.756  10.647  -3.063
  486    H    CYS  79           H        CYS  79   7.222   7.178   0.540
  487    HA   CYS  79           HA       CYS  79   7.365   6.484  -2.182
  488    HB2  CYS  79           HB1      CYS  79   9.049   6.344   0.112
  489    HB3  CYS  79           HB2      CYS  79   9.036   4.749  -0.643
  490    H    CYS  80           H        CYS  80   7.661   4.230  -3.000
  491    HA   CYS  80           HA       CYS  80   5.352   2.738  -2.764
  492    HB2  CYS  80           HB1      CYS  80   8.113   2.130  -3.752
  493    HB3  CYS  80           HB2      CYS  80   6.946   0.815  -3.619
  494    HA   PRO  81           HA       PRO  81   5.603   0.309   0.880
  495    HB2  PRO  81           HB1      PRO  81   4.570  -2.090   0.059
  496    HB3  PRO  81           HB2      PRO  81   3.599  -0.635   0.272
  497    HG2  PRO  81           HG1      PRO  81   4.789  -1.775  -2.234
  498    HG3  PRO  81           HG2      PRO  81   3.130  -1.129  -1.951
  499    HD2  PRO  81           HD1      PRO  81   5.068   0.304  -3.201
  500    HD3  PRO  81           HD2      PRO  81   3.837   1.054  -2.170
  501    H    GLY  82           H        GLY  82   7.470  -0.353   1.738
  502    HA2  GLY  82           HA2      GLY  82   9.080  -2.008   2.204
  503    HA3  GLY  82           HA3      GLY  82   8.770  -2.721   0.629
  504    HA1  GLY  82           HA1      GLY  82   9.061  -1.143   2.023
  505    H    THR  83           H        THR  83   9.273   0.694   0.858
  506    HA   THR  83           HA       THR  83  12.073   0.402   0.029
  507    HB   THR  83           HB       THR  83  11.213   2.518  -1.516
  508    HG1  THR  83           HG1      THR  83   9.326   0.423  -1.880
  509   HG21  THR  83          HG21      THR  83  11.107   0.287  -3.191
  510   HG22  THR  83          HG22      THR  83  12.206  -0.170  -1.890
  511   HG23  THR  83          HG23      THR  83  12.519   1.283  -2.838
  512    H    LEU  84           H        LEU  84  13.089   2.691  -0.160
  513    HA   LEU  84           HA       LEU  84  12.030   4.440   1.951
  514    HB2  LEU  84           HB1      LEU  84  14.520   2.944   1.929
  515    HB3  LEU  84           HB2      LEU  84  14.791   4.687   2.106
  516    HG   LEU  84           HG       LEU  84  13.017   4.507   4.002
  517   HD11  LEU  84          HD11      LEU  84  13.338   2.235   5.148
  518   HD12  LEU  84          HD12      LEU  84  13.817   1.654   3.554
  519   HD13  LEU  84          HD13      LEU  84  12.207   2.333   3.798
  520   HD21  LEU  84          HD21      LEU  84  14.735   4.393   5.556
  521   HD22  LEU  84          HD22      LEU  84  15.569   4.901   4.088
  522   HD23  LEU  84          HD23      LEU  84  15.649   3.219   4.611
  523    H    CYS  85           H        CYS  85  12.976   6.639   1.894
  524    HA   CYS  85           HA       CYS  85  13.315   7.490  -0.887
  525    HB2  CYS  85           HB1      CYS  85  11.541   8.458   0.717
  526    HB3  CYS  85           HB2      CYS  85  12.887   9.319   1.465
  527    H    VAL  86           H        VAL  86  15.346   7.673  -1.554
  528    HA   VAL  86           HA       VAL  86  17.290   8.976   0.232
  529    HB   VAL  86           HB       VAL  86  17.860   6.608  -1.558
  530   HG11  VAL  86          HG11      VAL  86  20.128   6.716  -0.651
  531   HG12  VAL  86          HG12      VAL  86  19.714   8.197  -1.518
  532   HG13  VAL  86          HG13      VAL  86  19.703   8.173   0.246
  533   HG21  VAL  86          HG21      VAL  86  17.128   5.452   0.214
  534   HG22  VAL  86          HG22      VAL  86  18.637   5.943   0.984
  535   HG23  VAL  86          HG23      VAL  86  17.161   6.867   1.267
  536    H    ASN  87           H        ASN  87  18.546  10.512  -0.687
  537    HA   ASN  87           HA       ASN  87  19.188  12.094  -2.194
  538    HB2  ASN  87           HB1      ASN  87  20.303   9.902  -3.030
  539    HB3  ASN  87           HB2      ASN  87  19.100   9.972  -4.323
  540   HD21  ASN  87          HD21      ASN  87  19.886  10.797  -6.107
  541   HD22  ASN  87          HD22      ASN  87  21.023  12.093  -6.222
  542    H    ASP  88           H        ASP  88  16.404  11.894  -1.766
  543    HA   ASP  88           HA       ASP  88  14.436  12.688  -2.586
  544    HB2  ASP  88           HB1      ASP  88  16.035  13.741  -4.928
  545    HB3  ASP  88           HB2      ASP  88  14.506  14.362  -4.293
  546    HD2  ASP  88           HD       ASP  88  16.251  15.719  -1.471
  547    H    VAL  89           H        VAL  89  15.553  10.053  -3.454
  548    HA   VAL  89           HA       VAL  89  13.631   9.588  -5.605
  549    HB   VAL  89           HB       VAL  89  16.490   8.620  -5.750
  550   HG11  VAL  89          HG11      VAL  89  14.946   6.977  -6.634
  551   HG12  VAL  89          HG12      VAL  89  14.160   8.210  -7.621
  552   HG13  VAL  89          HG13      VAL  89  15.828   7.743  -7.955
  553   HG21  VAL  89          HG21      VAL  89  15.049  10.576  -7.538
  554   HG22  VAL  89          HG22      VAL  89  16.194  11.027  -6.274
  555   HG23  VAL  89          HG23      VAL  89  16.736  10.075  -7.654
  556    H    CYS  90           H        CYS  90  12.617   7.642  -5.491
  557    HA   CYS  90           HA       CYS  90  12.669   6.210  -3.074
  558    HB2  CYS  90           HB1      CYS  90  10.978   6.360  -5.236
  559    HB3  CYS  90           HB2      CYS  90  11.635   4.730  -5.390
  560    H    THR  91           H        THR  91  14.352   5.053  -2.400
  561    HA   THR  91           HA       THR  91  15.681   3.268  -4.334
  562    HB   THR  91           HB       THR  91  16.889   4.589  -1.896
  563    HG1  THR  91           HG1      THR  91  17.046   5.061  -4.678
  564   HG21  THR  91          HG21      THR  91  18.990   3.567  -2.611
  565   HG22  THR  91          HG22      THR  91  18.155   2.756  -3.936
  566   HG23  THR  91          HG23      THR  91  17.780   2.331  -2.266
  567    H    THR  92           H        THR  92  16.129   1.169  -3.716
  568    HA   THR  92           HA       THR  92  14.371  -0.015  -1.844
  569    HB   THR  92           HB       THR  92  16.552  -1.782  -2.372
  570    HG1  THR  92           HG1      THR  92  17.213  -0.987  -4.223
  571   HG21  THR  92          HG21      THR  92  14.052  -2.219  -2.096
  572   HG22  THR  92          HG22      THR  92  14.885  -3.129  -3.356
  573   HG23  THR  92          HG23      THR  92  13.895  -1.734  -3.783
  574    H    MET  93           H        MET  93  14.840  -1.115   0.105
  575    HA   MET  93           HA       MET  93  16.569   0.266   1.854
  576    HB2  MET  93           HB1      MET  93  14.429  -1.213   2.291
  577    HB3  MET  93           HB2      MET  93  15.628  -2.500   2.486
  578    HG2  MET  93           HG1      MET  93  16.739  -0.619   4.056
  579    HG3  MET  93           HG2      MET  93  15.036  -0.189   4.214
  580    HE1  MET  93           HE1      MET  93  14.226  -0.549   6.131
  581    HE2  MET  93           HE2      MET  93  13.245  -1.996   5.893
  582    HE3  MET  93           HE3      MET  93  14.387  -1.915   7.236
  583    H    GLU  94           H        GLU  94  16.867  -2.806   0.138
  584    HA   GLU  94           HA       GLU  94  19.257  -3.656   1.377
  585    HB2  GLU  94           HB1      GLU  94  17.748  -4.378  -1.088
  586    HB3  GLU  94           HB2      GLU  94  19.438  -4.895  -0.979
  587    HG2  GLU  94           HG1      GLU  94  17.368  -5.483   1.133
  588    HG3  GLU  94           HG2      GLU  94  17.769  -6.576  -0.199
  589    HE2  GLU  94           HE       GLU  94  19.828  -7.536   2.601
  590    H    ASP  95           H        ASP  95  18.595  -1.405  -1.177
  591    HA   ASP  95           HA       ASP  95  21.323  -1.333  -2.128
  592    HB2  ASP  95           HB1      ASP  95  18.761  -0.403  -3.045
  593    HB3  ASP  95           HB2      ASP  95  19.910   0.942  -3.039
  594    HD2  ASP  95           HD       ASP  95  21.997  -1.070  -5.255
  595    H    ALA  96           H        ALA  96  19.223   0.599  -0.067
  596    HA   ALA  96           HA       ALA  96  20.796   2.874   0.219
  597    HB1  ALA  96           HB1      ALA  96  18.552   1.676   1.593
  598    HB2  ALA  96           HB2      ALA  96  19.642   2.492   2.713
  599    HB3  ALA  96           HB3      ALA  96  18.951   3.378   1.354
  600    H    THR  97           H        THR  97  22.560   3.399   1.395
  601    HA   THR  97           HA       THR  97  23.748   1.279   3.066
  602    HB   THR  97           HB       THR  97  25.638   3.253   2.016
  603    HG1  THR  97           HG1      THR  97  25.550   1.983  -0.093
  604   HG21  THR  97          HG21      THR  97  26.128   1.074   3.213
  605   HG22  THR  97          HG22      THR  97  27.022   1.349   1.718
  606   HG23  THR  97          HG23      THR  97  25.638   0.254   1.730
  607    H    GLU  98           H        GLU  98  24.136   4.784   2.490
  608    HA   GLU  98           HA       GLU  98  24.480   6.522   3.923
  609    HB2  GLU  98           HB1      GLU  98  22.624   4.852   5.635
  610    HB3  GLU  98           HB2      GLU  98  23.039   6.544   5.947
  611    HG2  GLU  98           HG1      GLU  98  22.089   6.175   3.237
  612    HG3  GLU  98           HG2      GLU  98  20.920   5.592   4.431
  613    HE2  GLU  98           HE       GLU  98  21.022   8.981   5.836
  614    H    ASN  99           H        ASN  99  26.706   5.342   3.981
  615    HA   ASN  99           HA       ASN  99  27.475   4.021   6.370
  616    HB2  ASN  99           HB1      ASN  99  28.616   4.194   3.974
  617    HB3  ASN  99           HB2      ASN  99  29.483   5.524   4.753
  618   HD21  ASN  99          HD21      ASN  99  31.227   5.055   5.889
  619   HD22  ASN  99          HD22      ASN  99  31.676   3.484   6.449
  620    H    LEU 100           H        LEU 100  29.121   4.863   7.894
  621    HA   LEU 100           HA       LEU 100  28.305   7.473   8.854
  622    HB2  LEU 100           HB1      LEU 100  30.231   5.446  10.007
  623    HB3  LEU 100           HB2      LEU 100  29.686   6.928  10.814
  624    HG   LEU 100           HG       LEU 100  28.007   4.520  10.124
  625   HD11  LEU 100          HD11      LEU 100  29.091   5.661  12.679
  626   HD12  LEU 100          HD12      LEU 100  29.255   4.025  12.043
  627   HD13  LEU 100          HD13      LEU 100  27.696   4.581  12.653
  628   HD21  LEU 100          HD21      LEU 100  27.241   7.204  11.252
  629   HD22  LEU 100          HD22      LEU 100  26.229   5.766  11.388
  630   HD23  LEU 100          HD23      LEU 100  26.620   6.422   9.798
  631    H    TYR 101           H        TYR 101  30.261   8.734   9.941
  632    HA   TYR 101           HA       TYR 101  32.723   8.726   8.494
  633    HB2  TYR 101           HB1      TYR 101  32.404  11.069   7.572
  634    HB3  TYR 101           HB2      TYR 101  31.537   9.780   6.734
  635    HD1  TYR 101           HD1      TYR 101  30.942  12.166   9.554
  636    HD2  TYR 101           HD2      TYR 101  29.340  10.164   6.159
  637    HE1  TYR 101           HE1      TYR 101  28.819  13.371   9.851
  638    HE2  TYR 101           HE2      TYR 101  27.213  11.364   6.446
  639    HH   TYR 101           HH       TYR 101  26.766  13.984   7.933
  640    H    PHE 102           H        PHE 102  34.089  10.655   9.111
  641    HA   PHE 102           HA       PHE 102  33.335  11.690  11.760
  642    HB2  PHE 102           HB1      PHE 102  35.557  11.315  12.608
  643    HB3  PHE 102           HB2      PHE 102  34.945   9.793  11.958
  644    HD1  PHE 102           HD1      PHE 102  35.622   9.168   9.559
  645    HD2  PHE 102           HD2      PHE 102  37.622  12.118  11.887
  646    HE1  PHE 102           HE1      PHE 102  37.606   8.953   8.121
  647    HE2  PHE 102           HE2      PHE 102  39.609  11.907  10.452
  648    HZ   PHE 102           HZ       PHE 102  39.602  10.325   8.566
  649    H    GLN 103           H        GLN 103  34.116  13.740  12.292
  650    HA   GLN 103           HA       GLN 103  35.613  15.188  10.236
  651    HB2  GLN 103           HB1      GLN 103  34.063  17.097  10.363
  652    HB3  GLN 103           HB2      GLN 103  33.278  15.640   9.732
  653    HG2  GLN 103           HG1      GLN 103  32.080  15.271  11.717
  654    HG3  GLN 103           HG2      GLN 103  33.094  16.402  12.624
  655   HE21  GLN 103          HE21      GLN 103  30.416  16.053  10.481
  656   HE22  GLN 103          HE22      GLN 103  29.885  17.695  10.530
  657    H    SER 104           H        SER 104  35.751  17.646  11.212
  658    HA   SER 104           HA       SER 104  36.787  18.967  12.746
  659    HB2  SER 104           HB1      SER 104  35.725  17.043  14.835
  660    HB3  SER 104           HB2      SER 104  36.164  18.748  15.057
  661    HG   SER 104           HG       SER 104  34.434  18.966  13.257
  662    H    LEU 105           H        LEU 105  38.389  18.846  14.701
  663    HA   LEU 105           HA       LEU 105  39.905  16.533  15.160
  664    HB2  LEU 105           HB1      LEU 105  40.345  17.378  12.630
  665    HB3  LEU 105           HB2      LEU 105  41.574  18.311  13.503
  666    HG   LEU 105           HG       LEU 105  41.457  15.403  14.061
  667   HD11  LEU 105          HD11      LEU 105  41.461  14.890  11.876
  668   HD12  LEU 105          HD12      LEU 105  43.140  15.426  11.939
  669   HD13  LEU 105          HD13      LEU 105  41.882  16.531  11.383
  670   HD21  LEU 105          HD21      LEU 105  44.003  15.893  13.769
  671   HD22  LEU 105          HD22      LEU 105  43.158  16.442  15.217
  672   HD23  LEU 105          HD23      LEU 105  43.498  17.577  13.910
  673    H    GLU 106           H        GLU 106  40.640  16.945  17.128
  674    HA   GLU 106           HA       GLU 106  41.021  19.637  18.061
  675    HB2  GLU 106           HB1      GLU 106  40.287  17.328  19.282
  676    HB3  GLU 106           HB2      GLU 106  42.000  17.403  19.726
  677    HG2  GLU 106           HG1      GLU 106  41.529  19.802  20.476
  678    HG3  GLU 106           HG2      GLU 106  39.821  19.355  20.370
  679    HE2  GLU 106           HE       GLU 106  41.941  17.450  23.145
  680    H    HIS 107           H        HIS 107  43.040  20.191  19.318
  681    HA   HIS 107           HA       HIS 107  45.270  20.638  19.353
  682    HB2  HIS 107           HB1      HIS 107  45.135  17.980  19.568
  683    HB3  HIS 107           HB2      HIS 107  45.964  18.070  18.011
  684    HD1  HIS 107           HD1      HIS 107  47.469  20.824  19.100
  685    HD2  HIS 107           HD2      HIS 107  47.594  16.968  20.641
  686    HE1  HIS 107           HE1      HIS 107  49.606  20.696  20.420
  687    HE2  HIS 107           HE2      HIS 107  49.683  18.338  21.361
  688    H    HIS 108           H        HIS 108  45.552  22.274  17.938
  689    HA   HIS 108           HA       HIS 108  46.828  21.724  15.446
  690    HB2  HIS 108           HB1      HIS 108  44.173  21.567  15.172
  691    HB3  HIS 108           HB2      HIS 108  44.347  23.320  15.032
  692    HD1  HIS 108           HD1      HIS 108  45.112  20.147  13.230
  693    HD2  HIS 108           HD2      HIS 108  45.662  24.234  12.721
  694    HE1  HIS 108           HE1      HIS 108  45.816  20.438  10.833
  695    HE2  HIS 108           HE2      HIS 108  46.152  22.935  10.520
  696    H    HIS 109           H        HIS 109  48.112  23.388  14.866
  697    HA   HIS 109           HA       HIS 109  47.540  26.075  15.844
  698    HB2  HIS 109           HB1      HIS 109  49.911  26.295  16.673
  699    HB3  HIS 109           HB2      HIS 109  48.865  25.266  17.654
  700    HD1  HIS 109           HD1      HIS 109  51.136  24.579  14.667
  701    HD2  HIS 109           HD2      HIS 109  50.228  23.081  18.433
  702    HE1  HIS 109           HE1      HIS 109  52.607  22.561  14.960
  703    HE2  HIS 109           HE2      HIS 109  52.053  21.644  17.262
  704    H    HIS 110           H        HIS 110  48.874  27.721  14.829
  705    HA   HIS 110           HA       HIS 110  50.379  26.887  12.474
  706    HB2  HIS 110           HB1      HIS 110  47.759  28.283  12.441
  707    HB3  HIS 110           HB2      HIS 110  48.993  28.902  11.338
  708    HD1  HIS 110           HD1      HIS 110  46.290  27.245  10.633
  709    HD2  HIS 110           HD2      HIS 110  50.215  25.889  10.505
  710    HE1  HIS 110           HE1      HIS 110  46.281  25.312   9.023
  711    HE2  HIS 110           HE2      HIS 110  48.681  24.483   8.944
  712    H    HIS 111           H        HIS 111  51.865  28.417  11.735
  713    HA   HIS 111           HA       HIS 111  52.014  30.994  13.076
  714    HB2  HIS 111           HB1      HIS 111  54.079  28.814  13.371
  715    HB3  HIS 111           HB2      HIS 111  54.496  30.519  13.573
  716    HD1  HIS 111           HD1      HIS 111  53.430  27.698  15.489
  717    HD2  HIS 111           HD2      HIS 111  52.733  31.791  15.651
  718    HE1  HIS 111           HE1      HIS 111  52.604  28.148  17.821
  719    HE2  HIS 111           HE2      HIS 111  52.178  30.649  17.921
  720    H    HIS 112           H        HIS 112  52.174  32.345  11.416
  721    HA   HIS 112           HA       HIS 112  54.382  32.148   9.587
  722    HB2  HIS 112           HB1      HIS 112  52.067  30.852   8.807
  723    HB3  HIS 112           HB2      HIS 112  51.927  32.427   8.019
  724    HD1  HIS 112           HD1      HIS 112  53.819  29.247   7.872
  725    HD2  HIS 112           HD2      HIS 112  53.951  33.005   6.104
  726    HE1  HIS 112           HE1      HIS 112  55.353  29.006   5.894
  727    HE2  HIS 112           HE2      HIS 112  55.435  31.303   4.812
  Start of MODEL   38
    1    H1   MET  18           H        MET  18 -23.009 -56.486  -7.095
    2    HA   MET  18           HA       MET  18 -22.327 -54.613  -8.639
    3    HB2  MET  18           HB1      MET  18 -23.661 -56.520 -10.414
    4    HB3  MET  18           HB2      MET  18 -24.227 -54.857 -10.624
    5    HG2  MET  18           HG1      MET  18 -21.752 -54.212 -10.766
    6    HG3  MET  18           HG2      MET  18 -21.458 -55.940 -10.979
    7    HE1  MET  18           HE1      MET  18 -21.196 -53.906 -14.477
    8    HE2  MET  18           HE2      MET  18 -21.527 -52.875 -13.085
    9    HE3  MET  18           HE3      MET  18 -20.336 -54.170 -12.959
   10    H    LEU  19           H        LEU  19 -23.350 -52.780  -8.102
   11    HA   LEU  19           HA       LEU  19 -26.220 -52.652  -7.863
   12    HB2  LEU  19           HB1      LEU  19 -24.531 -53.111  -5.549
   13    HB3  LEU  19           HB2      LEU  19 -25.452 -51.605  -5.406
   14    HG   LEU  19           HG       LEU  19 -26.846 -54.155  -6.127
   15   HD11  LEU  19          HD11      LEU  19 -26.451 -55.088  -4.158
   16   HD12  LEU  19          HD12      LEU  19 -27.103 -53.665  -3.346
   17   HD13  LEU  19          HD13      LEU  19 -25.384 -53.752  -3.727
   18   HD21  LEU  19          HD21      LEU  19 -28.136 -52.148  -6.339
   19   HD22  LEU  19          HD22      LEU  19 -27.640 -51.600  -4.737
   20   HD23  LEU  19          HD23      LEU  19 -28.688 -53.010  -4.902
   21    H    VAL  20           H        VAL  20 -26.993 -50.475  -7.459
   22    HA   VAL  20           HA       VAL  20 -24.991 -48.443  -8.203
   23    HB   VAL  20           HB       VAL  20 -26.753 -48.865  -9.910
   24   HG11  VAL  20          HG11      VAL  20 -28.479 -49.152  -7.902
   25   HG12  VAL  20          HG12      VAL  20 -28.768 -47.449  -8.263
   26   HG13  VAL  20          HG13      VAL  20 -28.982 -48.666  -9.521
   27   HG21  VAL  20          HG21      VAL  20 -27.196 -46.553 -10.372
   28   HG22  VAL  20          HG22      VAL  20 -26.949 -46.118  -8.681
   29   HG23  VAL  20          HG23      VAL  20 -25.589 -46.676  -9.657
   30    H    LEU  21           H        LEU  21 -24.940 -46.504  -7.117
   31    HA   LEU  21           HA       LEU  21 -26.183 -46.504  -4.495
   32    HB2  LEU  21           HB1      LEU  21 -24.410 -44.349  -5.624
   33    HB3  LEU  21           HB2      LEU  21 -24.693 -44.776  -3.927
   34    HG   LEU  21           HG       LEU  21 -23.132 -46.407  -5.929
   35   HD11  LEU  21          HD11      LEU  21 -21.915 -45.305  -3.472
   36   HD12  LEU  21          HD12      LEU  21 -22.270 -44.164  -4.768
   37   HD13  LEU  21          HD13      LEU  21 -21.221 -45.548  -5.076
   38   HD21  LEU  21          HD21      LEU  21 -24.350 -47.774  -4.271
   39   HD22  LEU  21          HD22      LEU  21 -23.553 -46.874  -2.980
   40   HD23  LEU  21          HD23      LEU  21 -22.599 -47.865  -4.083
   41    H    ASP  22           H        ASP  22 -27.654 -45.024  -3.747
   42    HA   ASP  22           HA       ASP  22 -28.889 -43.300  -5.793
   43    HB2  ASP  22           HB1      ASP  22 -30.498 -44.915  -5.182
   44    HB3  ASP  22           HB2      ASP  22 -30.075 -44.803  -3.468
   45    HD2  ASP  22           HD       ASP  22 -32.142 -41.700  -4.837
   46    H    PHE  23           H        PHE  23 -29.035 -43.407  -2.239
   47    HA   PHE  23           HA       PHE  23 -28.854 -41.769  -0.668
   48    HB2  PHE  23           HB1      PHE  23 -26.793 -40.695  -2.613
   49    HB3  PHE  23           HB2      PHE  23 -26.955 -40.213  -0.923
   50    HD1  PHE  23           HD1      PHE  23 -24.788 -41.838  -2.794
   51    HD2  PHE  23           HD2      PHE  23 -27.353 -42.700   0.491
   52    HE1  PHE  23           HE1      PHE  23 -23.289 -43.665  -2.109
   53    HE2  PHE  23           HE2      PHE  23 -25.858 -44.528   1.182
   54    HZ   PHE  23           HZ       PHE  23 -23.823 -45.012  -0.118
   55    H    ASN  24           H        ASN  24 -28.567 -39.129  -0.588
   56    HA   ASN  24           HA       ASN  24 -29.908 -37.684  -2.626
   57    HB2  ASN  24           HB1      ASN  24 -31.581 -39.098  -0.786
   58    HB3  ASN  24           HB2      ASN  24 -31.745 -37.366  -0.475
   59   HD21  ASN  24          HD21      ASN  24 -33.860 -37.358  -1.242
   60   HD22  ASN  24          HD22      ASN  24 -34.222 -37.450  -2.929
   61    H    ASN  25           H        ASN  25 -30.452 -35.433  -1.896
   62    HA   ASN  25           HA       ASN  25 -29.543 -34.425   0.576
   63    HB2  ASN  25           HB1      ASN  25 -27.485 -34.947  -1.338
   64    HB3  ASN  25           HB2      ASN  25 -27.651 -33.195  -1.165
   65   HD21  ASN  25          HD21      ASN  25 -25.484 -34.952  -0.322
   66   HD22  ASN  25          HD22      ASN  25 -25.303 -34.707   1.378
   67    H    ILE  26           H        ILE  26 -30.337 -32.421   0.878
   68    HA   ILE  26           HA       ILE  26 -31.130 -30.868  -1.492
   69    HB   ILE  26           HB       ILE  26 -32.813 -31.249   0.988
   70   HG12  ILE  26          HG11      ILE  26 -34.305 -31.998  -1.215
   71   HG13  ILE  26          HG12      ILE  26 -32.692 -32.632  -1.589
   72   HG21  ILE  26          HG21      ILE  26 -34.510 -29.992  -0.425
   73   HG22  ILE  26          HG22      ILE  26 -33.179 -29.048   0.244
   74   HG23  ILE  26          HG23      ILE  26 -33.153 -29.530  -1.453
   75   HD11  ILE  26          HD11      ILE  26 -33.108 -34.370  -0.295
   76   HD12  ILE  26          HD12      ILE  26 -33.190 -33.288   1.096
   77   HD13  ILE  26          HD13      ILE  26 -34.655 -33.678   0.194
   78    H    ARG  27           H        ARG  27 -30.255 -28.915  -1.470
   79    HA   ARG  27           HA       ARG  27 -30.141 -27.355   0.959
   80    HB2  ARG  27           HB1      ARG  27 -27.713 -26.898   0.775
   81    HB3  ARG  27           HB2      ARG  27 -28.070 -28.584   1.181
   82    HG2  ARG  27           HG1      ARG  27 -27.695 -29.246  -1.142
   83    HG3  ARG  27           HG2      ARG  27 -27.341 -27.560  -1.555
   84    HD2  ARG  27           HD1      ARG  27 -25.197 -28.060  -1.135
   85    HD3  ARG  27           HD2      ARG  27 -25.666 -28.018   0.571
   86    HE   ARG  27           HE       ARG  27 -26.201 -30.577  -0.450
   87   HH11  ARG  27          HH11      ARG  27 -23.509 -28.518   0.346
   88   HH12  ARG  27          HH12      ARG  27 -22.439 -29.833   0.700
   89   HH21  ARG  27          HH21      ARG  27 -24.801 -32.318   0.013
   90   HH22  ARG  27          HH22      ARG  27 -23.176 -31.995   0.510
   91    H    SER  28           H        SER  28 -28.967 -25.178   0.427
   92    HA   SER  28           HA       SER  28 -29.001 -24.322  -2.298
   93    HB2  SER  28           HB1      SER  28 -31.504 -24.411  -1.163
   94    HB3  SER  28           HB2      SER  28 -31.007 -22.739  -0.846
   95    HG   SER  28           HG       SER  28 -31.595 -23.982  -3.240
   96    H    SER  29           H        SER  29 -29.264 -23.309   1.089
   97    HA   SER  29           HA       SER  29 -28.152 -21.739   2.304
   98    HB2  SER  29           HB1      SER  29 -26.057 -21.359   0.212
   99    HB3  SER  29           HB2      SER  29 -25.887 -21.567   1.964
  100    HG   SER  29           HG       SER  29 -26.235 -23.759   1.728
  101    H    ALA  30           H        ALA  30 -27.158 -19.431   2.113
  102    HA   ALA  30           HA       ALA  30 -28.338 -17.921  -0.096
  103    HB1  ALA  30           HB1      ALA  30 -29.895 -16.847   1.092
  104    HB2  ALA  30           HB2      ALA  30 -29.697 -18.140   2.276
  105    HB3  ALA  30           HB3      ALA  30 -28.817 -16.624   2.471
  106    H    ASP  31           H        ASP  31 -27.835 -15.427   0.459
  107    HA   ASP  31           HA       ASP  31 -25.391 -14.920   1.829
  108    HB2  ASP  31           HB1      ASP  31 -24.139 -14.220  -0.288
  109    HB3  ASP  31           HB2      ASP  31 -24.260 -15.954   0.034
  110    HD2  ASP  31           HD       ASP  31 -25.449 -16.272  -3.161
  111    H    LEU  32           H        LEU  32 -24.564 -12.649   1.262
  112    HA   LEU  32           HA       LEU  32 -26.694 -10.896   0.291
  113    HB2  LEU  32           HB1      LEU  32 -25.375 -10.691   3.001
  114    HB3  LEU  32           HB2      LEU  32 -26.320  -9.390   2.256
  115    HG   LEU  32           HG       LEU  32 -27.498 -12.104   2.797
  116   HD11  LEU  32          HD11      LEU  32 -27.884  -9.777   4.630
  117   HD12  LEU  32          HD12      LEU  32 -26.512 -10.862   4.848
  118   HD13  LEU  32          HD13      LEU  32 -28.156 -11.494   4.924
  119   HD21  LEU  32          HD21      LEU  32 -29.314  -9.935   3.013
  120   HD22  LEU  32          HD22      LEU  32 -29.285 -11.232   1.818
  121   HD23  LEU  32          HD23      LEU  32 -28.400  -9.735   1.518
  122    H    HIS  33           H        HIS  33 -25.959  -8.709  -0.159
  123    HA   HIS  33           HA       HIS  33 -23.126  -8.688  -0.929
  124    HB2  HIS  33           HB1      HIS  33 -25.534  -7.172  -1.941
  125    HB3  HIS  33           HB2      HIS  33 -23.884  -6.721  -2.379
  126    HD1  HIS  33           HD1      HIS  33 -26.590  -8.713  -3.569
  127    HD2  HIS  33           HD2      HIS  33 -22.453  -9.081  -3.593
  128    HE1  HIS  33           HE1      HIS  33 -26.076 -10.386  -5.374
  129    HE2  HIS  33           HE2      HIS  33 -23.547 -10.613  -5.389
  130    H    GLY  34           H        GLY  34 -25.555  -6.279   0.107
  131    HA2  GLY  34           HA2      GLY  34 -25.323  -4.894   2.024
  132    HA3  GLY  34           HA3      GLY  34 -23.597  -5.224   2.020
  133    HA1  GLY  34           HA1      GLY  34 -25.501  -4.826   1.164
  134    H    ALA  35           H        ALA  35 -23.696  -2.794   2.353
  135    HA   ALA  35           HA       ALA  35 -22.804  -1.514   0.008
  136    HB1  ALA  35           HB1      ALA  35 -25.081   0.099   0.665
  137    HB2  ALA  35           HB2      ALA  35 -24.620  -0.604  -0.886
  138    HB3  ALA  35           HB3      ALA  35 -25.601  -1.533   0.247
  139    H    ARG  36           H        ARG  36 -21.922   0.538   0.413
  140    HA   ARG  36           HA       ARG  36 -22.307   1.867   2.922
  141    HB2  ARG  36           HB1      ARG  36 -19.893   1.660   3.611
  142    HB3  ARG  36           HB2      ARG  36 -20.859   0.190   3.794
  143    HG2  ARG  36           HG1      ARG  36 -19.912  -0.760   1.789
  144    HG3  ARG  36           HG2      ARG  36 -19.030   0.744   1.469
  145    HD2  ARG  36           HD1      ARG  36 -17.316  -0.139   2.598
  146    HD3  ARG  36           HD2      ARG  36 -18.296   0.081   4.055
  147    HE   ARG  36           HE       ARG  36 -18.909  -2.362   2.716
  148   HH11  ARG  36          HH11      ARG  36 -16.641  -0.833   4.868
  149   HH12  ARG  36          HH12      ARG  36 -16.157  -2.316   5.623
  150   HH21  ARG  36          HH21      ARG  36 -18.281  -4.322   3.702
  151   HH22  ARG  36          HH22      ARG  36 -17.089  -4.299   4.959
  152    H    LYS  37           H        LYS  37 -20.566   3.668   3.149
  153    HA   LYS  37           HA       LYS  37 -19.236   4.579   0.816
  154    HB2  LYS  37           HB1      LYS  37 -22.027   5.160   0.968
  155    HB3  LYS  37           HB2      LYS  37 -21.132   6.672   1.195
  156    HG2  LYS  37           HG1      LYS  37 -19.958   6.359  -0.890
  157    HG3  LYS  37           HG2      LYS  37 -20.718   4.772  -1.104
  158    HD2  LYS  37           HD1      LYS  37 -22.503   7.130  -0.719
  159    HD3  LYS  37           HD2      LYS  37 -21.674   6.951  -2.275
  160    HE2  LYS  37           HE1      LYS  37 -22.783   4.419  -1.442
  161    HE3  LYS  37           HE2      LYS  37 -24.027   5.677  -1.433
  162    HZ1  LYS  37           HZ1      LYS  37 -23.466   6.223  -3.713
  163    HZ2  LYS  37           HZ2      LYS  37 -23.872   4.586  -3.587
  164    HZ3  LYS  37           HZ3      LYS  37 -22.250   5.045  -3.729
  165    H    GLY  38           H        GLY  38 -18.697   7.052   1.113
  166    HA2  GLY  38           HA2      GLY  38 -18.770   8.476   3.404
  167    HA3  GLY  38           HA3      GLY  38 -17.550   7.263   3.761
  168    HA1  GLY  38           HA1      GLY  38 -18.744   8.513   2.523
  169    H    SER  39           H        SER  39 -16.078   9.064   3.992
  170    HA   SER  39           HA       SER  39 -15.468  10.877   1.949
  171    HB2  SER  39           HB1      SER  39 -14.077   9.875   4.391
  172    HB3  SER  39           HB2      SER  39 -13.099  10.728   3.185
  173    HG   SER  39           HG       SER  39 -15.274  11.681   4.696
  174    H    GLN  40           H        GLN  40 -13.172  10.915   0.937
  175    HA   GLN  40           HA       GLN  40 -13.031   8.947  -1.015
  176    HB2  GLN  40           HB1      GLN  40 -11.106  11.009  -0.004
  177    HB3  GLN  40           HB2      GLN  40 -10.562   9.816  -1.194
  178    HG2  GLN  40           HG1      GLN  40 -11.291  11.949  -2.208
  179    HG3  GLN  40           HG2      GLN  40 -12.203  10.543  -2.774
  180   HE21  GLN  40          HE21      GLN  40 -12.324  13.089  -0.316
  181   HE22  GLN  40          HE22      GLN  40 -14.037  13.305  -0.375
  182    H    CYS  41           H        CYS  41 -10.513   9.414   1.463
  183    HA   CYS  41           HA       CYS  41 -10.496   6.580   2.065
  184    HB2  CYS  41           HB1      CYS  41  -8.040   6.386   1.588
  185    HB3  CYS  41           HB2      CYS  41  -9.057   6.535   0.154
  186    H    LEU  42           H        LEU  42  -9.544   6.098   4.030
  187    HA   LEU  42           HA       LEU  42  -9.156   8.359   5.792
  188    HB2  LEU  42           HB1      LEU  42 -10.190   5.815   6.097
  189    HB3  LEU  42           HB2      LEU  42  -8.616   5.721   6.905
  190    HG   LEU  42           HG       LEU  42 -10.439   7.980   7.586
  191   HD11  LEU  42          HD11      LEU  42 -10.980   5.129   8.070
  192   HD12  LEU  42          HD12      LEU  42 -12.076   6.510   8.054
  193   HD13  LEU  42          HD13      LEU  42 -11.097   6.179   9.482
  194   HD21  LEU  42          HD21      LEU  42  -9.320   7.908   9.665
  195   HD22  LEU  42          HD22      LEU  42  -8.072   7.715   8.433
  196   HD23  LEU  42          HD23      LEU  42  -8.648   6.312   9.335
  197    H    SER  43           H        SER  43  -7.230   5.901   4.236
  198    HA   SER  43           HA       SER  43  -4.812   7.291   5.071
  199    HB2  SER  43           HB1      SER  43  -5.097   4.296   5.458
  200    HB3  SER  43           HB2      SER  43  -3.696   5.300   5.873
  201    HG   SER  43           HG       SER  43  -5.234   6.456   7.299
  202    H    ASP  44           H        ASP  44  -2.847   6.147   3.978
  203    HA   ASP  44           HA       ASP  44  -3.323   6.203   1.178
  204    HB2  ASP  44           HB1      ASP  44  -1.004   6.020   0.909
  205    HB3  ASP  44           HB2      ASP  44  -1.180   6.844   2.463
  206    HD2  ASP  44           HD       ASP  44   0.464   3.274   2.398
  207    H    THR  45           H        THR  45  -3.146   3.673   3.547
  208    HA   THR  45           HA       THR  45  -2.868   1.566   1.578
  209    HB   THR  45           HB       THR  45  -3.456   0.164   3.751
  210    HG1  THR  45           HG1      THR  45  -3.216   1.247   5.597
  211   HG21  THR  45          HG21      THR  45  -1.325  -0.368   3.369
  212   HG22  THR  45          HG22      THR  45  -0.841   1.041   4.313
  213   HG23  THR  45          HG23      THR  45  -1.046   1.177   2.567
  214    H    ASP  46           H        ASP  46  -5.339   3.510   2.304
  215    HA   ASP  46           HA       ASP  46  -7.490   1.709   2.747
  216    HB2  ASP  46           HB1      ASP  46  -7.331   4.314   3.062
  217    HB3  ASP  46           HB2      ASP  46  -7.878   4.345   1.381
  218    HD2  ASP  46           HD       ASP  46 -11.099   3.873   2.391
  219    H    CYS  47           H        CYS  47  -5.787   2.778  -0.078
  220    HA   CYS  47           HA       CYS  47  -7.764   2.113  -2.003
  221    HB2  CYS  47           HB1      CYS  47  -5.154   3.220  -1.997
  222    HB3  CYS  47           HB2      CYS  47  -5.112   1.818  -3.065
  223    H    ASN  48           H        ASN  48  -7.746   0.331  -3.487
  224    HA   ASN  48           HA       ASN  48  -7.470  -2.176  -2.221
  225    HB2  ASN  48           HB1      ASN  48  -8.103  -1.259  -5.004
  226    HB3  ASN  48           HB2      ASN  48  -7.743  -2.967  -4.723
  227   HD21  ASN  48          HD21      ASN  48 -10.100  -2.718  -5.640
  228   HD22  ASN  48          HD22      ASN  48 -11.334  -2.788  -4.433
  229    H    THR  49           H        THR  49  -5.696  -0.846  -5.017
  230    HA   THR  49           HA       THR  49  -3.649  -2.875  -4.748
  231    HB   THR  49           HB       THR  49  -2.833  -0.859  -6.580
  232    HG1  THR  49           HG1      THR  49  -4.895  -0.100  -6.804
  233   HG21  THR  49          HG21      THR  49  -2.190  -2.894  -7.313
  234   HG22  THR  49          HG22      THR  49  -3.752  -2.889  -8.130
  235   HG23  THR  49          HG23      THR  49  -3.572  -3.706  -6.579
  236    H    ARG  50           H        ARG  50  -1.304  -1.823  -5.218
  237    HA   ARG  50           HA       ARG  50  -0.655  -0.453  -2.783
  238    HB2  ARG  50           HB1      ARG  50   1.197  -0.994  -5.108
  239    HB3  ARG  50           HB2      ARG  50   1.629  -0.749  -3.409
  240    HG2  ARG  50           HG1      ARG  50   1.661  -2.958  -3.188
  241    HG3  ARG  50           HG2      ARG  50  -0.101  -2.917  -3.365
  242    HD2  ARG  50           HD1      ARG  50   0.760  -4.498  -4.950
  243    HD3  ARG  50           HD2      ARG  50   0.205  -3.070  -5.834
  244    HE   ARG  50           HE       ARG  50   2.918  -2.723  -5.303
  245   HH11  ARG  50          HH11      ARG  50   0.857  -4.847  -7.138
  246   HH12  ARG  50          HH12      ARG  50   2.053  -5.174  -8.348
  247   HH21  ARG  50          HH21      ARG  50   4.500  -3.146  -6.890
  248   HH22  ARG  50          HH22      ARG  50   4.125  -4.207  -8.206
  249    H    LYS  51           H        LYS  51  -1.991   1.463  -3.284
  250    HA   LYS  51           HA       LYS  51  -0.416   3.432  -4.800
  251    HB2  LYS  51           HB1      LYS  51  -3.323   2.779  -4.999
  252    HB3  LYS  51           HB2      LYS  51  -2.832   4.471  -5.170
  253    HG2  LYS  51           HG1      LYS  51  -2.602   3.973  -7.339
  254    HG3  LYS  51           HG2      LYS  51  -1.069   3.243  -6.831
  255    HD2  LYS  51           HD1      LYS  51  -2.232   1.071  -6.534
  256    HD3  LYS  51           HD2      LYS  51  -3.711   1.821  -7.158
  257    HE2  LYS  51           HE1      LYS  51  -2.384   2.423  -9.240
  258    HE3  LYS  51           HE2      LYS  51  -1.119   1.355  -8.614
  259    HZ1  LYS  51           HZ1      LYS  51  -3.913   0.465  -9.050
  260    HZ2  LYS  51           HZ2      LYS  51  -2.561  -0.501  -8.733
  261    HZ3  LYS  51           HZ3      LYS  51  -2.697   0.304 -10.215
  262    H    PHE  52           H        PHE  52  -0.580   5.607  -4.059
  263    HA   PHE  52           HA       PHE  52  -1.297   5.774  -1.217
  264    HB2  PHE  52           HB1      PHE  52   0.147   7.846  -1.250
  265    HB3  PHE  52           HB2      PHE  52   0.995   6.329  -1.560
  266    HD1  PHE  52           HD1      PHE  52  -0.666   9.100  -3.416
  267    HD2  PHE  52           HD2      PHE  52   2.428   6.178  -3.353
  268    HE1  PHE  52           HE1      PHE  52   0.228  10.008  -5.521
  269    HE2  PHE  52           HE2      PHE  52   3.328   7.082  -5.457
  270    HZ   PHE  52           HZ       PHE  52   2.229   8.999  -6.543
  271    H    CYS  53           H        CYS  53  -2.437   7.581  -0.411
  272    HA   CYS  53           HA       CYS  53  -4.419   8.593  -2.255
  273    HB2  CYS  53           HB1      CYS  53  -4.031   8.695   0.722
  274    HB3  CYS  53           HB2      CYS  53  -5.195   9.770  -0.053
  275    H    LEU  54           H        LEU  54  -3.431  10.065  -3.592
  276    HA   LEU  54           HA       LEU  54  -1.828  12.211  -2.499
  277    HB2  LEU  54           HB1      LEU  54  -1.199  11.251  -4.631
  278    HB3  LEU  54           HB2      LEU  54  -2.794  11.638  -5.296
  279    HG   LEU  54           HG       LEU  54  -1.731  14.081  -4.420
  280   HD11  LEU  54          HD11      LEU  54   0.466  12.984  -4.309
  281   HD12  LEU  54          HD12      LEU  54   0.399  14.225  -5.559
  282   HD13  LEU  54          HD13      LEU  54   0.307  12.521  -6.003
  283   HD21  LEU  54          HD21      LEU  54  -3.098  13.204  -6.527
  284   HD22  LEU  54          HD22      LEU  54  -1.501  13.295  -7.270
  285   HD23  LEU  54          HD23      LEU  54  -2.220  14.733  -6.541
  286    H    GLN  55           H        GLN  55  -2.550  14.143  -1.893
  287    HA   GLN  55           HA       GLN  55  -5.242  14.964  -2.765
  288    HB2  GLN  55           HB1      GLN  55  -5.337  16.226  -0.566
  289    HB3  GLN  55           HB2      GLN  55  -5.434  14.460  -0.461
  290    HG2  GLN  55           HG1      GLN  55  -2.690  15.290  -0.304
  291    HG3  GLN  55           HG2      GLN  55  -3.665  16.168   0.882
  292   HE21  GLN  55          HE21      GLN  55  -3.152  15.197   2.739
  293   HE22  GLN  55          HE22      GLN  55  -3.336  13.510   3.061
  294    HA   PRO  56           HA       PRO  56  -2.374  18.168  -4.343
  295    HB2  PRO  56           HB1      PRO  56  -3.899  18.754  -6.540
  296    HB3  PRO  56           HB2      PRO  56  -2.748  17.419  -6.481
  297    HG2  PRO  56           HG1      PRO  56  -5.717  17.392  -6.052
  298    HG3  PRO  56           HG2      PRO  56  -4.695  16.270  -7.027
  299    HD2  PRO  56           HD1      PRO  56  -5.613  15.638  -4.551
  300    HD3  PRO  56           HD2      PRO  56  -4.043  15.083  -5.161
  301    H    ARG  57           H        ARG  57  -2.538  20.391  -4.234
  302    HA   ARG  57           HA       ARG  57  -4.813  21.415  -2.777
  303    HB2  ARG  57           HB1      ARG  57  -2.106  22.021  -2.856
  304    HB3  ARG  57           HB2      ARG  57  -2.869  23.397  -3.664
  305    HG2  ARG  57           HG1      ARG  57  -4.490  23.267  -1.565
  306    HG3  ARG  57           HG2      ARG  57  -3.057  22.517  -0.842
  307    HD2  ARG  57           HD1      ARG  57  -2.110  24.756  -2.255
  308    HD3  ARG  57           HD2      ARG  57  -3.573  25.288  -1.417
  309    HE   ARG  57           HE       ARG  57  -2.000  23.838   0.389
  310   HH11  ARG  57          HH11      ARG  57  -1.948  26.840  -1.373
  311   HH12  ARG  57          HH12      ARG  57  -0.983  27.665  -0.196
  312   HH21  ARG  57          HH21      ARG  57  -0.728  24.915   1.947
  313   HH22  ARG  57          HH22      ARG  57  -0.289  26.570   1.693
  314    H    ASP  58           H        ASP  58  -3.603  21.464  -6.026
  315    HA   ASP  58           HA       ASP  58  -5.395  23.616  -6.825
  316    HB2  ASP  58           HB1      ASP  58  -2.928  22.919  -7.714
  317    HB3  ASP  58           HB2      ASP  58  -3.943  22.081  -8.894
  318    HD2  ASP  58           HD       ASP  58  -3.858  26.033  -8.962
  319    H    GLU  59           H        GLU  59  -5.274  20.173  -6.772
  320    HA   GLU  59           HA       GLU  59  -7.766  20.076  -8.341
  321    HB2  GLU  59           HB1      GLU  59  -5.305  18.694  -8.769
  322    HB3  GLU  59           HB2      GLU  59  -6.534  17.510  -8.296
  323    HG2  GLU  59           HG1      GLU  59  -7.836  17.891 -10.152
  324    HG3  GLU  59           HG2      GLU  59  -7.194  19.523 -10.388
  325    HE2  GLU  59           HE       GLU  59  -4.516  16.844 -11.480
  326    H    LYS  60           H        LYS  60  -8.806  17.743  -7.852
  327    HA   LYS  60           HA       LYS  60  -9.447  17.839  -5.029
  328    HB2  LYS  60           HB1      LYS  60 -11.297  16.450  -5.531
  329    HB3  LYS  60           HB2      LYS  60 -11.157  17.581  -6.886
  330    HG2  LYS  60           HG1      LYS  60  -9.676  15.600  -7.883
  331    HG3  LYS  60           HG2      LYS  60 -10.724  14.656  -6.807
  332    HD2  LYS  60           HD1      LYS  60 -12.708  15.713  -7.859
  333    HD3  LYS  60           HD2      LYS  60 -11.619  16.538  -8.989
  334    HE2  LYS  60           HE1      LYS  60 -11.178  14.648 -10.183
  335    HE3  LYS  60           HE2      LYS  60 -11.313  13.604  -8.760
  336    HZ1  LYS  60           HZ1      LYS  60 -13.509  13.306  -9.070
  337    HZ2  LYS  60           HZ2      LYS  60 -13.145  13.699 -10.673
  338    HZ3  LYS  60           HZ3      LYS  60 -13.774  14.878  -9.636
  339    HA   PRO  61           HA       PRO  61  -6.984  14.461  -3.689
  340    HB2  PRO  61           HB1      PRO  61  -8.579  13.390  -1.735
  341    HB3  PRO  61           HB2      PRO  61  -7.723  14.922  -1.563
  342    HG2  PRO  61           HG1      PRO  61 -10.573  14.412  -2.343
  343    HG3  PRO  61           HG2      PRO  61  -9.909  15.614  -1.176
  344    HD2  PRO  61           HD1      PRO  61 -10.676  16.281  -3.693
  345    HD3  PRO  61           HD2      PRO  61  -9.324  17.071  -2.864
  346    H    PHE  62           H        PHE  62  -6.616  12.372  -4.224
  347    HA   PHE  62           HA       PHE  62  -8.659  10.430  -4.564
  348    HB2  PHE  62           HB1      PHE  62  -8.647  10.121  -6.925
  349    HB3  PHE  62           HB2      PHE  62  -8.937  11.839  -6.642
  350    HD1  PHE  62           HD1      PHE  62  -7.108   9.583  -8.551
  351    HD2  PHE  62           HD2      PHE  62  -6.717  13.307  -6.526
  352    HE1  PHE  62           HE1      PHE  62  -5.200  10.164  -9.993
  353    HE2  PHE  62           HE2      PHE  62  -4.810  13.893  -7.965
  354    HZ   PHE  62           HZ       PHE  62  -4.049  12.322  -9.702
  355    H    CYS  63           H        CYS  63  -7.664   8.449  -5.828
  356    HA   CYS  63           HA       CYS  63  -5.103   7.935  -4.542
  357    HB2  CYS  63           HB1      CYS  63  -7.360   6.403  -4.903
  358    HB3  CYS  63           HB2      CYS  63  -6.281   5.782  -6.153
  359    H    ALA  64           H        ALA  64  -3.266   8.250  -5.590
  360    HA   ALA  64           HA       ALA  64  -3.271   8.169  -8.528
  361    HB1  ALA  64           HB1      ALA  64  -2.387  10.213  -8.088
  362    HB2  ALA  64           HB2      ALA  64  -1.744   9.721  -6.521
  363    HB3  ALA  64           HB3      ALA  64  -0.901   9.267  -8.002
  364    H    THR  65           H        THR  65  -1.636   7.057  -9.654
  365    HA   THR  65           HA       THR  65  -1.007   4.519  -8.778
  366    HB   THR  65           HB       THR  65  -0.836   4.964 -11.106
  367    HG1  THR  65           HG1      THR  65   0.741   3.566 -11.156
  368   HG21  THR  65          HG21      THR  65  -0.297   7.324 -11.046
  369   HG22  THR  65          HG22      THR  65   0.889   6.477 -12.041
  370   HG23  THR  65          HG23      THR  65   1.305   6.973 -10.400
  371    H    CYS  66           H        CYS  66   1.096   3.552  -8.298
  372    HA   CYS  66           HA       CYS  66   2.432   4.998  -6.207
  373    HB2  CYS  66           HB1      CYS  66   1.941   2.364  -6.639
  374    HB3  CYS  66           HB2      CYS  66   3.618   2.470  -7.182
  375    H    ARG  67           H        ARG  67   4.946   4.751  -6.158
  376    HA   ARG  67           HA       ARG  67   5.949   5.848  -8.697
  377    HB2  ARG  67           HB1      ARG  67   7.048   6.205  -5.899
  378    HB3  ARG  67           HB2      ARG  67   7.672   6.969  -7.368
  379    HG2  ARG  67           HG1      ARG  67   4.809   7.422  -6.773
  380    HG3  ARG  67           HG2      ARG  67   5.982   8.181  -5.686
  381    HD2  ARG  67           HD1      ARG  67   7.151   8.966  -7.872
  382    HD3  ARG  67           HD2      ARG  67   5.595   8.597  -8.625
  383    HE   ARG  67           HE       ARG  67   5.039  10.181  -6.425
  384   HH11  ARG  67          HH11      ARG  67   6.826  10.452  -9.402
  385   HH12  ARG  67          HH12      ARG  67   6.584  12.162  -9.543
  386   HH21  ARG  67          HH21      ARG  67   4.713  12.432  -6.601
  387   HH22  ARG  67          HH22      ARG  67   5.383  13.288  -7.949
  388    H    GLY  68           H        GLY  68   8.239   5.391  -9.202
  389    HA2  GLY  68           HA2      GLY  68   8.861   2.595  -8.524
  390    HA3  GLY  68           HA3      GLY  68   9.389   3.428  -9.978
  391    HA1  GLY  68           HA1      GLY  68   8.900   3.235  -7.918
  392    H    LEU  69           H        LEU  69  11.411   2.280  -9.042
  393    HA   LEU  69           HA       LEU  69  12.716   3.475  -6.817
  394    HB2  LEU  69           HB1      LEU  69  13.443   1.554  -8.969
  395    HB3  LEU  69           HB2      LEU  69  14.763   2.379  -8.122
  396    HG   LEU  69           HG       LEU  69  12.644   0.668  -6.821
  397   HD11  LEU  69          HD11      LEU  69  14.072  -1.087  -6.859
  398   HD12  LEU  69          HD12      LEU  69  15.508  -0.065  -6.792
  399   HD13  LEU  69          HD13      LEU  69  14.646  -0.276  -8.316
  400   HD21  LEU  69          HD21      LEU  69  13.217   2.052  -5.104
  401   HD22  LEU  69          HD22      LEU  69  14.807   2.414  -5.776
  402   HD23  LEU  69          HD23      LEU  69  14.522   0.873  -4.964
  403    H    ARG  70           H        ARG  70  12.511   4.233 -10.195
  404    HA   ARG  70           HA       ARG  70  14.731   6.118 -10.045
  405    HB2  ARG  70           HB1      ARG  70  12.901   5.487 -12.374
  406    HB3  ARG  70           HB2      ARG  70  14.406   6.416 -12.435
  407    HG2  ARG  70           HG1      ARG  70  15.047   3.927 -11.269
  408    HG3  ARG  70           HG2      ARG  70  14.025   3.601 -12.680
  409    HD2  ARG  70           HD1      ARG  70  16.010   3.709 -13.777
  410    HD3  ARG  70           HD2      ARG  70  15.646   5.441 -13.749
  411    HE   ARG  70           HE       ARG  70  17.077   4.675 -11.422
  412   HH11  ARG  70          HH11      ARG  70  17.468   5.305 -14.823
  413   HH12  ARG  70          HH12      ARG  70  19.131   5.771 -14.678
  414   HH21  ARG  70          HH21      ARG  70  19.264   5.286 -11.218
  415   HH22  ARG  70          HH22      ARG  70  20.152   5.758 -12.627
  416    H    ARG  71           H        ARG  71  11.856   6.288  -8.820
  417    HA   ARG  71           HA       ARG  71  11.102   8.897  -9.929
  418    HB2  ARG  71           HB1      ARG  71   9.655   6.734  -8.485
  419    HB3  ARG  71           HB2      ARG  71   9.113   8.396  -8.214
  420    HG2  ARG  71           HG1      ARG  71   9.359   7.073 -10.917
  421    HG3  ARG  71           HG2      ARG  71   7.857   7.274  -9.999
  422    HD2  ARG  71           HD1      ARG  71   7.590   9.321 -10.833
  423    HD3  ARG  71           HD2      ARG  71   9.148   9.802 -10.146
  424    HE   ARG  71           HE       ARG  71  10.063   9.672 -12.233
  425   HH11  ARG  71          HH11      ARG  71   7.066   7.900 -12.207
  426   HH12  ARG  71          HH12      ARG  71   7.074   7.606 -13.915
  427   HH21  ARG  71          HH21      ARG  71  10.085   9.292 -14.483
  428   HH22  ARG  71          HH22      ARG  71   8.791   8.398 -15.208
  429    H    ARG  72           H        ARG  72  11.123  10.741  -8.733
  430    HA   ARG  72           HA       ARG  72  12.771  10.784  -6.397
  431    HB2  ARG  72           HB1      ARG  72  11.093  13.007  -7.586
  432    HB3  ARG  72           HB2      ARG  72  12.421  13.193  -6.431
  433    HG2  ARG  72           HG1      ARG  72  12.777  12.012  -9.182
  434    HG3  ARG  72           HG2      ARG  72  12.987  13.733  -8.809
  435    HD2  ARG  72           HD1      ARG  72  14.634  12.966  -6.997
  436    HD3  ARG  72           HD2      ARG  72  14.589  11.396  -7.812
  437    HE   ARG  72           HE       ARG  72  15.120  13.283  -9.768
  438   HH11  ARG  72          HH11      ARG  72  16.616  12.100  -6.855
  439   HH12  ARG  72          HH12      ARG  72  18.230  12.421  -7.398
  440   HH21  ARG  72          HH21      ARG  72  17.240  13.711 -10.494
  441   HH22  ARG  72          HH22      ARG  72  18.584  13.338  -9.468
  442    H    CYS  73           H        CYS  73  12.222  11.066  -4.285
  443    HA   CYS  73           HA       CYS  73   9.385  11.389  -3.613
  444    HB2  CYS  73           HB1      CYS  73   9.455   9.595  -1.990
  445    HB3  CYS  73           HB2      CYS  73   9.908   8.967  -3.576
  446    H    GLN  74           H        GLN  74   9.152  11.706  -1.160
  447    HA   GLN  74           HA       GLN  74  11.415  13.300  -0.154
  448    HB2  GLN  74           HB1      GLN  74   8.546  14.001  -0.461
  449    HB3  GLN  74           HB2      GLN  74   9.344  14.541   1.025
  450    HG2  GLN  74           HG1      GLN  74   9.873  16.344  -0.197
  451    HG3  GLN  74           HG2      GLN  74  11.173  15.305  -0.795
  452   HE21  GLN  74          HE21      GLN  74   9.676  17.547  -2.039
  453   HE22  GLN  74          HE22      GLN  74   9.081  16.916  -3.533
  454    H    ARG  75           H        ARG  75   8.600  11.330   0.636
  455    HA   ARG  75           HA       ARG  75   9.699  10.946   3.343
  456    HB2  ARG  75           HB1      ARG  75   6.853  10.605   2.363
  457    HB3  ARG  75           HB2      ARG  75   7.412  10.297   4.014
  458    HG2  ARG  75           HG1      ARG  75   7.368  12.463   4.577
  459    HG3  ARG  75           HG2      ARG  75   8.075  12.966   3.032
  460    HD2  ARG  75           HD1      ARG  75   5.922  12.780   1.928
  461    HD3  ARG  75           HD2      ARG  75   5.199  12.146   3.412
  462    HE   ARG  75           HE       ARG  75   6.390  14.720   3.790
  463   HH11  ARG  75          HH11      ARG  75   3.549  13.058   2.656
  464   HH12  ARG  75          HH12      ARG  75   2.490  14.398   2.945
  465   HH21  ARG  75          HH21      ARG  75   5.006  16.492   4.173
  466   HH22  ARG  75          HH22      ARG  75   3.321  16.352   3.807
  467    H    ASP  76           H        ASP  76   9.120   8.754   4.289
  468    HA   ASP  76           HA       ASP  76  10.132   6.731   2.525
  469    HB2  ASP  76           HB1      ASP  76   8.975   6.131   5.231
  470    HB3  ASP  76           HB2      ASP  76  10.358   5.388   4.416
  471    HD2  ASP  76           HD       ASP  76  12.532   7.870   5.522
  472    H    ALA  77           H        ALA  77   7.008   7.702   3.694
  473    HA   ALA  77           HA       ALA  77   5.688   5.258   2.913
  474    HB1  ALA  77           HB1      ALA  77   3.982   7.591   3.305
  475    HB2  ALA  77           HB2      ALA  77   3.959   6.020   4.107
  476    HB3  ALA  77           HB3      ALA  77   5.067   7.276   4.659
  477    H    MET  78           H        MET  78   6.474   8.302   1.464
  478    HA   MET  78           HA       MET  78   4.541   8.528  -0.512
  479    HB2  MET  78           HB1      MET  78   7.339   9.440  -0.166
  480    HB3  MET  78           HB2      MET  78   6.722   9.435  -1.826
  481    HG2  MET  78           HG1      MET  78   5.347  10.803   0.486
  482    HG3  MET  78           HG2      MET  78   6.453  11.598  -0.637
  483    HE1  MET  78           HE1      MET  78   5.952  10.898  -3.446
  484    HE2  MET  78           HE2      MET  78   4.559  11.873  -3.914
  485    HE3  MET  78           HE3      MET  78   5.807  12.560  -2.874
  486    H    CYS  79           H        CYS  79   7.437   6.525  -0.415
  487    HA   CYS  79           HA       CYS  79   6.952   5.529  -3.106
  488    HB2  CYS  79           HB1      CYS  79   9.257   6.012  -1.893
  489    HB3  CYS  79           HB2      CYS  79   9.032   4.362  -1.306
  490    H    CYS  80           H        CYS  80   6.602   3.318  -3.587
  491    HA   CYS  80           HA       CYS  80   4.635   2.043  -2.125
  492    HB2  CYS  80           HB1      CYS  80   6.397   1.357  -4.367
  493    HB3  CYS  80           HB2      CYS  80   5.887  -0.044  -3.423
  494    HA   PRO  81           HA       PRO  81   6.518  -0.086   1.215
  495    HB2  PRO  81           HB1      PRO  81   5.170  -2.471   1.235
  496    HB3  PRO  81           HB2      PRO  81   4.444  -0.939   1.718
  497    HG2  PRO  81           HG1      PRO  81   4.291  -2.368  -0.914
  498    HG3  PRO  81           HG2      PRO  81   2.974  -1.587   0.038
  499    HD2  PRO  81           HD1      PRO  81   4.123  -0.403  -2.118
  500    HD3  PRO  81           HD2      PRO  81   3.541   0.515  -0.719
  501    H    GLY  82           H        GLY  82   8.548  -0.820   1.192
  502    HA2  GLY  82           HA2      GLY  82   9.695  -3.089   0.965
  503    HA3  GLY  82           HA3      GLY  82   9.250  -2.946  -0.728
  504    HA1  GLY  82           HA1      GLY  82   9.774  -2.246   1.209
  505    H    THR  83           H        THR  83   9.763   0.062  -0.402
  506    HA   THR  83           HA       THR  83  12.696  -0.106  -0.657
  507    HB   THR  83           HB       THR  83  12.159   2.148  -2.019
  508    HG1  THR  83           HG1      THR  83  10.267   1.689  -3.308
  509   HG21  THR  83          HG21      THR  83  12.339  -0.708  -2.861
  510   HG22  THR  83          HG22      THR  83  13.472   0.617  -3.128
  511   HG23  THR  83          HG23      THR  83  11.989   0.519  -4.077
  512    H    LEU  84           H        LEU  84  13.705   2.181  -0.414
  513    HA   LEU  84           HA       LEU  84  12.435   3.568   1.851
  514    HB2  LEU  84           HB1      LEU  84  14.890   2.113   1.817
  515    HB3  LEU  84           HB2      LEU  84  15.254   3.836   2.031
  516    HG   LEU  84           HG       LEU  84  15.076   2.648   4.169
  517   HD11  LEU  84          HD11      LEU  84  12.687   4.429   4.049
  518   HD12  LEU  84          HD12      LEU  84  14.284   5.091   3.704
  519   HD13  LEU  84          HD13      LEU  84  13.963   4.334   5.263
  520   HD21  LEU  84          HD21      LEU  84  13.363   1.322   4.756
  521   HD22  LEU  84          HD22      LEU  84  13.049   1.251   3.022
  522   HD23  LEU  84          HD23      LEU  84  12.157   2.388   4.034
  523    H    CYS  85           H        CYS  85  12.552   5.771   1.863
  524    HA   CYS  85           HA       CYS  85  13.244   7.042  -0.627
  525    HB2  CYS  85           HB1      CYS  85  11.254   7.578   0.942
  526    HB3  CYS  85           HB2      CYS  85  12.435   8.493   1.879
  527    H    VAL  86           H        VAL  86  15.361   7.306  -1.013
  528    HA   VAL  86           HA       VAL  86  16.953   8.684   1.047
  529    HB   VAL  86           HB       VAL  86  17.962   6.546  -0.836
  530   HG11  VAL  86          HG11      VAL  86  20.080   6.775   0.335
  531   HG12  VAL  86          HG12      VAL  86  19.608   8.312  -0.395
  532   HG13  VAL  86          HG13      VAL  86  19.405   8.058   1.338
  533   HG21  VAL  86          HG21      VAL  86  16.724   6.366   1.728
  534   HG22  VAL  86          HG22      VAL  86  17.370   5.073   0.718
  535   HG23  VAL  86          HG23      VAL  86  18.416   5.895   1.876
  536    H    ASN  87           H        ASN  87  18.225  10.349   0.368
  537    HA   ASN  87           HA       ASN  87  18.941  12.059  -0.949
  538    HB2  ASN  87           HB1      ASN  87  19.974   9.849  -2.039
  539    HB3  ASN  87           HB2      ASN  87  18.947  10.350  -3.388
  540   HD21  ASN  87          HD21      ASN  87  21.841  10.257  -3.231
  541   HD22  ASN  87          HD22      ASN  87  22.397  11.861  -3.557
  542    H    ASP  88           H        ASP  88  16.093  11.605  -0.686
  543    HA   ASP  88           HA       ASP  88  14.143  12.481  -1.468
  544    HB2  ASP  88           HB1      ASP  88  16.030  14.321  -2.137
  545    HB3  ASP  88           HB2      ASP  88  15.371  13.929  -3.732
  546    HD2  ASP  88           HD       ASP  88  12.961  16.268  -2.996
  547    H    VAL  89           H        VAL  89  15.398  10.032  -2.635
  548    HA   VAL  89           HA       VAL  89  13.552   9.768  -4.870
  549    HB   VAL  89           HB       VAL  89  15.677  10.460  -5.919
  550   HG11  VAL  89          HG11      VAL  89  17.288   9.652  -4.357
  551   HG12  VAL  89          HG12      VAL  89  16.744   7.987  -4.569
  552   HG13  VAL  89          HG13      VAL  89  17.569   8.821  -5.887
  553   HG21  VAL  89          HG21      VAL  89  14.109   8.967  -7.090
  554   HG22  VAL  89          HG22      VAL  89  15.784   8.679  -7.563
  555   HG23  VAL  89          HG23      VAL  89  14.979   7.573  -6.449
  556    H    CYS  90           H        CYS  90  12.954   7.626  -5.321
  557    HA   CYS  90           HA       CYS  90  12.897   5.883  -3.122
  558    HB2  CYS  90           HB1      CYS  90  12.285   5.490  -6.052
  559    HB3  CYS  90           HB2      CYS  90  12.084   4.196  -4.870
  560    H    THR  91           H        THR  91  14.401   4.577  -2.342
  561    HA   THR  91           HA       THR  91  16.312   3.324  -4.182
  562    HB   THR  91           HB       THR  91  17.094   4.721  -1.615
  563    HG1  THR  91           HG1      THR  91  16.862   6.179  -3.323
  564   HG21  THR  91          HG21      THR  91  18.497   2.782  -3.383
  565   HG22  THR  91          HG22      THR  91  18.595   2.992  -1.634
  566   HG23  THR  91          HG23      THR  91  19.433   4.114  -2.706
  567    H    THR  92           H        THR  92  16.755   1.238  -3.729
  568    HA   THR  92           HA       THR  92  15.146  -0.188  -1.917
  569    HB   THR  92           HB       THR  92  17.016  -2.013  -2.362
  570    HG1  THR  92           HG1      THR  92  17.386  -0.471  -4.687
  571   HG21  THR  92          HG21      THR  92  15.883  -2.580  -4.469
  572   HG22  THR  92          HG22      THR  92  15.148  -0.977  -4.499
  573   HG23  THR  92          HG23      THR  92  14.733  -2.114  -3.217
  574    H    MET  93           H        MET  93  15.518  -1.030   0.093
  575    HA   MET  93           HA       MET  93  17.173   0.318   1.867
  576    HB2  MET  93           HB1      MET  93  15.796  -2.354   1.977
  577    HB3  MET  93           HB2      MET  93  16.819  -1.805   3.314
  578    HG2  MET  93           HG1      MET  93  15.405  -0.044   3.865
  579    HG3  MET  93           HG2      MET  93  14.632  -0.057   2.278
  580    HE1  MET  93           HE1      MET  93  15.248  -1.679   5.527
  581    HE2  MET  93           HE2      MET  93  13.655  -1.082   5.993
  582    HE3  MET  93           HE3      MET  93  13.930  -2.816   5.811
  583    H    GLU  94           H        GLU  94  17.827  -2.448  -0.155
  584    HA   GLU  94           HA       GLU  94  20.141  -3.390   1.141
  585    HB2  GLU  94           HB1      GLU  94  18.999  -3.641  -1.611
  586    HB3  GLU  94           HB2      GLU  94  20.667  -4.165  -1.328
  587    HG2  GLU  94           HG1      GLU  94  18.450  -5.136   0.441
  588    HG3  GLU  94           HG2      GLU  94  18.752  -5.884  -1.135
  589    HE2  GLU  94           HE       GLU  94  21.081  -7.854   0.415
  590    H    ASP  95           H        ASP  95  19.636  -0.890  -1.282
  591    HA   ASP  95           HA       ASP  95  22.456  -0.422  -1.653
  592    HB2  ASP  95           HB1      ASP  95  19.952   0.950  -2.630
  593    HB3  ASP  95           HB2      ASP  95  21.560   1.632  -2.917
  594    HD2  ASP  95           HD       ASP  95  22.222  -1.486  -4.778
  595    H    ALA  96           H        ALA  96  19.922   0.782   0.380
  596    HA   ALA  96           HA       ALA  96  21.294   3.193   1.138
  597    HB1  ALA  96           HB1      ALA  96  18.852   3.068   1.172
  598    HB2  ALA  96           HB2      ALA  96  18.932   1.830   2.427
  599    HB3  ALA  96           HB3      ALA  96  19.500   3.466   2.763
  600    H    THR  97           H        THR  97  23.297   1.792   1.575
  601    HA   THR  97           HA       THR  97  24.793   0.874   3.033
  602    HB   THR  97           HB       THR  97  23.141   2.328   5.107
  603    HG1  THR  97           HG1      THR  97  24.132   3.483   3.147
  604   HG21  THR  97          HG21      THR  97  25.991   2.258   5.545
  605   HG22  THR  97          HG22      THR  97  25.342   0.624   5.403
  606   HG23  THR  97          HG23      THR  97  24.683   1.734   6.606
  607    H    GLU  98           H        GLU  98  24.132  -1.293   2.702
  608    HA   GLU  98           HA       GLU  98  23.294  -2.614   5.097
  609    HB2  GLU  98           HB1      GLU  98  21.152  -1.805   3.856
  610    HB3  GLU  98           HB2      GLU  98  21.506  -3.138   2.746
  611    HG2  GLU  98           HG1      GLU  98  20.897  -4.728   4.218
  612    HG3  GLU  98           HG2      GLU  98  21.543  -3.833   5.602
  613    HE2  GLU  98           HE       GLU  98  17.921  -2.647   4.481
  614    H    ASN  99           H        ASN  99  24.934  -4.026   5.095
  615    HA   ASN  99           HA       ASN  99  25.041  -6.006   2.977
  616    HB2  ASN  99           HB1      ASN  99  27.604  -5.742   2.910
  617    HB3  ASN  99           HB2      ASN  99  26.630  -4.565   2.021
  618   HD21  ASN  99          HD21      ASN  99  27.141  -2.525   2.296
  619   HD22  ASN  99          HD22      ASN  99  27.961  -1.854   3.661
  620    H    LEU 100           H        LEU 100  24.086  -6.749   5.229
  621    HA   LEU 100           HA       LEU 100  25.948  -7.393   7.281
  622    HB2  LEU 100           HB1      LEU 100  23.151  -8.294   6.637
  623    HB3  LEU 100           HB2      LEU 100  24.070  -8.993   7.981
  624    HG   LEU 100           HG       LEU 100  24.204  -6.194   8.293
  625   HD11  LEU 100          HD11      LEU 100  22.128  -6.464   6.695
  626   HD12  LEU 100          HD12      LEU 100  22.096  -5.347   8.059
  627   HD13  LEU 100          HD13      LEU 100  21.323  -6.926   8.195
  628   HD21  LEU 100          HD21      LEU 100  22.976  -6.665  10.346
  629   HD22  LEU 100          HD22      LEU 100  24.235  -7.870  10.071
  630   HD23  LEU 100          HD23      LEU 100  22.548  -8.263   9.734
  631    H    TYR 101           H        TYR 101  26.725  -9.469   7.884
  632    HA   TYR 101           HA       TYR 101  26.488 -11.675   6.037
  633    HB2  TYR 101           HB1      TYR 101  28.421  -9.917   5.380
  634    HB3  TYR 101           HB2      TYR 101  29.316 -10.917   6.529
  635    HD1  TYR 101           HD1      TYR 101  30.216 -12.979   5.886
  636    HD2  TYR 101           HD2      TYR 101  27.268 -11.138   3.432
  637    HE1  TYR 101           HE1      TYR 101  30.611 -14.675   4.149
  638    HE2  TYR 101           HE2      TYR 101  27.654 -12.829   1.689
  639    HH   TYR 101           HH       TYR 101  29.408 -14.374   0.981
  640    H    PHE 102           H        PHE 102  26.716 -13.577   7.059
  641    HA   PHE 102           HA       PHE 102  28.301 -13.813   9.467
  642    HB2  PHE 102           HB1      PHE 102  25.291 -13.952   9.482
  643    HB3  PHE 102           HB2      PHE 102  26.250 -14.838  10.671
  644    HD1  PHE 102           HD1      PHE 102  24.837 -11.676   9.806
  645    HD2  PHE 102           HD2      PHE 102  27.870 -13.546  12.134
  646    HE1  PHE 102           HE1      PHE 102  25.001  -9.659  11.206
  647    HE2  PHE 102           HE2      PHE 102  28.039 -11.533  13.539
  648    HZ   PHE 102           HZ       PHE 102  26.603  -9.586  13.076
  649    H    GLN 103           H        GLN 103  29.031 -15.855   9.783
  650    HA   GLN 103           HA       GLN 103  27.734 -18.088   8.442
  651    HB2  GLN 103           HB1      GLN 103  29.850 -16.775   7.207
  652    HB3  GLN 103           HB2      GLN 103  30.607 -18.176   7.984
  653    HG2  GLN 103           HG1      GLN 103  28.424 -19.330   6.843
  654    HG3  GLN 103           HG2      GLN 103  28.799 -18.046   5.685
  655   HE21  GLN 103          HE21      GLN 103  31.193 -17.893   5.137
  656   HE22  GLN 103          HE22      GLN 103  32.000 -19.389   4.831
  657    H    SER 104           H        SER 104  27.915 -19.952   9.554
  658    HA   SER 104           HA       SER 104  29.919 -20.098  11.701
  659    HB2  SER 104           HB1      SER 104  28.096 -21.328  13.042
  660    HB3  SER 104           HB2      SER 104  27.960 -19.566  12.903
  661    HG   SER 104           HG       SER 104  26.506 -19.959  11.115
  662    H    LEU 105           H        LEU 105  30.404 -22.280  12.418
  663    HA   LEU 105           HA       LEU 105  29.465 -24.537  10.936
  664    HB2  LEU 105           HB1      LEU 105  31.524 -25.131   9.824
  665    HB3  LEU 105           HB2      LEU 105  30.978 -23.532   9.287
  666    HG   LEU 105           HG       LEU 105  32.900 -23.461  11.500
  667   HD11  LEU 105          HD11      LEU 105  33.597 -25.442  10.025
  668   HD12  LEU 105          HD12      LEU 105  34.797 -24.198  10.369
  669   HD13  LEU 105          HD13      LEU 105  33.977 -24.222   8.809
  670   HD21  LEU 105          HD21      LEU 105  33.217 -21.431  10.653
  671   HD22  LEU 105          HD22      LEU 105  31.942 -21.778   9.486
  672   HD23  LEU 105          HD23      LEU 105  33.628 -22.094   9.072
  673    H    GLU 106           H        GLU 106  30.851 -26.527  11.485
  674    HA   GLU 106           HA       GLU 106  32.518 -26.462  13.779
  675    HB2  GLU 106           HB1      GLU 106  29.974 -26.097  14.528
  676    HB3  GLU 106           HB2      GLU 106  29.985 -27.866  14.442
  677    HG2  GLU 106           HG1      GLU 106  31.445 -28.099  16.189
  678    HG3  GLU 106           HG2      GLU 106  32.180 -26.512  15.916
  679    HE2  GLU 106           HE       GLU 106  30.310 -25.487  18.614
  680    H    HIS 107           H        HIS 107  32.987 -28.697  14.591
  681    HA   HIS 107           HA       HIS 107  32.157 -31.009  13.248
  682    HB2  HIS 107           HB1      HIS 107  33.791 -29.464  11.628
  683    HB3  HIS 107           HB2      HIS 107  34.901 -30.654  12.314
  684    HD1  HIS 107           HD1      HIS 107  35.236 -32.237  10.415
  685    HD2  HIS 107           HD2      HIS 107  31.220 -31.428  11.107
  686    HE1  HIS 107           HE1      HIS 107  33.966 -33.797   8.906
  687    HE2  HIS 107           HE2      HIS 107  31.510 -33.305   9.329
  688    H    HIS 108           H        HIS 108  32.987 -32.842  14.188
  689    HA   HIS 108           HA       HIS 108  35.324 -32.632  15.911
  690    HB2  HIS 108           HB1      HIS 108  32.586 -33.432  16.927
  691    HB3  HIS 108           HB2      HIS 108  34.090 -33.650  17.829
  692    HD1  HIS 108           HD1      HIS 108  31.626 -31.047  16.836
  693    HD2  HIS 108           HD2      HIS 108  35.243 -31.291  18.865
  694    HE1  HIS 108           HE1      HIS 108  31.895 -28.833  17.999
  695    HE2  HIS 108           HE2      HIS 108  34.107 -28.981  19.239
  696    H    HIS 109           H        HIS 109  36.064 -34.738  16.693
  697    HA   HIS 109           HA       HIS 109  34.923 -37.105  15.489
  698    HB2  HIS 109           HB1      HIS 109  36.871 -37.746  14.217
  699    HB3  HIS 109           HB2      HIS 109  36.329 -36.156  13.673
  700    HD1  HIS 109           HD1      HIS 109  37.755 -34.069  14.564
  701    HD2  HIS 109           HD2      HIS 109  39.481 -37.813  15.074
  702    HE1  HIS 109           HE1      HIS 109  40.190 -33.631  15.016
  703    HE2  HIS 109           HE2      HIS 109  41.246 -35.918  15.328
  704    H    HIS 110           H        HIS 110  36.447 -39.049  15.982
  705    HA   HIS 110           HA       HIS 110  38.083 -38.738  18.341
  706    HB2  HIS 110           HB1      HIS 110  35.339 -39.244  18.672
  707    HB3  HIS 110           HB2      HIS 110  36.139 -40.797  18.933
  708    HD1  HIS 110           HD1      HIS 110  37.397 -41.133  21.092
  709    HD2  HIS 110           HD2      HIS 110  36.183 -37.200  20.525
  710    HE1  HIS 110           HE1      HIS 110  37.856 -39.968  23.272
  711    HE2  HIS 110           HE2      HIS 110  37.116 -37.563  22.926
  712    H    HIS 111           H        HIS 111  39.390 -40.534  18.764
  713    HA   HIS 111           HA       HIS 111  39.071 -42.968  17.251
  714    HB2  HIS 111           HB1      HIS 111  40.466 -40.923  16.015
  715    HB3  HIS 111           HB2      HIS 111  41.745 -41.894  16.751
  716    HD1  HIS 111           HD1      HIS 111  38.588 -42.786  14.803
  717    HD2  HIS 111           HD2      HIS 111  42.638 -43.698  14.965
  718    HE1  HIS 111           HE1      HIS 111  38.963 -44.502  13.003
  719    HE2  HIS 111           HE2      HIS 111  41.439 -45.061  13.100
  720    H    HIS 112           H        HIS 112  40.971 -44.476  17.683
  721    HA   HIS 112           HA       HIS 112  41.571 -44.334  20.527
  722    HB2  HIS 112           HB1      HIS 112  41.725 -46.496  18.441
  723    HB3  HIS 112           HB2      HIS 112  42.544 -46.687  19.995
  724    HD1  HIS 112           HD1      HIS 112  41.099 -48.450  21.046
  725    HD2  HIS 112           HD2      HIS 112  38.905 -45.219  19.630
  726    HE1  HIS 112           HE1      HIS 112  38.755 -48.808  21.887
  727    HE2  HIS 112           HE2      HIS 112  37.414 -46.833  21.020
  Start of MODEL   39
    1    H1   MET  18           H        MET  18  -7.701 -35.283  -2.541
    2    HA   MET  18           HA       MET  18  -8.809 -34.023  -0.357
    3    HB2  MET  18           HB1      MET  18  -7.535 -32.150  -2.304
    4    HB3  MET  18           HB2      MET  18  -9.077 -31.682  -1.572
    5    HG2  MET  18           HG1      MET  18  -7.199 -32.670   0.411
    6    HG3  MET  18           HG2      MET  18  -6.560 -31.300  -0.501
    7    HE1  MET  18           HE1      MET  18  -7.974 -28.362   0.509
    8    HE2  MET  18           HE2      MET  18  -7.549 -29.300  -0.923
    9    HE3  MET  18           HE3      MET  18  -9.237 -28.906  -0.595
   10    H    LEU  19           H        LEU  19 -10.620 -35.178  -0.799
   11    HA   LEU  19           HA       LEU  19 -12.254 -34.243  -3.026
   12    HB2  LEU  19           HB1      LEU  19 -12.896 -36.682  -3.470
   13    HB3  LEU  19           HB2      LEU  19 -11.347 -36.095  -4.098
   14    HG   LEU  19           HG       LEU  19 -11.209 -37.376  -1.452
   15   HD11  LEU  19          HD11      LEU  19 -11.406 -39.274  -3.716
   16   HD12  LEU  19          HD12      LEU  19 -12.914 -38.643  -3.054
   17   HD13  LEU  19          HD13      LEU  19 -11.782 -39.499  -2.008
   18   HD21  LEU  19          HD21      LEU  19  -9.085 -37.530  -2.072
   19   HD22  LEU  19          HD22      LEU  19  -9.497 -36.710  -3.578
   20   HD23  LEU  19          HD23      LEU  19  -9.529 -38.472  -3.496
   21    H    VAL  20           H        VAL  20 -13.201 -33.252  -1.045
   22    HA   VAL  20           HA       VAL  20 -14.900 -35.139   0.443
   23    HB   VAL  20           HB       VAL  20 -14.274 -32.272   1.157
   24   HG11  VAL  20          HG11      VAL  20 -15.111 -34.135   3.248
   25   HG12  VAL  20          HG12      VAL  20 -15.654 -32.491   2.908
   26   HG13  VAL  20          HG13      VAL  20 -16.338 -33.850   2.014
   27   HG21  VAL  20          HG21      VAL  20 -13.116 -34.029   3.016
   28   HG22  VAL  20          HG22      VAL  20 -12.668 -34.635   1.422
   29   HG23  VAL  20          HG23      VAL  20 -12.289 -32.973   1.871
   30    H    LEU  21           H        LEU  21 -16.996 -35.200  -0.009
   31    HA   LEU  21           HA       LEU  21 -18.143 -33.167  -1.751
   32    HB2  LEU  21           HB1      LEU  21 -19.018 -35.892  -0.831
   33    HB3  LEU  21           HB2      LEU  21 -20.147 -34.780  -1.622
   34    HG   LEU  21           HG       LEU  21 -18.359 -34.716  -3.512
   35   HD11  LEU  21          HD11      LEU  21 -17.099 -36.464  -1.726
   36   HD12  LEU  21          HD12      LEU  21 -16.624 -36.089  -3.382
   37   HD13  LEU  21          HD13      LEU  21 -17.677 -37.467  -3.058
   38   HD21  LEU  21          HD21      LEU  21 -20.069 -37.153  -3.022
   39   HD22  LEU  21          HD22      LEU  21 -19.420 -36.641  -4.581
   40   HD23  LEU  21          HD23      LEU  21 -20.606 -35.637  -3.745
   41    H    ASP  22           H        ASP  22 -20.074 -32.051  -1.274
   42    HA   ASP  22           HA       ASP  22 -21.154 -32.188   1.414
   43    HB2  ASP  22           HB1      ASP  22 -20.838 -29.757   1.821
   44    HB3  ASP  22           HB2      ASP  22 -19.314 -30.653   1.762
   45    HD2  ASP  22           HD       ASP  22 -18.351 -29.084  -1.208
   46    H    PHE  23           H        PHE  23 -22.922 -30.417   1.642
   47    HA   PHE  23           HA       PHE  23 -24.147 -29.348  -0.656
   48    HB2  PHE  23           HB1      PHE  23 -26.185 -30.875  -0.631
   49    HB3  PHE  23           HB2      PHE  23 -24.717 -31.537  -1.353
   50    HD1  PHE  23           HD1      PHE  23 -23.553 -33.382  -0.381
   51    HD2  PHE  23           HD2      PHE  23 -26.929 -31.679   1.573
   52    HE1  PHE  23           HE1      PHE  23 -23.656 -35.324   1.127
   53    HE2  PHE  23           HE2      PHE  23 -27.037 -33.617   3.084
   54    HZ   PHE  23           HZ       PHE  23 -25.398 -35.442   2.863
   55    H    ASN  24           H        ASN  24 -25.791 -27.965  -0.125
   56    HA   ASN  24           HA       ASN  24 -27.333 -28.147   2.243
   57    HB2  ASN  24           HB1      ASN  24 -24.783 -27.219   2.735
   58    HB3  ASN  24           HB2      ASN  24 -25.707 -25.725   2.539
   59   HD21  ASN  24          HD21      ASN  24 -26.947 -25.028   4.155
   60   HD22  ASN  24          HD22      ASN  24 -27.262 -25.902   5.613
   61    H    ASN  25           H        ASN  25 -28.090 -25.615   2.716
   62    HA   ASN  25           HA       ASN  25 -28.420 -24.048   0.355
   63    HB2  ASN  25           HB1      ASN  25 -30.959 -24.311   0.327
   64    HB3  ASN  25           HB2      ASN  25 -30.019 -25.646  -0.349
   65   HD21  ASN  25          HD21      ASN  25 -30.209 -27.632   0.494
   66   HD22  ASN  25          HD22      ASN  25 -31.182 -28.026   1.866
   67    H    ILE  26           H        ILE  26 -29.493 -22.062   0.751
   68    HA   ILE  26           HA       ILE  26 -30.778 -21.422   3.181
   69    HB   ILE  26           HB       ILE  26 -28.471 -21.697   4.064
   70   HG12  ILE  26          HG11      ILE  26 -28.985 -18.773   4.257
   71   HG13  ILE  26          HG12      ILE  26 -30.305 -19.855   4.732
   72   HG21  ILE  26          HG21      ILE  26 -27.849 -19.346   2.281
   73   HG22  ILE  26          HG22      ILE  26 -26.767 -20.038   3.488
   74   HG23  ILE  26          HG23      ILE  26 -27.242 -20.989   2.081
   75   HD11  ILE  26          HD11      ILE  26 -29.039 -20.831   6.454
   76   HD12  ILE  26          HD12      ILE  26 -27.536 -20.128   5.851
   77   HD13  ILE  26          HD13      ILE  26 -28.765 -19.093   6.578
   78    H    ARG  27           H        ARG  27 -31.672 -19.377   3.146
   79    HA   ARG  27           HA       ARG  27 -30.907 -17.595   0.948
   80    HB2  ARG  27           HB1      ARG  27 -33.617 -18.781   1.472
   81    HB3  ARG  27           HB2      ARG  27 -33.471 -17.193   0.704
   82    HG2  ARG  27           HG1      ARG  27 -33.528 -18.456  -1.173
   83    HG3  ARG  27           HG2      ARG  27 -31.786 -18.532  -0.855
   84    HD2  ARG  27           HD1      ARG  27 -32.124 -20.762  -1.060
   85    HD3  ARG  27           HD2      ARG  27 -32.599 -20.609   0.637
   86    HE   ARG  27           HE       ARG  27 -34.793 -20.207  -1.154
   87   HH11  ARG  27          HH11      ARG  27 -32.857 -22.614   0.452
   88   HH12  ARG  27          HH12      ARG  27 -34.099 -23.823   0.417
   89   HH21  ARG  27          HH21      ARG  27 -36.434 -21.790  -1.206
   90   HH22  ARG  27          HH22      ARG  27 -36.132 -23.353  -0.527
   91    H    SER  28           H        SER  28 -29.937 -16.324   2.607
   92    HA   SER  28           HA       SER  28 -31.682 -15.184   4.637
   93    HB2  SER  28           HB1      SER  28 -28.717 -14.957   4.081
   94    HB3  SER  28           HB2      SER  28 -29.534 -13.981   5.314
   95    HG   SER  28           HG       SER  28 -28.666 -15.897   6.204
   96    H    SER  29           H        SER  29 -30.968 -12.676   4.992
   97    HA   SER  29           HA       SER  29 -31.030 -11.253   2.448
   98    HB2  SER  29           HB1      SER  29 -33.252 -11.240   4.484
   99    HB3  SER  29           HB2      SER  29 -32.966  -9.833   3.445
  100    HG   SER  29           HG       SER  29 -34.313 -11.000   2.241
  101    H    ALA  30           H        ALA  30 -28.976 -10.492   3.044
  102    HA   ALA  30           HA       ALA  30 -28.611  -9.048   5.514
  103    HB1  ALA  30           HB1      ALA  30 -26.889  -9.827   3.226
  104    HB2  ALA  30           HB2      ALA  30 -26.389  -8.445   4.203
  105    HB3  ALA  30           HB3      ALA  30 -26.628 -10.020   4.959
  106    H    ASP  31           H        ASP  31 -28.187  -8.083   2.102
  107    HA   ASP  31           HA       ASP  31 -28.505  -6.103   1.030
  108    HB2  ASP  31           HB1      ASP  31 -30.750  -6.426   2.829
  109    HB3  ASP  31           HB2      ASP  31 -30.362  -4.714   2.614
  110    HD2  ASP  31           HD       ASP  31 -32.016  -4.756  -0.368
  111    H    LEU  32           H        LEU  32 -28.773  -3.561   1.611
  112    HA   LEU  32           HA       LEU  32 -27.403  -2.702   3.961
  113    HB2  LEU  32           HB1      LEU  32 -25.664  -3.691   2.217
  114    HB3  LEU  32           HB2      LEU  32 -25.854  -2.081   1.501
  115    HG   LEU  32           HG       LEU  32 -25.168  -1.088   3.674
  116   HD11  LEU  32          HD11      LEU  32 -25.431  -3.828   4.521
  117   HD12  LEU  32          HD12      LEU  32 -25.236  -2.366   5.486
  118   HD13  LEU  32          HD13      LEU  32 -23.816  -3.211   4.872
  119   HD21  LEU  32          HD21      LEU  32 -22.971  -1.181   3.120
  120   HD22  LEU  32          HD22      LEU  32 -23.628  -1.941   1.670
  121   HD23  LEU  32          HD23      LEU  32 -22.967  -2.938   2.966
  122    H    HIS  33           H        HIS  33 -27.765  -0.577   4.346
  123    HA   HIS  33           HA       HIS  33 -28.943   1.005   2.155
  124    HB2  HIS  33           HB1      HIS  33 -29.672   1.199   5.087
  125    HB3  HIS  33           HB2      HIS  33 -30.440   2.051   3.744
  126    HD1  HIS  33           HD1      HIS  33 -30.136  -1.424   5.183
  127    HD2  HIS  33           HD2      HIS  33 -32.445   0.686   2.449
  128    HE1  HIS  33           HE1      HIS  33 -32.030  -2.961   4.577
  129    HE2  HIS  33           HE2      HIS  33 -33.442  -1.672   2.904
  130    H    GLY  34           H        GLY  34 -26.696   1.703   1.820
  131    HA2  GLY  34           HA2      GLY  34 -26.196   4.255   2.765
  132    HA3  GLY  34           HA3      GLY  34 -25.304   3.171   3.823
  133    HA1  GLY  34           HA1      GLY  34 -26.282   3.769   2.032
  134    H    ALA  35           H        ALA  35 -24.877   5.134   1.325
  135    HA   ALA  35           HA       ALA  35 -22.428   3.869   0.527
  136    HB1  ALA  35           HB1      ALA  35 -22.896   3.154  -1.563
  137    HB2  ALA  35           HB2      ALA  35 -24.523   2.987  -0.904
  138    HB3  ALA  35           HB3      ALA  35 -24.096   4.416  -1.844
  139    H    ARG  36           H        ARG  36 -21.691   5.233  -1.638
  140    HA   ARG  36           HA       ARG  36 -22.449   7.970  -1.663
  141    HB2  ARG  36           HB1      ARG  36 -20.249   8.861  -0.826
  142    HB3  ARG  36           HB2      ARG  36 -21.300   8.164   0.414
  143    HG2  ARG  36           HG1      ARG  36 -19.993   6.058   0.298
  144    HG3  ARG  36           HG2      ARG  36 -18.892   6.861  -0.835
  145    HD2  ARG  36           HD1      ARG  36 -17.852   7.056   1.275
  146    HD3  ARG  36           HD2      ARG  36 -18.574   8.638   0.950
  147    HE   ARG  36           HE       ARG  36 -20.313   6.923   2.441
  148   HH11  ARG  36          HH11      ARG  36 -17.621   9.117   2.674
  149   HH12  ARG  36          HH12      ARG  36 -17.935   9.532   4.326
  150   HH21  ARG  36          HH21      ARG  36 -20.737   7.462   4.617
  151   HH22  ARG  36          HH22      ARG  36 -19.707   8.590   5.430
  152    H    LYS  37           H        LYS  37 -21.339   9.182  -3.265
  153    HA   LYS  37           HA       LYS  37 -19.371   7.747  -4.883
  154    HB2  LYS  37           HB1      LYS  37 -20.627   8.423  -6.964
  155    HB3  LYS  37           HB2      LYS  37 -21.386   7.147  -5.999
  156    HG2  LYS  37           HG1      LYS  37 -22.814   8.945  -4.944
  157    HG3  LYS  37           HG2      LYS  37 -22.187  10.036  -6.191
  158    HD2  LYS  37           HD1      LYS  37 -23.098   7.547  -7.358
  159    HD3  LYS  37           HD2      LYS  37 -24.377   8.317  -6.402
  160    HE2  LYS  37           HE1      LYS  37 -23.780  10.480  -7.639
  161    HE3  LYS  37           HE2      LYS  37 -22.862   9.445  -8.741
  162    HZ1  LYS  37           HZ1      LYS  37 -25.768   9.576  -8.321
  163    HZ2  LYS  37           HZ2      LYS  37 -25.077   8.135  -8.870
  164    HZ3  LYS  37           HZ3      LYS  37 -24.894   9.555  -9.770
  165    H    GLY  38           H        GLY  38 -18.522   9.685  -3.346
  166    HA2  GLY  38           HA2      GLY  38 -18.186  11.964  -5.188
  167    HA3  GLY  38           HA3      GLY  38 -18.505  12.233  -3.481
  168    HA1  GLY  38           HA1      GLY  38 -17.768  11.187  -5.179
  169    H    SER  39           H        SER  39 -16.188  12.947  -5.218
  170    HA   SER  39           HA       SER  39 -13.927  13.110  -5.036
  171    HB2  SER  39           HB1      SER  39 -13.937  11.762  -2.362
  172    HB3  SER  39           HB2      SER  39 -13.035  13.187  -2.906
  173    HG   SER  39           HG       SER  39 -15.267  14.169  -3.022
  174    H    GLN  40           H        GLN  40 -11.907  11.646  -4.230
  175    HA   GLN  40           HA       GLN  40 -12.397   8.988  -5.400
  176    HB2  GLN  40           HB1      GLN  40 -10.124  10.917  -5.616
  177    HB3  GLN  40           HB2      GLN  40  -9.783   9.184  -5.736
  178    HG2  GLN  40           HG1      GLN  40 -12.036   9.922  -7.394
  179    HG3  GLN  40           HG2      GLN  40 -10.598  10.878  -7.779
  180   HE21  GLN  40          HE21      GLN  40 -11.939   7.666  -7.622
  181   HE22  GLN  40          HE22      GLN  40 -10.745   6.904  -8.610
  182    H    CYS  41           H        CYS  41 -10.110  10.605  -3.186
  183    HA   CYS  41           HA       CYS  41 -10.503   8.512  -1.220
  184    HB2  CYS  41           HB1      CYS  41  -8.168   7.892  -1.053
  185    HB3  CYS  41           HB2      CYS  41  -8.739   7.598  -2.695
  186    H    LEU  42           H        LEU  42 -10.070   9.173   0.846
  187    HA   LEU  42           HA       LEU  42  -9.393  12.006   1.153
  188    HB2  LEU  42           HB1      LEU  42 -11.159  10.132   2.510
  189    HB3  LEU  42           HB2      LEU  42 -10.129  11.031   3.638
  190    HG   LEU  42           HG       LEU  42 -11.677  12.512   1.553
  191   HD11  LEU  42          HD11      LEU  42 -12.912  12.056   4.216
  192   HD12  LEU  42          HD12      LEU  42 -13.072  10.796   2.994
  193   HD13  LEU  42          HD13      LEU  42 -13.666  12.422   2.664
  194   HD21  LEU  42          HD21      LEU  42 -10.765  13.149   4.357
  195   HD22  LEU  42          HD22      LEU  42 -11.669  14.239   3.304
  196   HD23  LEU  42          HD23      LEU  42 -10.040  13.731   2.858
  197    H    SER  43           H        SER  43  -8.248   8.817   1.875
  198    HA   SER  43           HA       SER  43  -5.759   9.935   2.874
  199    HB2  SER  43           HB1      SER  43  -7.722   8.512   4.569
  200    HB3  SER  43           HB2      SER  43  -6.051   7.933   4.700
  201    HG   SER  43           HG       SER  43  -5.485  10.217   5.003
  202    H    ASP  44           H        ASP  44  -4.155   8.082   3.305
  203    HA   ASP  44           HA       ASP  44  -3.847   6.605   0.941
  204    HB2  ASP  44           HB1      ASP  44  -2.495   6.666   3.601
  205    HB3  ASP  44           HB2      ASP  44  -2.180   5.283   2.544
  206    HD2  ASP  44           HD       ASP  44  -1.196   8.653   0.745
  207    H    THR  45           H        THR  45  -5.413   5.851   3.955
  208    HA   THR  45           HA       THR  45  -5.512   3.034   3.648
  209    HB   THR  45           HB       THR  45  -7.173   3.034   5.397
  210    HG1  THR  45           HG1      THR  45  -8.193   4.929   6.048
  211   HG21  THR  45          HG21      THR  45  -4.663   3.930   5.724
  212   HG22  THR  45          HG22      THR  45  -5.802   3.754   7.059
  213   HG23  THR  45          HG23      THR  45  -5.552   5.333   6.316
  214    H    ASP  46           H        ASP  46  -7.372   5.642   2.330
  215    HA   ASP  46           HA       ASP  46  -9.699   4.164   1.648
  216    HB2  ASP  46           HB1      ASP  46  -8.937   6.829   1.557
  217    HB3  ASP  46           HB2      ASP  46  -9.083   6.382  -0.148
  218    HD2  ASP  46           HD       ASP  46 -12.369   6.497   2.051
  219    H    CYS  47           H        CYS  47  -6.582   4.584   0.164
  220    HA   CYS  47           HA       CYS  47  -7.454   3.399  -2.347
  221    HB2  CYS  47           HB1      CYS  47  -4.888   4.612  -1.356
  222    HB3  CYS  47           HB2      CYS  47  -4.895   3.618  -2.812
  223    H    ASN  48           H        ASN  48  -5.669   1.751  -3.223
  224    HA   ASN  48           HA       ASN  48  -6.042  -0.628  -1.775
  225    HB2  ASN  48           HB1      ASN  48  -5.043   0.118  -4.314
  226    HB3  ASN  48           HB2      ASN  48  -3.775  -0.836  -3.536
  227   HD21  ASN  48          HD21      ASN  48  -6.273  -1.094  -5.549
  228   HD22  ASN  48          HD22      ASN  48  -6.772  -2.717  -5.231
  229    H    THR  49           H        THR  49  -4.274  -2.075  -1.020
  230    HA   THR  49           HA       THR  49  -2.779  -0.826   1.020
  231    HB   THR  49           HB       THR  49  -2.431  -3.608  -0.116
  232    HG1  THR  49           HG1      THR  49  -3.778  -4.141   1.732
  233   HG21  THR  49          HG21      THR  49  -0.682  -3.728   1.268
  234   HG22  THR  49          HG22      THR  49  -1.826  -3.592   2.603
  235   HG23  THR  49          HG23      THR  49  -1.042  -2.148   1.962
  236    H    ARG  50           H        ARG  50  -2.009  -1.748  -2.259
  237    HA   ARG  50           HA       ARG  50   0.808  -1.043  -1.837
  238    HB2  ARG  50           HB1      ARG  50  -0.508  -2.312  -4.251
  239    HB3  ARG  50           HB2      ARG  50   1.230  -2.089  -3.996
  240    HG2  ARG  50           HG1      ARG  50  -0.404  -3.692  -2.058
  241    HG3  ARG  50           HG2      ARG  50   0.199  -4.406  -3.563
  242    HD2  ARG  50           HD1      ARG  50   2.486  -3.350  -2.775
  243    HD3  ARG  50           HD2      ARG  50   1.709  -3.431  -1.187
  244    HE   ARG  50           HE       ARG  50   2.019  -5.691  -1.199
  245   HH11  ARG  50          HH11      ARG  50   2.267  -4.509  -4.465
  246   HH12  ARG  50          HH12      ARG  50   2.756  -6.037  -5.119
  247   HH21  ARG  50          HH21      ARG  50   2.662  -7.708  -2.049
  248   HH22  ARG  50          HH22      ARG  50   2.980  -7.857  -3.744
  249    H    LYS  51           H        LYS  51  -1.425   0.894  -1.978
  250    HA   LYS  51           HA       LYS  51  -0.263   2.607  -4.037
  251    HB2  LYS  51           HB1      LYS  51  -3.066   1.611  -3.976
  252    HB3  LYS  51           HB2      LYS  51  -2.824   3.315  -4.394
  253    HG2  LYS  51           HG1      LYS  51  -2.579   2.585  -6.489
  254    HG3  LYS  51           HG2      LYS  51  -0.962   2.082  -5.965
  255    HD2  LYS  51           HD1      LYS  51  -1.553  -0.141  -5.770
  256    HD3  LYS  51           HD2      LYS  51  -3.266   0.237  -5.517
  257    HE2  LYS  51           HE1      LYS  51  -2.853   1.221  -8.040
  258    HE3  LYS  51           HE2      LYS  51  -1.778  -0.186  -8.007
  259    HZ1  LYS  51           HZ1      LYS  51  -4.699  -0.080  -7.810
  260    HZ2  LYS  51           HZ2      LYS  51  -3.891  -1.323  -6.995
  261    HZ3  LYS  51           HZ3      LYS  51  -3.714  -1.155  -8.670
  262    H    PHE  52           H        PHE  52  -0.671   4.865  -3.707
  263    HA   PHE  52           HA       PHE  52  -1.426   5.488  -0.929
  264    HB2  PHE  52           HB1      PHE  52   0.045   7.517  -1.215
  265    HB3  PHE  52           HB2      PHE  52   0.892   5.970  -1.216
  266    HD1  PHE  52           HD1      PHE  52   2.004   5.136  -3.166
  267    HD2  PHE  52           HD2      PHE  52  -0.190   8.781  -3.305
  268    HE1  PHE  52           HE1      PHE  52   3.043   5.675  -5.331
  269    HE2  PHE  52           HE2      PHE  52   0.845   9.325  -5.470
  270    HZ   PHE  52           HZ       PHE  52   2.462   7.771  -6.486
  271    H    CYS  53           H        CYS  53  -2.486   7.517  -0.540
  272    HA   CYS  53           HA       CYS  53  -4.284   8.231  -2.729
  273    HB2  CYS  53           HB1      CYS  53  -5.371   7.666  -0.657
  274    HB3  CYS  53           HB2      CYS  53  -4.368   8.810   0.236
  275    H    LEU  54           H        LEU  54  -3.066   9.589  -4.010
  276    HA   LEU  54           HA       LEU  54  -1.536  11.755  -2.954
  277    HB2  LEU  54           HB1      LEU  54  -1.557  10.436  -5.316
  278    HB3  LEU  54           HB2      LEU  54  -2.459  11.899  -5.751
  279    HG   LEU  54           HG       LEU  54  -0.080  12.094  -6.291
  280   HD11  LEU  54          HD11      LEU  54   0.343  14.229  -5.117
  281   HD12  LEU  54          HD12      LEU  54  -1.028  13.888  -4.064
  282   HD13  LEU  54          HD13      LEU  54  -1.283  14.118  -5.794
  283   HD21  LEU  54          HD21      LEU  54   1.532  11.418  -4.922
  284   HD22  LEU  54          HD22      LEU  54   0.284  10.814  -3.832
  285   HD23  LEU  54          HD23      LEU  54   0.929  12.443  -3.619
  286    H    GLN  55           H        GLN  55  -2.280  13.626  -2.223
  287    HA   GLN  55           HA       GLN  55  -4.751  14.720  -3.378
  288    HB2  GLN  55           HB1      GLN  55  -4.959  15.658  -0.870
  289    HB3  GLN  55           HB2      GLN  55  -5.704  14.141  -1.400
  290    HG2  GLN  55           HG1      GLN  55  -4.546  13.923   0.757
  291    HG3  GLN  55           HG2      GLN  55  -3.881  12.863  -0.495
  292   HE21  GLN  55          HE21      GLN  55  -3.373  15.880   1.232
  293   HE22  GLN  55          HE22      GLN  55  -1.660  15.929   1.022
  294    HA   PRO  56           HA       PRO  56  -1.458  17.892  -3.672
  295    HB2  PRO  56           HB1      PRO  56  -2.408  18.966  -6.005
  296    HB3  PRO  56           HB2      PRO  56  -1.362  17.550  -5.942
  297    HG2  PRO  56           HG1      PRO  56  -4.347  17.699  -6.186
  298    HG3  PRO  56           HG2      PRO  56  -3.178  16.678  -7.103
  299    HD2  PRO  56           HD1      PRO  56  -4.668  15.713  -5.047
  300    HD3  PRO  56           HD2      PRO  56  -3.026  15.142  -5.390
  301    H    ARG  57           H        ARG  57  -1.552  20.127  -3.336
  302    HA   ARG  57           HA       ARG  57  -4.013  21.058  -2.140
  303    HB2  ARG  57           HB1      ARG  57  -1.357  21.497  -1.611
  304    HB3  ARG  57           HB2      ARG  57  -1.825  22.992  -2.432
  305    HG2  ARG  57           HG1      ARG  57  -3.447  23.520  -0.812
  306    HG3  ARG  57           HG2      ARG  57  -3.406  21.883  -0.137
  307    HD2  ARG  57           HD1      ARG  57  -1.247  22.214   0.809
  308    HD3  ARG  57           HD2      ARG  57  -1.020  23.715  -0.098
  309    HE   ARG  57           HE       ARG  57  -3.286  23.931   1.578
  310   HH11  ARG  57          HH11      ARG  57   0.194  23.864   1.681
  311   HH12  ARG  57          HH12      ARG  57   0.299  24.818   3.124
  312   HH21  ARG  57          HH21      ARG  57  -3.159  25.187   3.478
  313   HH22  ARG  57          HH22      ARG  57  -1.608  25.568   4.145
  314    H    ASP  58           H        ASP  58  -2.261  21.493  -5.102
  315    HA   ASP  58           HA       ASP  58  -3.827  23.825  -5.868
  316    HB2  ASP  58           HB1      ASP  58  -2.443  23.896  -7.860
  317    HB3  ASP  58           HB2      ASP  58  -1.415  23.703  -6.433
  318    HD2  ASP  58           HD       ASP  58  -0.135  20.752  -7.595
  319    H    GLU  59           H        GLU  59  -3.819  20.404  -6.293
  320    HA   GLU  59           HA       GLU  59  -5.997  20.657  -8.263
  321    HB2  GLU  59           HB1      GLU  59  -3.555  19.253  -8.494
  322    HB3  GLU  59           HB2      GLU  59  -4.824  18.036  -8.293
  323    HG2  GLU  59           HG1      GLU  59  -6.080  19.332 -10.130
  324    HG3  GLU  59           HG2      GLU  59  -4.508  20.077 -10.458
  325    HE2  GLU  59           HE       GLU  59  -3.780  16.330 -10.911
  326    H    LYS  60           H        LYS  60  -7.194  18.348  -8.279
  327    HA   LYS  60           HA       LYS  60  -8.302  18.112  -5.607
  328    HB2  LYS  60           HB1      LYS  60  -9.135  17.334  -8.358
  329    HB3  LYS  60           HB2      LYS  60  -9.766  16.368  -7.013
  330    HG2  LYS  60           HG1      LYS  60 -11.070  18.047  -6.213
  331    HG3  LYS  60           HG2      LYS  60  -9.957  19.312  -6.767
  332    HD2  LYS  60           HD1      LYS  60 -10.954  19.501  -8.783
  333    HD3  LYS  60           HD2      LYS  60 -11.212  17.753  -8.919
  334    HE2  LYS  60           HE1      LYS  60 -12.830  19.045  -6.831
  335    HE3  LYS  60           HE2      LYS  60 -13.173  19.603  -8.474
  336    HZ1  LYS  60           HZ1      LYS  60 -12.942  16.799  -8.483
  337    HZ2  LYS  60           HZ2      LYS  60 -14.290  17.749  -8.861
  338    HZ3  LYS  60           HZ3      LYS  60 -14.027  17.250  -7.267
  339    HA   PRO  61           HA       PRO  61  -6.422  14.326  -4.434
  340    HB2  PRO  61           HB1      PRO  61  -8.480  12.993  -3.213
  341    HB3  PRO  61           HB2      PRO  61  -7.681  14.401  -2.514
  342    HG2  PRO  61           HG1      PRO  61 -10.239  14.244  -4.074
  343    HG3  PRO  61           HG2      PRO  61  -9.885  15.144  -2.553
  344    HD2  PRO  61           HD1      PRO  61  -9.964  16.349  -4.986
  345    HD3  PRO  61           HD2      PRO  61  -8.865  16.867  -3.696
  346    H    PHE  62           H        PHE  62  -5.933  12.396  -5.323
  347    HA   PHE  62           HA       PHE  62  -7.918  10.815  -6.699
  348    HB2  PHE  62           HB1      PHE  62  -6.940  10.847  -8.869
  349    HB3  PHE  62           HB2      PHE  62  -7.140  12.532  -8.382
  350    HD1  PHE  62           HD1      PHE  62  -4.936  10.305  -9.858
  351    HD2  PHE  62           HD2      PHE  62  -5.024  13.512  -7.062
  352    HE1  PHE  62           HE1      PHE  62  -2.548  10.728 -10.273
  353    HE2  PHE  62           HE2      PHE  62  -2.637  13.941  -7.473
  354    HZ   PHE  62           HZ       PHE  62  -1.396  12.549  -9.080
  355    H    CYS  63           H        CYS  63  -7.347   8.677  -6.885
  356    HA   CYS  63           HA       CYS  63  -5.187   7.790  -5.232
  357    HB2  CYS  63           HB1      CYS  63  -7.506   6.687  -5.661
  358    HB3  CYS  63           HB2      CYS  63  -6.728   5.997  -7.086
  359    H    ALA  64           H        ALA  64  -3.143   7.623  -5.839
  360    HA   ALA  64           HA       ALA  64  -2.525   7.307  -8.695
  361    HB1  ALA  64           HB1      ALA  64  -1.042   8.917  -8.345
  362    HB2  ALA  64           HB2      ALA  64  -1.411   8.926  -6.620
  363    HB3  ALA  64           HB3      ALA  64  -0.168   7.845  -7.249
  364    H    THR  65           H        THR  65  -0.678   5.936  -9.263
  365    HA   THR  65           HA       THR  65  -0.801   3.426  -7.805
  366    HB   THR  65           HB       THR  65   0.945   2.943  -9.838
  367    HG1  THR  65           HG1      THR  65   0.859   4.793 -10.952
  368   HG21  THR  65          HG21      THR  65  -0.850   1.846 -10.929
  369   HG22  THR  65          HG22      THR  65  -2.038   2.965 -10.259
  370   HG23  THR  65          HG23      THR  65  -1.231   1.799  -9.208
  371    H    CYS  66           H        CYS  66   1.300   2.174  -7.590
  372    HA   CYS  66           HA       CYS  66   3.017   3.512  -5.832
  373    HB2  CYS  66           HB1      CYS  66   2.748   1.107  -5.742
  374    HB3  CYS  66           HB2      CYS  66   3.416   0.936  -7.367
  375    H    ARG  67           H        ARG  67   5.009   4.439  -6.043
  376    HA   ARG  67           HA       ARG  67   5.731   5.330  -8.702
  377    HB2  ARG  67           HB1      ARG  67   7.014   5.921  -6.024
  378    HB3  ARG  67           HB2      ARG  67   7.368   6.744  -7.550
  379    HG2  ARG  67           HG1      ARG  67   4.569   6.718  -6.486
  380    HG3  ARG  67           HG2      ARG  67   5.768   7.848  -5.836
  381    HD2  ARG  67           HD1      ARG  67   6.040   7.993  -8.629
  382    HD3  ARG  67           HD2      ARG  67   4.301   7.966  -8.310
  383    HE   ARG  67           HE       ARG  67   5.685   9.805  -6.615
  384   HH11  ARG  67          HH11      ARG  67   4.322   9.369  -9.789
  385   HH12  ARG  67          HH12      ARG  67   4.058  11.062 -10.050
  386   HH21  ARG  67          HH21      ARG  67   5.341  12.036  -6.946
  387   HH22  ARG  67          HH22      ARG  67   4.638  12.577  -8.433
  388    H    GLY  68           H        GLY  68   8.053   5.303  -9.372
  389    HA2  GLY  68           HA2      GLY  68   9.145   2.621  -8.872
  390    HA3  GLY  68           HA3      GLY  68   9.485   3.621 -10.277
  391    HA1  GLY  68           HA1      GLY  68   9.108   3.218  -8.224
  392    H    LEU  69           H        LEU  69  11.655   2.617  -9.311
  393    HA   LEU  69           HA       LEU  69  12.836   3.938  -7.105
  394    HB2  LEU  69           HB1      LEU  69  14.012   2.433  -9.442
  395    HB3  LEU  69           HB2      LEU  69  14.985   3.082  -8.111
  396    HG   LEU  69           HG       LEU  69  12.858   0.953  -7.898
  397   HD11  LEU  69          HD11      LEU  69  15.649   0.463  -7.090
  398   HD12  LEU  69          HD12      LEU  69  15.362   0.630  -8.822
  399   HD13  LEU  69          HD13      LEU  69  14.494  -0.597  -7.899
  400   HD21  LEU  69          HD21      LEU  69  12.793   2.241  -5.896
  401   HD22  LEU  69          HD22      LEU  69  14.554   2.299  -5.803
  402   HD23  LEU  69          HD23      LEU  69  13.706   0.773  -5.547
  403    H    ARG  70           H        ARG  70  12.468   4.763 -10.450
  404    HA   ARG  70           HA       ARG  70  14.443   6.901 -10.289
  405    HB2  ARG  70           HB1      ARG  70  12.626   6.115 -12.581
  406    HB3  ARG  70           HB2      ARG  70  13.987   7.246 -12.657
  407    HG2  ARG  70           HG1      ARG  70  14.944   4.780 -11.601
  408    HG3  ARG  70           HG2      ARG  70  14.004   4.451 -13.067
  409    HD2  ARG  70           HD1      ARG  70  16.104   4.834 -13.952
  410    HD3  ARG  70           HD2      ARG  70  15.366   6.438 -14.060
  411    HE   ARG  70           HE       ARG  70  16.869   7.208 -12.507
  412   HH11  ARG  70          HH11      ARG  70  16.910   3.727 -12.530
  413   HH12  ARG  70          HH12      ARG  70  18.300   3.606 -11.503
  414   HH21  ARG  70          HH21      ARG  70  18.699   7.062 -11.154
  415   HH22  ARG  70          HH22      ARG  70  19.317   5.505 -10.720
  416    H    ARG  71           H        ARG  71  11.610   6.680  -8.975
  417    HA   ARG  71           HA       ARG  71  10.579   9.268  -9.918
  418    HB2  ARG  71           HB1      ARG  71   9.293   6.915  -8.556
  419    HB3  ARG  71           HB2      ARG  71   8.541   8.516  -8.497
  420    HG2  ARG  71           HG1      ARG  71   9.297   7.152 -11.076
  421    HG3  ARG  71           HG2      ARG  71   7.709   6.988 -10.306
  422    HD2  ARG  71           HD1      ARG  71   7.222   9.295 -10.561
  423    HD3  ARG  71           HD2      ARG  71   8.905   9.666 -10.960
  424    HE   ARG  71           HE       ARG  71   8.041   7.912 -12.904
  425   HH11  ARG  71          HH11      ARG  71   7.134  11.066 -11.740
  426   HH12  ARG  71          HH12      ARG  71   6.537  11.604 -13.275
  427   HH21  ARG  71          HH21      ARG  71   7.257   8.608 -14.929
  428   HH22  ARG  71          HH22      ARG  71   6.607  10.205 -15.088
  429    H    ARG  72           H        ARG  72   9.825  10.801  -8.328
  430    HA   ARG  72           HA       ARG  72  11.609  10.921  -6.045
  431    HB2  ARG  72           HB1      ARG  72   9.657  12.859  -7.284
  432    HB3  ARG  72           HB2      ARG  72  10.456  13.190  -5.740
  433    HG2  ARG  72           HG1      ARG  72  12.514  12.429  -7.476
  434    HG3  ARG  72           HG2      ARG  72  11.458  13.499  -8.414
  435    HD2  ARG  72           HD1      ARG  72  12.317  14.245  -5.630
  436    HD3  ARG  72           HD2      ARG  72  13.370  14.539  -7.021
  437    HE   ARG  72           HE       ARG  72  10.966  15.616  -7.746
  438   HH11  ARG  72          HH11      ARG  72  13.162  16.038  -5.078
  439   HH12  ARG  72          HH12      ARG  72  12.746  17.701  -4.828
  440   HH21  ARG  72          HH21      ARG  72  10.408  17.805  -7.427
  441   HH22  ARG  72          HH22      ARG  72  11.179  18.704  -6.164
  442    H    CYS  73           H        CYS  73  10.912  11.258  -3.885
  443    HA   CYS  73           HA       CYS  73   8.115  10.642  -3.289
  444    HB2  CYS  73           HB1      CYS  73   8.818   8.996  -1.555
  445    HB3  CYS  73           HB2      CYS  73   9.152   8.472  -3.206
  446    H    GLN  74           H        GLN  74   7.534  11.097  -1.044
  447    HA   GLN  74           HA       GLN  74   9.229  13.222   0.084
  448    HB2  GLN  74           HB1      GLN  74   6.437  13.124  -0.556
  449    HB3  GLN  74           HB2      GLN  74   6.623  13.342   1.191
  450    HG2  GLN  74           HG1      GLN  74   7.712  15.375   0.971
  451    HG3  GLN  74           HG2      GLN  74   8.185  15.043  -0.701
  452   HE21  GLN  74          HE21      GLN  74   5.628  16.098   1.395
  453   HE22  GLN  74          HE22      GLN  74   4.597  16.726   0.160
  454    H    ARG  75           H        ARG  75   7.559  10.245   0.730
  455    HA   ARG  75           HA       ARG  75   8.726  10.231   3.430
  456    HB2  ARG  75           HB1      ARG  75   6.078  10.530   3.072
  457    HB3  ARG  75           HB2      ARG  75   6.181   8.764   3.031
  458    HG2  ARG  75           HG1      ARG  75   7.719   9.391   5.220
  459    HG3  ARG  75           HG2      ARG  75   6.420  10.594   5.283
  460    HD2  ARG  75           HD1      ARG  75   5.002   8.345   4.701
  461    HD3  ARG  75           HD2      ARG  75   6.317   7.683   5.681
  462    HE   ARG  75           HE       ARG  75   4.135   9.272   6.601
  463   HH11  ARG  75          HH11      ARG  75   7.482   8.502   7.173
  464   HH12  ARG  75          HH12      ARG  75   7.421   8.903   8.857
  465   HH21  ARG  75          HH21      ARG  75   4.042   9.802   8.818
  466   HH22  ARG  75          HH22      ARG  75   5.464   9.641   9.792
  467    H    ASP  76           H        ASP  76   8.848   7.976   4.337
  468    HA   ASP  76           HA       ASP  76  10.089   6.268   2.382
  469    HB2  ASP  76           HB1      ASP  76   9.551   5.599   5.279
  470    HB3  ASP  76           HB2      ASP  76  10.807   4.938   4.225
  471    HD2  ASP  76           HD       ASP  76  11.474   8.377   6.028
  472    H    ALA  77           H        ALA  77   7.084   6.342   4.169
  473    HA   ALA  77           HA       ALA  77   6.319   3.661   3.463
  474    HB1  ALA  77           HB1      ALA  77   4.274   4.105   4.589
  475    HB2  ALA  77           HB2      ALA  77   5.557   4.866   5.530
  476    HB3  ALA  77           HB3      ALA  77   4.526   5.849   4.491
  477    H    MET  78           H        MET  78   5.984   6.824   2.078
  478    HA   MET  78           HA       MET  78   3.755   6.493   0.454
  479    HB2  MET  78           HB1      MET  78   6.127   8.233   0.493
  480    HB3  MET  78           HB2      MET  78   5.408   8.013  -1.109
  481    HG2  MET  78           HG1      MET  78   3.631   8.695   1.195
  482    HG3  MET  78           HG2      MET  78   4.628   9.954   0.457
  483    HE1  MET  78           HE1      MET  78   4.904  10.227  -1.888
  484    HE2  MET  78           HE2      MET  78   4.035   9.340  -3.141
  485    HE3  MET  78           HE3      MET  78   3.444  10.912  -2.602
  486    H    CYS  79           H        CYS  79   7.109   5.526  -0.083
  487    HA   CYS  79           HA       CYS  79   6.582   4.536  -2.736
  488    HB2  CYS  79           HB1      CYS  79   8.830   5.399  -1.535
  489    HB3  CYS  79           HB2      CYS  79   9.013   3.664  -1.272
  490    H    CYS  80           H        CYS  80   6.889   2.298  -3.368
  491    HA   CYS  80           HA       CYS  80   5.281   0.507  -2.020
  492    HB2  CYS  80           HB1      CYS  80   7.316   0.311  -4.169
  493    HB3  CYS  80           HB2      CYS  80   6.901  -1.198  -3.351
  494    HA   PRO  81           HA       PRO  81   7.568  -1.242   1.289
  495    HB2  PRO  81           HB1      PRO  81   6.858  -3.883   1.171
  496    HB3  PRO  81           HB2      PRO  81   5.763  -2.605   1.692
  497    HG2  PRO  81           HG1      PRO  81   6.025  -3.904  -0.998
  498    HG3  PRO  81           HG2      PRO  81   4.535  -3.519  -0.058
  499    HD2  PRO  81           HD1      PRO  81   5.396  -1.989  -2.127
  500    HD3  PRO  81           HD2      PRO  81   4.575  -1.310  -0.712
  501    H    GLY  82           H        GLY  82   9.643  -1.789   1.569
  502    HA2  GLY  82           HA2      GLY  82  11.466  -3.329   1.297
  503    HA3  GLY  82           HA3      GLY  82  10.873  -3.684  -0.319
  504    HA1  GLY  82           HA1      GLY  82  11.297  -2.467   1.372
  505    H    THR  83           H        THR  83  10.921  -0.385   0.656
  506    HA   THR  83           HA       THR  83  13.533   0.090  -0.559
  507    HB   THR  83           HB       THR  83  12.288   2.077  -1.807
  508    HG1  THR  83           HG1      THR  83  10.299   0.193  -1.222
  509   HG21  THR  83          HG21      THR  83  11.940   0.335  -3.749
  510   HG22  THR  83          HG22      THR  83  12.761  -0.753  -2.629
  511   HG23  THR  83          HG23      THR  83  13.560   0.725  -3.168
  512    H    LEU  84           H        LEU  84  13.998   2.553  -0.499
  513    HA   LEU  84           HA       LEU  84  12.826   3.758   1.910
  514    HB2  LEU  84           HB1      LEU  84  15.531   2.809   1.550
  515    HB3  LEU  84           HB2      LEU  84  15.507   4.553   1.858
  516    HG   LEU  84           HG       LEU  84  15.817   3.383   3.934
  517   HD11  LEU  84          HD11      LEU  84  14.073   4.354   5.223
  518   HD12  LEU  84          HD12      LEU  84  12.963   4.333   3.853
  519   HD13  LEU  84          HD13      LEU  84  14.354   5.417   3.844
  520   HD21  LEU  84          HD21      LEU  84  14.931   1.381   4.283
  521   HD22  LEU  84          HD22      LEU  84  14.006   1.518   2.788
  522   HD23  LEU  84          HD23      LEU  84  13.318   2.095   4.307
  523    H    CYS  85           H        CYS  85  12.972   6.054   2.020
  524    HA   CYS  85           HA       CYS  85  13.139   7.290  -0.631
  525    HB2  CYS  85           HB1      CYS  85  11.072   7.493   0.854
  526    HB3  CYS  85           HB2      CYS  85  12.041   8.550   1.881
  527    H    VAL  86           H        VAL  86  15.164   7.945  -1.045
  528    HA   VAL  86           HA       VAL  86  16.520   9.576   1.004
  529    HB   VAL  86           HB       VAL  86  17.832   7.850  -1.101
  530   HG11  VAL  86          HG11      VAL  86  19.578   9.201  -0.800
  531   HG12  VAL  86          HG12      VAL  86  18.795  10.028   0.549
  532   HG13  VAL  86          HG13      VAL  86  19.696   8.538   0.831
  533   HG21  VAL  86          HG21      VAL  86  17.624   7.479   1.886
  534   HG22  VAL  86          HG22      VAL  86  16.826   6.500   0.654
  535   HG23  VAL  86          HG23      VAL  86  18.584   6.480   0.795
  536    H    ASN  87           H        ASN  87  17.198  11.562   0.430
  537    HA   ASN  87           HA       ASN  87  17.344  13.492  -0.773
  538    HB2  ASN  87           HB1      ASN  87  18.981  11.645  -1.960
  539    HB3  ASN  87           HB2      ASN  87  17.982  12.167  -3.323
  540   HD21  ASN  87          HD21      ASN  87  20.338  13.134  -0.970
  541   HD22  ASN  87          HD22      ASN  87  20.744  14.648  -1.698
  542    H    ASP  88           H        ASP  88  14.766  12.307  -0.645
  543    HA   ASP  88           HA       ASP  88  12.681  12.572  -1.514
  544    HB2  ASP  88           HB1      ASP  88  13.902  14.435  -3.556
  545    HB3  ASP  88           HB2      ASP  88  12.254  14.446  -2.915
  546    HD2  ASP  88           HD       ASP  88  15.120  16.039  -0.682
  547    H    VAL  89           H        VAL  89  14.556  10.558  -2.591
  548    HA   VAL  89           HA       VAL  89  13.094   9.994  -5.073
  549    HB   VAL  89           HB       VAL  89  16.069   9.575  -4.759
  550   HG11  VAL  89          HG11      VAL  89  14.117   8.974  -6.959
  551   HG12  VAL  89          HG12      VAL  89  15.843   9.161  -7.271
  552   HG13  VAL  89          HG13      VAL  89  15.274   7.893  -6.184
  553   HG21  VAL  89          HG21      VAL  89  15.767  11.275  -6.857
  554   HG22  VAL  89          HG22      VAL  89  14.489  11.830  -5.777
  555   HG23  VAL  89          HG23      VAL  89  16.158  11.777  -5.212
  556    H    CYS  90           H        CYS  90  12.601   7.861  -5.420
  557    HA   CYS  90           HA       CYS  90  12.669   6.137  -3.139
  558    HB2  CYS  90           HB1      CYS  90  11.611   5.930  -5.940
  559    HB3  CYS  90           HB2      CYS  90  11.716   4.481  -4.938
  560    H    THR  91           H        THR  91  14.511   5.188  -2.555
  561    HA   THR  91           HA       THR  91  16.195   3.992  -4.657
  562    HB   THR  91           HB       THR  91  17.310   5.791  -3.362
  563    HG1  THR  91           HG1      THR  91  18.822   4.422  -4.048
  564   HG21  THR  91          HG21      THR  91  17.946   5.317  -1.013
  565   HG22  THR  91          HG22      THR  91  16.883   3.910  -1.038
  566   HG23  THR  91          HG23      THR  91  16.209   5.529  -1.223
  567    H    THR  92           H        THR  92  17.367   2.018  -4.017
  568    HA   THR  92           HA       THR  92  15.565   0.189  -2.679
  569    HB   THR  92           HB       THR  92  17.648  -1.389  -3.288
  570    HG1  THR  92           HG1      THR  92  18.542  -0.594  -5.276
  571   HG21  THR  92          HG21      THR  92  15.241  -0.500  -4.725
  572   HG22  THR  92          HG22      THR  92  15.796  -2.130  -4.341
  573   HG23  THR  92          HG23      THR  92  16.464  -1.275  -5.731
  574    H    MET  93           H        MET  93  16.046  -1.052  -0.866
  575    HA   MET  93           HA       MET  93  17.394   0.167   1.223
  576    HB2  MET  93           HB1      MET  93  16.029  -2.327   0.760
  577    HB3  MET  93           HB2      MET  93  17.480  -2.606   1.734
  578    HG2  MET  93           HG1      MET  93  16.213  -0.309   2.792
  579    HG3  MET  93           HG2      MET  93  14.965  -1.531   2.528
  580    HE1  MET  93           HE1      MET  93  14.221  -2.206   4.688
  581    HE2  MET  93           HE2      MET  93  15.205  -2.578   6.103
  582    HE3  MET  93           HE3      MET  93  15.095  -0.918   5.518
  583    H    GLU  94           H        GLU  94  18.564  -2.156  -1.146
  584    HA   GLU  94           HA       GLU  94  21.005  -2.805   0.071
  585    HB2  GLU  94           HB1      GLU  94  20.471  -2.600  -2.901
  586    HB3  GLU  94           HB2      GLU  94  21.717  -3.575  -2.106
  587    HG2  GLU  94           HG1      GLU  94  19.739  -4.739  -0.917
  588    HG3  GLU  94           HG2      GLU  94  18.764  -4.021  -2.207
  589    HE2  GLU  94           HE       GLU  94  19.752  -7.205  -3.484
  590    H    ASP  95           H        ASP  95  19.981   0.010  -1.680
  591    HA   ASP  95           HA       ASP  95  22.687   0.997  -2.039
  592    HB2  ASP  95           HB1      ASP  95  19.954   1.884  -2.860
  593    HB3  ASP  95           HB2      ASP  95  21.232   3.103  -2.756
  594    HD2  ASP  95           HD       ASP  95  22.967   1.693  -5.455
  595    H    ALA  96           H        ALA  96  19.768   2.003  -0.264
  596    HA   ALA  96           HA       ALA  96  21.050   4.113   1.133
  597    HB1  ALA  96           HB1      ALA  96  18.564   2.651   1.999
  598    HB2  ALA  96           HB2      ALA  96  19.043   4.302   2.395
  599    HB3  ALA  96           HB3      ALA  96  18.582   3.890   0.744
  600    H    THR  97           H        THR  97  22.467   3.976   2.733
  601    HA   THR  97           HA       THR  97  22.189   1.928   4.777
  602    HB   THR  97           HB       THR  97  24.913   1.825   4.371
  603    HG1  THR  97           HG1      THR  97  25.313   1.768   2.253
  604   HG21  THR  97          HG21      THR  97  24.138  -0.424   3.129
  605   HG22  THR  97          HG22      THR  97  22.604   0.043   3.861
  606   HG23  THR  97          HG23      THR  97  24.025  -0.206   4.874
  607    H    GLU  98           H        GLU  98  21.879   3.437   6.354
  608    HA   GLU  98           HA       GLU  98  24.165   5.200   6.921
  609    HB2  GLU  98           HB1      GLU  98  22.535   6.883   7.805
  610    HB3  GLU  98           HB2      GLU  98  22.466   6.645   6.051
  611    HG2  GLU  98           HG1      GLU  98  20.290   6.292   6.210
  612    HG3  GLU  98           HG2      GLU  98  20.634   4.831   7.149
  613    HE2  GLU  98           HE       GLU  98  19.038   6.282   9.801
  614    H    ASN  99           H        ASN  99  24.389   5.796   9.179
  615    HA   ASN  99           HA       ASN  99  22.855   4.387  11.163
  616    HB2  ASN  99           HB1      ASN  99  24.972   3.287  12.112
  617    HB3  ASN  99           HB2      ASN  99  24.233   2.536  10.693
  618   HD21  ASN  99          HD21      ASN  99  25.224   2.756   8.668
  619   HD22  ASN  99          HD22      ASN  99  26.893   3.179   8.524
  620    H    LEU 100           H        LEU 100  23.901   4.742  13.402
  621    HA   LEU 100           HA       LEU 100  25.360   7.286  13.497
  622    HB2  LEU 100           HB1      LEU 100  22.905   6.651  15.144
  623    HB3  LEU 100           HB2      LEU 100  23.890   8.119  15.250
  624    HG   LEU 100           HG       LEU 100  23.071   7.962  12.575
  625   HD11  LEU 100          HD11      LEU 100  20.568   7.853  14.147
  626   HD12  LEU 100          HD12      LEU 100  21.365   6.319  13.799
  627   HD13  LEU 100          HD13      LEU 100  20.884   7.383  12.477
  628   HD21  LEU 100          HD21      LEU 100  22.374   9.637  14.952
  629   HD22  LEU 100          HD22      LEU 100  21.549   9.889  13.414
  630   HD23  LEU 100          HD23      LEU 100  23.302  10.064  13.514
  631    H    TYR 101           H        TYR 101  26.751   7.520  15.212
  632    HA   TYR 101           HA       TYR 101  26.953   5.223  17.048
  633    HB2  TYR 101           HB1      TYR 101  29.026   6.611  15.411
  634    HB3  TYR 101           HB2      TYR 101  29.494   6.050  17.018
  635    HD1  TYR 101           HD1      TYR 101  29.664   3.697  17.539
  636    HD2  TYR 101           HD2      TYR 101  28.408   4.977  13.681
  637    HE1  TYR 101           HE1      TYR 101  30.008   1.419  16.679
  638    HE2  TYR 101           HE2      TYR 101  28.749   2.702  12.809
  639    HH   TYR 101           HH       TYR 101  30.487   0.568  13.870
  640    H    PHE 102           H        PHE 102  27.200   5.647  19.176
  641    HA   PHE 102           HA       PHE 102  26.787   8.371  20.045
  642    HB2  PHE 102           HB1      PHE 102  26.655   5.670  21.274
  643    HB3  PHE 102           HB2      PHE 102  27.061   7.004  22.357
  644    HD1  PHE 102           HD1      PHE 102  24.735   6.862  19.452
  645    HD2  PHE 102           HD2      PHE 102  25.201   7.457  23.640
  646    HE1  PHE 102           HE1      PHE 102  22.357   7.470  19.627
  647    HE2  PHE 102           HE2      PHE 102  22.824   8.065  23.822
  648    HZ   PHE 102           HZ       PHE 102  21.399   8.072  21.814
  649    H    GLN 103           H        GLN 103  28.445   9.715  20.254
  650    HA   GLN 103           HA       GLN 103  31.139   8.994  20.318
  651    HB2  GLN 103           HB1      GLN 103  29.630  11.387  20.306
  652    HB3  GLN 103           HB2      GLN 103  30.760  11.499  21.666
  653    HG2  GLN 103           HG1      GLN 103  32.282  10.496  19.554
  654    HG3  GLN 103           HG2      GLN 103  31.257  11.748  18.841
  655   HE21  GLN 103          HE21      GLN 103  31.140  13.798  20.217
  656   HE22  GLN 103          HE22      GLN 103  32.646  14.379  20.832
  657    H    SER 104           H        SER 104  32.706   9.257  22.038
  658    HA   SER 104           HA       SER 104  31.769   8.058  24.492
  659    HB2  SER 104           HB1      SER 104  34.238   8.176  23.050
  660    HB3  SER 104           HB2      SER 104  34.516   8.789  24.690
  661    HG   SER 104           HG       SER 104  33.445   6.276  23.937
  662    H    LEU 105           H        LEU 105  32.934   8.944  26.569
  663    HA   LEU 105           HA       LEU 105  31.987  11.668  26.884
  664    HB2  LEU 105           HB1      LEU 105  32.040   9.423  28.512
  665    HB3  LEU 105           HB2      LEU 105  33.282  10.484  29.199
  666    HG   LEU 105           HG       LEU 105  31.226  10.871  30.357
  667   HD11  LEU 105          HD11      LEU 105  31.190  13.166  30.268
  668   HD12  LEU 105          HD12      LEU 105  31.318  13.210  28.510
  669   HD13  LEU 105          HD13      LEU 105  32.733  12.821  29.487
  670   HD21  LEU 105          HD21      LEU 105  29.539  12.012  28.405
  671   HD22  LEU 105          HD22      LEU 105  29.273  10.551  29.357
  672   HD23  LEU 105          HD23      LEU 105  30.068  10.449  27.783
  673    H    GLU 106           H        GLU 106  33.246  13.402  26.796
  674    HA   GLU 106           HA       GLU 106  36.099  13.126  27.437
  675    HB2  GLU 106           HB1      GLU 106  35.107  13.476  24.852
  676    HB3  GLU 106           HB2      GLU 106  35.631  15.091  25.352
  677    HG2  GLU 106           HG1      GLU 106  37.694  14.526  24.778
  678    HG3  GLU 106           HG2      GLU 106  37.693  13.409  26.151
  679    HE2  GLU 106           HE       GLU 106  38.128  10.859  23.912
  680    H    HIS 107           H        HIS 107  37.130  15.377  27.628
  681    HA   HIS 107           HA       HIS 107  35.535  17.624  28.237
  682    HB2  HIS 107           HB1      HIS 107  35.223  15.833  30.196
  683    HB3  HIS 107           HB2      HIS 107  36.720  16.582  30.762
  684    HD1  HIS 107           HD1      HIS 107  35.690  17.770  32.763
  685    HD2  HIS 107           HD2      HIS 107  33.888  18.761  29.153
  686    HE1  HIS 107           HE1      HIS 107  34.204  19.734  33.270
  687    HE2  HIS 107           HE2      HIS 107  33.101  20.341  31.064
  688    H    HIS 108           H        HIS 108  36.769  19.438  28.408
  689    HA   HIS 108           HA       HIS 108  39.513  19.371  29.225
  690    HB2  HIS 108           HB1      HIS 108  38.928  18.881  26.477
  691    HB3  HIS 108           HB2      HIS 108  39.659  20.484  26.601
  692    HD1  HIS 108           HD1      HIS 108  40.745  17.316  25.841
  693    HD2  HIS 108           HD2      HIS 108  42.042  20.093  28.647
  694    HE1  HIS 108           HE1      HIS 108  43.117  16.676  26.376
  695    HE2  HIS 108           HE2      HIS 108  43.911  18.373  28.089
  696    H    HIS 109           H        HIS 109  40.555  21.616  28.557
  697    HA   HIS 109           HA       HIS 109  38.683  23.792  28.354
  698    HB2  HIS 109           HB1      HIS 109  39.251  22.812  30.921
  699    HB3  HIS 109           HB2      HIS 109  40.227  24.274  30.755
  700    HD1  HIS 109           HD1      HIS 109  36.732  23.130  31.164
  701    HD2  HIS 109           HD2      HIS 109  38.746  26.678  30.374
  702    HE1  HIS 109           HE1      HIS 109  35.043  24.958  31.526
  703    HE2  HIS 109           HE2      HIS 109  36.273  27.126  31.046
  704    H    HIS 110           H        HIS 110  39.774  25.902  28.311
  705    HA   HIS 110           HA       HIS 110  42.586  26.148  28.297
  706    HB2  HIS 110           HB1      HIS 110  42.839  26.562  25.818
  707    HB3  HIS 110           HB2      HIS 110  42.612  24.873  26.286
  708    HD1  HIS 110           HD1      HIS 110  40.573  23.657  25.406
  709    HD2  HIS 110           HD2      HIS 110  40.551  27.716  24.528
  710    HE1  HIS 110           HE1      HIS 110  38.683  23.981  23.781
  711    HE2  HIS 110           HE2      HIS 110  38.668  26.463  23.242
  712    H    HIS 111           H        HIS 111  43.278  28.280  27.330
  713    HA   HIS 111           HA       HIS 111  41.096  30.242  27.603
  714    HB2  HIS 111           HB1      HIS 111  42.667  31.801  28.558
  715    HB3  HIS 111           HB2      HIS 111  42.756  30.284  29.458
  716    HD1  HIS 111           HD1      HIS 111  44.994  29.181  29.643
  717    HD2  HIS 111           HD2      HIS 111  44.925  32.153  26.741
  718    HE1  HIS 111           HE1      HIS 111  47.381  29.449  28.899
  719    HE2  HIS 111           HE2      HIS 111  47.341  31.266  27.126
  720    H    HIS 112           H        HIS 112  42.286  32.505  26.748
  721    HA   HIS 112           HA       HIS 112  42.189  32.253  23.939
  722    HB2  HIS 112           HB1      HIS 112  42.574  34.408  25.899
  723    HB3  HIS 112           HB2      HIS 112  43.406  34.682  24.365
  724    HD1  HIS 112           HD1      HIS 112  40.145  34.993  25.923
  725    HD2  HIS 112           HD2      HIS 112  41.592  34.544  22.054
  726    HE1  HIS 112           HE1      HIS 112  38.254  35.679  24.413
  727    HE2  HIS 112           HE2      HIS 112  39.137  35.407  22.048
  Start of MODEL   40
    1    H1   MET  18           H        MET  18   0.255  31.666  21.896
    2    HA   MET  18           HA       MET  18   2.483  31.109  20.493
    3    HB2  MET  18           HB1      MET  18   1.727  28.697  22.154
    4    HB3  MET  18           HB2      MET  18   2.771  28.621  20.725
    5    HG2  MET  18           HG1      MET  18   4.506  28.984  22.056
    6    HG3  MET  18           HG2      MET  18   3.886  30.622  22.291
    7    HE1  MET  18           HE1      MET  18   1.592  30.670  24.769
    8    HE2  MET  18           HE2      MET  18   3.068  31.037  25.663
    9    HE3  MET  18           HE3      MET  18   2.903  31.551  23.983
   10    H    LEU  19           H        LEU  19   0.037  31.941  19.804
   11    HA   LEU  19           HA       LEU  19  -1.255  29.686  18.433
   12    HB2  LEU  19           HB1      LEU  19  -2.299  32.492  18.843
   13    HB3  LEU  19           HB2      LEU  19  -3.192  31.106  18.195
   14    HG   LEU  19           HG       LEU  19  -2.085  30.957  20.965
   15   HD11  LEU  19          HD11      LEU  19  -4.670  32.321  20.227
   16   HD12  LEU  19          HD12      LEU  19  -3.228  33.124  20.848
   17   HD13  LEU  19          HD13      LEU  19  -4.099  31.973  21.859
   18   HD21  LEU  19          HD21      LEU  19  -4.610  29.889  19.710
   19   HD22  LEU  19          HD22      LEU  19  -3.974  29.497  21.308
   20   HD23  LEU  19          HD23      LEU  19  -3.100  28.990  19.861
   21    H    VAL  20           H        VAL  20  -0.964  29.442  16.322
   22    HA   VAL  20           HA       VAL  20   0.381  31.537  14.814
   23    HB   VAL  20           HB       VAL  20  -0.383  28.764  13.891
   24   HG11  VAL  20          HG11      VAL  20   1.557  29.228  12.301
   25   HG12  VAL  20          HG12      VAL  20   0.045  30.084  11.995
   26   HG13  VAL  20          HG13      VAL  20   1.390  30.918  12.775
   27   HG21  VAL  20          HG21      VAL  20   1.621  29.595  15.763
   28   HG22  VAL  20          HG22      VAL  20   1.222  27.969  15.207
   29   HG23  VAL  20          HG23      VAL  20   2.390  28.944  14.316
   30    H    LEU  21           H        LEU  21  -0.547  32.767  13.289
   31    HA   LEU  21           HA       LEU  21  -3.418  32.520  12.896
   32    HB2  LEU  21           HB1      LEU  21  -1.447  34.647  12.798
   33    HB3  LEU  21           HB2      LEU  21  -2.498  34.655  11.371
   34    HG   LEU  21           HG       LEU  21  -3.381  36.151  13.043
   35   HD11  LEU  21          HD11      LEU  21  -5.423  34.228  13.533
   36   HD12  LEU  21          HD12      LEU  21  -4.792  33.987  11.904
   37   HD13  LEU  21          HD13      LEU  21  -5.413  35.566  12.385
   38   HD21  LEU  21          HD21      LEU  21  -3.860  35.572  15.251
   39   HD22  LEU  21          HD22      LEU  21  -2.293  34.820  14.950
   40   HD23  LEU  21          HD23      LEU  21  -3.762  33.843  14.919
   41    H    ASP  22           H        ASP  22  -4.364  31.772  11.106
   42    HA   ASP  22           HA       ASP  22  -2.659  30.837   8.934
   43    HB2  ASP  22           HB1      ASP  22  -5.633  30.418   9.345
   44    HB3  ASP  22           HB2      ASP  22  -4.592  29.564   8.197
   45    HD2  ASP  22           HD       ASP  22  -4.974  27.932  11.602
   46    H    PHE  23           H        PHE  23  -4.227  30.880   6.757
   47    HA   PHE  23           HA       PHE  23  -5.597  33.285   6.242
   48    HB2  PHE  23           HB1      PHE  23  -2.717  33.456   6.157
   49    HB3  PHE  23           HB2      PHE  23  -3.389  33.743   4.550
   50    HD1  PHE  23           HD1      PHE  23  -2.257  35.418   7.259
   51    HD2  PHE  23           HD2      PHE  23  -5.733  35.227   4.809
   52    HE1  PHE  23           HE1      PHE  23  -2.825  37.727   7.890
   53    HE2  PHE  23           HE2      PHE  23  -6.306  37.536   5.435
   54    HZ   PHE  23           HZ       PHE  23  -4.851  38.789   6.976
   55    H    ASN  24           H        ASN  24  -6.296  33.466   4.047
   56    HA   ASN  24           HA       ASN  24  -5.717  31.119   2.373
   57    HB2  ASN  24           HB1      ASN  24  -8.117  31.056   1.717
   58    HB3  ASN  24           HB2      ASN  24  -7.852  30.685   3.426
   59   HD21  ASN  24          HD21      ASN  24  -9.694  32.426   1.323
   60   HD22  ASN  24          HD22      ASN  24 -10.322  33.613   2.410
   61    H    ASN  25           H        ASN  25  -7.066  34.394   2.496
   62    HA   ASN  25           HA       ASN  25  -7.044  36.111   1.005
   63    HB2  ASN  25           HB1      ASN  25  -4.539  34.776   0.717
   64    HB3  ASN  25           HB2      ASN  25  -5.088  35.258  -0.892
   65   HD21  ASN  25          HD21      ASN  25  -6.252  37.579  -0.664
   66   HD22  ASN  25          HD22      ASN  25  -5.216  38.771   0.036
   67    H    ILE  26           H        ILE  26  -9.010  35.894   0.033
   68    HA   ILE  26           HA       ILE  26  -9.600  33.931  -1.935
   69    HB   ILE  26           HB       ILE  26 -11.054  36.537  -1.490
   70   HG12  ILE  26          HG11      ILE  26 -12.409  34.385  -0.253
   71   HG13  ILE  26          HG12      ILE  26 -10.720  34.288   0.271
   72   HG21  ILE  26          HG21      ILE  26 -12.999  35.205  -2.305
   73   HG22  ILE  26          HG22      ILE  26 -11.742  35.466  -3.513
   74   HG23  ILE  26          HG23      ILE  26 -11.876  33.906  -2.703
   75   HD11  ILE  26          HD11      ILE  26 -11.617  37.004   0.403
   76   HD12  ILE  26          HD12      ILE  26 -12.716  35.949   1.293
   77   HD13  ILE  26          HD13      ILE  26 -10.997  35.962   1.684
   78    H    ARG  27           H        ARG  27  -9.180  33.913  -4.043
   79    HA   ARG  27           HA       ARG  27  -7.777  36.128  -5.244
   80    HB2  ARG  27           HB1      ARG  27  -7.558  34.678  -7.197
   81    HB3  ARG  27           HB2      ARG  27  -7.103  33.818  -5.717
   82    HG2  ARG  27           HG1      ARG  27  -8.993  32.472  -5.745
   83    HG3  ARG  27           HG2      ARG  27  -9.878  33.584  -6.803
   84    HD2  ARG  27           HD1      ARG  27  -7.438  32.624  -8.060
   85    HD3  ARG  27           HD2      ARG  27  -8.503  31.297  -7.574
   86    HE   ARG  27           HE       ARG  27 -10.049  33.238  -8.872
   87   HH11  ARG  27          HH11      ARG  27  -7.534  30.935  -9.569
   88   HH12  ARG  27          HH12      ARG  27  -8.017  30.709 -11.218
   89   HH21  ARG  27          HH21      ARG  27 -10.696  32.950 -11.040
   90   HH22  ARG  27          HH22      ARG  27  -9.815  31.857 -12.053
   91    H    SER  28           H        SER  28  -8.524  36.303  -7.785
   92    HA   SER  28           HA       SER  28 -11.078  37.657  -7.605
   93    HB2  SER  28           HB1      SER  28  -9.078  37.416  -9.874
   94    HB3  SER  28           HB2      SER  28 -10.550  38.399  -9.930
   95    HG   SER  28           HG       SER  28  -8.302  39.258  -9.132
   96    H    SER  29           H        SER  29 -12.967  36.876  -8.266
   97    HA   SER  29           HA       SER  29 -14.534  35.433  -9.071
   98    HB2  SER  29           HB1      SER  29 -12.484  35.330 -11.299
   99    HB3  SER  29           HB2      SER  29 -14.075  34.557 -11.407
  100    HG   SER  29           HG       SER  29 -14.814  36.431 -11.964
  101    H    ALA  30           H        ALA  30 -14.405  33.867  -7.464
  102    HA   ALA  30           HA       ALA  30 -13.626  31.269  -8.344
  103    HB1  ALA  30           HB1      ALA  30 -11.431  31.778  -7.737
  104    HB2  ALA  30           HB2      ALA  30 -11.936  32.665  -6.298
  105    HB3  ALA  30           HB3      ALA  30 -12.069  30.907  -6.342
  106    H    ASP  31           H        ASP  31 -15.798  30.832  -7.882
  107    HA   ASP  31           HA       ASP  31 -16.489  30.808  -5.017
  108    HB2  ASP  31           HB1      ASP  31 -17.960  31.682  -7.363
  109    HB3  ASP  31           HB2      ASP  31 -18.850  30.441  -6.470
  110    HD2  ASP  31           HD       ASP  31 -19.801  32.742  -4.141
  111    H    LEU  32           H        LEU  32 -17.451  29.087  -7.993
  112    HA   LEU  32           HA       LEU  32 -17.753  26.879  -8.443
  113    HB2  LEU  32           HB1      LEU  32 -15.363  27.014  -7.196
  114    HB3  LEU  32           HB2      LEU  32 -16.241  25.952  -6.084
  115    HG   LEU  32           HG       LEU  32 -16.482  25.162  -8.890
  116   HD11  LEU  32          HD11      LEU  32 -13.869  25.835  -7.822
  117   HD12  LEU  32          HD12      LEU  32 -14.346  25.418  -9.467
  118   HD13  LEU  32          HD13      LEU  32 -13.986  24.143  -8.303
  119   HD21  LEU  32          HD21      LEU  32 -15.980  23.908  -6.231
  120   HD22  LEU  32          HD22      LEU  32 -15.603  23.005  -7.698
  121   HD23  LEU  32          HD23      LEU  32 -17.248  23.577  -7.412
  122    H    HIS  33           H        HIS  33 -19.591  28.265  -6.701
  123    HA   HIS  33           HA       HIS  33 -21.421  27.843  -5.419
  124    HB2  HIS  33           HB1      HIS  33 -20.863  25.382  -6.856
  125    HB3  HIS  33           HB2      HIS  33 -21.630  25.056  -5.299
  126    HD1  HIS  33           HD1      HIS  33 -24.098  25.447  -5.114
  127    HD2  HIS  33           HD2      HIS  33 -22.476  27.099  -8.565
  128    HE1  HIS  33           HE1      HIS  33 -26.064  26.218  -6.479
  129    HE2  HIS  33           HE2      HIS  33 -25.076  27.229  -8.588
  130    H    GLY  34           H        GLY  34 -22.168  26.211  -3.510
  131    HA2  GLY  34           HA2      GLY  34 -19.941  26.327  -1.587
  132    HA3  GLY  34           HA3      GLY  34 -21.647  26.394  -1.171
  133    HA1  GLY  34           HA1      GLY  34 -19.937  25.759  -2.263
  134    H    ALA  35           H        ALA  35 -18.926  24.428  -1.419
  135    HA   ALA  35           HA       ALA  35 -20.430  22.128  -0.534
  136    HB1  ALA  35           HB1      ALA  35 -20.703  21.463  -2.700
  137    HB2  ALA  35           HB2      ALA  35 -19.230  22.266  -3.249
  138    HB3  ALA  35           HB3      ALA  35 -19.127  20.743  -2.364
  139    H    ARG  36           H        ARG  36 -19.285  21.038   0.937
  140    HA   ARG  36           HA       ARG  36 -16.437  21.678   1.207
  141    HB2  ARG  36           HB1      ARG  36 -18.248  20.301   3.201
  142    HB3  ARG  36           HB2      ARG  36 -16.628  20.951   3.500
  143    HG2  ARG  36           HG1      ARG  36 -17.777  23.201   2.679
  144    HG3  ARG  36           HG2      ARG  36 -19.223  22.361   3.266
  145    HD2  ARG  36           HD1      ARG  36 -17.261  21.951   5.236
  146    HD3  ARG  36           HD2      ARG  36 -17.126  23.649   4.759
  147    HE   ARG  36           HE       ARG  36 -19.835  22.858   5.223
  148   HH11  ARG  36          HH11      ARG  36 -16.889  23.888   6.765
  149   HH12  ARG  36          HH12      ARG  36 -17.690  24.542   8.155
  150   HH21  ARG  36          HH21      ARG  36 -20.902  23.715   7.047
  151   HH22  ARG  36          HH22      ARG  36 -19.974  24.442   8.314
  152    H    LYS  37           H        LYS  37 -18.564  18.842   1.622
  153    HA   LYS  37           HA       LYS  37 -18.233  16.623   1.248
  154    HB2  LYS  37           HB1      LYS  37 -17.253  17.974  -0.995
  155    HB3  LYS  37           HB2      LYS  37 -15.995  16.797  -0.589
  156    HG2  LYS  37           HG1      LYS  37 -17.772  15.025  -0.557
  157    HG3  LYS  37           HG2      LYS  37 -18.886  16.242  -1.204
  158    HD2  LYS  37           HD1      LYS  37 -16.892  16.555  -2.961
  159    HD3  LYS  37           HD2      LYS  37 -16.612  14.863  -2.515
  160    HE2  LYS  37           HE1      LYS  37 -19.397  15.125  -2.892
  161    HE3  LYS  37           HE2      LYS  37 -18.620  15.975  -4.236
  162    HZ1  LYS  37           HZ1      LYS  37 -17.171  13.726  -4.121
  163    HZ2  LYS  37           HZ2      LYS  37 -18.514  13.939  -5.127
  164    HZ3  LYS  37           HZ3      LYS  37 -18.686  13.147  -3.642
  165    H    GLY  38           H        GLY  38 -16.122  15.006   0.831
  166    HA2  GLY  38           HA2      GLY  38 -14.128  15.758   2.868
  167    HA3  GLY  38           HA3      GLY  38 -14.965  14.216   2.976
  168    HA1  GLY  38           HA1      GLY  38 -14.132  15.912   2.000
  169    H    SER  39           H        SER  39 -13.720  12.596   2.352
  170    HA   SER  39           HA       SER  39 -12.186  12.852  -0.124
  171    HB2  SER  39           HB1      SER  39 -10.444  11.387   1.416
  172    HB3  SER  39           HB2      SER  39 -10.285  13.117   1.069
  173    HG   SER  39           HG       SER  39 -10.311  13.201   3.192
  174    H    GLN  40           H        GLN  40 -11.987  10.972  -1.280
  175    HA   GLN  40           HA       GLN  40 -13.863   8.919  -0.766
  176    HB2  GLN  40           HB1      GLN  40 -12.830   7.776  -2.704
  177    HB3  GLN  40           HB2      GLN  40 -13.237   9.467  -3.036
  178    HG2  GLN  40           HG1      GLN  40 -11.142   9.962  -3.556
  179    HG3  GLN  40           HG2      GLN  40 -10.546   9.256  -2.046
  180   HE21  GLN  40          HE21      GLN  40  -9.832   9.162  -5.060
  181   HE22  GLN  40          HE22      GLN  40  -9.505   7.488  -5.323
  182    H    CYS  41           H        CYS  41 -10.523   9.343   0.057
  183    HA   CYS  41           HA       CYS  41 -10.523   6.666   1.286
  184    HB2  CYS  41           HB1      CYS  41  -8.147   6.458   0.834
  185    HB3  CYS  41           HB2      CYS  41  -9.023   6.729  -0.674
  186    H    LEU  42           H        LEU  42  -9.294   6.455   3.234
  187    HA   LEU  42           HA       LEU  42  -9.027   9.004   4.678
  188    HB2  LEU  42           HB1      LEU  42 -10.673   7.102   5.385
  189    HB3  LEU  42           HB2      LEU  42  -9.206   6.347   6.033
  190    HG   LEU  42           HG       LEU  42  -9.804   9.152   6.831
  191   HD11  LEU  42          HD11      LEU  42 -11.467   8.645   8.327
  192   HD12  LEU  42          HD12      LEU  42 -11.056   6.932   8.376
  193   HD13  LEU  42          HD13      LEU  42 -11.903   7.596   6.978
  194   HD21  LEU  42          HD21      LEU  42  -7.959   7.161   7.533
  195   HD22  LEU  42          HD22      LEU  42  -9.055   7.314   8.907
  196   HD23  LEU  42          HD23      LEU  42  -8.195   8.731   8.301
  197    H    SER  43           H        SER  43  -7.396   6.101   3.709
  198    HA   SER  43           HA       SER  43  -4.862   7.223   4.552
  199    HB2  SER  43           HB1      SER  43  -6.017   5.653   6.399
  200    HB3  SER  43           HB2      SER  43  -5.241   4.401   5.413
  201    HG   SER  43           HG       SER  43  -4.119   6.077   7.184
  202    H    ASP  44           H        ASP  44  -3.050   5.560   3.952
  203    HA   ASP  44           HA       ASP  44  -3.213   5.129   1.174
  204    HB2  ASP  44           HB1      ASP  44  -1.008   4.367   1.286
  205    HB3  ASP  44           HB2      ASP  44  -1.129   5.453   2.676
  206    HD2  ASP  44           HD       ASP  44  -0.527   2.915   4.903
  207    H    THR  45           H        THR  45  -4.004   3.135   3.892
  208    HA   THR  45           HA       THR  45  -3.937   0.633   2.513
  209    HB   THR  45           HB       THR  45  -5.218  -0.228   4.464
  210    HG1  THR  45           HG1      THR  45  -4.930   2.296   5.686
  211   HG21  THR  45          HG21      THR  45  -2.832  -0.259   4.630
  212   HG22  THR  45          HG22      THR  45  -3.462   0.309   6.177
  213   HG23  THR  45          HG23      THR  45  -2.781   1.458   5.025
  214    H    ASP  46           H        ASP  46  -6.247   3.191   2.843
  215    HA   ASP  46           HA       ASP  46  -8.584   1.711   2.209
  216    HB2  ASP  46           HB1      ASP  46  -8.609   3.944   3.293
  217    HB3  ASP  46           HB2      ASP  46  -8.047   4.656   1.775
  218    HD2  ASP  46           HD       ASP  46 -11.188   4.523   0.363
  219    H    CYS  47           H        CYS  47  -6.034   3.112   0.312
  220    HA   CYS  47           HA       CYS  47  -7.248   3.396  -2.164
  221    HB2  CYS  47           HB1      CYS  47  -4.538   3.151  -1.139
  222    HB3  CYS  47           HB2      CYS  47  -4.703   2.390  -2.723
  223    H    ASN  48           H        ASN  48  -5.253   0.588  -1.229
  224    HA   ASN  48           HA       ASN  48  -7.170  -1.326  -2.066
  225    HB2  ASN  48           HB1      ASN  48  -5.350  -0.257  -4.089
  226    HB3  ASN  48           HB2      ASN  48  -5.228  -2.014  -3.923
  227   HD21  ASN  48          HD21      ASN  48  -7.404  -3.148  -3.803
  228   HD22  ASN  48          HD22      ASN  48  -8.597  -2.625  -4.938
  229    H    THR  49           H        THR  49  -3.642  -1.286  -2.503
  230    HA   THR  49           HA       THR  49  -3.180  -2.748  -0.068
  231    HB   THR  49           HB       THR  49  -2.666  -4.159  -2.693
  232    HG1  THR  49           HG1      THR  49  -4.710  -4.350  -0.766
  233   HG21  THR  49          HG21      THR  49  -2.147  -6.080  -1.130
  234   HG22  THR  49          HG22      THR  49  -2.117  -4.896   0.177
  235   HG23  THR  49          HG23      THR  49  -0.965  -4.771  -1.153
  236    H    ARG  50           H        ARG  50  -1.560  -2.592  -3.242
  237    HA   ARG  50           HA       ARG  50   0.851  -1.622  -1.886
  238    HB2  ARG  50           HB1      ARG  50   0.538  -2.609  -4.730
  239    HB3  ARG  50           HB2      ARG  50   2.057  -2.285  -3.880
  240    HG2  ARG  50           HG1      ARG  50   1.478  -4.091  -2.263
  241    HG3  ARG  50           HG2      ARG  50   0.078  -4.470  -3.279
  242    HD2  ARG  50           HD1      ARG  50   2.712  -4.307  -4.642
  243    HD3  ARG  50           HD2      ARG  50   2.447  -5.679  -3.557
  244    HE   ARG  50           HE       ARG  50   0.298  -5.252  -5.419
  245   HH11  ARG  50          HH11      ARG  50   3.393  -6.762  -4.909
  246   HH12  ARG  50          HH12      ARG  50   3.142  -7.982  -6.113
  247   HH21  ARG  50          HH21      ARG  50  -0.044  -6.853  -7.007
  248   HH22  ARG  50          HH22      ARG  50   1.188  -8.032  -7.307
  249    H    LYS  51           H        LYS  51  -1.426   0.112  -2.375
  250    HA   LYS  51           HA       LYS  51  -0.093   2.099  -4.089
  251    HB2  LYS  51           HB1      LYS  51  -3.005   1.318  -4.031
  252    HB3  LYS  51           HB2      LYS  51  -2.473   2.894  -4.641
  253    HG2  LYS  51           HG1      LYS  51  -0.936   1.606  -6.211
  254    HG3  LYS  51           HG2      LYS  51  -1.876   0.174  -5.755
  255    HD2  LYS  51           HD1      LYS  51  -3.939   1.277  -6.506
  256    HD3  LYS  51           HD2      LYS  51  -2.994   2.702  -6.970
  257    HE2  LYS  51           HE1      LYS  51  -1.643   1.146  -8.474
  258    HE3  LYS  51           HE2      LYS  51  -2.910  -0.052  -8.176
  259    HZ1  LYS  51           HZ1      LYS  51  -3.483   1.041 -10.161
  260    HZ2  LYS  51           HZ2      LYS  51  -3.184   2.575  -9.515
  261    HZ3  LYS  51           HZ3      LYS  51  -4.520   1.680  -8.987
  262    H    PHE  52           H        PHE  52  -0.550   4.317  -3.551
  263    HA   PHE  52           HA       PHE  52  -1.470   4.672  -0.774
  264    HB2  PHE  52           HB1      PHE  52   0.176   6.496  -0.545
  265    HB3  PHE  52           HB2      PHE  52   0.947   4.943  -0.878
  266    HD1  PHE  52           HD1      PHE  52   1.852   4.449  -3.129
  267    HD2  PHE  52           HD2      PHE  52   0.402   8.308  -2.070
  268    HE1  PHE  52           HE1      PHE  52   3.039   5.420  -5.054
  269    HE2  PHE  52           HE2      PHE  52   1.585   9.285  -3.993
  270    HZ   PHE  52           HZ       PHE  52   2.904   7.840  -5.488
  271    H    CYS  53           H        CYS  53  -2.320   6.815  -0.273
  272    HA   CYS  53           HA       CYS  53  -3.797   7.903  -2.560
  273    HB2  CYS  53           HB1      CYS  53  -4.506   7.274   0.122
  274    HB3  CYS  53           HB2      CYS  53  -4.651   9.022  -0.067
  275    H    LEU  54           H        LEU  54  -2.859   9.595  -3.493
  276    HA   LEU  54           HA       LEU  54  -1.251  11.435  -1.887
  277    HB2  LEU  54           HB1      LEU  54  -0.170  10.646  -3.866
  278    HB3  LEU  54           HB2      LEU  54  -1.577  11.067  -4.857
  279    HG   LEU  54           HG       LEU  54  -0.762  13.470  -3.674
  280   HD11  LEU  54          HD11      LEU  54   1.358  12.654  -3.040
  281   HD12  LEU  54          HD12      LEU  54   1.613  13.554  -4.534
  282   HD13  LEU  54          HD13      LEU  54   1.568  11.792  -4.564
  283   HD21  LEU  54          HD21      LEU  54  -0.099  12.494  -6.444
  284   HD22  LEU  54          HD22      LEU  54  -0.372  14.155  -5.917
  285   HD23  LEU  54          HD23      LEU  54  -1.713  13.008  -5.951
  286    H    GLN  55           H        GLN  55  -2.018  13.328  -1.233
  287    HA   GLN  55           HA       GLN  55  -4.469  14.354  -2.497
  288    HB2  GLN  55           HB1      GLN  55  -4.907  13.902  -0.216
  289    HB3  GLN  55           HB2      GLN  55  -3.378  14.634   0.297
  290    HG2  GLN  55           HG1      GLN  55  -4.267  16.667   0.443
  291    HG3  GLN  55           HG2      GLN  55  -5.063  16.511  -1.129
  292   HE21  GLN  55          HE21      GLN  55  -6.847  17.628  -0.184
  293   HE22  GLN  55          HE22      GLN  55  -7.989  16.778   0.795
  294    HA   PRO  56           HA       PRO  56  -1.297  17.364  -3.854
  295    HB2  PRO  56           HB1      PRO  56  -2.585  17.989  -6.189
  296    HB3  PRO  56           HB2      PRO  56  -1.523  16.592  -6.006
  297    HG2  PRO  56           HG1      PRO  56  -4.513  16.740  -5.846
  298    HG3  PRO  56           HG2      PRO  56  -3.476  15.543  -6.706
  299    HD2  PRO  56           HD1      PRO  56  -4.645  15.015  -4.314
  300    HD3  PRO  56           HD2      PRO  56  -3.062  14.361  -4.771
  301    H    ARG  57           H        ARG  57  -1.370  19.623  -3.941
  302    HA   ARG  57           HA       ARG  57  -3.641  20.805  -2.604
  303    HB2  ARG  57           HB1      ARG  57  -0.843  21.438  -2.995
  304    HB3  ARG  57           HB2      ARG  57  -1.864  22.841  -3.343
  305    HG2  ARG  57           HG1      ARG  57  -2.490  23.115  -1.193
  306    HG3  ARG  57           HG2      ARG  57  -2.505  21.372  -0.872
  307    HD2  ARG  57           HD1      ARG  57  -0.449  21.431  -0.001
  308    HD3  ARG  57           HD2      ARG  57   0.174  22.282  -1.420
  309    HE   ARG  57           HE       ARG  57   0.134  24.209  -0.208
  310   HH11  ARG  57          HH11      ARG  57  -2.066  21.940   1.253
  311   HH12  ARG  57          HH12      ARG  57  -2.431  22.963   2.602
  312   HH21  ARG  57          HH21      ARG  57  -0.338  25.565   1.565
  313   HH22  ARG  57          HH22      ARG  57  -1.448  25.025   2.779
  314    H    ASP  58           H        ASP  58  -2.013  21.139  -5.736
  315    HA   ASP  58           HA       ASP  58  -3.861  23.108  -6.699
  316    HB2  ASP  58           HB1      ASP  58  -1.441  21.766  -7.668
  317    HB3  ASP  58           HB2      ASP  58  -2.640  22.050  -8.937
  318    HD2  ASP  58           HD       ASP  58  -2.394  25.573  -8.378
  319    H    GLU  59           H        GLU  59  -3.754  19.665  -6.599
  320    HA   GLU  59           HA       GLU  59  -6.107  19.543  -8.370
  321    HB2  GLU  59           HB1      GLU  59  -3.836  17.611  -7.957
  322    HB3  GLU  59           HB2      GLU  59  -5.398  17.066  -8.589
  323    HG2  GLU  59           HG1      GLU  59  -4.243  19.421  -9.933
  324    HG3  GLU  59           HG2      GLU  59  -3.352  17.904 -10.127
  325    HE2  GLU  59           HE       GLU  59  -6.961  18.163 -11.759
  326    H    LYS  60           H        LYS  60  -7.253  17.261  -7.861
  327    HA   LYS  60           HA       LYS  60  -8.087  17.498  -5.078
  328    HB2  LYS  60           HB1      LYS  60  -9.281  16.498  -7.588
  329    HB3  LYS  60           HB2      LYS  60  -9.702  15.579  -6.134
  330    HG2  LYS  60           HG1      LYS  60 -10.222  17.935  -5.129
  331    HG3  LYS  60           HG2      LYS  60 -10.334  18.406  -6.834
  332    HD2  LYS  60           HD1      LYS  60 -12.215  17.165  -7.213
  333    HD3  LYS  60           HD2      LYS  60 -11.774  15.947  -6.002
  334    HE2  LYS  60           HE1      LYS  60 -12.397  17.430  -4.194
  335    HE3  LYS  60           HE2      LYS  60 -12.695  18.742  -5.343
  336    HZ1  LYS  60           HZ1      LYS  60 -14.347  17.007  -6.354
  337    HZ2  LYS  60           HZ2      LYS  60 -14.800  17.966  -5.038
  338    HZ3  LYS  60           HZ3      LYS  60 -14.315  16.365  -4.789
  339    HA   PRO  61           HA       PRO  61  -6.180  13.837  -3.595
  340    HB2  PRO  61           HB1      PRO  61  -8.113  12.778  -1.969
  341    HB3  PRO  61           HB2      PRO  61  -7.200  14.234  -1.574
  342    HG2  PRO  61           HG1      PRO  61  -9.927  13.968  -2.794
  343    HG3  PRO  61           HG2      PRO  61  -9.372  15.057  -1.470
  344    HD2  PRO  61           HD1      PRO  61  -9.709  15.912  -4.024
  345    HD3  PRO  61           HD2      PRO  61  -8.450  16.558  -2.956
  346    H    PHE  62           H        PHE  62  -5.768  11.981  -4.601
  347    HA   PHE  62           HA       PHE  62  -7.955  10.212  -5.357
  348    HB2  PHE  62           HB1      PHE  62  -7.285   9.965  -7.636
  349    HB3  PHE  62           HB2      PHE  62  -7.459  11.694  -7.329
  350    HD1  PHE  62           HD1      PHE  62  -5.245   9.108  -8.417
  351    HD2  PHE  62           HD2      PHE  62  -5.387  13.066  -6.861
  352    HE1  PHE  62           HE1      PHE  62  -2.951   9.499  -9.215
  353    HE2  PHE  62           HE2      PHE  62  -3.093  13.465  -7.657
  354    HZ   PHE  62           HZ       PHE  62  -1.872  11.680  -8.836
  355    H    CYS  63           H        CYS  63  -6.993   8.109  -6.306
  356    HA   CYS  63           HA       CYS  63  -4.944   7.227  -4.448
  357    HB2  CYS  63           HB1      CYS  63  -7.050   5.924  -4.863
  358    HB3  CYS  63           HB2      CYS  63  -6.460   5.598  -6.494
  359    H    ALA  64           H        ALA  64  -2.866   7.073  -4.948
  360    HA   ALA  64           HA       ALA  64  -2.087   7.180  -7.779
  361    HB1  ALA  64           HB1      ALA  64   0.223   7.663  -6.598
  362    HB2  ALA  64           HB2      ALA  64  -0.979   8.934  -6.823
  363    HB3  ALA  64           HB3      ALA  64  -0.827   8.133  -5.261
  364    H    THR  65           H        THR  65  -0.233   5.902  -8.463
  365    HA   THR  65           HA       THR  65  -0.252   3.264  -7.180
  366    HB   THR  65           HB       THR  65  -0.834   3.361  -9.585
  367    HG1  THR  65           HG1      THR  65   0.044   1.444  -9.641
  368   HG21  THR  65          HG21      THR  65   0.590   5.247 -10.229
  369   HG22  THR  65          HG22      THR  65   0.916   3.834 -11.233
  370   HG23  THR  65          HG23      THR  65   2.026   4.269  -9.933
  371    H    CYS  66           H        CYS  66   1.892   2.034  -7.464
  372    HA   CYS  66           HA       CYS  66   3.877   3.387  -5.968
  373    HB2  CYS  66           HB1      CYS  66   3.626   1.005  -5.739
  374    HB3  CYS  66           HB2      CYS  66   3.931   0.759  -7.460
  375    H    ARG  67           H        ARG  67   5.728   4.389  -6.554
  376    HA   ARG  67           HA       ARG  67   6.070   4.969  -9.391
  377    HB2  ARG  67           HB1      ARG  67   7.276   6.155  -6.887
  378    HB3  ARG  67           HB2      ARG  67   7.770   6.630  -8.518
  379    HG2  ARG  67           HG1      ARG  67   6.020   7.979  -8.774
  380    HG3  ARG  67           HG2      ARG  67   4.896   6.740  -8.195
  381    HD2  ARG  67           HD1      ARG  67   4.796   7.626  -6.135
  382    HD3  ARG  67           HD2      ARG  67   6.552   7.837  -6.067
  383    HE   ARG  67           HE       ARG  67   6.268  10.023  -6.658
  384   HH11  ARG  67          HH11      ARG  67   3.387   8.255  -7.486
  385   HH12  ARG  67          HH12      ARG  67   2.493   9.668  -7.941
  386   HH21  ARG  67          HH21      ARG  67   5.103  11.891  -7.255
  387   HH22  ARG  67          HH22      ARG  67   3.471  11.736  -7.810
  388    H    GLY  68           H        GLY  68   8.644   5.427  -9.783
  389    HA2  GLY  68           HA2      GLY  68   9.822   2.759  -9.522
  390    HA3  GLY  68           HA3      GLY  68  10.331   4.010 -10.646
  391    HA1  GLY  68           HA1      GLY  68   9.646   3.225  -8.794
  392    H    LEU  69           H        LEU  69  12.490   3.368  -9.863
  393    HA   LEU  69           HA       LEU  69  13.178   4.206  -7.170
  394    HB2  LEU  69           HB1      LEU  69  14.837   3.066  -9.425
  395    HB3  LEU  69           HB2      LEU  69  15.465   3.467  -7.816
  396    HG   LEU  69           HG       LEU  69  13.457   1.322  -8.497
  397   HD11  LEU  69          HD11      LEU  69  15.713   0.440  -7.005
  398   HD12  LEU  69          HD12      LEU  69  16.282   1.353  -8.401
  399   HD13  LEU  69          HD13      LEU  69  15.209  -0.026  -8.629
  400   HD21  LEU  69          HD21      LEU  69  14.223   2.577  -5.912
  401   HD22  LEU  69          HD22      LEU  69  13.953   0.834  -5.952
  402   HD23  LEU  69          HD23      LEU  69  12.668   1.938  -6.444
  403    H    ARG  70           H        ARG  70  13.283   5.437 -10.395
  404    HA   ARG  70           HA       ARG  70  15.251   7.471  -9.825
  405    HB2  ARG  70           HB1      ARG  70  13.391   7.184 -12.196
  406    HB3  ARG  70           HB2      ARG  70  14.793   8.260 -12.090
  407    HG2  ARG  70           HG1      ARG  70  15.777   6.570 -13.228
  408    HG3  ARG  70           HG2      ARG  70  16.026   5.959 -11.584
  409    HD2  ARG  70           HD1      ARG  70  14.438   4.318 -11.789
  410    HD3  ARG  70           HD2      ARG  70  13.482   5.256 -12.943
  411    HE   ARG  70           HE       ARG  70  16.016   4.400 -13.991
  412   HH11  ARG  70          HH11      ARG  70  12.691   3.512 -13.463
  413   HH12  ARG  70          HH12      ARG  70  12.662   2.348 -14.747
  414   HH21  ARG  70          HH21      ARG  70  15.991   2.870 -15.683
  415   HH22  ARG  70          HH22      ARG  70  14.540   1.983 -16.008
  416    H    ARG  71           H        ARG  71  11.810   7.129  -9.686
  417    HA   ARG  71           HA       ARG  71  10.982   9.781  -9.895
  418    HB2  ARG  71           HB1      ARG  71   9.875   7.273  -8.986
  419    HB3  ARG  71           HB2      ARG  71   9.366   8.595  -7.925
  420    HG2  ARG  71           HG1      ARG  71   7.751   8.226  -9.715
  421    HG3  ARG  71           HG2      ARG  71   8.500   9.828  -9.835
  422    HD2  ARG  71           HD1      ARG  71   9.950   9.104 -11.609
  423    HD3  ARG  71           HD2      ARG  71   9.436   7.425 -11.393
  424    HE   ARG  71           HE       ARG  71   7.154   8.898 -11.959
  425   HH11  ARG  71          HH11      ARG  71  10.154   8.066 -13.517
  426   HH12  ARG  71          HH12      ARG  71   9.492   8.131 -15.117
  427   HH21  ARG  71          HH21      ARG  71   6.270   8.985 -14.061
  428   HH22  ARG  71          HH22      ARG  71   7.283   8.654 -15.425
  429    H    ARG  72           H        ARG  72  11.111  11.516  -8.608
  430    HA   ARG  72           HA       ARG  72  12.715  11.361  -6.221
  431    HB2  ARG  72           HB1      ARG  72  12.349  13.835  -6.137
  432    HB3  ARG  72           HB2      ARG  72  13.059  13.253  -7.650
  433    HG2  ARG  72           HG1      ARG  72  10.134  13.382  -7.703
  434    HG3  ARG  72           HG2      ARG  72  10.929  14.946  -7.451
  435    HD2  ARG  72           HD1      ARG  72  12.473  13.940  -9.436
  436    HD3  ARG  72           HD2      ARG  72  10.919  13.186  -9.815
  437    HE   ARG  72           HE       ARG  72  10.260  15.782  -9.431
  438   HH11  ARG  72          HH11      ARG  72  12.644  14.181 -11.398
  439   HH12  ARG  72          HH12      ARG  72  12.625  15.392 -12.638
  440   HH21  ARG  72          HH21      ARG  72  10.225  17.383 -11.055
  441   HH22  ARG  72          HH22      ARG  72  11.248  17.213 -12.440
  442    H    CYS  73           H        CYS  73  12.066  11.524  -4.138
  443    HA   CYS  73           HA       CYS  73   9.208  11.974  -3.613
  444    HB2  CYS  73           HB1      CYS  73   9.118  10.167  -2.045
  445    HB3  CYS  73           HB2      CYS  73   9.776   9.532  -3.554
  446    H    GLN  74           H        GLN  74   8.748  12.578  -1.361
  447    HA   GLN  74           HA       GLN  74  11.006  14.052  -0.173
  448    HB2  GLN  74           HB1      GLN  74   8.168  14.779  -0.664
  449    HB3  GLN  74           HB2      GLN  74   8.887  15.343   0.854
  450    HG2  GLN  74           HG1      GLN  74  10.807  16.232  -0.604
  451    HG3  GLN  74           HG2      GLN  74   9.683  16.006  -1.953
  452   HE21  GLN  74          HE21      GLN  74   8.910  17.907  -2.516
  453   HE22  GLN  74          HE22      GLN  74   8.316  19.123  -1.443
  454    H    ARG  75           H        ARG  75   8.409  11.823   0.360
  455    HA   ARG  75           HA       ARG  75   9.421  11.317   3.050
  456    HB2  ARG  75           HB1      ARG  75   7.058  11.173   3.914
  457    HB3  ARG  75           HB2      ARG  75   7.631  12.807   3.548
  458    HG2  ARG  75           HG1      ARG  75   6.359  11.646   1.234
  459    HG3  ARG  75           HG2      ARG  75   5.290  11.592   2.645
  460    HD2  ARG  75           HD1      ARG  75   6.250  14.103   2.896
  461    HD3  ARG  75           HD2      ARG  75   6.327  13.909   1.139
  462    HE   ARG  75           HE       ARG  75   3.805  13.105   2.234
  463   HH11  ARG  75          HH11      ARG  75   5.691  15.824   1.150
  464   HH12  ARG  75          HH12      ARG  75   4.310  16.799   0.774
  465   HH21  ARG  75          HH21      ARG  75   1.978  14.380   1.743
  466   HH22  ARG  75          HH22      ARG  75   2.198  15.978   1.114
  467    H    ASP  76           H        ASP  76   8.960   9.223   3.838
  468    HA   ASP  76           HA       ASP  76   9.030   7.172   1.965
  469    HB2  ASP  76           HB1      ASP  76   9.813   6.866   4.251
  470    HB3  ASP  76           HB2      ASP  76   8.166   7.067   4.862
  471    HD2  ASP  76           HD       ASP  76   8.156   3.609   4.751
  472    H    ALA  77           H        ALA  77   6.327   8.850   3.331
  473    HA   ALA  77           HA       ALA  77   4.343   6.894   2.724
  474    HB1  ALA  77           HB1      ALA  77   2.830   8.360   3.595
  475    HB2  ALA  77           HB2      ALA  77   4.304   9.002   4.322
  476    HB3  ALA  77           HB3      ALA  77   3.622   9.770   2.889
  477    H    MET  78           H        MET  78   5.790   9.570   0.986
  478    HA   MET  78           HA       MET  78   3.893   9.763  -1.092
  479    HB2  MET  78           HB1      MET  78   6.658  10.696  -0.604
  480    HB3  MET  78           HB2      MET  78   6.185  10.554  -2.303
  481    HG2  MET  78           HG1      MET  78   4.026  11.849  -1.298
  482    HG3  MET  78           HG2      MET  78   5.309  12.464  -0.253
  483    HE1  MET  78           HE1      MET  78   4.108  11.796  -3.750
  484    HE2  MET  78           HE2      MET  78   4.883  13.007  -4.770
  485    HE3  MET  78           HE3      MET  78   5.778  11.570  -4.272
  486    H    CYS  79           H        CYS  79   6.650   7.666  -0.575
  487    HA   CYS  79           HA       CYS  79   6.337   6.495  -3.237
  488    HB2  CYS  79           HB1      CYS  79   8.594   7.114  -1.996
  489    HB3  CYS  79           HB2      CYS  79   8.368   5.520  -1.273
  490    H    CYS  80           H        CYS  80   5.803   4.354  -3.581
  491    HA   CYS  80           HA       CYS  80   3.914   3.169  -1.959
  492    HB2  CYS  80           HB1      CYS  80   4.454   1.042  -3.215
  493    HB3  CYS  80           HB2      CYS  80   4.078   2.444  -4.216
  494    HA   PRO  81           HA       PRO  81   5.983   1.198   1.370
  495    HB2  PRO  81           HB1      PRO  81   4.464  -1.058   1.700
  496    HB3  PRO  81           HB2      PRO  81   3.911   0.560   2.131
  497    HG2  PRO  81           HG1      PRO  81   3.384  -1.031  -0.357
  498    HG3  PRO  81           HG2      PRO  81   2.233  -0.078   0.651
  499    HD2  PRO  81           HD1      PRO  81   3.249   0.852  -1.688
  500    HD3  PRO  81           HD2      PRO  81   2.881   1.911  -0.317
  501    H    GLY  82           H        GLY  82   7.941   0.305   1.199
  502    HA2  GLY  82           HA2      GLY  82   8.795  -2.135   1.005
  503    HA3  GLY  82           HA3      GLY  82   8.330  -1.925  -0.676
  504    HA1  GLY  82           HA1      GLY  82   8.973  -1.307   1.253
  505    H    THR  83           H        THR  83   9.181   1.007  -0.325
  506    HA   THR  83           HA       THR  83  12.068   0.517  -0.669
  507    HB   THR  83           HB       THR  83  11.955   2.683  -2.065
  508    HG1  THR  83           HG1      THR  83   9.240   1.879  -2.340
  509   HG21  THR  83          HG21      THR  83  10.543   0.897  -3.779
  510   HG22  THR  83          HG22      THR  83  11.587  -0.052  -2.720
  511   HG23  THR  83          HG23      THR  83  12.275   1.227  -3.720
  512    H    LEU  84           H        LEU  84  13.335   2.671  -0.417
  513    HA   LEU  84           HA       LEU  84  12.325   4.081   1.965
  514    HB2  LEU  84           HB1      LEU  84  14.321   2.371   2.139
  515    HB3  LEU  84           HB2      LEU  84  15.248   3.736   1.492
  516    HG   LEU  84           HG       LEU  84  14.258   5.071   3.463
  517   HD11  LEU  84          HD11      LEU  84  12.568   3.474   4.134
  518   HD12  LEU  84          HD12      LEU  84  13.739   3.697   5.433
  519   HD13  LEU  84          HD13      LEU  84  13.804   2.251   4.427
  520   HD21  LEU  84          HD21      LEU  84  16.055   4.305   4.938
  521   HD22  LEU  84          HD22      LEU  84  16.608   4.466   3.271
  522   HD23  LEU  84          HD23      LEU  84  16.264   2.868   3.937
  523    H    CYS  85           H        CYS  85  12.390   6.253   1.934
  524    HA   CYS  85           HA       CYS  85  13.053   7.573  -0.528
  525    HB2  CYS  85           HB1      CYS  85  11.708   8.266   2.008
  526    HB3  CYS  85           HB2      CYS  85  12.566   9.600   1.233
  527    H    VAL  86           H        VAL  86  15.215   7.588  -0.919
  528    HA   VAL  86           HA       VAL  86  16.937   8.833   1.125
  529    HB   VAL  86           HB       VAL  86  17.751   6.939  -1.084
  530   HG11  VAL  86          HG11      VAL  86  19.275   8.579   0.873
  531   HG12  VAL  86          HG12      VAL  86  19.882   6.971   0.475
  532   HG13  VAL  86          HG13      VAL  86  19.655   8.171  -0.799
  533   HG21  VAL  86          HG21      VAL  86  18.287   6.093   1.633
  534   HG22  VAL  86          HG22      VAL  86  16.564   6.352   1.357
  535   HG23  VAL  86          HG23      VAL  86  17.464   5.238   0.328
  536    H    ASN  87           H        ASN  87  18.118  10.596   0.596
  537    HA   ASN  87           HA       ASN  87  18.680  12.498  -0.525
  538    HB2  ASN  87           HB1      ASN  87  19.829  10.411  -1.818
  539    HB3  ASN  87           HB2      ASN  87  18.883  11.113  -3.134
  540   HD21  ASN  87          HD21      ASN  87  21.442  11.686  -0.837
  541   HD22  ASN  87          HD22      ASN  87  22.124  13.055  -1.640
  542    H    ASP  88           H        ASP  88  15.881  11.916  -0.365
  543    HA   ASP  88           HA       ASP  88  13.901  12.730  -1.132
  544    HB2  ASP  88           HB1      ASP  88  15.376  14.369  -3.182
  545    HB3  ASP  88           HB2      ASP  88  13.894  14.762  -2.298
  546    HD2  ASP  88           HD       ASP  88  17.325  15.775  -0.727
  547    H    VAL  89           H        VAL  89  15.078  10.361  -2.316
  548    HA   VAL  89           HA       VAL  89  13.432  10.260  -4.718
  549    HB   VAL  89           HB       VAL  89  16.332   9.408  -4.768
  550   HG11  VAL  89          HG11      VAL  89  14.918   7.952  -6.100
  551   HG12  VAL  89          HG12      VAL  89  14.209   9.350  -6.911
  552   HG13  VAL  89          HG13      VAL  89  15.913   8.962  -7.147
  553   HG21  VAL  89          HG21      VAL  89  14.955  11.693  -6.178
  554   HG22  VAL  89          HG22      VAL  89  16.096  11.839  -4.840
  555   HG23  VAL  89          HG23      VAL  89  16.637  11.207  -6.396
  556    H    CYS  90           H        CYS  90  12.676   8.208  -5.218
  557    HA   CYS  90           HA       CYS  90  12.436   6.393  -3.078
  558    HB2  CYS  90           HB1      CYS  90  11.805   6.167  -6.023
  559    HB3  CYS  90           HB2      CYS  90  11.466   4.866  -4.881
  560    H    THR  91           H        THR  91  14.143   5.322  -2.301
  561    HA   THR  91           HA       THR  91  15.914   3.957  -4.223
  562    HB   THR  91           HB       THR  91  16.578   4.939  -1.441
  563    HG1  THR  91           HG1      THR  91  17.398   5.795  -4.034
  564   HG21  THR  91          HG21      THR  91  17.877   3.017  -1.691
  565   HG22  THR  91          HG22      THR  91  18.943   4.300  -2.264
  566   HG23  THR  91          HG23      THR  91  18.096   3.275  -3.421
  567    H    THR  92           H        THR  92  15.827   1.815  -4.216
  568    HA   THR  92           HA       THR  92  14.126   0.284  -2.676
  569    HB   THR  92           HB       THR  92  16.183  -1.481  -3.275
  570    HG1  THR  92           HG1      THR  92  16.696  -0.789  -5.478
  571   HG21  THR  92          HG21      THR  92  14.250  -2.319  -4.054
  572   HG22  THR  92          HG22      THR  92  14.645  -1.467  -5.547
  573   HG23  THR  92          HG23      THR  92  13.576  -0.719  -4.361
  574    H    MET  93           H        MET  93  14.454  -1.189  -0.951
  575    HA   MET  93           HA       MET  93  16.092  -0.161   1.143
  576    HB2  MET  93           HB1      MET  93  13.827  -1.706   1.026
  577    HB3  MET  93           HB2      MET  93  15.060  -2.885   1.502
  578    HG2  MET  93           HG1      MET  93  15.632  -1.643   3.453
  579    HG3  MET  93           HG2      MET  93  14.655  -0.271   2.923
  580    HE1  MET  93           HE1      MET  93  13.857  -0.538   5.586
  581    HE2  MET  93           HE2      MET  93  12.927  -1.923   6.155
  582    HE3  MET  93           HE3      MET  93  14.638  -2.109   5.772
  583    H    GLU  94           H        GLU  94  16.341  -2.861  -1.092
  584    HA   GLU  94           HA       GLU  94  18.505  -4.167   0.182
  585    HB2  GLU  94           HB1      GLU  94  17.713  -4.194  -2.741
  586    HB3  GLU  94           HB2      GLU  94  18.788  -5.355  -1.944
  587    HG2  GLU  94           HG1      GLU  94  16.676  -5.663  -0.363
  588    HG3  GLU  94           HG2      GLU  94  15.839  -5.104  -1.819
  589    HE2  GLU  94           HE       GLU  94  17.036  -7.992  -3.580
  590    H    ASP  95           H        ASP  95  18.291  -1.512  -2.077
  591    HA   ASP  95           HA       ASP  95  21.097  -1.506  -2.709
  592    HB2  ASP  95           HB1      ASP  95  19.498  -0.673  -4.344
  593    HB3  ASP  95           HB2      ASP  95  18.936   0.554  -3.199
  594    HD2  ASP  95           HD       ASP  95  22.168   1.279  -5.294
  595    H    ALA  96           H        ALA  96  18.947   0.541  -0.749
  596    HA   ALA  96           HA       ALA  96  20.825   2.370   0.162
  597    HB1  ALA  96           HB1      ALA  96  18.139   1.626   0.821
  598    HB2  ALA  96           HB2      ALA  96  19.057   1.917   2.299
  599    HB3  ALA  96           HB3      ALA  96  18.960   3.168   1.060
  600    H    THR  97           H        THR  97  22.091   2.510   2.031
  601    HA   THR  97           HA       THR  97  22.726  -0.085   3.278
  602    HB   THR  97           HB       THR  97  24.609   2.250   2.897
  603    HG1  THR  97           HG1      THR  97  25.574   0.788   1.335
  604   HG21  THR  97          HG21      THR  97  26.261   0.281   3.375
  605   HG22  THR  97          HG22      THR  97  24.857  -0.455   4.147
  606   HG23  THR  97          HG23      THR  97  25.459   1.101   4.714
  607    H    GLU  98           H        GLU  98  23.291   3.371   3.982
  608    HA   GLU  98           HA       GLU  98  22.413   2.842   6.745
  609    HB2  GLU  98           HB1      GLU  98  24.782   4.110   5.689
  610    HB3  GLU  98           HB2      GLU  98  23.877   5.240   6.709
  611    HG2  GLU  98           HG1      GLU  98  23.805   3.107   8.313
  612    HG3  GLU  98           HG2      GLU  98  25.300   2.754   7.434
  613    HE2  GLU  98           HE       GLU  98  26.140   6.204   8.761
  614    H    ASN  99           H        ASN  99  20.970   4.221   7.707
  615    HA   ASN  99           HA       ASN  99  19.458   5.921   5.897
  616    HB2  ASN  99           HB1      ASN  99  18.798   5.521   8.804
  617    HB3  ASN  99           HB2      ASN  99  17.706   5.815   7.445
  618   HD21  ASN  99          HD21      ASN  99  17.830   4.050   5.712
  619   HD22  ASN  99          HD22      ASN  99  17.798   2.425   6.297
  620    H    LEU 100           H        LEU 100  20.839   6.260   9.170
  621    HA   LEU 100           HA       LEU 100  20.786   9.160   8.889
  622    HB2  LEU 100           HB1      LEU 100  20.819   7.249  11.087
  623    HB3  LEU 100           HB2      LEU 100  21.983   8.568  11.311
  624    HG   LEU 100           HG       LEU 100  19.761   8.945  12.379
  625   HD11  LEU 100          HD11      LEU 100  19.561  11.203  10.776
  626   HD12  LEU 100          HD12      LEU 100  21.255  10.727  10.664
  627   HD13  LEU 100          HD13      LEU 100  20.525  11.026  12.242
  628   HD21  LEU 100          HD21      LEU 100  17.824   8.922  11.248
  629   HD22  LEU 100          HD22      LEU 100  18.720   7.973  10.062
  630   HD23  LEU 100          HD23      LEU 100  18.522   9.711   9.834
  631    H    TYR 101           H        TYR 101  22.667  10.459   9.315
  632    HA   TYR 101           HA       TYR 101  25.244   9.103   8.979
  633    HB2  TYR 101           HB1      TYR 101  25.903  10.895   7.323
  634    HB3  TYR 101           HB2      TYR 101  24.735   9.709   6.736
  635    HD1  TYR 101           HD1      TYR 101  22.538  10.339   6.069
  636    HD2  TYR 101           HD2      TYR 101  25.098  13.187   7.923
  637    HE1  TYR 101           HE1      TYR 101  20.982  12.137   5.440
  638    HE2  TYR 101           HE2      TYR 101  23.549  14.993   7.300
  639    HH   TYR 101           HH       TYR 101  20.411  14.333   5.931
  640    H    PHE 102           H        PHE 102  26.890  10.002  10.101
  641    HA   PHE 102           HA       PHE 102  26.252  12.393  11.684
  642    HB2  PHE 102           HB1      PHE 102  27.926   9.966  12.168
  643    HB3  PHE 102           HB2      PHE 102  28.407  11.475  12.945
  644    HD1  PHE 102           HD1      PHE 102  27.644  11.842  15.069
  645    HD2  PHE 102           HD2      PHE 102  25.270   9.524  12.405
  646    HE1  PHE 102           HE1      PHE 102  25.998  11.474  16.861
  647    HE2  PHE 102           HE2      PHE 102  23.620   9.153  14.191
  648    HZ   PHE 102           HZ       PHE 102  23.983  10.130  16.423
  649    H    GLN 103           H        GLN 103  27.169  14.235  11.098
  650    HA   GLN 103           HA       GLN 103  29.940  14.399  10.397
  651    HB2  GLN 103           HB1      GLN 103  29.541  15.458   8.165
  652    HB3  GLN 103           HB2      GLN 103  29.183  13.725   8.228
  653    HG2  GLN 103           HG1      GLN 103  27.088  14.049   7.584
  654    HG3  GLN 103           HG2      GLN 103  26.833  15.247   8.861
  655   HE21  GLN 103          HE21      GLN 103  26.632  14.831   5.669
  656   HE22  GLN 103          HE22      GLN 103  26.913  16.444   5.119
  657    H    SER 104           H        SER 104  28.893  15.566  12.490
  658    HA   SER 104           HA       SER 104  28.524  18.383  11.707
  659    HB2  SER 104           HB1      SER 104  27.266  18.641  13.883
  660    HB3  SER 104           HB2      SER 104  26.456  17.636  12.667
  661    HG   SER 104           HG       SER 104  26.338  16.395  14.423
  662    H    LEU 105           H        LEU 105  29.329  19.963  13.266
  663    HA   LEU 105           HA       LEU 105  31.516  18.934  14.944
  664    HB2  LEU 105           HB1      LEU 105  32.851  20.931  14.278
  665    HB3  LEU 105           HB2      LEU 105  32.568  19.760  12.978
  666    HG   LEU 105           HG       LEU 105  30.534  21.449  12.500
  667   HD11  LEU 105          HD11      LEU 105  31.146  23.712  12.858
  668   HD12  LEU 105          HD12      LEU 105  32.736  23.256  13.468
  669   HD13  LEU 105          HD13      LEU 105  31.293  22.890  14.412
  670   HD21  LEU 105          HD21      LEU 105  31.877  20.939  10.707
  671   HD22  LEU 105          HD22      LEU 105  33.363  21.364  11.558
  672   HD23  LEU 105          HD23      LEU 105  32.292  22.634  10.966
  673    H    GLU 106           H        GLU 106  32.201  20.419  16.646
  674    HA   GLU 106           HA       GLU 106  30.483  22.641  17.304
  675    HB2  GLU 106           HB1      GLU 106  29.262  20.548  18.071
  676    HB3  GLU 106           HB2      GLU 106  30.573  20.331  19.241
  677    HG2  GLU 106           HG1      GLU 106  29.796  21.915  20.613
  678    HG3  GLU 106           HG2      GLU 106  29.404  23.005  19.276
  679    HE2  GLU 106           HE       GLU 106  26.091  22.273  19.639
  680    H    HIS 107           H        HIS 107  31.351  23.996  18.879
  681    HA   HIS 107           HA       HIS 107  33.710  23.227  20.347
  682    HB2  HIS 107           HB1      HIS 107  35.128  25.033  19.393
  683    HB3  HIS 107           HB2      HIS 107  34.761  23.750  18.235
  684    HD1  HIS 107           HD1      HIS 107  34.505  27.368  18.700
  685    HD2  HIS 107           HD2      HIS 107  32.742  24.487  16.281
  686    HE1  HIS 107           HE1      HIS 107  33.422  28.639  16.820
  687    HE2  HIS 107           HE2      HIS 107  32.345  26.879  15.341
  688    H    HIS 108           H        HIS 108  34.318  24.764  21.943
  689    HA   HIS 108           HA       HIS 108  32.929  27.248  22.226
  690    HB2  HIS 108           HB1      HIS 108  31.151  25.668  22.899
  691    HB3  HIS 108           HB2      HIS 108  32.219  25.021  24.148
  692    HD1  HIS 108           HD1      HIS 108  30.546  28.305  23.245
  693    HD2  HIS 108           HD2      HIS 108  32.095  26.307  26.542
  694    HE1  HIS 108           HE1      HIS 108  29.968  29.736  25.231
  695    HE2  HIS 108           HE2      HIS 108  30.913  28.515  27.246
  696    H    HIS 109           H        HIS 109  35.267  27.684  22.255
  697    HA   HIS 109           HA       HIS 109  36.320  27.463  24.993
  698    HB2  HIS 109           HB1      HIS 109  38.533  27.037  24.205
  699    HB3  HIS 109           HB2      HIS 109  37.464  25.878  23.410
  700    HD1  HIS 109           HD1      HIS 109  40.219  27.885  22.606
  701    HD2  HIS 109           HD2      HIS 109  36.593  27.133  20.724
  702    HE1  HIS 109           HE1      HIS 109  40.576  28.494  20.193
  703    HE2  HIS 109           HE2      HIS 109  38.359  28.035  19.041
  704    H    HIS 110           H        HIS 110  38.564  28.960  24.792
  705    HA   HIS 110           HA       HIS 110  39.332  31.102  24.826
  706    HB2  HIS 110           HB1      HIS 110  38.886  30.744  22.311
  707    HB3  HIS 110           HB2      HIS 110  37.451  31.743  22.565
  708    HD1  HIS 110           HD1      HIS 110  38.508  33.945  24.352
  709    HD2  HIS 110           HD2      HIS 110  40.609  32.461  21.090
  710    HE1  HIS 110           HE1      HIS 110  40.108  35.771  23.696
  711    HE2  HIS 110           HE2      HIS 110  41.394  34.864  21.702
  712    H    HIS 111           H        HIS 111  38.471  31.663  26.815
  713    HA   HIS 111           HA       HIS 111  35.865  33.024  26.792
  714    HB2  HIS 111           HB1      HIS 111  37.441  32.101  29.204
  715    HB3  HIS 111           HB2      HIS 111  35.761  32.647  29.170
  716    HD1  HIS 111           HD1      HIS 111  34.646  30.975  26.871
  717    HD2  HIS 111           HD2      HIS 111  37.148  29.459  29.822
  718    HE1  HIS 111           HE1      HIS 111  34.207  28.500  26.919
  719    HE2  HIS 111           HE2      HIS 111  35.735  27.573  28.722
  720    H    HIS 112           H        HIS 112  39.005  33.332  28.463
  721    HA   HIS 112           HA       HIS 112  38.920  36.218  27.959
  722    HB2  HIS 112           HB1      HIS 112  38.181  35.284  30.382
  723    HB3  HIS 112           HB2      HIS 112  39.927  35.398  30.624
  724    HD1  HIS 112           HD1      HIS 112  40.871  37.655  31.127
  725    HD2  HIS 112           HD2      HIS 112  36.995  37.857  29.647
  726    HE1  HIS 112           HE1      HIS 112  40.189  40.066  31.354
  727    HE2  HIS 112           HE2      HIS 112  37.819  40.189  30.449
  Start of MODEL   41
    1    H1   MET  18           H        MET  18 -53.706 -30.987  29.608
    2    HA   MET  18           HA       MET  18 -52.539 -29.666  31.057
    3    HB2  MET  18           HB1      MET  18 -50.434 -30.595  32.100
    4    HB3  MET  18           HB2      MET  18 -51.904 -31.543  32.373
    5    HG2  MET  18           HG1      MET  18 -51.215 -33.287  31.058
    6    HG3  MET  18           HG2      MET  18 -50.186 -32.255  30.059
    7    HE1  MET  18           HE1      MET  18 -47.313 -34.237  31.061
    8    HE2  MET  18           HE2      MET  18 -48.470 -33.680  29.851
    9    HE3  MET  18           HE3      MET  18 -47.277 -32.561  30.513
   10    H    LEU  19           H        LEU  19 -52.349 -28.566  28.870
   11    HA   LEU  19           HA       LEU  19 -49.523 -27.983  28.406
   12    HB2  LEU  19           HB1      LEU  19 -49.892 -27.962  25.951
   13    HB3  LEU  19           HB2      LEU  19 -50.001 -29.571  26.689
   14    HG   LEU  19           HG       LEU  19 -52.567 -28.157  26.371
   15   HD11  LEU  19          HD11      LEU  19 -52.051 -27.480  24.277
   16   HD12  LEU  19          HD12      LEU  19 -52.417 -29.162  23.895
   17   HD13  LEU  19          HD13      LEU  19 -50.743 -28.650  24.100
   18   HD21  LEU  19          HD21      LEU  19 -51.592 -30.792  26.729
   19   HD22  LEU  19          HD22      LEU  19 -52.441 -30.739  25.184
   20   HD23  LEU  19          HD23      LEU  19 -53.266 -30.241  26.662
   21    H    VAL  20           H        VAL  20 -50.896 -26.320  29.873
   22    HA   VAL  20           HA       VAL  20 -52.439 -24.386  28.468
   23    HB   VAL  20           HB       VAL  20 -50.988 -24.038  31.093
   24   HG11  VAL  20          HG11      VAL  20 -53.521 -22.659  30.709
   25   HG12  VAL  20          HG12      VAL  20 -51.969 -22.040  31.281
   26   HG13  VAL  20          HG13      VAL  20 -52.288 -22.162  29.551
   27   HG21  VAL  20          HG21      VAL  20 -53.383 -25.563  30.365
   28   HG22  VAL  20          HG22      VAL  20 -52.339 -25.697  31.780
   29   HG23  VAL  20          HG23      VAL  20 -53.598 -24.465  31.729
   30    H    LEU  21           H        LEU  21 -51.778 -22.795  27.191
   31    HA   LEU  21           HA       LEU  21 -48.955 -22.281  26.858
   32    HB2  LEU  21           HB1      LEU  21 -49.532 -21.050  24.940
   33    HB3  LEU  21           HB2      LEU  21 -50.650 -22.423  24.989
   34    HG   LEU  21           HG       LEU  21 -52.188 -20.623  26.212
   35   HD11  LEU  21          HD11      LEU  21 -51.738 -18.529  24.610
   36   HD12  LEU  21          HD12      LEU  21 -50.078 -19.075  24.842
   37   HD13  LEU  21          HD13      LEU  21 -51.071 -18.658  26.239
   38   HD21  LEU  21          HD21      LEU  21 -52.472 -21.961  24.029
   39   HD22  LEU  21          HD22      LEU  21 -51.938 -20.483  23.229
   40   HD23  LEU  21          HD23      LEU  21 -53.392 -20.470  24.229
   41    H    ASP  22           H        ASP  22 -47.900 -20.328  27.202
   42    HA   ASP  22           HA       ASP  22 -49.361 -18.337  28.806
   43    HB2  ASP  22           HB1      ASP  22 -47.029 -19.928  29.524
   44    HB3  ASP  22           HB2      ASP  22 -46.710 -18.193  29.652
   45    HD2  ASP  22           HD       ASP  22 -49.737 -19.414  31.909
   46    H    PHE  23           H        PHE  23 -48.052 -16.234  28.953
   47    HA   PHE  23           HA       PHE  23 -47.230 -14.400  27.889
   48    HB2  PHE  23           HB1      PHE  23 -45.658 -16.365  26.205
   49    HB3  PHE  23           HB2      PHE  23 -45.271 -14.669  26.503
   50    HD1  PHE  23           HD1      PHE  23 -44.875 -13.983  28.973
   51    HD2  PHE  23           HD2      PHE  23 -44.687 -17.989  27.546
   52    HE1  PHE  23           HE1      PHE  23 -43.514 -14.611  30.924
   53    HE2  PHE  23           HE2      PHE  23 -43.327 -18.623  29.496
   54    HZ   PHE  23           HZ       PHE  23 -42.740 -16.933  31.189
   55    H    ASN  24           H        ASN  24 -46.905 -13.409  25.599
   56    HA   ASN  24           HA       ASN  24 -48.348 -14.544  23.429
   57    HB2  ASN  24           HB1      ASN  24 -50.165 -12.767  23.415
   58    HB3  ASN  24           HB2      ASN  24 -50.336 -14.042  24.627
   59   HD21  ASN  24          HD21      ASN  24 -49.404 -10.709  24.116
   60   HD22  ASN  24          HD22      ASN  24 -49.622 -10.198  25.752
   61    H    ASN  25           H        ASN  25 -48.871 -12.670  21.771
   62    HA   ASN  25           HA       ASN  25 -48.039 -11.072  20.383
   63    HB2  ASN  25           HB1      ASN  25 -48.339  -9.706  22.519
   64    HB3  ASN  25           HB2      ASN  25 -46.601  -9.915  22.770
   65   HD21  ASN  25          HD21      ASN  25 -49.018  -8.170  21.147
   66   HD22  ASN  25          HD22      ASN  25 -47.985  -7.167  20.191
   67    H    ILE  26           H        ILE  26 -46.774 -12.806  19.430
   68    HA   ILE  26           HA       ILE  26 -43.959 -12.925  20.171
   69    HB   ILE  26           HB       ILE  26 -43.810 -14.688  18.423
   70   HG12  ILE  26          HG11      ILE  26 -46.820 -14.420  18.283
   71   HG13  ILE  26          HG12      ILE  26 -45.719 -13.772  17.056
   72   HG21  ILE  26          HG21      ILE  26 -44.201 -16.037  20.139
   73   HG22  ILE  26          HG22      ILE  26 -45.149 -14.780  20.930
   74   HG23  ILE  26          HG23      ILE  26 -45.934 -15.916  19.833
   75   HD11  ILE  26          HD11      ILE  26 -46.847 -16.284  17.061
   76   HD12  ILE  26          HD12      ILE  26 -45.487 -15.747  16.073
   77   HD13  ILE  26          HD13      ILE  26 -45.194 -16.565  17.607
   78    H    ARG  27           H        ARG  27 -42.495 -13.194  18.068
   79    HA   ARG  27           HA       ARG  27 -41.430 -12.130  16.364
   80    HB2  ARG  27           HB1      ARG  27 -44.179 -11.109  15.615
   81    HB3  ARG  27           HB2      ARG  27 -42.761 -11.218  14.560
   82    HG2  ARG  27           HG1      ARG  27 -42.809 -13.642  14.670
   83    HG3  ARG  27           HG2      ARG  27 -44.175 -13.573  15.796
   84    HD2  ARG  27           HD1      ARG  27 -45.491 -12.375  14.033
   85    HD3  ARG  27           HD2      ARG  27 -44.143 -12.661  12.923
   86    HE   ARG  27           HE       ARG  27 -45.031 -15.085  14.118
   87   HH11  ARG  27          HH11      ARG  27 -45.797 -12.753  11.649
   88   HH12  ARG  27          HH12      ARG  27 -46.662 -13.886  10.664
   89   HH21  ARG  27          HH21      ARG  27 -46.168 -16.587  12.831
   90   HH22  ARG  27          HH22      ARG  27 -46.874 -16.065  11.338
   91    H    SER  28           H        SER  28 -41.284  -9.817  15.259
   92    HA   SER  28           HA       SER  28 -42.088  -7.581  16.817
   93    HB2  SER  28           HB1      SER  28 -39.765  -8.960  17.727
   94    HB3  SER  28           HB2      SER  28 -39.240  -7.420  17.020
   95    HG   SER  28           HG       SER  28 -39.868  -6.586  18.838
   96    H    SER  29           H        SER  29 -40.406  -5.652  16.184
   97    HA   SER  29           HA       SER  29 -40.257  -5.775  13.247
   98    HB2  SER  29           HB1      SER  29 -40.292  -3.240  14.890
   99    HB3  SER  29           HB2      SER  29 -40.683  -3.449  13.174
  100    HG   SER  29           HG       SER  29 -42.516  -3.229  14.671
  101    H    ALA  30           H        ALA  30 -38.668  -3.658  12.685
  102    HA   ALA  30           HA       ALA  30 -36.141  -4.137  14.105
  103    HB1  ALA  30           HB1      ALA  30 -35.592  -5.438  12.335
  104    HB2  ALA  30           HB2      ALA  30 -36.729  -4.637  11.250
  105    HB3  ALA  30           HB3      ALA  30 -35.183  -3.875  11.625
  106    H    ASP  31           H        ASP  31 -37.227  -2.249  11.280
  107    HA   ASP  31           HA       ASP  31 -37.096  -0.032  10.787
  108    HB2  ASP  31           HB1      ASP  31 -37.991  -0.182  13.446
  109    HB3  ASP  31           HB2      ASP  31 -36.728   1.056  13.442
  110    HD2  ASP  31           HD       ASP  31 -39.984   1.773  11.277
  111    H    LEU  32           H        LEU  32 -35.686   2.009  11.222
  112    HA   LEU  32           HA       LEU  32 -33.622   2.955  11.097
  113    HB2  LEU  32           HB1      LEU  32 -32.861   0.791  13.065
  114    HB3  LEU  32           HB2      LEU  32 -31.962   2.282  12.738
  115    HG   LEU  32           HG       LEU  32 -34.767   2.535  13.694
  116   HD11  LEU  32          HD11      LEU  32 -32.533   1.351  15.243
  117   HD12  LEU  32          HD12      LEU  32 -34.272   1.085  15.372
  118   HD13  LEU  32          HD13      LEU  32 -33.550   2.543  16.052
  119   HD21  LEU  32          HD21      LEU  32 -32.744   4.153  14.958
  120   HD22  LEU  32          HD22      LEU  32 -34.142   4.645  14.000
  121   HD23  LEU  32          HD23      LEU  32 -32.619   4.246  13.201
  122    H    HIS  33           H        HIS  33 -31.091   2.136  10.981
  123    HA   HIS  33           HA       HIS  33 -30.691  -0.289   9.540
  124    HB2  HIS  33           HB1      HIS  33 -31.837   1.179   7.833
  125    HB3  HIS  33           HB2      HIS  33 -30.428   2.243   7.912
  126    HD1  HIS  33           HD1      HIS  33 -31.392  -1.236   6.829
  127    HD2  HIS  33           HD2      HIS  33 -28.224   1.428   6.472
  128    HE1  HIS  33           HE1      HIS  33 -29.846  -2.256   5.128
  129    HE2  HIS  33           HE2      HIS  33 -27.908  -0.630   4.910
  130    H    GLY  34           H        GLY  34 -29.339   3.020   9.581
  131    HA2  GLY  34           HA2      GLY  34 -27.217   2.640  11.257
  132    HA3  GLY  34           HA3      GLY  34 -26.646   2.025   9.713
  133    HA1  GLY  34           HA1      GLY  34 -27.853   3.200  11.010
  134    H    ALA  35           H        ALA  35 -25.105   3.591   9.372
  135    HA   ALA  35           HA       ALA  35 -26.039   6.048   8.244
  136    HB1  ALA  35           HB1      ALA  35 -25.926   6.350  10.834
  137    HB2  ALA  35           HB2      ALA  35 -24.191   6.490  10.544
  138    HB3  ALA  35           HB3      ALA  35 -25.308   7.611   9.765
  139    H    ARG  36           H        ARG  36 -24.687   6.651   6.669
  140    HA   ARG  36           HA       ARG  36 -21.907   5.684   6.773
  141    HB2  ARG  36           HB1      ARG  36 -23.982   5.172   4.799
  142    HB3  ARG  36           HB2      ARG  36 -22.548   5.910   4.072
  143    HG2  ARG  36           HG1      ARG  36 -21.198   4.121   4.524
  144    HG3  ARG  36           HG2      ARG  36 -22.156   3.628   5.932
  145    HD2  ARG  36           HD1      ARG  36 -23.431   2.251   4.713
  146    HD3  ARG  36           HD2      ARG  36 -23.696   3.493   3.481
  147    HE   ARG  36           HE       ARG  36 -21.828   1.340   3.363
  148   HH11  ARG  36          HH11      ARG  36 -22.403   4.618   2.340
  149   HH12  ARG  36          HH12      ARG  36 -21.393   4.496   0.938
  150   HH21  ARG  36          HH21      ARG  36 -20.495   1.167   1.520
  151   HH22  ARG  36          HH22      ARG  36 -20.309   2.532   0.472
  152    H    LYS  37           H        LYS  37 -20.340   7.108   6.208
  153    HA   LYS  37           HA       LYS  37 -21.095   9.881   5.970
  154    HB2  LYS  37           HB1      LYS  37 -18.597   8.353   6.455
  155    HB3  LYS  37           HB2      LYS  37 -18.419   9.939   5.687
  156    HG2  LYS  37           HG1      LYS  37 -18.718  11.000   7.610
  157    HG3  LYS  37           HG2      LYS  37 -20.215  10.103   7.928
  158    HD2  LYS  37           HD1      LYS  37 -19.098   8.372   9.044
  159    HD3  LYS  37           HD2      LYS  37 -17.529   8.835   8.361
  160    HE2  LYS  37           HE1      LYS  37 -18.784  10.969   9.928
  161    HE3  LYS  37           HE2      LYS  37 -18.451   9.503  10.862
  162    HZ1  LYS  37           HZ1      LYS  37 -16.644  11.347  10.577
  163    HZ2  LYS  37           HZ2      LYS  37 -16.341  10.549   9.117
  164    HZ3  LYS  37           HZ3      LYS  37 -16.210   9.711  10.580
  165    H    GLY  38           H        GLY  38 -19.581  11.189   4.360
  166    HA2  GLY  38           HA2      GLY  38 -19.699   9.845   1.734
  167    HA3  GLY  38           HA3      GLY  38 -20.324  11.472   1.957
  168    HA1  GLY  38           HA1      GLY  38 -19.058   9.807   2.337
  169    H    SER  39           H        SER  39 -17.367   9.534   2.230
  170    HA   SER  39           HA       SER  39 -15.853  11.899   1.356
  171    HB2  SER  39           HB1      SER  39 -14.396  11.826   3.088
  172    HB3  SER  39           HB2      SER  39 -15.700  10.952   3.910
  173    HG   SER  39           HG       SER  39 -13.352  10.039   3.588
  174    H    GLN  40           H        GLN  40 -13.472  11.075   0.832
  175    HA   GLN  40           HA       GLN  40 -13.838   9.002  -1.183
  176    HB2  GLN  40           HB1      GLN  40 -11.487  10.840  -0.670
  177    HB3  GLN  40           HB2      GLN  40 -11.674   9.759  -2.059
  178    HG2  GLN  40           HG1      GLN  40 -13.873  11.680  -1.607
  179    HG3  GLN  40           HG2      GLN  40 -12.318  12.360  -2.104
  180   HE21  GLN  40          HE21      GLN  40 -15.112  10.696  -3.091
  181   HE22  GLN  40          HE22      GLN  40 -14.673  10.455  -4.744
  182    H    CYS  41           H        CYS  41 -11.344   9.806   1.242
  183    HA   CYS  41           HA       CYS  41 -11.158   7.007   1.992
  184    HB2  CYS  41           HB1      CYS  41  -8.790   6.802   1.581
  185    HB3  CYS  41           HB2      CYS  41  -9.594   7.248   0.076
  186    H    LEU  42           H        LEU  42 -10.329   6.686   4.040
  187    HA   LEU  42           HA       LEU  42 -10.117   9.097   5.669
  188    HB2  LEU  42           HB1      LEU  42 -11.322   6.628   6.054
  189    HB3  LEU  42           HB2      LEU  42  -9.873   6.564   7.071
  190    HG   LEU  42           HG       LEU  42 -11.856   8.821   7.234
  191   HD11  LEU  42          HD11      LEU  42 -11.915   6.767   9.327
  192   HD12  LEU  42          HD12      LEU  42 -12.550   6.253   7.764
  193   HD13  LEU  42          HD13      LEU  42 -13.233   7.664   8.573
  194   HD21  LEU  42          HD21      LEU  42  -9.645   7.801   9.006
  195   HD22  LEU  42          HD22      LEU  42 -10.860   8.963   9.539
  196   HD23  LEU  42          HD23      LEU  42  -9.767   9.374   8.218
  197    H    SER  43           H        SER  43  -8.187   6.438   4.516
  198    HA   SER  43           HA       SER  43  -5.797   7.745   5.540
  199    HB2  SER  43           HB1      SER  43  -6.860   5.695   7.018
  200    HB3  SER  43           HB2      SER  43  -5.726   4.833   5.963
  201    HG   SER  43           HG       SER  43  -4.522   5.460   7.677
  202    H    ASP  44           H        ASP  44  -3.792   6.515   4.727
  203    HA   ASP  44           HA       ASP  44  -3.964   6.354   1.903
  204    HB2  ASP  44           HB1      ASP  44  -1.660   5.258   3.503
  205    HB3  ASP  44           HB2      ASP  44  -1.633   6.039   1.917
  206    HD2  ASP  44           HD       ASP  44  -1.211   9.134   3.308
  207    H    THR  45           H        THR  45  -4.174   4.007   4.445
  208    HA   THR  45           HA       THR  45  -3.762   1.746   2.683
  209    HB   THR  45           HB       THR  45  -4.971   1.118   5.258
  210    HG1  THR  45           HG1      THR  45  -2.626   2.725   5.163
  211   HG21  THR  45          HG21      THR  45  -3.612  -0.343   3.643
  212   HG22  THR  45          HG22      THR  45  -3.258  -0.482   5.365
  213   HG23  THR  45          HG23      THR  45  -2.194   0.457   4.318
  214    H    ASP  46           H        ASP  46  -6.208   3.833   2.954
  215    HA   ASP  46           HA       ASP  46  -8.484   2.171   3.266
  216    HB2  ASP  46           HB1      ASP  46  -8.313   4.743   3.437
  217    HB3  ASP  46           HB2      ASP  46  -8.466   4.725   1.675
  218    HD2  ASP  46           HD       ASP  46 -11.673   4.108   3.846
  219    H    CYS  47           H        CYS  47  -6.431   2.958   0.570
  220    HA   CYS  47           HA       CYS  47  -8.234   2.033  -1.455
  221    HB2  CYS  47           HB1      CYS  47  -5.673   3.321  -1.336
  222    HB3  CYS  47           HB2      CYS  47  -5.558   1.914  -2.394
  223    H    ASN  48           H        ASN  48  -8.361   0.065  -2.425
  224    HA   ASN  48           HA       ASN  48  -7.643  -2.226  -1.000
  225    HB2  ASN  48           HB1      ASN  48  -8.931  -1.601  -3.534
  226    HB3  ASN  48           HB2      ASN  48  -7.937  -3.059  -3.648
  227   HD21  ASN  48          HD21      ASN  48  -8.540  -4.895  -2.598
  228   HD22  ASN  48          HD22      ASN  48 -10.044  -5.069  -1.766
  229    H    THR  49           H        THR  49  -6.142  -0.764  -3.867
  230    HA   THR  49           HA       THR  49  -4.084  -2.713  -4.089
  231    HB   THR  49           HB       THR  49  -3.266  -0.193  -5.202
  232    HG1  THR  49           HG1      THR  49  -5.062   0.528  -6.086
  233   HG21  THR  49          HG21      THR  49  -3.079  -1.424  -7.177
  234   HG22  THR  49          HG22      THR  49  -4.402  -2.506  -6.740
  235   HG23  THR  49          HG23      THR  49  -2.845  -2.638  -5.921
  236    H    ARG  50           H        ARG  50  -1.704  -1.666  -4.222
  237    HA   ARG  50           HA       ARG  50  -1.152  -0.817  -1.484
  238    HB2  ARG  50           HB1      ARG  50   1.181  -1.396  -1.984
  239    HB3  ARG  50           HB2      ARG  50   0.085  -2.742  -2.324
  240    HG2  ARG  50           HG1      ARG  50   0.233  -1.380  -4.739
  241    HG3  ARG  50           HG2      ARG  50   1.883  -1.335  -4.096
  242    HD2  ARG  50           HD1      ARG  50   2.173  -3.586  -4.261
  243    HD3  ARG  50           HD2      ARG  50   0.474  -3.924  -3.899
  244    HE   ARG  50           HE       ARG  50   0.691  -2.704  -6.437
  245   HH11  ARG  50          HH11      ARG  50   1.314  -5.710  -4.793
  246   HH12  ARG  50          HH12      ARG  50   1.125  -6.678  -6.216
  247   HH21  ARG  50          HH21      ARG  50   0.439  -3.970  -8.319
  248   HH22  ARG  50          HH22      ARG  50   0.629  -5.688  -8.222
  249    H    LYS  51           H        LYS  51  -2.286   1.230  -2.772
  250    HA   LYS  51           HA       LYS  51  -0.031   3.014  -3.421
  251    HB2  LYS  51           HB1      LYS  51  -2.872   3.332  -4.406
  252    HB3  LYS  51           HB2      LYS  51  -1.441   4.239  -4.926
  253    HG2  LYS  51           HG1      LYS  51  -0.517   2.300  -6.004
  254    HG3  LYS  51           HG2      LYS  51  -1.823   1.284  -5.364
  255    HD2  LYS  51           HD1      LYS  51  -3.412   2.895  -6.607
  256    HD3  LYS  51           HD2      LYS  51  -1.958   3.407  -7.481
  257    HE2  LYS  51           HE1      LYS  51  -1.556   1.108  -8.215
  258    HE3  LYS  51           HE2      LYS  51  -2.973   0.571  -7.300
  259    HZ1  LYS  51           HZ1      LYS  51  -3.373   0.897  -9.712
  260    HZ2  LYS  51           HZ2      LYS  51  -3.099   2.553  -9.504
  261    HZ3  LYS  51           HZ3      LYS  51  -4.402   1.807  -8.724
  262    H    PHE  52           H        PHE  52  -0.535   5.353  -2.978
  263    HA   PHE  52           HA       PHE  52  -1.889   5.548  -0.379
  264    HB2  PHE  52           HB1      PHE  52  -0.576   7.699  -0.164
  265    HB3  PHE  52           HB2      PHE  52   0.387   6.220  -0.200
  266    HD1  PHE  52           HD1      PHE  52   1.998   5.830  -1.872
  267    HD2  PHE  52           HD2      PHE  52  -0.702   9.099  -2.240
  268    HE1  PHE  52           HE1      PHE  52   3.327   6.713  -3.746
  269    HE2  PHE  52           HE2      PHE  52   0.621   9.986  -4.115
  270    HZ   PHE  52           HZ       PHE  52   2.638   8.792  -4.870
  271    H    CYS  53           H        CYS  53  -2.946   7.673   0.085
  272    HA   CYS  53           HA       CYS  53  -4.692   8.356  -2.141
  273    HB2  CYS  53           HB1      CYS  53  -4.983   8.167   0.680
  274    HB3  CYS  53           HB2      CYS  53  -5.291   9.846   0.231
  275    H    LEU  54           H        LEU  54  -3.517   9.680  -3.480
  276    HA   LEU  54           HA       LEU  54  -2.070  11.949  -2.433
  277    HB2  LEU  54           HB1      LEU  54  -1.203  10.745  -4.358
  278    HB3  LEU  54           HB2      LEU  54  -2.686  11.103  -5.259
  279    HG   LEU  54           HG       LEU  54  -1.721  13.603  -4.531
  280   HD11  LEU  54          HD11      LEU  54   0.404  12.726  -3.855
  281   HD12  LEU  54          HD12      LEU  54   0.606  13.549  -5.401
  282   HD13  LEU  54          HD13      LEU  54   0.544  11.787  -5.341
  283   HD21  LEU  54          HD21      LEU  54  -2.771  13.139  -6.628
  284   HD22  LEU  54          HD22      LEU  54  -1.484  12.025  -7.088
  285   HD23  LEU  54          HD23      LEU  54  -1.151  13.753  -6.956
  286    H    GLN  55           H        GLN  55  -2.916  13.877  -2.033
  287    HA   GLN  55           HA       GLN  55  -5.438  14.606  -3.372
  288    HB2  GLN  55           HB1      GLN  55  -5.839  16.056  -1.331
  289    HB3  GLN  55           HB2      GLN  55  -5.950  14.306  -1.079
  290    HG2  GLN  55           HG1      GLN  55  -4.325  14.315   0.433
  291    HG3  GLN  55           HG2      GLN  55  -3.267  15.264  -0.619
  292   HE21  GLN  55          HE21      GLN  55  -4.644  15.264   2.302
  293   HE22  GLN  55          HE22      GLN  55  -4.783  16.962   2.587
  294    HA   PRO  56           HA       PRO  56  -2.367  17.685  -4.811
  295    HB2  PRO  56           HB1      PRO  56  -3.565  18.057  -7.245
  296    HB3  PRO  56           HB2      PRO  56  -2.439  16.744  -6.906
  297    HG2  PRO  56           HG1      PRO  56  -5.438  16.728  -6.896
  298    HG3  PRO  56           HG2      PRO  56  -4.294  15.533  -7.614
  299    HD2  PRO  56           HD1      PRO  56  -5.552  15.114  -5.245
  300    HD3  PRO  56           HD2      PRO  56  -3.915  14.524  -5.577
  301    H    ARG  57           H        ARG  57  -2.559  19.923  -5.077
  302    HA   ARG  57           HA       ARG  57  -4.963  21.064  -3.948
  303    HB2  ARG  57           HB1      ARG  57  -2.391  21.708  -3.627
  304    HB3  ARG  57           HB2      ARG  57  -2.770  22.792  -4.974
  305    HG2  ARG  57           HG1      ARG  57  -3.431  24.238  -3.411
  306    HG3  ARG  57           HG2      ARG  57  -4.877  23.222  -3.288
  307    HD2  ARG  57           HD1      ARG  57  -4.174  22.193  -1.348
  308    HD3  ARG  57           HD2      ARG  57  -2.465  22.469  -1.711
  309    HE   ARG  57           HE       ARG  57  -4.202  24.197  -0.252
  310   HH11  ARG  57          HH11      ARG  57  -1.439  24.133  -2.370
  311   HH12  ARG  57          HH12      ARG  57  -0.793  25.631  -1.785
  312   HH21  ARG  57          HH21      ARG  57  -3.361  26.170   0.526
  313   HH22  ARG  57          HH22      ARG  57  -1.886  26.788  -0.137
  314    H    ASP  58           H        ASP  58  -3.438  20.797  -7.065
  315    HA   ASP  58           HA       ASP  58  -5.198  22.767  -8.275
  316    HB2  ASP  58           HB1      ASP  58  -2.985  21.015  -9.352
  317    HB3  ASP  58           HB2      ASP  58  -4.005  22.007 -10.401
  318    HD2  ASP  58           HD       ASP  58  -2.415  24.926  -9.462
  319    H    GLU  59           H        GLU  59  -5.042  19.360  -7.781
  320    HA   GLU  59           HA       GLU  59  -7.388  19.014  -9.533
  321    HB2  GLU  59           HB1      GLU  59  -4.994  17.267  -9.089
  322    HB3  GLU  59           HB2      GLU  59  -6.548  16.528  -9.510
  323    HG2  GLU  59           HG1      GLU  59  -6.127  16.907 -11.644
  324    HG3  GLU  59           HG2      GLU  59  -6.176  18.645 -11.311
  325    HE2  GLU  59           HE       GLU  59  -2.842  18.908 -11.991
  326    H    LYS  60           H        LYS  60  -8.460  16.755  -8.846
  327    HA   LYS  60           HA       LYS  60  -9.285  17.168  -6.091
  328    HB2  LYS  60           HB1      LYS  60 -11.004  15.422  -6.638
  329    HB3  LYS  60           HB2      LYS  60 -11.066  16.868  -7.659
  330    HG2  LYS  60           HG1      LYS  60 -10.549  15.743  -9.537
  331    HG3  LYS  60           HG2      LYS  60  -9.401  14.683  -8.699
  332    HD2  LYS  60           HD1      LYS  60 -11.006  13.144  -8.125
  333    HD3  LYS  60           HD2      LYS  60 -12.302  14.352  -8.117
  334    HE2  LYS  60           HE1      LYS  60 -11.313  14.250 -10.767
  335    HE3  LYS  60           HE2      LYS  60 -11.499  12.577 -10.217
  336    HZ1  LYS  60           HZ1      LYS  60 -13.753  14.035  -9.403
  337    HZ2  LYS  60           HZ2      LYS  60 -13.673  12.751 -10.501
  338    HZ3  LYS  60           HZ3      LYS  60 -13.495  14.343 -11.048
  339    HA   PRO  61           HA       PRO  61  -7.046  13.848  -4.294
  340    HB2  PRO  61           HB1      PRO  61  -8.811  12.971  -2.391
  341    HB3  PRO  61           HB2      PRO  61  -7.931  14.496  -2.275
  342    HG2  PRO  61           HG1      PRO  61 -10.728  13.983  -3.232
  343    HG3  PRO  61           HG2      PRO  61 -10.120  15.263  -2.116
  344    HD2  PRO  61           HD1      PRO  61 -10.675  15.740  -4.731
  345    HD3  PRO  61           HD2      PRO  61  -9.370  16.565  -3.863
  346    H    PHE  62           H        PHE  62  -6.675  11.746  -4.716
  347    HA   PHE  62           HA       PHE  62  -8.719   9.794  -5.003
  348    HB2  PHE  62           HB1      PHE  62  -8.617   9.326  -7.335
  349    HB3  PHE  62           HB2      PHE  62  -8.903  11.060  -7.181
  350    HD1  PHE  62           HD1      PHE  62  -6.637  12.494  -7.029
  351    HD2  PHE  62           HD2      PHE  62  -7.061   8.698  -8.908
  352    HE1  PHE  62           HE1      PHE  62  -4.671  12.971  -8.428
  353    HE2  PHE  62           HE2      PHE  62  -5.095   9.168 -10.310
  354    HZ   PHE  62           HZ       PHE  62  -3.897  11.306 -10.070
  355    H    CYS  63           H        CYS  63  -7.652   7.754  -6.183
  356    HA   CYS  63           HA       CYS  63  -5.251   7.219  -4.656
  357    HB2  CYS  63           HB1      CYS  63  -7.412   5.693  -5.314
  358    HB3  CYS  63           HB2      CYS  63  -6.241   5.156  -6.519
  359    H    ALA  64           H        ALA  64  -3.281   7.533  -5.429
  360    HA   ALA  64           HA       ALA  64  -2.860   7.338  -8.341
  361    HB1  ALA  64           HB1      ALA  64  -2.510   9.581  -7.975
  362    HB2  ALA  64           HB2      ALA  64  -1.850   9.327  -6.359
  363    HB3  ALA  64           HB3      ALA  64  -0.878   8.942  -7.779
  364    H    THR  65           H        THR  65  -1.151   6.159  -9.065
  365    HA   THR  65           HA       THR  65  -0.029   4.215  -7.325
  366    HB   THR  65           HB       THR  65   1.537   4.335  -9.683
  367    HG1  THR  65           HG1      THR  65  -0.241   4.266 -11.228
  368   HG21  THR  65          HG21      THR  65   0.797   2.176  -9.977
  369   HG22  THR  65          HG22      THR  65  -0.844   2.552  -9.450
  370   HG23  THR  65          HG23      THR  65   0.453   2.404  -8.264
  371    H    CYS  66           H        CYS  66   1.978   4.047  -6.429
  372    HA   CYS  66           HA       CYS  66   3.368   6.351  -5.713
  373    HB2  CYS  66           HB1      CYS  66   5.195   4.785  -5.008
  374    HB3  CYS  66           HB2      CYS  66   3.599   4.378  -4.377
  375    H    ARG  67           H        ARG  67   5.579   6.973  -6.230
  376    HA   ARG  67           HA       ARG  67   5.977   7.122  -9.061
  377    HB2  ARG  67           HB1      ARG  67   7.950   7.966  -6.939
  378    HB3  ARG  67           HB2      ARG  67   7.769   8.605  -8.578
  379    HG2  ARG  67           HG1      ARG  67   5.302   9.115  -7.551
  380    HG3  ARG  67           HG2      ARG  67   6.333   9.299  -6.123
  381    HD2  ARG  67           HD1      ARG  67   7.409  11.132  -6.948
  382    HD3  ARG  67           HD2      ARG  67   7.287  10.568  -8.620
  383    HE   ARG  67           HE       ARG  67   4.717  11.217  -7.727
  384   HH11  ARG  67          HH11      ARG  67   7.743  12.773  -8.460
  385   HH12  ARG  67          HH12      ARG  67   7.009  14.276  -8.913
  386   HH21  ARG  67          HH21      ARG  67   3.738  13.190  -8.320
  387   HH22  ARG  67          HH22      ARG  67   4.731  14.513  -8.832
  388    H    GLY  68           H        GLY  68   8.325   6.786  -9.892
  389    HA2  GLY  68           HA2      GLY  68   8.905   3.984  -9.549
  390    HA3  GLY  68           HA3      GLY  68   9.706   5.090 -10.654
  391    HA1  GLY  68           HA1      GLY  68   8.868   4.458  -8.807
  392    H    LEU  69           H        LEU  69  11.377   3.429  -9.574
  393    HA   LEU  69           HA       LEU  69  12.372   4.153  -7.006
  394    HB2  LEU  69           HB1      LEU  69  13.221   2.383  -9.235
  395    HB3  LEU  69           HB2      LEU  69  14.477   2.923  -8.106
  396    HG   LEU  69           HG       LEU  69  11.977   1.406  -7.359
  397   HD11  LEU  69          HD11      LEU  69  13.228  -0.515  -7.251
  398   HD12  LEU  69          HD12      LEU  69  14.752   0.355  -7.080
  399   HD13  LEU  69          HD13      LEU  69  13.952   0.279  -8.650
  400   HD21  LEU  69          HD21      LEU  69  13.264   1.169  -5.176
  401   HD22  LEU  69          HD22      LEU  69  12.528   2.738  -5.506
  402   HD23  LEU  69          HD23      LEU  69  14.261   2.508  -5.749
  403    H    ARG  70           H        ARG  70  12.915   5.298 -10.236
  404    HA   ARG  70           HA       ARG  70  15.288   6.798  -9.455
  405    HB2  ARG  70           HB1      ARG  70  13.834   6.526 -12.094
  406    HB3  ARG  70           HB2      ARG  70  15.273   7.527 -11.853
  407    HG2  ARG  70           HG1      ARG  70  15.980   5.025 -10.843
  408    HG3  ARG  70           HG2      ARG  70  15.069   4.693 -12.326
  409    HD2  ARG  70           HD1      ARG  70  16.688   6.800 -13.069
  410    HD3  ARG  70           HD2      ARG  70  17.719   5.863 -11.979
  411    HE   ARG  70           HE       ARG  70  16.873   5.115 -14.607
  412   HH11  ARG  70          HH11      ARG  70  17.827   3.891 -11.491
  413   HH12  ARG  70          HH12      ARG  70  18.379   2.371 -12.112
  414   HH21  ARG  70          HH21      ARG  70  17.596   3.118 -15.437
  415   HH22  ARG  70          HH22      ARG  70  18.248   1.932 -14.356
  416    H    ARG  71           H        ARG  71  12.286   7.264  -8.702
  417    HA   ARG  71           HA       ARG  71  12.072  10.060  -9.553
  418    HB2  ARG  71           HB1      ARG  71  10.125   8.062  -8.437
  419    HB3  ARG  71           HB2      ARG  71   9.776   9.795  -8.358
  420    HG2  ARG  71           HG1      ARG  71  10.401   8.313 -10.913
  421    HG3  ARG  71           HG2      ARG  71   8.767   8.639 -10.312
  422    HD2  ARG  71           HD1      ARG  71  10.002  11.120 -10.193
  423    HD3  ARG  71           HD2      ARG  71  10.631  10.400 -11.682
  424    HE   ARG  71           HE       ARG  71   7.947   9.955 -11.819
  425   HH11  ARG  71          HH11      ARG  71   9.943  12.772 -11.376
  426   HH12  ARG  71          HH12      ARG  71   8.823  13.848 -12.143
  427   HH21  ARG  71          HH21      ARG  71   6.463  11.361 -12.832
  428   HH22  ARG  71          HH22      ARG  71   6.843  13.045 -12.969
  429    H    ARG  72           H        ARG  72  11.604  11.716  -8.002
  430    HA   ARG  72           HA       ARG  72  13.151  11.423  -5.594
  431    HB2  ARG  72           HB1      ARG  72  11.545  13.727  -6.720
  432    HB3  ARG  72           HB2      ARG  72  12.493  13.821  -5.228
  433    HG2  ARG  72           HG1      ARG  72  14.407  12.918  -6.858
  434    HG3  ARG  72           HG2      ARG  72  13.394  13.759  -8.042
  435    HD2  ARG  72           HD1      ARG  72  14.369  15.023  -5.474
  436    HD3  ARG  72           HD2      ARG  72  15.211  15.155  -7.024
  437    HE   ARG  72           HE       ARG  72  12.459  15.960  -7.157
  438   HH11  ARG  72          HH11      ARG  72  15.701  16.980  -6.405
  439   HH12  ARG  72          HH12      ARG  72  15.381  18.658  -6.700
  440   HH21  ARG  72          HH21      ARG  72  12.025  18.165  -7.548
  441   HH22  ARG  72          HH22      ARG  72  13.290  19.330  -7.349
  442    H    CYS  73           H        CYS  73  12.377  11.862  -3.456
  443    HA   CYS  73           HA       CYS  73   9.499  11.700  -3.024
  444    HB2  CYS  73           HB1      CYS  73   9.789   9.850  -1.373
  445    HB3  CYS  73           HB2      CYS  73  10.085   9.370  -3.044
  446    H    GLN  74           H        GLN  74   8.915  12.061  -0.740
  447    HA   GLN  74           HA       GLN  74  10.898  13.796   0.573
  448    HB2  GLN  74           HB1      GLN  74   8.529  14.608  -0.320
  449    HB3  GLN  74           HB2      GLN  74   8.000  13.973   1.246
  450    HG2  GLN  74           HG1      GLN  74  10.369  15.647   1.475
  451    HG3  GLN  74           HG2      GLN  74   8.993  16.495   0.755
  452   HE21  GLN  74          HE21      GLN  74   7.796  17.526   2.167
  453   HE22  GLN  74          HE22      GLN  74   7.503  17.054   3.803
  454    H    ARG  75           H        ARG  75   8.810  11.060   0.943
  455    HA   ARG  75           HA       ARG  75   9.806  10.719   3.690
  456    HB2  ARG  75           HB1      ARG  75   7.055  10.896   2.759
  457    HB3  ARG  75           HB2      ARG  75   7.369   9.378   3.613
  458    HG2  ARG  75           HG1      ARG  75   7.913  10.450   5.608
  459    HG3  ARG  75           HG2      ARG  75   8.200  11.998   4.796
  460    HD2  ARG  75           HD1      ARG  75   5.512  11.209   4.261
  461    HD3  ARG  75           HD2      ARG  75   5.808  11.044   5.997
  462    HE   ARG  75           HE       ARG  75   5.586  13.476   4.525
  463   HH11  ARG  75          HH11      ARG  75   7.122  11.994   7.274
  464   HH12  ARG  75          HH12      ARG  75   7.320  13.486   8.133
  465   HH21  ARG  75          HH21      ARG  75   5.840  15.447   5.645
  466   HH22  ARG  75          HH22      ARG  75   6.589  15.449   7.205
  467    H    ASP  76           H        ASP  76   9.557   8.392   4.429
  468    HA   ASP  76           HA       ASP  76  10.817   6.700   2.489
  469    HB2  ASP  76           HB1      ASP  76   9.758   5.689   5.112
  470    HB3  ASP  76           HB2      ASP  76  11.230   5.226   4.246
  471    HD2  ASP  76           HD       ASP  76  13.097   7.586   5.879
  472    H    ALA  77           H        ALA  77   7.697   6.649   4.190
  473    HA   ALA  77           HA       ALA  77   6.767   4.345   2.748
  474    HB1  ALA  77           HB1      ALA  77   4.886   6.155   4.178
  475    HB2  ALA  77           HB2      ALA  77   4.933   4.393   4.114
  476    HB3  ALA  77           HB3      ALA  77   6.088   5.269   5.118
  477    H    MET  78           H        MET  78   6.704   7.772   2.283
  478    HA   MET  78           HA       MET  78   4.469   8.135   0.698
  479    HB2  MET  78           HB1      MET  78   7.005   9.516   1.145
  480    HB3  MET  78           HB2      MET  78   6.375   9.748  -0.494
  481    HG2  MET  78           HG1      MET  78   4.136  10.300   0.709
  482    HG3  MET  78           HG2      MET  78   5.173  10.549   2.117
  483    HE1  MET  78           HE1      MET  78   6.006  11.400  -1.738
  484    HE2  MET  78           HE2      MET  78   4.275  11.587  -1.457
  485    HE3  MET  78           HE3      MET  78   5.276  13.005  -1.772
  486    H    CYS  79           H        CYS  79   7.490   6.586  -0.062
  487    HA   CYS  79           HA       CYS  79   6.933   6.512  -2.910
  488    HB2  CYS  79           HB1      CYS  79   9.256   6.493  -1.444
  489    HB3  CYS  79           HB2      CYS  79   9.087   4.795  -1.888
  490    H    CYS  80           H        CYS  80   7.642   4.105  -3.777
  491    HA   CYS  80           HA       CYS  80   5.377   2.514  -3.362
  492    HB2  CYS  80           HB1      CYS  80   8.079   1.934  -4.575
  493    HB3  CYS  80           HB2      CYS  80   6.806   0.715  -4.508
  494    HA   PRO  81           HA       PRO  81   6.202   0.115   0.218
  495    HB2  PRO  81           HB1      PRO  81   5.108  -2.301  -0.465
  496    HB3  PRO  81           HB2      PRO  81   4.150  -0.866  -0.100
  497    HG2  PRO  81           HG1      PRO  81   4.986  -1.969  -2.762
  498    HG3  PRO  81           HG2      PRO  81   3.373  -1.357  -2.236
  499    HD2  PRO  81           HD1      PRO  81   5.080   0.123  -3.742
  500    HD3  PRO  81           HD2      PRO  81   3.999   0.840  -2.537
  501    H    GLY  82           H        GLY  82   8.187  -0.515   0.791
  502    HA2  GLY  82           HA2      GLY  82   9.759  -2.325   0.979
  503    HA3  GLY  82           HA3      GLY  82   9.421  -2.738  -0.695
  504    HA1  GLY  82           HA1      GLY  82   9.718  -1.444   0.964
  505    H    THR  83           H        THR  83   9.791   0.597   0.014
  506    HA   THR  83           HA       THR  83  12.588   0.537  -0.898
  507    HB   THR  83           HB       THR  83  12.161   2.542  -2.283
  508    HG1  THR  83           HG1      THR  83   9.790   2.809  -2.772
  509   HG21  THR  83          HG21      THR  83  12.201   0.611  -3.576
  510   HG22  THR  83          HG22      THR  83  10.637   1.312  -3.992
  511   HG23  THR  83          HG23      THR  83  10.728  -0.027  -2.849
  512    H    LEU  84           H        LEU  84  13.779   2.537  -0.434
  513    HA   LEU  84           HA       LEU  84  12.699   3.958   1.911
  514    HB2  LEU  84           HB1      LEU  84  14.642   2.196   2.170
  515    HB3  LEU  84           HB2      LEU  84  15.632   3.545   1.584
  516    HG   LEU  84           HG       LEU  84  14.672   4.905   3.499
  517   HD11  LEU  84          HD11      LEU  84  14.151   2.503   5.064
  518   HD12  LEU  84          HD12      LEU  84  12.976   2.766   3.775
  519   HD13  LEU  84          HD13      LEU  84  13.256   4.022   4.980
  520   HD21  LEU  84          HD21      LEU  84  16.918   3.509   3.326
  521   HD22  LEU  84          HD22      LEU  84  16.165   2.605   4.640
  522   HD23  LEU  84          HD23      LEU  84  16.446   4.339   4.810
  523    H    CYS  85           H        CYS  85  13.032   6.142   2.026
  524    HA   CYS  85           HA       CYS  85  13.728   7.460  -0.443
  525    HB2  CYS  85           HB1      CYS  85  11.867   8.061   1.316
  526    HB3  CYS  85           HB2      CYS  85  13.181   8.933   2.107
  527    H    VAL  86           H        VAL  86  15.891   7.357  -0.823
  528    HA   VAL  86           HA       VAL  86  17.701   8.333   1.282
  529    HB   VAL  86           HB       VAL  86  18.349   6.749  -1.208
  530   HG11  VAL  86          HG11      VAL  86  20.602   6.575  -0.276
  531   HG12  VAL  86          HG12      VAL  86  20.164   8.257  -0.579
  532   HG13  VAL  86          HG13      VAL  86  20.132   7.617   1.065
  533   HG21  VAL  86          HG21      VAL  86  17.227   5.839   1.123
  534   HG22  VAL  86          HG22      VAL  86  18.162   4.866  -0.013
  535   HG23  VAL  86          HG23      VAL  86  18.949   5.577   1.395
  536    H    ASN  87           H        ASN  87  18.587  10.279   1.075
  537    HA   ASN  87           HA       ASN  87  19.159  12.309   0.222
  538    HB2  ASN  87           HB1      ASN  87  20.522  10.449  -1.202
  539    HB3  ASN  87           HB2      ASN  87  19.637  11.256  -2.504
  540   HD21  ASN  87          HD21      ASN  87  19.862  13.570  -2.708
  541   HD22  ASN  87          HD22      ASN  87  21.342  14.323  -2.228
  542    H    ASP  88           H        ASP  88  16.424  11.751   0.180
  543    HA   ASP  88           HA       ASP  88  14.471  12.588  -0.632
  544    HB2  ASP  88           HB1      ASP  88  16.492  14.489  -1.358
  545    HB3  ASP  88           HB2      ASP  88  15.308  14.382  -2.669
  546    HD2  ASP  88           HD       ASP  88  12.741  15.575  -0.560
  547    H    VAL  89           H        VAL  89  15.982  10.370  -1.990
  548    HA   VAL  89           HA       VAL  89  14.352  10.333  -4.428
  549    HB   VAL  89           HB       VAL  89  17.243   9.461  -4.359
  550   HG11  VAL  89          HG11      VAL  89  15.153   9.468  -6.525
  551   HG12  VAL  89          HG12      VAL  89  16.882   9.322  -6.853
  552   HG13  VAL  89          HG13      VAL  89  16.059   8.094  -5.890
  553   HG21  VAL  89          HG21      VAL  89  17.033  11.438  -6.246
  554   HG22  VAL  89          HG22      VAL  89  15.988  12.031  -4.954
  555   HG23  VAL  89          HG23      VAL  89  17.675  11.644  -4.617
  556    H    CYS  90           H        CYS  90  13.419   8.403  -4.873
  557    HA   CYS  90           HA       CYS  90  13.186   6.460  -2.881
  558    HB2  CYS  90           HB1      CYS  90  11.813   7.023  -5.132
  559    HB3  CYS  90           HB2      CYS  90  12.714   5.608  -5.684
  560    H    THR  91           H        THR  91  14.248   4.622  -2.411
  561    HA   THR  91           HA       THR  91  16.089   3.428  -4.304
  562    HB   THR  91           HB       THR  91  17.091   4.530  -1.671
  563    HG1  THR  91           HG1      THR  91  18.139   5.129  -4.224
  564   HG21  THR  91          HG21      THR  91  18.540   2.920  -3.779
  565   HG22  THR  91          HG22      THR  91  18.066   2.336  -2.183
  566   HG23  THR  91          HG23      THR  91  19.264   3.623  -2.332
  567    H    THR  92           H        THR  92  15.527   1.360  -4.211
  568    HA   THR  92           HA       THR  92  14.086   0.090  -2.232
  569    HB   THR  92           HB       THR  92  16.012  -1.689  -3.547
  570    HG1  THR  92           HG1      THR  92  15.362  -1.238  -5.630
  571   HG21  THR  92          HG21      THR  92  13.095  -1.493  -3.052
  572   HG22  THR  92          HG22      THR  92  14.191  -2.859  -2.842
  573   HG23  THR  92          HG23      THR  92  13.610  -2.433  -4.451
  574    H    MET  93           H        MET  93  14.569  -1.167  -0.456
  575    HA   MET  93           HA       MET  93  16.757  -0.447   1.116
  576    HB2  MET  93           HB1      MET  93  14.787  -2.714   1.222
  577    HB3  MET  93           HB2      MET  93  16.126  -2.634   2.378
  578    HG2  MET  93           HG1      MET  93  15.289  -0.216   2.819
  579    HG3  MET  93           HG2      MET  93  13.801  -0.789   2.063
  580    HE1  MET  93           HE1      MET  93  14.091   0.495   4.615
  581    HE2  MET  93           HE2      MET  93  13.201  -0.434   5.822
  582    HE3  MET  93           HE3      MET  93  14.963  -0.384   5.872
  583    H    GLU  94           H        GLU  94  16.336  -3.086  -1.157
  584    HA   GLU  94           HA       GLU  94  18.476  -4.709  -0.465
  585    HB2  GLU  94           HB1      GLU  94  17.125  -4.106  -3.081
  586    HB3  GLU  94           HB2      GLU  94  18.523  -5.192  -3.016
  587    HG2  GLU  94           HG1      GLU  94  15.999  -5.572  -1.410
  588    HG3  GLU  94           HG2      GLU  94  16.332  -6.351  -2.961
  589    HE2  GLU  94           HE       GLU  94  19.031  -8.149  -1.320
  590    H    ASP  95           H        ASP  95  18.423  -1.712  -2.292
  591    HA   ASP  95           HA       ASP  95  21.290  -1.904  -2.819
  592    HB2  ASP  95           HB1      ASP  95  19.489  -1.099  -4.515
  593    HB3  ASP  95           HB2      ASP  95  19.558   0.419  -3.611
  594    HD2  ASP  95           HD       ASP  95  22.280   1.355  -5.437
  595    H    ALA  96           H        ALA  96  18.992  -0.172  -0.848
  596    HA   ALA  96           HA       ALA  96  20.788   1.875   0.010
  597    HB1  ALA  96           HB1      ALA  96  18.622   1.259   1.856
  598    HB2  ALA  96           HB2      ALA  96  18.983   2.752   0.989
  599    HB3  ALA  96           HB3      ALA  96  18.076   1.467   0.192
  600    H    THR  97           H        THR  97  20.911   2.075   2.596
  601    HA   THR  97           HA       THR  97  22.050   1.401   4.449
  602    HB   THR  97           HB       THR  97  21.096  -1.397   3.860
  603    HG1  THR  97           HG1      THR  97  19.112  -0.787   4.294
  604   HG21  THR  97          HG21      THR  97  21.424  -1.830   6.085
  605   HG22  THR  97          HG22      THR  97  21.145  -0.157   6.564
  606   HG23  THR  97          HG23      THR  97  22.683  -0.620   5.837
  607    H    GLU  98           H        GLU  98  23.972   1.838   3.028
  608    HA   GLU  98           HA       GLU  98  25.411  -0.496   2.087
  609    HB2  GLU  98           HB1      GLU  98  25.936   2.468   2.043
  610    HB3  GLU  98           HB2      GLU  98  27.207   1.309   1.628
  611    HG2  GLU  98           HG1      GLU  98  24.839   0.618   0.192
  612    HG3  GLU  98           HG2      GLU  98  25.171   2.342  -0.027
  613    HE2  GLU  98           HE       GLU  98  27.212  -0.034  -2.185
  614    H    ASN  99           H        ASN  99  25.652  -1.580   4.118
  615    HA   ASN  99           HA       ASN  99  27.452  -0.305   6.044
  616    HB2  ASN  99           HB1      ASN  99  25.201  -1.960   6.334
  617    HB3  ASN  99           HB2      ASN  99  26.585  -2.964   6.788
  618   HD21  ASN  99          HD21      ASN  99  26.079  -3.023   8.947
  619   HD22  ASN  99          HD22      ASN  99  26.224  -1.648   9.983
  620    H    LEU 100           H        LEU 100  28.919  -2.104   7.153
  621    HA   LEU 100           HA       LEU 100  30.551  -3.186   4.980
  622    HB2  LEU 100           HB1      LEU 100  31.218  -1.736   7.200
  623    HB3  LEU 100           HB2      LEU 100  31.561  -3.394   7.725
  624    HG   LEU 100           HG       LEU 100  32.786  -3.309   5.280
  625   HD11  LEU 100          HD11      LEU 100  33.713  -1.290   4.812
  626   HD12  LEU 100          HD12      LEU 100  33.694  -0.764   6.495
  627   HD13  LEU 100          HD13      LEU 100  32.209  -0.731   5.546
  628   HD21  LEU 100          HD21      LEU 100  33.745  -2.871   8.083
  629   HD22  LEU 100          HD22      LEU 100  34.875  -2.861   6.729
  630   HD23  LEU 100          HD23      LEU 100  33.905  -4.298   7.058
  631    H    TYR 101           H        TYR 101  31.818  -5.252   5.717
  632    HA   TYR 101           HA       TYR 101  29.888  -7.147   6.886
  633    HB2  TYR 101           HB1      TYR 101  30.580  -7.127   4.261
  634    HB3  TYR 101           HB2      TYR 101  31.819  -8.204   4.911
  635    HD1  TYR 101           HD1      TYR 101  28.144  -7.731   4.706
  636    HD2  TYR 101           HD2      TYR 101  31.337 -10.442   5.451
  637    HE1  TYR 101           HE1      TYR 101  26.548  -9.601   4.702
  638    HE2  TYR 101           HE2      TYR 101  29.750 -12.321   5.447
  639    HH   TYR 101           HH       TYR 101  27.268 -12.633   5.880
  640    H    PHE 102           H        PHE 102  31.917  -5.781   8.319
  641    HA   PHE 102           HA       PHE 102  33.643  -6.129   9.762
  642    HB2  PHE 102           HB1      PHE 102  32.765  -9.020   9.541
  643    HB3  PHE 102           HB2      PHE 102  33.719  -8.319  10.848
  644    HD1  PHE 102           HD1      PHE 102  32.669  -6.467  12.249
  645    HD2  PHE 102           HD2      PHE 102  30.430  -9.009   9.671
  646    HE1  PHE 102           HE1      PHE 102  30.615  -5.906  13.483
  647    HE2  PHE 102           HE2      PHE 102  28.374  -8.451  10.900
  648    HZ   PHE 102           HZ       PHE 102  28.463  -6.896  12.808
  649    H    GLN 103           H        GLN 103  35.518  -8.021  10.156
  650    HA   GLN 103           HA       GLN 103  36.999  -7.950   7.632
  651    HB2  GLN 103           HB1      GLN 103  37.692  -7.720  10.457
  652    HB3  GLN 103           HB2      GLN 103  38.736  -8.859   9.592
  653    HG2  GLN 103           HG1      GLN 103  39.929  -7.152   8.849
  654    HG3  GLN 103           HG2      GLN 103  38.515  -6.622   7.928
  655   HE21  GLN 103          HE21      GLN 103  38.175  -4.546   8.206
  656   HE22  GLN 103          HE22      GLN 103  38.317  -3.676   9.692
  657    H    SER 104           H        SER 104  36.958 -10.208  10.391
  658    HA   SER 104           HA       SER 104  36.033 -12.435   8.955
  659    HB2  SER 104           HB1      SER 104  38.474 -13.574   9.169
  660    HB3  SER 104           HB2      SER 104  37.897 -12.786   7.689
  661    HG   SER 104           HG       SER 104  40.055 -12.164   8.727
  662    H    LEU 105           H        LEU 105  38.459 -11.575  11.419
  663    HA   LEU 105           HA       LEU 105  36.894 -12.871  13.467
  664    HB2  LEU 105           HB1      LEU 105  38.679 -14.379  14.201
  665    HB3  LEU 105           HB2      LEU 105  38.092 -14.773  12.576
  666    HG   LEU 105           HG       LEU 105  40.519 -13.066  12.818
  667   HD11  LEU 105          HD11      LEU 105  40.392 -16.004  13.431
  668   HD12  LEU 105          HD12      LEU 105  41.151 -14.716  14.365
  669   HD13  LEU 105          HD13      LEU 105  41.858 -15.226  12.831
  670   HD21  LEU 105          HD21      LEU 105  41.040 -14.777  10.869
  671   HD22  LEU 105          HD22      LEU 105  40.026 -13.357  10.611
  672   HD23  LEU 105          HD23      LEU 105  39.283 -14.936  10.868
  673    H    GLU 106           H        GLU 106  38.503 -12.945  15.557
  674    HA   GLU 106           HA       GLU 106  40.058 -10.471  15.650
  675    HB2  GLU 106           HB1      GLU 106  37.566 -11.052  17.204
  676    HB3  GLU 106           HB2      GLU 106  38.857 -10.109  17.964
  677    HG2  GLU 106           HG1      GLU 106  37.889  -8.328  17.050
  678    HG3  GLU 106           HG2      GLU 106  38.600  -8.888  15.530
  679    HE2  GLU 106           HE       GLU 106  34.716  -9.536  16.075
  680    H    HIS 107           H        HIS 107  41.910 -10.768  16.697
  681    HA   HIS 107           HA       HIS 107  42.392 -13.264  18.071
  682    HB2  HIS 107           HB1      HIS 107  43.993 -11.144  16.857
  683    HB3  HIS 107           HB2      HIS 107  44.656 -11.690  18.401
  684    HD1  HIS 107           HD1      HIS 107  44.435 -14.606  18.432
  685    HD2  HIS 107           HD2      HIS 107  45.231 -12.555  14.907
  686    HE1  HIS 107           HE1      HIS 107  45.514 -16.287  16.905
  687    HE2  HIS 107           HE2      HIS 107  46.001 -15.036  14.749
  688    H    HIS 108           H        HIS 108  43.981 -12.902  20.098
  689    HA   HIS 108           HA       HIS 108  43.287 -10.768  21.855
  690    HB2  HIS 108           HB1      HIS 108  41.616 -13.141  21.847
  691    HB3  HIS 108           HB2      HIS 108  42.387 -12.907  23.419
  692    HD1  HIS 108           HD1      HIS 108  42.310  -9.860  23.655
  693    HD2  HIS 108           HD2      HIS 108  39.113 -12.155  22.323
  694    HE1  HIS 108           HE1      HIS 108  40.261  -8.462  24.067
  695    HE2  HIS 108           HE2      HIS 108  38.305  -9.864  23.252
  696    H    HIS 109           H        HIS 109  44.279 -11.036  24.010
  697    HA   HIS 109           HA       HIS 109  46.599 -12.847  23.883
  698    HB2  HIS 109           HB1      HIS 109  46.492 -10.029  24.168
  699    HB3  HIS 109           HB2      HIS 109  47.015 -10.684  25.725
  700    HD1  HIS 109           HD1      HIS 109  49.468 -10.763  25.893
  701    HD2  HIS 109           HD2      HIS 109  48.177 -11.487  22.011
  702    HE1  HIS 109           HE1      HIS 109  51.559 -11.140  24.548
  703    HE2  HIS 109           HE2      HIS 109  50.771 -11.582  22.174
  704    H    HIS 110           H        HIS 110  47.561 -12.721  26.385
  705    HA   HIS 110           HA       HIS 110  45.333 -13.454  28.157
  706    HB2  HIS 110           HB1      HIS 110  47.395 -15.193  27.093
  707    HB3  HIS 110           HB2      HIS 110  47.456 -15.144  28.858
  708    HD1  HIS 110           HD1      HIS 110  46.256 -17.370  26.640
  709    HD2  HIS 110           HD2      HIS 110  44.295 -15.174  29.572
  710    HE1  HIS 110           HE1      HIS 110  44.148 -18.647  27.139
  711    HE2  HIS 110           HE2      HIS 110  42.947 -17.307  28.930
  712    H    HIS 111           H        HIS 111  45.503 -11.631  29.407
  713    HA   HIS 111           HA       HIS 111  47.987 -10.614  30.365
  714    HB2  HIS 111           HB1      HIS 111  45.444  -9.621  30.179
  715    HB3  HIS 111           HB2      HIS 111  45.570  -9.945  31.911
  716    HD1  HIS 111           HD1      HIS 111  48.287  -8.601  29.626
  717    HD2  HIS 111           HD2      HIS 111  46.039  -7.470  32.931
  718    HE1  HIS 111           HE1      HIS 111  49.239  -6.393  30.362
  719    HE2  HIS 111           HE2      HIS 111  47.865  -5.699  32.383
  720    H    HIS 112           H        HIS 112  48.365 -10.325  32.770
  721    HA   HIS 112           HA       HIS 112  47.481 -12.615  34.358
  722    HB2  HIS 112           HB1      HIS 112  50.321 -11.984  33.596
  723    HB3  HIS 112           HB2      HIS 112  49.968 -12.796  35.124
  724    HD1  HIS 112           HD1      HIS 112  50.332 -13.433  31.535
  725    HD2  HIS 112           HD2      HIS 112  48.688 -15.374  34.819
  726    HE1  HIS 112           HE1      HIS 112  50.009 -15.820  30.812
  727    HE2  HIS 112           HE2      HIS 112  49.004 -17.008  32.819
  Start of MODEL   42
    1    H1   MET  18           H        MET  18  -2.243  16.047  24.034
    2    HA   MET  18           HA       MET  18  -0.302  16.284  22.605
    3    HB2  MET  18           HB1      MET  18   0.302  15.328  25.403
    4    HB3  MET  18           HB2      MET  18   1.564  15.919  24.311
    5    HG2  MET  18           HG1      MET  18   0.103  18.031  24.083
    6    HG3  MET  18           HG2      MET  18  -0.713  17.429  25.528
    7    HE1  MET  18           HE1      MET  18   1.558  17.130  28.174
    8    HE2  MET  18           HE2      MET  18   0.747  18.696  28.192
    9    HE3  MET  18           HE3      MET  18  -0.088  17.276  27.558
   10    H    LEU  19           H        LEU  19  -1.166  14.116  21.429
   11    HA   LEU  19           HA       LEU  19  -0.571  12.211  20.339
   12    HB2  LEU  19           HB1      LEU  19   1.622  13.811  20.346
   13    HB3  LEU  19           HB2      LEU  19   2.261  12.353  21.125
   14    HG   LEU  19           HG       LEU  19   0.887  11.439  18.863
   15   HD11  LEU  19          HD11      LEU  19   2.367  12.800  17.173
   16   HD12  LEU  19          HD12      LEU  19   2.230  14.056  18.402
   17   HD13  LEU  19          HD13      LEU  19   0.777  13.384  17.663
   18   HD21  LEU  19          HD21      LEU  19   3.022  10.647  19.971
   19   HD22  LEU  19          HD22      LEU  19   3.851  11.913  19.064
   20   HD23  LEU  19          HD23      LEU  19   3.003  10.624  18.208
   21    H    VAL  20           H        VAL  20  -1.304  12.058  23.144
   22    HA   VAL  20           HA       VAL  20   0.367   9.953  24.254
   23    HB   VAL  20           HB       VAL  20  -2.205  11.094  25.354
   24   HG11  VAL  20          HG11      VAL  20  -1.972   9.205  26.590
   25   HG12  VAL  20          HG12      VAL  20  -0.231   9.106  26.312
   26   HG13  VAL  20          HG13      VAL  20  -0.873  10.241  27.501
   27   HG21  VAL  20          HG21      VAL  20  -0.029  11.980  26.871
   28   HG22  VAL  20          HG22      VAL  20   0.430  12.236  25.187
   29   HG23  VAL  20          HG23      VAL  20  -1.059  12.943  25.813
   30    H    LEU  21           H        LEU  21  -0.220   7.831  24.507
   31    HA   LEU  21           HA       LEU  21  -1.865   6.649  22.593
   32    HB2  LEU  21           HB1      LEU  21  -1.681   4.592  23.977
   33    HB3  LEU  21           HB2      LEU  21  -0.133   5.382  23.631
   34    HG   LEU  21           HG       LEU  21  -0.719   6.472  26.042
   35   HD11  LEU  21          HD11      LEU  21  -2.719   5.176  26.379
   36   HD12  LEU  21          HD12      LEU  21  -1.472   4.616  27.491
   37   HD13  LEU  21          HD13      LEU  21  -1.850   3.678  26.048
   38   HD21  LEU  21          HD21      LEU  21   0.907   4.192  25.096
   39   HD22  LEU  21          HD22      LEU  21   0.679   4.332  26.840
   40   HD23  LEU  21          HD23      LEU  21   1.393   5.666  25.933
   41    H    ASP  22           H        ASP  22  -3.917   5.749  22.655
   42    HA   ASP  22           HA       ASP  22  -5.575   5.671  24.932
   43    HB2  ASP  22           HB1      ASP  22  -5.316   8.220  24.322
   44    HB3  ASP  22           HB2      ASP  22  -6.503   7.824  23.071
   45    HD2  ASP  22           HD       ASP  22  -9.051   7.432  25.394
   46    H    PHE  23           H        PHE  23  -5.057   3.793  23.081
   47    HA   PHE  23           HA       PHE  23  -7.672   3.431  21.833
   48    HB2  PHE  23           HB1      PHE  23  -6.732   2.731  19.704
   49    HB3  PHE  23           HB2      PHE  23  -6.217   4.378  20.074
   50    HD1  PHE  23           HD1      PHE  23  -3.929   4.927  20.465
   51    HD2  PHE  23           HD2      PHE  23  -5.111   0.883  19.869
   52    HE1  PHE  23           HE1      PHE  23  -1.572   4.285  20.174
   53    HE2  PHE  23           HE2      PHE  23  -2.755   0.234  19.578
   54    HZ   PHE  23           HZ       PHE  23  -0.982   1.936  19.731
   55    H    ASN  24           H        ASN  24  -8.368   1.338  21.796
   56    HA   ASN  24           HA       ASN  24  -6.567  -0.867  22.213
   57    HB2  ASN  24           HB1      ASN  24  -8.239   0.236  24.430
   58    HB3  ASN  24           HB2      ASN  24  -8.091  -1.522  24.296
   59   HD21  ASN  24          HD21      ASN  24  -5.797  -2.313  23.997
   60   HD22  ASN  24          HD22      ASN  24  -4.592  -1.568  24.987
   61    H    ASN  25           H        ASN  25  -7.796  -2.962  22.371
   62    HA   ASN  25           HA       ASN  25 -10.133  -2.808  20.606
   63    HB2  ASN  25           HB1      ASN  25  -8.351  -5.163  21.289
   64    HB3  ASN  25           HB2      ASN  25  -9.688  -5.189  20.135
   65   HD21  ASN  25          HD21      ASN  25  -9.517  -3.306  18.483
   66   HD22  ASN  25          HD22      ASN  25  -7.969  -3.138  17.734
   67    H    ILE  26           H        ILE  26 -11.681  -2.305  22.196
   68    HA   ILE  26           HA       ILE  26 -12.262  -4.500  24.077
   69    HB   ILE  26           HB       ILE  26 -13.122  -1.627  24.401
   70   HG12  ILE  26          HG11      ILE  26 -11.308  -2.186  26.412
   71   HG13  ILE  26          HG12      ILE  26 -10.573  -2.935  24.984
   72   HG21  ILE  26          HG21      ILE  26 -12.979  -3.730  26.532
   73   HG22  ILE  26          HG22      ILE  26 -13.900  -2.226  26.516
   74   HG23  ILE  26          HG23      ILE  26 -14.394  -3.574  25.491
   75   HD11  ILE  26          HD11      ILE  26 -10.240  -0.947  23.925
   76   HD12  ILE  26          HD12      ILE  26 -11.595  -0.160  24.734
   77   HD13  ILE  26          HD13      ILE  26 -10.087  -0.433  25.605
   78    H    ARG  27           H        ARG  27 -13.797  -5.712  23.155
   79    HA   ARG  27           HA       ARG  27 -15.935  -4.448  21.625
   80    HB2  ARG  27           HB1      ARG  27 -14.542  -6.839  21.347
   81    HB3  ARG  27           HB2      ARG  27 -16.133  -7.332  21.945
   82    HG2  ARG  27           HG1      ARG  27 -17.255  -6.422  20.099
   83    HG3  ARG  27           HG2      ARG  27 -15.845  -5.459  19.624
   84    HD2  ARG  27           HD1      ARG  27 -14.635  -7.681  19.266
   85    HD3  ARG  27           HD2      ARG  27 -16.234  -8.429  19.388
   86    HE   ARG  27           HE       ARG  27 -16.382  -6.368  17.504
   87   HH11  ARG  27          HH11      ARG  27 -14.862  -9.473  17.920
   88   HH12  ARG  27          HH12      ARG  27 -14.821  -9.825  16.224
   89   HH21  ARG  27          HH21      ARG  27 -16.334  -6.822  15.269
   90   HH22  ARG  27          HH22      ARG  27 -15.657  -8.316  14.717
   91    H    SER  28           H        SER  28 -18.174  -5.463  21.958
   92    HA   SER  28           HA       SER  28 -18.866  -6.428  24.545
   93    HB2  SER  28           HB1      SER  28 -18.360  -3.838  24.750
   94    HB3  SER  28           HB2      SER  28 -19.991  -3.697  24.071
   95    HG   SER  28           HG       SER  28 -20.081  -3.757  26.334
   96    H    SER  29           H        SER  29 -21.457  -5.794  24.784
   97    HA   SER  29           HA       SER  29 -22.732  -7.388  22.888
   98    HB2  SER  29           HB1      SER  29 -23.667  -5.468  24.989
   99    HB3  SER  29           HB2      SER  29 -24.842  -6.083  23.813
  100    HG   SER  29           HG       SER  29 -24.926  -7.652  25.249
  101    H    ALA  30           H        ALA  30 -23.282  -3.888  23.302
  102    HA   ALA  30           HA       ALA  30 -24.176  -3.710  20.539
  103    HB1  ALA  30           HB1      ALA  30 -25.286  -1.826  21.130
  104    HB2  ALA  30           HB2      ALA  30 -25.124  -2.527  22.741
  105    HB3  ALA  30           HB3      ALA  30 -24.003  -1.274  22.206
  106    H    ASP  31           H        ASP  31 -23.138  -2.641  18.921
  107    HA   ASP  31           HA       ASP  31 -20.618  -1.276  19.549
  108    HB2  ASP  31           HB1      ASP  31 -20.972  -3.749  18.002
  109    HB3  ASP  31           HB2      ASP  31 -20.048  -2.501  17.153
  110    HD2  ASP  31           HD       ASP  31 -18.137  -4.554  19.735
  111    H    LEU  32           H        LEU  32 -20.530   0.662  18.635
  112    HA   LEU  32           HA       LEU  32 -22.569   1.666  16.982
  113    HB2  LEU  32           HB1      LEU  32 -19.821   2.667  17.696
  114    HB3  LEU  32           HB2      LEU  32 -20.894   3.563  16.608
  115    HG   LEU  32           HG       LEU  32 -21.740   2.800  19.390
  116   HD11  LEU  32          HD11      LEU  32 -20.818   4.696  20.306
  117   HD12  LEU  32          HD12      LEU  32 -20.667   5.509  18.748
  118   HD13  LEU  32          HD13      LEU  32 -19.554   4.209  19.177
  119   HD21  LEU  32          HD21      LEU  32 -23.652   3.656  18.641
  120   HD22  LEU  32          HD22      LEU  32 -22.895   4.230  17.155
  121   HD23  LEU  32          HD23      LEU  32 -22.845   5.225  18.612
  122    H    HIS  33           H        HIS  33 -22.931   0.920  14.991
  123    HA   HIS  33           HA       HIS  33 -20.779   1.096  13.035
  124    HB2  HIS  33           HB1      HIS  33 -20.750  -1.244  13.869
  125    HB3  HIS  33           HB2      HIS  33 -22.432  -1.418  13.361
  126    HD1  HIS  33           HD1      HIS  33 -22.906  -1.815  10.892
  127    HD2  HIS  33           HD2      HIS  33 -18.892  -1.115  11.705
  128    HE1  HIS  33           HE1      HIS  33 -21.680  -2.388   8.772
  129    HE2  HIS  33           HE2      HIS  33 -19.227  -1.960   9.268
  130    H    GLY  34           H        GLY  34 -22.230   2.973  12.607
  131    HA2  GLY  34           HA2      GLY  34 -23.997   2.320  10.429
  132    HA3  GLY  34           HA3      GLY  34 -24.839   2.952  11.837
  133    HA1  GLY  34           HA1      GLY  34 -23.186   2.650  10.534
  134    H    ALA  35           H        ALA  35 -21.935   3.724   9.912
  135    HA   ALA  35           HA       ALA  35 -22.919   6.468   9.650
  136    HB1  ALA  35           HB1      ALA  35 -20.461   5.624  11.064
  137    HB2  ALA  35           HB2      ALA  35 -20.339   7.042  10.021
  138    HB3  ALA  35           HB3      ALA  35 -21.510   7.016  11.339
  139    H    ARG  36           H        ARG  36 -22.453   7.415   7.723
  140    HA   ARG  36           HA       ARG  36 -20.526   6.108   5.944
  141    HB2  ARG  36           HB1      ARG  36 -23.408   6.730   5.262
  142    HB3  ARG  36           HB2      ARG  36 -22.172   6.317   4.063
  143    HG2  ARG  36           HG1      ARG  36 -22.045   4.113   4.727
  144    HG3  ARG  36           HG2      ARG  36 -22.669   4.466   6.347
  145    HD2  ARG  36           HD1      ARG  36 -24.833   5.177   5.006
  146    HD3  ARG  36           HD2      ARG  36 -24.144   4.098   3.785
  147    HE   ARG  36           HE       ARG  36 -24.162   2.819   6.305
  148   HH11  ARG  36          HH11      ARG  36 -26.284   3.820   3.732
  149   HH12  ARG  36          HH12      ARG  36 -27.456   2.583   4.042
  150   HH21  ARG  36          HH21      ARG  36 -25.698   1.185   6.722
  151   HH22  ARG  36          HH22      ARG  36 -27.122   1.085   5.744
  152    H    LYS  37           H        LYS  37 -19.571   8.205   6.952
  153    HA   LYS  37           HA       LYS  37 -20.309  10.521   5.293
  154    HB2  LYS  37           HB1      LYS  37 -19.273  10.209   8.055
  155    HB3  LYS  37           HB2      LYS  37 -18.632  11.575   7.127
  156    HG2  LYS  37           HG1      LYS  37 -20.707  12.606   6.939
  157    HG3  LYS  37           HG2      LYS  37 -21.581  11.106   7.297
  158    HD2  LYS  37           HD1      LYS  37 -21.012  11.193   9.597
  159    HD3  LYS  37           HD2      LYS  37 -19.804  12.459   9.313
  160    HE2  LYS  37           HE1      LYS  37 -22.541  13.140   8.445
  161    HE3  LYS  37           HE2      LYS  37 -22.338  12.908  10.189
  162    HZ1  LYS  37           HZ1      LYS  37 -21.816  15.103   9.989
  163    HZ2  LYS  37           HZ2      LYS  37 -21.159  14.942   8.439
  164    HZ3  LYS  37           HZ3      LYS  37 -20.273  14.440   9.790
  165    H    GLY  38           H        GLY  38 -19.120  10.465   3.476
  166    HA2  GLY  38           HA2      GLY  38 -16.277  10.827   3.675
  167    HA3  GLY  38           HA3      GLY  38 -16.711   9.266   2.994
  168    HA1  GLY  38           HA1      GLY  38 -16.993  11.312   3.497
  169    H    SER  39           H        SER  39 -15.240  11.010   1.505
  170    HA   SER  39           HA       SER  39 -17.189  11.965  -0.491
  171    HB2  SER  39           HB1      SER  39 -14.513  13.163  -0.660
  172    HB3  SER  39           HB2      SER  39 -16.107  13.937  -0.689
  173    HG   SER  39           HG       SER  39 -14.375  13.838   1.321
  174    H    GLN  40           H        GLN  40 -13.749  11.049  -0.231
  175    HA   GLN  40           HA       GLN  40 -14.101   9.385  -2.629
  176    HB2  GLN  40           HB1      GLN  40 -12.596  11.769  -2.476
  177    HB3  GLN  40           HB2      GLN  40 -11.429  10.437  -2.511
  178    HG2  GLN  40           HG1      GLN  40 -11.653  10.760  -4.743
  179    HG3  GLN  40           HG2      GLN  40 -12.970   9.606  -4.486
  180   HE21  GLN  40          HE21      GLN  40 -14.004  10.402  -6.350
  181   HE22  GLN  40          HE22      GLN  40 -14.871  11.896  -6.326
  182    H    CYS  41           H        CYS  41 -11.559  10.174  -0.249
  183    HA   CYS  41           HA       CYS  41 -11.477   7.377   0.570
  184    HB2  CYS  41           HB1      CYS  41  -9.039   7.236   0.291
  185    HB3  CYS  41           HB2      CYS  41  -9.860   7.470  -1.253
  186    H    LEU  42           H        LEU  42 -10.590   7.043   2.621
  187    HA   LEU  42           HA       LEU  42 -10.501   9.441   4.274
  188    HB2  LEU  42           HB1      LEU  42 -11.227   6.656   4.644
  189    HB3  LEU  42           HB2      LEU  42 -10.127   7.226   5.912
  190    HG   LEU  42           HG       LEU  42 -11.776   9.170   6.205
  191   HD11  LEU  42          HD11      LEU  42 -14.030   8.813   5.495
  192   HD12  LEU  42          HD12      LEU  42 -13.623   7.237   4.819
  193   HD13  LEU  42          HD13      LEU  42 -12.986   8.704   4.077
  194   HD21  LEU  42          HD21      LEU  42 -13.221   6.755   7.009
  195   HD22  LEU  42          HD22      LEU  42 -12.557   8.062   7.989
  196   HD23  LEU  42          HD23      LEU  42 -11.511   6.753   7.437
  197    H    SER  43           H        SER  43  -8.415   6.951   3.049
  198    HA   SER  43           HA       SER  43  -6.075   8.394   3.797
  199    HB2  SER  43           HB1      SER  43  -7.048   6.713   5.788
  200    HB3  SER  43           HB2      SER  43  -5.785   5.752   4.999
  201    HG   SER  43           HG       SER  43  -4.582   7.926   5.211
  202    H    ASP  44           H        ASP  44  -4.083   6.732   3.481
  203    HA   ASP  44           HA       ASP  44  -4.124   6.052   0.751
  204    HB2  ASP  44           HB1      ASP  44  -1.934   4.885   1.281
  205    HB3  ASP  44           HB2      ASP  44  -2.023   6.596   1.720
  206    HD2  ASP  44           HD       ASP  44  -2.036   5.830   5.149
  207    H    THR  45           H        THR  45  -4.934   4.266   3.605
  208    HA   THR  45           HA       THR  45  -4.736   1.664   2.421
  209    HB   THR  45           HB       THR  45  -6.019   0.912   4.429
  210    HG1  THR  45           HG1      THR  45  -7.253   2.675   4.949
  211   HG21  THR  45          HG21      THR  45  -3.838   2.721   5.385
  212   HG22  THR  45          HG22      THR  45  -3.456   1.394   4.289
  213   HG23  THR  45          HG23      THR  45  -4.201   1.060   5.852
  214    H    ASP  46           H        ASP  46  -7.143   4.147   2.546
  215    HA   ASP  46           HA       ASP  46  -9.418   2.534   2.022
  216    HB2  ASP  46           HB1      ASP  46  -9.596   4.810   2.934
  217    HB3  ASP  46           HB2      ASP  46  -8.955   5.462   1.420
  218    HD2  ASP  46           HD       ASP  46 -12.757   4.542   1.605
  219    H    CYS  47           H        CYS  47  -6.911   3.880   0.031
  220    HA   CYS  47           HA       CYS  47  -8.101   3.950  -2.463
  221    HB2  CYS  47           HB1      CYS  47  -5.381   3.740  -1.411
  222    HB3  CYS  47           HB2      CYS  47  -5.566   2.956  -2.981
  223    H    ASN  48           H        ASN  48  -5.973   1.266  -1.497
  224    HA   ASN  48           HA       ASN  48  -7.928  -0.715  -2.236
  225    HB2  ASN  48           HB1      ASN  48  -5.719   0.067  -4.070
  226    HB3  ASN  48           HB2      ASN  48  -6.026  -1.665  -3.880
  227   HD21  ASN  48          HD21      ASN  48  -6.837   1.030  -5.602
  228   HD22  ASN  48          HD22      ASN  48  -8.339   0.497  -6.268
  229    H    THR  49           H        THR  49  -4.373  -0.734  -2.331
  230    HA   THR  49           HA       THR  49  -4.052  -1.864   0.251
  231    HB   THR  49           HB       THR  49  -4.976  -3.879  -0.642
  232    HG1  THR  49           HG1      THR  49  -2.232  -4.429  -0.915
  233   HG21  THR  49          HG21      THR  49  -4.176  -4.953  -2.660
  234   HG22  THR  49          HG22      THR  49  -2.972  -3.684  -2.893
  235   HG23  THR  49          HG23      THR  49  -4.689  -3.309  -3.035
  236    H    ARG  50           H        ARG  50  -2.754  -1.547  -3.019
  237    HA   ARG  50           HA       ARG  50  -0.103  -1.043  -1.836
  238    HB2  ARG  50           HB1      ARG  50   0.851  -1.817  -4.012
  239    HB3  ARG  50           HB2      ARG  50   0.016  -3.081  -3.098
  240    HG2  ARG  50           HG1      ARG  50  -2.015  -2.634  -4.530
  241    HG3  ARG  50           HG2      ARG  50  -0.961  -1.629  -5.539
  242    HD2  ARG  50           HD1      ARG  50   0.341  -4.134  -5.065
  243    HD3  ARG  50           HD2      ARG  50  -1.310  -4.435  -5.624
  244    HE   ARG  50           HE       ARG  50  -0.268  -2.506  -7.305
  245   HH11  ARG  50          HH11      ARG  50   0.455  -5.795  -6.423
  246   HH12  ARG  50          HH12      ARG  50   1.146  -6.193  -7.962
  247   HH21  ARG  50          HH21      ARG  50   0.639  -3.019  -9.335
  248   HH22  ARG  50          HH22      ARG  50   1.251  -4.613  -9.617
  249    H    LYS  51           H        LYS  51  -2.003   0.980  -2.099
  250    HA   LYS  51           HA       LYS  51  -0.581   2.772  -3.886
  251    HB2  LYS  51           HB1      LYS  51  -3.441   1.955  -4.264
  252    HB3  LYS  51           HB2      LYS  51  -2.946   3.606  -4.671
  253    HG2  LYS  51           HG1      LYS  51  -2.476   2.772  -6.688
  254    HG3  LYS  51           HG2      LYS  51  -1.019   2.130  -5.911
  255    HD2  LYS  51           HD1      LYS  51  -2.123   0.012  -5.478
  256    HD3  LYS  51           HD2      LYS  51  -3.639   0.649  -6.136
  257    HE2  LYS  51           HE1      LYS  51  -1.794   1.116  -8.161
  258    HE3  LYS  51           HE2      LYS  51  -1.338  -0.468  -7.514
  259    HZ1  LYS  51           HZ1      LYS  51  -4.178  -0.020  -7.992
  260    HZ2  LYS  51           HZ2      LYS  51  -3.248  -1.415  -8.220
  261    HZ3  LYS  51           HZ3      LYS  51  -3.195  -0.166  -9.361
  262    H    PHE  52           H        PHE  52  -1.050   5.020  -3.479
  263    HA   PHE  52           HA       PHE  52  -2.282   5.474  -0.840
  264    HB2  PHE  52           HB1      PHE  52  -0.656   7.373  -0.590
  265    HB3  PHE  52           HB2      PHE  52   0.081   5.769  -0.590
  266    HD1  PHE  52           HD1      PHE  52   1.846   5.289  -2.004
  267    HD2  PHE  52           HD2      PHE  52  -0.676   8.606  -2.872
  268    HE1  PHE  52           HE1      PHE  52   3.354   5.953  -3.832
  269    HE2  PHE  52           HE2      PHE  52   0.828   9.275  -4.702
  270    HZ   PHE  52           HZ       PHE  52   2.845   7.947  -5.183
  271    H    CYS  53           H        CYS  53  -3.449   7.388  -0.538
  272    HA   CYS  53           HA       CYS  53  -4.665   8.418  -2.950
  273    HB2  CYS  53           HB1      CYS  53  -5.458   8.066  -0.258
  274    HB3  CYS  53           HB2      CYS  53  -5.511   9.801  -0.573
  275    H    LEU  54           H        LEU  54  -3.340   9.794  -4.020
  276    HA   LEU  54           HA       LEU  54  -1.723  11.742  -2.669
  277    HB2  LEU  54           HB1      LEU  54  -0.925  10.801  -4.730
  278    HB3  LEU  54           HB2      LEU  54  -2.395  11.317  -5.574
  279    HG   LEU  54           HG       LEU  54  -1.354  13.688  -4.619
  280   HD11  LEU  54          HD11      LEU  54   0.725  12.732  -3.956
  281   HD12  LEU  54          HD12      LEU  54   1.001  13.625  -5.452
  282   HD13  LEU  54          HD13      LEU  54   0.881  11.865  -5.485
  283   HD21  LEU  54          HD21      LEU  54  -2.126  13.887  -6.728
  284   HD22  LEU  54          HD22      LEU  54  -1.564  12.284  -7.202
  285   HD23  LEU  54          HD23      LEU  54  -0.431  13.636  -7.148
  286    H    GLN  55           H        GLN  55  -2.424  13.608  -1.892
  287    HA   GLN  55           HA       GLN  55  -4.859  14.792  -3.043
  288    HB2  GLN  55           HB1      GLN  55  -5.240  14.310  -0.758
  289    HB3  GLN  55           HB2      GLN  55  -3.657  14.947  -0.286
  290    HG2  GLN  55           HG1      GLN  55  -4.427  17.021  -0.064
  291    HG3  GLN  55           HG2      GLN  55  -5.287  16.945  -1.609
  292   HE21  GLN  55          HE21      GLN  55  -7.239  17.716  -1.113
  293   HE22  GLN  55          HE22      GLN  55  -8.285  17.067   0.099
  294    HA   PRO  56           HA       PRO  56  -1.578  17.659  -4.450
  295    HB2  PRO  56           HB1      PRO  56  -2.911  18.405  -6.723
  296    HB3  PRO  56           HB2      PRO  56  -1.919  16.951  -6.609
  297    HG2  PRO  56           HG1      PRO  56  -4.891  17.253  -6.335
  298    HG3  PRO  56           HG2      PRO  56  -3.950  16.024  -7.260
  299    HD2  PRO  56           HD1      PRO  56  -5.062  15.501  -4.840
  300    HD3  PRO  56           HD2      PRO  56  -3.533  14.777  -5.367
  301    H    ARG  57           H        ARG  57  -1.520  19.909  -4.439
  302    HA   ARG  57           HA       ARG  57  -3.703  21.180  -3.034
  303    HB2  ARG  57           HB1      ARG  57  -2.232  23.098  -2.844
  304    HB3  ARG  57           HB2      ARG  57  -1.354  21.621  -2.416
  305    HG2  ARG  57           HG1      ARG  57  -0.603  21.657  -4.914
  306    HG3  ARG  57           HG2      ARG  57  -1.051  23.367  -4.813
  307    HD2  ARG  57           HD1      ARG  57   0.869  23.846  -3.791
  308    HD3  ARG  57           HD2      ARG  57   0.470  22.704  -2.500
  309    HE   ARG  57           HE       ARG  57   1.412  21.196  -4.625
  310   HH11  ARG  57          HH11      ARG  57   2.602  23.682  -2.498
  311   HH12  ARG  57          HH12      ARG  57   4.247  23.139  -2.571
  312   HH21  ARG  57          HH21      ARG  57   3.572  20.472  -4.729
  313   HH22  ARG  57          HH22      ARG  57   4.797  21.314  -3.841
  314    H    ASP  58           H        ASP  58  -2.233  21.295  -6.227
  315    HA   ASP  58           HA       ASP  58  -3.889  23.497  -7.096
  316    HB2  ASP  58           HB1      ASP  58  -1.463  22.511  -7.915
  317    HB3  ASP  58           HB2      ASP  58  -2.551  21.899  -9.167
  318    HD2  ASP  58           HD       ASP  58  -1.771  25.753  -9.067
  319    H    GLU  59           H        GLU  59  -4.053  20.054  -7.047
  320    HA   GLU  59           HA       GLU  59  -6.469  20.155  -8.732
  321    HB2  GLU  59           HB1      GLU  59  -4.325  18.055  -8.489
  322    HB3  GLU  59           HB2      GLU  59  -5.945  17.649  -9.080
  323    HG2  GLU  59           HG1      GLU  59  -5.195  19.904 -10.544
  324    HG3  GLU  59           HG2      GLU  59  -3.747  18.890 -10.463
  325    HE2  GLU  59           HE       GLU  59  -6.832  16.971 -12.040
  326    H    LYS  60           H        LYS  60  -7.724  17.911  -8.252
  327    HA   LYS  60           HA       LYS  60  -8.465  18.126  -5.446
  328    HB2  LYS  60           HB1      LYS  60 -10.367  16.632  -6.124
  329    HB3  LYS  60           HB2      LYS  60 -10.300  18.182  -6.977
  330    HG2  LYS  60           HG1      LYS  60 -10.207  17.173  -8.948
  331    HG3  LYS  60           HG2      LYS  60  -8.818  16.200  -8.430
  332    HD2  LYS  60           HD1      LYS  60 -10.298  14.505  -8.797
  333    HD3  LYS  60           HD2      LYS  60 -10.722  14.881  -7.118
  334    HE2  LYS  60           HE1      LYS  60 -12.201  16.632  -8.824
  335    HE3  LYS  60           HE2      LYS  60 -12.379  14.975  -9.420
  336    HZ1  LYS  60           HZ1      LYS  60 -12.652  14.771  -6.701
  337    HZ2  LYS  60           HZ2      LYS  60 -13.899  14.716  -7.843
  338    HZ3  LYS  60           HZ3      LYS  60 -13.499  16.181  -7.095
  339    HA   PRO  61           HA       PRO  61  -6.554  14.418  -4.080
  340    HB2  PRO  61           HB1      PRO  61  -8.365  13.526  -2.229
  341    HB3  PRO  61           HB2      PRO  61  -7.328  14.930  -1.978
  342    HG2  PRO  61           HG1      PRO  61 -10.180  14.812  -2.897
  343    HG3  PRO  61           HG2      PRO  61  -9.421  15.895  -1.672
  344    HD2  PRO  61           HD1      PRO  61  -9.973  16.706  -4.204
  345    HD3  PRO  61           HD2      PRO  61  -8.571  17.296  -3.293
  346    H    PHE  62           H        PHE  62  -6.377  12.449  -4.940
  347    HA   PHE  62           HA       PHE  62  -8.724  10.819  -5.431
  348    HB2  PHE  62           HB1      PHE  62  -7.958  10.358  -7.809
  349    HB3  PHE  62           HB2      PHE  62  -8.706  11.930  -7.523
  350    HD1  PHE  62           HD1      PHE  62  -7.702  13.785  -8.419
  351    HD2  PHE  62           HD2      PHE  62  -5.304  10.396  -7.480
  352    HE1  PHE  62           HE1      PHE  62  -5.733  14.923  -9.358
  353    HE2  PHE  62           HE2      PHE  62  -3.331  11.528  -8.417
  354    HZ   PHE  62           HZ       PHE  62  -3.543  13.795  -9.356
  355    H    CYS  63           H        CYS  63  -7.870   8.697  -6.637
  356    HA   CYS  63           HA       CYS  63  -5.709   7.718  -4.938
  357    HB2  CYS  63           HB1      CYS  63  -7.946   6.532  -5.180
  358    HB3  CYS  63           HB2      CYS  63  -7.435   6.099  -6.814
  359    H    ALA  64           H        ALA  64  -3.703   7.600  -5.669
  360    HA   ALA  64           HA       ALA  64  -3.271   7.401  -8.578
  361    HB1  ALA  64           HB1      ALA  64  -2.318   9.423  -8.022
  362    HB2  ALA  64           HB2      ALA  64  -1.791   8.862  -6.436
  363    HB3  ALA  64           HB3      ALA  64  -0.937   8.333  -7.886
  364    H    THR  65           H        THR  65  -1.274   6.262  -9.229
  365    HA   THR  65           HA       THR  65  -1.110   3.724  -7.888
  366    HB   THR  65           HB       THR  65   0.565   3.181  -9.685
  367    HG1  THR  65           HG1      THR  65   1.341   4.786 -10.810
  368   HG21  THR  65          HG21      THR  65  -1.088   3.153 -11.502
  369   HG22  THR  65          HG22      THR  65  -2.094   4.287 -10.599
  370   HG23  THR  65          HG23      THR  65  -1.806   2.665  -9.968
  371    H    CYS  66           H        CYS  66   1.151   2.729  -7.618
  372    HA   CYS  66           HA       CYS  66   2.534   4.253  -5.648
  373    HB2  CYS  66           HB1      CYS  66   2.272   1.596  -6.154
  374    HB3  CYS  66           HB2      CYS  66   3.892   1.888  -6.791
  375    H    ARG  67           H        ARG  67   5.056   4.255  -5.774
  376    HA   ARG  67           HA       ARG  67   5.773   5.516  -8.335
  377    HB2  ARG  67           HB1      ARG  67   7.196   5.905  -5.702
  378    HB3  ARG  67           HB2      ARG  67   7.307   6.901  -7.161
  379    HG2  ARG  67           HG1      ARG  67   4.602   6.949  -6.474
  380    HG3  ARG  67           HG2      ARG  67   5.482   7.099  -4.944
  381    HD2  ARG  67           HD1      ARG  67   6.362   9.130  -5.476
  382    HD3  ARG  67           HD2      ARG  67   6.481   8.732  -7.196
  383    HE   ARG  67           HE       ARG  67   3.775   8.958  -6.568
  384   HH11  ARG  67          HH11      ARG  67   6.615  10.965  -6.703
  385   HH12  ARG  67          HH12      ARG  67   5.735  12.412  -7.068
  386   HH21  ARG  67          HH21      ARG  67   2.604  10.856  -7.049
  387   HH22  ARG  67          HH22      ARG  67   3.453  12.349  -7.264
  388    H    GLY  68           H        GLY  68   8.067   5.316  -8.986
  389    HA2  GLY  68           HA2      GLY  68   8.967   2.558  -8.530
  390    HA3  GLY  68           HA3      GLY  68   9.421   3.577  -9.889
  391    HA1  GLY  68           HA1      GLY  68   8.952   3.136  -7.862
  392    H    LEU  69           H        LEU  69  11.608   2.862  -9.380
  393    HA   LEU  69           HA       LEU  69  12.838   3.656  -6.923
  394    HB2  LEU  69           HB1      LEU  69  13.744   2.469  -9.504
  395    HB3  LEU  69           HB2      LEU  69  14.953   3.243  -8.463
  396    HG   LEU  69           HG       LEU  69  13.167   0.944  -7.666
  397   HD11  LEU  69          HD11      LEU  69  15.218   0.727  -9.349
  398   HD12  LEU  69          HD12      LEU  69  14.854  -0.496  -8.133
  399   HD13  LEU  69          HD13      LEU  69  16.113   0.701  -7.829
  400   HD21  LEU  69          HD21      LEU  69  14.469   2.840  -6.072
  401   HD22  LEU  69          HD22      LEU  69  15.475   1.392  -6.012
  402   HD23  LEU  69          HD23      LEU  69  13.771   1.303  -5.560
  403    H    ARG  70           H        ARG  70  13.276   4.772 -10.286
  404    HA   ARG  70           HA       ARG  70  14.863   6.996  -9.644
  405    HB2  ARG  70           HB1      ARG  70  13.191   6.223 -12.014
  406    HB3  ARG  70           HB2      ARG  70  13.915   7.836 -11.934
  407    HG2  ARG  70           HG1      ARG  70  15.610   5.402 -11.511
  408    HG3  ARG  70           HG2      ARG  70  15.182   5.937 -13.144
  409    HD2  ARG  70           HD1      ARG  70  15.978   8.290 -12.057
  410    HD3  ARG  70           HD2      ARG  70  17.000   7.151 -11.169
  411    HE   ARG  70           HE       ARG  70  17.057   6.605 -13.955
  412   HH11  ARG  70          HH11      ARG  70  18.275   8.796 -11.539
  413   HH12  ARG  70          HH12      ARG  70  19.704   9.193 -12.433
  414   HH21  ARG  70          HH21      ARG  70  18.935   7.122 -15.142
  415   HH22  ARG  70          HH22      ARG  70  20.078   8.242 -14.483
  416    H    ARG  71           H        ARG  71  11.436   6.497  -9.531
  417    HA   ARG  71           HA       ARG  71  10.436   9.063  -9.737
  418    HB2  ARG  71           HB1      ARG  71   9.555   6.529  -8.634
  419    HB3  ARG  71           HB2      ARG  71   8.971   7.889  -7.665
  420    HG2  ARG  71           HG1      ARG  71   7.366   7.224  -9.402
  421    HG3  ARG  71           HG2      ARG  71   7.938   8.888  -9.605
  422    HD2  ARG  71           HD1      ARG  71   8.761   8.447 -11.634
  423    HD3  ARG  71           HD2      ARG  71   9.646   7.044 -11.017
  424    HE   ARG  71           HE       ARG  71   6.901   6.420 -11.292
  425   HH11  ARG  71          HH11      ARG  71   9.787   6.961 -13.162
  426   HH12  ARG  71          HH12      ARG  71   9.281   5.951 -14.477
  427   HH21  ARG  71          HH21      ARG  71   6.224   5.088 -13.016
  428   HH22  ARG  71          HH22      ARG  71   7.254   4.888 -14.393
  429    H    ARG  72           H        ARG  72  10.294  10.819  -8.429
  430    HA   ARG  72           HA       ARG  72  12.124  10.951  -6.202
  431    HB2  ARG  72           HB1      ARG  72  10.272  13.010  -7.422
  432    HB3  ARG  72           HB2      ARG  72  11.416  13.344  -6.114
  433    HG2  ARG  72           HG1      ARG  72  12.872  12.081  -8.189
  434    HG3  ARG  72           HG2      ARG  72  11.870  13.345  -8.920
  435    HD2  ARG  72           HD1      ARG  72  13.424  13.949  -6.430
  436    HD3  ARG  72           HD2      ARG  72  14.248  13.916  -7.995
  437    HE   ARG  72           HE       ARG  72  11.897  15.518  -8.090
  438   HH11  ARG  72          HH11      ARG  72  15.214  15.493  -7.033
  439   HH12  ARG  72          HH12      ARG  72  15.397  17.212  -7.139
  440   HH21  ARG  72          HH21      ARG  72  12.125  17.783  -8.233
  441   HH22  ARG  72          HH22      ARG  72  13.639  18.515  -7.821
  442    H    CYS  73           H        CYS  73  11.606  11.425  -4.058
  443    HA   CYS  73           HA       CYS  73   8.805  11.444  -3.263
  444    HB2  CYS  73           HB1      CYS  73   9.055   9.606  -1.682
  445    HB3  CYS  73           HB2      CYS  73   9.382   9.054  -3.325
  446    H    GLN  74           H        GLN  74   8.730  11.550  -0.736
  447    HA   GLN  74           HA       GLN  74  10.927  13.274   0.199
  448    HB2  GLN  74           HB1      GLN  74   7.950  13.692   0.408
  449    HB3  GLN  74           HB2      GLN  74   9.078  14.479   1.523
  450    HG2  GLN  74           HG1      GLN  74   9.741  15.987   0.011
  451    HG3  GLN  74           HG2      GLN  74   9.789  14.792  -1.292
  452   HE21  GLN  74          HE21      GLN  74   8.894  16.616  -2.519
  453   HE22  GLN  74          HE22      GLN  74   7.182  16.844  -2.521
  454    H    ARG  75           H        ARG  75   8.334  11.046   1.053
  455    HA   ARG  75           HA       ARG  75   9.631  10.619   3.664
  456    HB2  ARG  75           HB1      ARG  75   6.767  10.108   2.823
  457    HB3  ARG  75           HB2      ARG  75   7.445   9.716   4.410
  458    HG2  ARG  75           HG1      ARG  75   7.850  12.056   4.874
  459    HG3  ARG  75           HG2      ARG  75   7.286  12.491   3.252
  460    HD2  ARG  75           HD1      ARG  75   5.074  11.400   3.860
  461    HD3  ARG  75           HD2      ARG  75   5.680  11.338   5.521
  462    HE   ARG  75           HE       ARG  75   5.237  13.568   5.717
  463   HH11  ARG  75          HH11      ARG  75   5.388  12.750   2.336
  464   HH12  ARG  75          HH12      ARG  75   4.874  14.315   1.801
  465   HH21  ARG  75          HH21      ARG  75   4.559  15.633   5.025
  466   HH22  ARG  75          HH22      ARG  75   4.404  15.955   3.331
  467    H    ASP  76           H        ASP  76   9.340   8.348   4.517
  468    HA   ASP  76           HA       ASP  76  10.400   6.514   2.591
  469    HB2  ASP  76           HB1      ASP  76   9.455   5.672   5.316
  470    HB3  ASP  76           HB2      ASP  76  10.848   5.099   4.389
  471    HD2  ASP  76           HD       ASP  76  11.282   8.309   6.647
  472    H    ALA  77           H        ALA  77   7.477   6.445   4.636
  473    HA   ALA  77           HA       ALA  77   6.317   4.178   3.497
  474    HB1  ALA  77           HB1      ALA  77   5.454   4.958   5.554
  475    HB2  ALA  77           HB2      ALA  77   5.096   6.551   4.885
  476    HB3  ALA  77           HB3      ALA  77   4.156   5.147   4.375
  477    H    MET  78           H        MET  78   6.515   7.433   2.335
  478    HA   MET  78           HA       MET  78   4.334   7.514   0.594
  479    HB2  MET  78           HB1      MET  78   6.938   8.918   0.816
  480    HB3  MET  78           HB2      MET  78   6.132   8.996  -0.756
  481    HG2  MET  78           HG1      MET  78   4.584   9.628   1.725
  482    HG3  MET  78           HG2      MET  78   5.689  10.823   1.041
  483    HE1  MET  78           HE1      MET  78   4.184  11.817  -2.299
  484    HE2  MET  78           HE2      MET  78   5.462  12.017  -1.101
  485    HE3  MET  78           HE3      MET  78   5.436  10.586  -2.132
  486    H    CYS  79           H        CYS  79   7.353   5.831   0.368
  487    HA   CYS  79           HA       CYS  79   6.899   5.202  -2.456
  488    HB2  CYS  79           HB1      CYS  79   9.231   5.396  -0.725
  489    HB3  CYS  79           HB2      CYS  79   9.210   3.879  -1.627
  490    H    CYS  80           H        CYS  80   6.917   3.014  -3.197
  491    HA   CYS  80           HA       CYS  80   5.225   1.290  -1.865
  492    HB2  CYS  80           HB1      CYS  80   7.011   1.140  -4.186
  493    HB3  CYS  80           HB2      CYS  80   6.757  -0.418  -3.396
  494    HA   PRO  81           HA       PRO  81   7.511  -0.854   1.204
  495    HB2  PRO  81           HB1      PRO  81   6.562  -3.412   0.974
  496    HB3  PRO  81           HB2      PRO  81   5.614  -2.078   1.630
  497    HG2  PRO  81           HG1      PRO  81   5.620  -3.223  -1.143
  498    HG3  PRO  81           HG2      PRO  81   4.220  -2.771  -0.098
  499    HD2  PRO  81           HD1      PRO  81   5.111  -1.194  -2.121
  500    HD3  PRO  81           HD2      PRO  81   4.425  -0.536  -0.625
  501    H    GLY  82           H        GLY  82   9.521  -1.651   1.367
  502    HA2  GLY  82           HA2      GLY  82  11.091  -3.444   0.841
  503    HA3  GLY  82           HA3      GLY  82  10.512  -3.375  -0.817
  504    HA1  GLY  82           HA1      GLY  82  11.037  -2.599   1.092
  505    H    THR  83           H        THR  83  10.511  -0.322  -0.465
  506    HA   THR  83           HA       THR  83  13.401   0.027  -0.937
  507    HB   THR  83           HB       THR  83  12.476   2.140  -2.234
  508    HG1  THR  83           HG1      THR  83  10.362   2.066  -2.321
  509   HG21  THR  83          HG21      THR  83  12.923  -0.662  -3.054
  510   HG22  THR  83          HG22      THR  83  13.689   0.821  -3.621
  511   HG23  THR  83          HG23      THR  83  12.097   0.365  -4.225
  512    H    LEU  84           H        LEU  84  14.016   2.452  -0.711
  513    HA   LEU  84           HA       LEU  84  12.685   3.596   1.650
  514    HB2  LEU  84           HB1      LEU  84  15.502   2.787   1.284
  515    HB3  LEU  84           HB2      LEU  84  15.242   4.370   2.036
  516    HG   LEU  84           HG       LEU  84  13.651   3.044   3.627
  517   HD11  LEU  84          HD11      LEU  84  14.838   0.944   2.047
  518   HD12  LEU  84          HD12      LEU  84  13.537   0.863   3.236
  519   HD13  LEU  84          HD13      LEU  84  15.219   0.749   3.758
  520   HD21  LEU  84          HD21      LEU  84  16.395   2.299   4.291
  521   HD22  LEU  84          HD22      LEU  84  15.264   3.349   5.145
  522   HD23  LEU  84          HD23      LEU  84  16.216   3.985   3.804
  523    H    CYS  85           H        CYS  85  13.059   5.899   1.946
  524    HA   CYS  85           HA       CYS  85  13.322   7.259  -0.638
  525    HB2  CYS  85           HB1      CYS  85  11.255   7.491   0.883
  526    HB3  CYS  85           HB2      CYS  85  12.284   8.500   1.903
  527    H    VAL  86           H        VAL  86  15.403   7.779  -0.977
  528    HA   VAL  86           HA       VAL  86  16.776   9.308   1.136
  529    HB   VAL  86           HB       VAL  86  18.153   7.506  -0.856
  530   HG11  VAL  86          HG11      VAL  86  19.758   7.950   1.380
  531   HG12  VAL  86          HG12      VAL  86  19.959   8.644  -0.229
  532   HG13  VAL  86          HG13      VAL  86  19.051   9.521   1.003
  533   HG21  VAL  86          HG21      VAL  86  18.586   6.064   1.167
  534   HG22  VAL  86          HG22      VAL  86  17.345   7.000   2.000
  535   HG23  VAL  86          HG23      VAL  86  16.927   6.058   0.570
  536    H    ASN  87           H        ASN  87  17.902  11.118   0.515
  537    HA   ASN  87           HA       ASN  87  18.400  12.955  -0.730
  538    HB2  ASN  87           HB1      ASN  87  18.686  10.786  -2.814
  539    HB3  ASN  87           HB2      ASN  87  19.054  12.481  -3.151
  540   HD21  ASN  87          HD21      ASN  87  21.203  11.694  -3.603
  541   HD22  ASN  87          HD22      ASN  87  22.314  11.458  -2.301
  542    H    ASP  88           H        ASP  88  15.622  12.204  -0.406
  543    HA   ASP  88           HA       ASP  88  13.570  12.921  -1.078
  544    HB2  ASP  88           HB1      ASP  88  15.390  14.889  -1.977
  545    HB3  ASP  88           HB2      ASP  88  14.255  14.608  -3.304
  546    HD2  ASP  88           HD       ASP  88  11.912  16.513  -1.723
  547    H    VAL  89           H        VAL  89  15.019  10.670  -2.411
  548    HA   VAL  89           HA       VAL  89  13.124  10.327  -4.596
  549    HB   VAL  89           HB       VAL  89  15.129  11.281  -5.675
  550   HG11  VAL  89          HG11      VAL  89  17.173   9.839  -5.791
  551   HG12  VAL  89          HG12      VAL  89  16.872  10.565  -4.211
  552   HG13  VAL  89          HG13      VAL  89  16.486   8.867  -4.491
  553   HG21  VAL  89          HG21      VAL  89  14.707   8.367  -6.333
  554   HG22  VAL  89          HG22      VAL  89  13.672   9.691  -6.868
  555   HG23  VAL  89          HG23      VAL  89  15.347   9.605  -7.414
  556    H    CYS  90           H        CYS  90  12.728   8.159  -5.136
  557    HA   CYS  90           HA       CYS  90  13.001   6.315  -3.015
  558    HB2  CYS  90           HB1      CYS  90  11.414   6.521  -5.258
  559    HB3  CYS  90           HB2      CYS  90  12.445   5.143  -5.646
  560    H    THR  91           H        THR  91  14.253   4.471  -2.805
  561    HA   THR  91           HA       THR  91  16.267   3.863  -4.806
  562    HB   THR  91           HB       THR  91  17.306   5.625  -3.376
  563    HG1  THR  91           HG1      THR  91  18.459   3.743  -4.377
  564   HG21  THR  91          HG21      THR  91  17.031   3.531  -1.216
  565   HG22  THR  91          HG22      THR  91  16.223   5.098  -1.260
  566   HG23  THR  91          HG23      THR  91  17.975   5.014  -1.086
  567    H    THR  92           H        THR  92  17.412   1.861  -4.361
  568    HA   THR  92           HA       THR  92  15.695  -0.149  -3.344
  569    HB   THR  92           HB       THR  92  17.631  -1.685  -3.704
  570    HG1  THR  92           HG1      THR  92  19.573  -0.894  -4.166
  571   HG21  THR  92          HG21      THR  92  17.435  -1.679  -6.018
  572   HG22  THR  92          HG22      THR  92  17.397   0.082  -6.110
  573   HG23  THR  92          HG23      THR  92  15.991  -0.801  -5.518
  574    H    MET  93           H        MET  93  16.258  -1.715  -1.656
  575    HA   MET  93           HA       MET  93  16.909  -0.398   0.785
  576    HB2  MET  93           HB1      MET  93  15.461  -2.617   0.130
  577    HB3  MET  93           HB2      MET  93  16.935  -3.343   0.785
  578    HG2  MET  93           HG1      MET  93  16.606  -1.753   2.780
  579    HG3  MET  93           HG2      MET  93  14.968  -1.549   2.153
  580    HE1  MET  93           HE1      MET  93  14.145  -3.715   5.092
  581    HE2  MET  93           HE2      MET  93  15.834  -3.242   5.279
  582    HE3  MET  93           HE3      MET  93  14.666  -2.100   4.612
  583    H    GLU  94           H        GLU  94  18.686  -2.301  -1.511
  584    HA   GLU  94           HA       GLU  94  20.856  -2.971   0.219
  585    HB2  GLU  94           HB1      GLU  94  20.693  -2.877  -2.803
  586    HB3  GLU  94           HB2      GLU  94  22.030  -3.579  -1.878
  587    HG2  GLU  94           HG1      GLU  94  19.238  -4.554  -1.428
  588    HG3  GLU  94           HG2      GLU  94  20.166  -5.113  -2.826
  589    HE2  GLU  94           HE       GLU  94  20.776  -7.077   0.321
  590    H    ASP  95           H        ASP  95  20.113  -0.296  -1.915
  591    HA   ASP  95           HA       ASP  95  22.752   0.844  -1.770
  592    HB2  ASP  95           HB1      ASP  95  20.117   1.721  -2.926
  593    HB3  ASP  95           HB2      ASP  95  21.453   2.869  -2.775
  594    HD2  ASP  95           HD       ASP  95  22.656  -0.120  -5.005
  595    H    ALA  96           H        ALA  96  19.577   1.583  -0.364
  596    HA   ALA  96           HA       ALA  96  20.419   3.844   1.107
  597    HB1  ALA  96           HB1      ALA  96  18.171   3.899   1.036
  598    HB2  ALA  96           HB2      ALA  96  18.023   2.142   0.994
  599    HB3  ALA  96           HB3      ALA  96  18.296   2.968   2.529
  600    H    THR  97           H        THR  97  20.500   3.995   3.479
  601    HA   THR  97           HA       THR  97  21.393   3.441   5.499
  602    HB   THR  97           HB       THR  97  21.022   0.520   4.940
  603    HG1  THR  97           HG1      THR  97  18.785   0.866   5.597
  604   HG21  THR  97          HG21      THR  97  21.826   0.812   7.088
  605   HG22  THR  97          HG22      THR  97  20.084   0.809   7.364
  606   HG23  THR  97          HG23      THR  97  20.967   2.335   7.315
  607    H    GLU  98           H        GLU  98  23.155   3.761   3.332
  608    HA   GLU  98           HA       GLU  98  25.121   1.642   3.454
  609    HB2  GLU  98           HB1      GLU  98  24.744   2.791   1.340
  610    HB3  GLU  98           HB2      GLU  98  25.181   4.336   2.085
  611    HG2  GLU  98           HG1      GLU  98  27.456   3.572   2.440
  612    HG3  GLU  98           HG2      GLU  98  27.036   1.988   1.776
  613    HE2  GLU  98           HE       GLU  98  28.377   3.517  -1.075
  614    H    ASN  99           H        ASN  99  26.522   1.486   5.065
  615    HA   ASN  99           HA       ASN  99  27.079   3.760   6.770
  616    HB2  ASN  99           HB1      ASN  99  27.932   0.858   6.868
  617    HB3  ASN  99           HB2      ASN  99  28.452   2.066   8.050
  618   HD21  ASN  99          HD21      ASN  99  26.870   3.067   9.383
  619   HD22  ASN  99          HD22      ASN  99  25.379   2.264   9.727
  620    H    LEU 100           H        LEU 100  29.381   4.156   7.448
  621    HA   LEU 100           HA       LEU 100  30.918   4.922   5.221
  622    HB2  LEU 100           HB1      LEU 100  31.412   4.776   8.172
  623    HB3  LEU 100           HB2      LEU 100  32.748   5.142   7.065
  624    HG   LEU 100           HG       LEU 100  30.664   6.884   6.352
  625   HD11  LEU 100          HD11      LEU 100  29.716   7.730   8.216
  626   HD12  LEU 100          HD12      LEU 100  31.132   7.410   9.217
  627   HD13  LEU 100          HD13      LEU 100  30.011   6.104   8.835
  628   HD21  LEU 100          HD21      LEU 100  33.014   7.396   6.183
  629   HD22  LEU 100          HD22      LEU 100  33.197   7.309   7.935
  630   HD23  LEU 100          HD23      LEU 100  32.230   8.595   7.212
  631    H    TYR 101           H        TYR 101  33.305   4.297   5.029
  632    HA   TYR 101           HA       TYR 101  34.803   2.729   4.335
  633    HB2  TYR 101           HB1      TYR 101  33.757   1.094   6.656
  634    HB3  TYR 101           HB2      TYR 101  35.350   0.984   5.904
  635    HD1  TYR 101           HD1      TYR 101  37.040   2.742   6.262
  636    HD2  TYR 101           HD2      TYR 101  33.298   2.816   8.283
  637    HE1  TYR 101           HE1      TYR 101  37.945   4.374   7.863
  638    HE2  TYR 101           HE2      TYR 101  34.192   4.448   9.891
  639    HH   TYR 101           HH       TYR 101  36.501   6.311   9.530
  640    H    PHE 102           H        PHE 102  34.912   0.054   4.180
  641    HA   PHE 102           HA       PHE 102  32.457  -0.703   2.736
  642    HB2  PHE 102           HB1      PHE 102  35.175  -0.495   1.789
  643    HB3  PHE 102           HB2      PHE 102  34.614  -2.161   1.651
  644    HD1  PHE 102           HD1      PHE 102  34.144   1.257   0.472
  645    HD2  PHE 102           HD2      PHE 102  32.766  -2.761   0.201
  646    HE1  PHE 102           HE1      PHE 102  32.907   1.823  -1.579
  647    HE2  PHE 102           HE2      PHE 102  31.527  -2.202  -1.850
  648    HZ   PHE 102           HZ       PHE 102  31.597   0.092  -2.744
  649    H    GLN 103           H        GLN 103  31.870  -2.905   2.767
  650    HA   GLN 103           HA       GLN 103  32.972  -4.366   5.064
  651    HB2  GLN 103           HB1      GLN 103  30.309  -4.529   3.646
  652    HB3  GLN 103           HB2      GLN 103  30.829  -5.703   4.865
  653    HG2  GLN 103           HG1      GLN 103  29.890  -4.384   6.382
  654    HG3  GLN 103           HG2      GLN 103  31.241  -3.276   6.103
  655   HE21  GLN 103          HE21      GLN 103  30.953  -1.637   4.430
  656   HE22  GLN 103          HE22      GLN 103  29.378  -0.978   4.171
  657    H    SER 104           H        SER 104  34.662  -4.606   3.075
  658    HA   SER 104           HA       SER 104  34.026  -7.162   1.754
  659    HB2  SER 104           HB1      SER 104  35.051  -6.457  -0.141
  660    HB3  SER 104           HB2      SER 104  34.781  -4.842   0.538
  661    HG   SER 104           HG       SER 104  36.849  -4.655   0.980
  662    H    LEU 105           H        LEU 105  35.366  -8.883   2.003
  663    HA   LEU 105           HA       LEU 105  37.278  -8.748   4.168
  664    HB2  LEU 105           HB1      LEU 105  36.227 -10.996   2.456
  665    HB3  LEU 105           HB2      LEU 105  37.504 -11.223   3.664
  666    HG   LEU 105           HG       LEU 105  34.904 -10.023   4.507
  667   HD11  LEU 105          HD11      LEU 105  33.802 -12.055   4.678
  668   HD12  LEU 105          HD12      LEU 105  35.283 -12.992   4.481
  669   HD13  LEU 105          HD13      LEU 105  34.574 -12.161   3.096
  670   HD21  LEU 105          HD21      LEU 105  35.969 -10.143   6.452
  671   HD22  LEU 105          HD22      LEU 105  37.298 -11.055   5.734
  672   HD23  LEU 105          HD23      LEU 105  35.869 -11.901   6.333
  673    H    GLU 106           H        GLU 106  39.433  -9.773   3.947
  674    HA   GLU 106           HA       GLU 106  40.596  -9.280   1.285
  675    HB2  GLU 106           HB1      GLU 106  41.702  -8.590   4.011
  676    HB3  GLU 106           HB2      GLU 106  42.692  -8.612   2.543
  677    HG2  GLU 106           HG1      GLU 106  41.378  -6.863   1.547
  678    HG3  GLU 106           HG2      GLU 106  40.240  -6.907   2.902
  679    HE2  GLU 106           HE       GLU 106  43.709  -5.647   4.232
  680    H    HIS 107           H        HIS 107  42.400 -10.570   0.698
  681    HA   HIS 107           HA       HIS 107  43.379 -12.666   2.358
  682    HB2  HIS 107           HB1      HIS 107  40.939 -13.210   1.103
  683    HB3  HIS 107           HB2      HIS 107  42.149 -14.025   0.108
  684    HD1  HIS 107           HD1      HIS 107  41.903 -13.706   3.896
  685    HD2  HIS 107           HD2      HIS 107  42.171 -16.598   0.925
  686    HE1  HIS 107           HE1      HIS 107  42.044 -15.905   5.108
  687    HE2  HIS 107           HE2      HIS 107  42.208 -17.674   3.293
  688    H    HIS 108           H        HIS 108  44.719 -14.257   0.995
  689    HA   HIS 108           HA       HIS 108  46.424 -12.686  -0.702
  690    HB2  HIS 108           HB1      HIS 108  47.904 -14.552  -0.701
  691    HB3  HIS 108           HB2      HIS 108  47.235 -14.431   0.929
  692    HD1  HIS 108           HD1      HIS 108  45.864 -16.376   1.804
  693    HD2  HIS 108           HD2      HIS 108  46.905 -16.784  -2.197
  694    HE1  HIS 108           HE1      HIS 108  45.256 -18.736   1.189
  695    HE2  HIS 108           HE2      HIS 108  45.890 -18.987  -1.257
  696    H    HIS 109           H        HIS 109  47.324 -14.241  -2.665
  697    HA   HIS 109           HA       HIS 109  45.112 -15.340  -4.190
  698    HB2  HIS 109           HB1      HIS 109  46.666 -12.910  -5.114
  699    HB3  HIS 109           HB2      HIS 109  45.611 -13.872  -6.156
  700    HD1  HIS 109           HD1      HIS 109  45.550 -11.057  -3.858
  701    HD2  HIS 109           HD2      HIS 109  42.809 -13.825  -5.300
  702    HE1  HIS 109           HE1      HIS 109  43.286 -10.081  -3.363
  703    HE2  HIS 109           HE2      HIS 109  41.609 -11.772  -4.243
  704    H    HIS 110           H        HIS 110  45.869 -16.269  -6.282
  705    HA   HIS 110           HA       HIS 110  48.633 -17.248  -6.001
  706    HB2  HIS 110           HB1      HIS 110  46.114 -18.602  -6.447
  707    HB3  HIS 110           HB2      HIS 110  47.246 -18.948  -7.759
  708    HD1  HIS 110           HD1      HIS 110  49.863 -19.370  -6.504
  709    HD2  HIS 110           HD2      HIS 110  46.359 -20.605  -4.644
  710    HE1  HIS 110           HE1      HIS 110  50.558 -21.162  -4.881
  711    HE2  HIS 110           HE2      HIS 110  48.417 -21.916  -3.745
  712    H    HIS 111           H        HIS 111  49.644 -17.924  -8.112
  713    HA   HIS 111           HA       HIS 111  48.724 -16.486 -10.458
  714    HB2  HIS 111           HB1      HIS 111  50.763 -15.219 -10.774
  715    HB3  HIS 111           HB2      HIS 111  50.055 -14.808  -9.210
  716    HD1  HIS 111           HD1      HIS 111  51.263 -15.750  -7.066
  717    HD2  HIS 111           HD2      HIS 111  53.308 -16.312 -10.637
  718    HE1  HIS 111           HE1      HIS 111  53.613 -16.350  -6.406
  719    HE2  HIS 111           HE2      HIS 111  54.864 -16.697  -8.589
  720    H    HIS 112           H        HIS 112  50.414 -16.817 -12.293
  721    HA   HIS 112           HA       HIS 112  51.098 -19.663 -12.271
  722    HB2  HIS 112           HB1      HIS 112  50.833 -17.678 -14.543
  723    HB3  HIS 112           HB2      HIS 112  51.303 -19.368 -14.749
  724    HD1  HIS 112           HD1      HIS 112  48.359 -17.207 -14.399
  725    HD2  HIS 112           HD2      HIS 112  49.219 -21.261 -14.096
  726    HE1  HIS 112           HE1      HIS 112  46.134 -18.375 -14.493
  727    HE2  HIS 112           HE2      HIS 112  46.658 -20.853 -14.307
  Start of MODEL   43
    1    H1   MET  18           H        MET  18 -77.435   5.344  12.935
    2    HA   MET  18           HA       MET  18 -76.527   7.933  14.006
    3    HB2  MET  18           HB1      MET  18 -75.450   5.326  14.491
    4    HB3  MET  18           HB2      MET  18 -74.273   6.266  13.561
    5    HG2  MET  18           HG1      MET  18 -73.743   7.555  15.301
    6    HG3  MET  18           HG2      MET  18 -75.438   7.794  15.733
    7    HE1  MET  18           HE1      MET  18 -73.637   7.292  18.650
    8    HE2  MET  18           HE2      MET  18 -72.488   6.046  18.161
    9    HE3  MET  18           HE3      MET  18 -72.707   7.483  17.163
   10    H    LEU  19           H        LEU  19 -74.730   8.899  12.752
   11    HA   LEU  19           HA       LEU  19 -74.889   8.173   9.901
   12    HB2  LEU  19           HB1      LEU  19 -74.596  10.588   9.394
   13    HB3  LEU  19           HB2      LEU  19 -76.122  10.192  10.206
   14    HG   LEU  19           HG       LEU  19 -73.951  11.015  12.009
   15   HD11  LEU  19          HD11      LEU  19 -74.627  13.472  11.356
   16   HD12  LEU  19          HD12      LEU  19 -74.880  12.742   9.771
   17   HD13  LEU  19          HD13      LEU  19 -73.298  12.643  10.544
   18   HD21  LEU  19          HD21      LEU  19 -76.655  10.702  12.170
   19   HD22  LEU  19          HD22      LEU  19 -76.505  12.448  11.965
   20   HD23  LEU  19          HD23      LEU  19 -75.675  11.640  13.297
   21    H    VAL  20           H        VAL  20 -72.958   6.925  11.103
   22    HA   VAL  20           HA       VAL  20 -70.528   8.524  11.165
   23    HB   VAL  20           HB       VAL  20 -70.910   5.562  11.631
   24   HG11  VAL  20          HG11      VAL  20 -68.682   5.656  11.145
   25   HG12  VAL  20          HG12      VAL  20 -68.530   7.342  11.641
   26   HG13  VAL  20          HG13      VAL  20 -68.623   6.068  12.858
   27   HG21  VAL  20          HG21      VAL  20 -70.386   7.681  13.698
   28   HG22  VAL  20          HG22      VAL  20 -72.015   7.173  13.253
   29   HG23  VAL  20          HG23      VAL  20 -70.887   6.009  13.947
   30    H    LEU  21           H        LEU  21 -69.361   8.862   9.402
   31    HA   LEU  21           HA       LEU  21 -69.732   7.156   7.067
   32    HB2  LEU  21           HB1      LEU  21 -68.490   9.847   7.541
   33    HB3  LEU  21           HB2      LEU  21 -68.150   8.940   6.058
   34    HG   LEU  21           HG       LEU  21 -70.993   9.415   6.813
   35   HD11  LEU  21          HD11      LEU  21 -70.756  11.553   5.384
   36   HD12  LEU  21          HD12      LEU  21 -69.059  11.490   5.860
   37   HD13  LEU  21          HD13      LEU  21 -70.316  11.613   7.091
   38   HD21  LEU  21          HD21      LEU  21 -71.394   9.159   4.549
   39   HD22  LEU  21          HD22      LEU  21 -70.055   8.044   4.822
   40   HD23  LEU  21          HD23      LEU  21 -69.754   9.625   4.099
   41    H    ASP  22           H        ASP  22 -68.007   6.171   5.956
   42    HA   ASP  22           HA       ASP  22 -65.747   5.490   7.694
   43    HB2  ASP  22           HB1      ASP  22 -66.779   4.151   5.178
   44    HB3  ASP  22           HB2      ASP  22 -65.408   3.587   6.141
   45    HD2  ASP  22           HD       ASP  22 -67.458   2.023   8.394
   46    H    PHE  23           H        PHE  23 -64.836   7.653   7.188
   47    HA   PHE  23           HA       PHE  23 -63.660   7.853   4.515
   48    HB2  PHE  23           HB1      PHE  23 -62.999  10.155   5.254
   49    HB3  PHE  23           HB2      PHE  23 -64.741   9.870   5.237
   50    HD1  PHE  23           HD1      PHE  23 -66.048  10.108   7.170
   51    HD2  PHE  23           HD2      PHE  23 -61.802  10.073   7.473
   52    HE1  PHE  23           HE1      PHE  23 -66.213  10.816   9.520
   53    HE2  PHE  23           HE2      PHE  23 -61.961  10.782   9.824
   54    HZ   PHE  23           HZ       PHE  23 -64.168  11.154  10.851
   55    H    ASN  24           H        ASN  24 -61.377   8.586   4.373
   56    HA   ASN  24           HA       ASN  24 -59.729   7.496   6.555
   57    HB2  ASN  24           HB1      ASN  24 -58.121   6.771   4.688
   58    HB3  ASN  24           HB2      ASN  24 -59.585   5.809   4.921
   59   HD21  ASN  24          HD21      ASN  24 -59.449   5.045   2.796
   60   HD22  ASN  24          HD22      ASN  24 -59.902   6.029   1.451
   61    H    ASN  25           H        ASN  25 -57.458   8.273   6.489
   62    HA   ASN  25           HA       ASN  25 -57.401  11.091   5.662
   63    HB2  ASN  25           HB1      ASN  25 -57.041  10.270   8.119
   64    HB3  ASN  25           HB2      ASN  25 -55.415   9.871   7.550
   65   HD21  ASN  25          HD21      ASN  25 -57.550  12.362   8.498
   66   HD22  ASN  25          HD22      ASN  25 -56.452  13.683   8.319
   67    H    ILE  26           H        ILE  26 -55.441  11.967   4.778
   68    HA   ILE  26           HA       ILE  26 -53.831   9.952   3.350
   69    HB   ILE  26           HB       ILE  26 -53.471  11.691   1.604
   70   HG12  ILE  26          HG11      ILE  26 -55.779  13.148   2.897
   71   HG13  ILE  26          HG12      ILE  26 -54.090  13.590   3.199
   72   HG21  ILE  26          HG21      ILE  26 -55.444  11.217   0.452
   73   HG22  ILE  26          HG22      ILE  26 -55.291   9.885   1.596
   74   HG23  ILE  26          HG23      ILE  26 -56.412  11.205   1.926
   75   HD11  ILE  26          HD11      ILE  26 -53.981  13.674   0.574
   76   HD12  ILE  26          HD12      ILE  26 -55.718  13.935   0.743
   77   HD13  ILE  26          HD13      ILE  26 -54.580  15.039   1.516
   78    H    ARG  27           H        ARG  27 -51.612  10.369   3.049
   79    HA   ARG  27           HA       ARG  27 -50.462  12.045   5.145
   80    HB2  ARG  27           HB1      ARG  27 -49.762   9.552   3.890
   81    HB3  ARG  27           HB2      ARG  27 -48.423  10.698   3.733
   82    HG2  ARG  27           HG1      ARG  27 -47.874   9.768   5.734
   83    HG3  ARG  27           HG2      ARG  27 -48.909  11.091   6.295
   84    HD2  ARG  27           HD1      ARG  27 -50.372   9.665   7.189
   85    HD3  ARG  27           HD2      ARG  27 -50.508   8.791   5.657
   86    HE   ARG  27           HE       ARG  27 -48.121   7.986   6.796
   87   HH11  ARG  27          HH11      ARG  27 -51.507   7.884   7.600
   88   HH12  ARG  27          HH12      ARG  27 -51.377   6.425   8.525
   89   HH21  ARG  27          HH21      ARG  27 -47.938   6.064   8.011
   90   HH22  ARG  27          HH22      ARG  27 -49.347   5.390   8.759
   91    H    SER  28           H        SER  28 -50.050  11.466   1.657
   92    HA   SER  28           HA       SER  28 -49.248  12.775  -0.022
   93    HB2  SER  28           HB1      SER  28 -50.023  15.069   1.807
   94    HB3  SER  28           HB2      SER  28 -49.778  15.151   0.053
   95    HG   SER  28           HG       SER  28 -52.016  14.635   1.291
   96    H    SER  29           H        SER  29 -47.346  11.803   1.782
   97    HA   SER  29           HA       SER  29 -45.251  13.797   1.420
   98    HB2  SER  29           HB1      SER  29 -46.432  13.259   3.964
   99    HB3  SER  29           HB2      SER  29 -44.786  12.600   3.969
  100    HG   SER  29           HG       SER  29 -44.007  14.629   3.371
  101    H    ALA  30           H        ALA  30 -43.097  12.900   1.566
  102    HA   ALA  30           HA       ALA  30 -42.894   9.990   1.575
  103    HB1  ALA  30           HB1      ALA  30 -41.347  10.905  -0.633
  104    HB2  ALA  30           HB2      ALA  30 -42.682   9.752  -0.619
  105    HB3  ALA  30           HB3      ALA  30 -43.004  11.473  -0.830
  106    H    ASP  31           H        ASP  31 -40.503   9.350   1.251
  107    HA   ASP  31           HA       ASP  31 -38.971  10.852   3.180
  108    HB2  ASP  31           HB1      ASP  31 -38.719   8.216   1.809
  109    HB3  ASP  31           HB2      ASP  31 -37.238   8.966   2.418
  110    HD2  ASP  31           HD       ASP  31 -38.270   8.588   5.746
  111    H    LEU  32           H        LEU  32 -36.973  11.842   2.839
  112    HA   LEU  32           HA       LEU  32 -36.413  12.527   0.029
  113    HB2  LEU  32           HB1      LEU  32 -36.557  14.118   2.499
  114    HB3  LEU  32           HB2      LEU  32 -35.145  14.451   1.482
  115    HG   LEU  32           HG       LEU  32 -36.936  16.008   0.992
  116   HD11  LEU  32          HD11      LEU  32 -36.291  16.015  -1.129
  117   HD12  LEU  32          HD12      LEU  32 -37.233  14.564  -1.470
  118   HD13  LEU  32          HD13      LEU  32 -35.579  14.422  -0.875
  119   HD21  LEU  32          HD21      LEU  32 -39.058  15.274   0.074
  120   HD22  LEU  32          HD22      LEU  32 -38.814  14.578   1.676
  121   HD23  LEU  32          HD23      LEU  32 -38.569  13.587   0.238
  122    H    HIS  33           H        HIS  33 -34.044  13.327  -0.211
  123    HA   HIS  33           HA       HIS  33 -32.289  11.415   1.186
  124    HB2  HIS  33           HB1      HIS  33 -32.221  12.382  -1.679
  125    HB3  HIS  33           HB2      HIS  33 -30.881  11.515  -0.920
  126    HD1  HIS  33           HD1      HIS  33 -32.143  10.210  -3.314
  127    HD2  HIS  33           HD2      HIS  33 -33.477   9.553   0.566
  128    HE1  HIS  33           HE1      HIS  33 -33.342   8.001  -3.379
  129    HE2  HIS  33           HE2      HIS  33 -34.159   7.598  -1.009
  130    H    GLY  34           H        GLY  34 -29.849  12.205   0.644
  131    HA2  GLY  34           HA2      GLY  34 -29.364  14.990   0.609
  132    HA3  GLY  34           HA3      GLY  34 -29.399  14.424   2.272
  133    HA1  GLY  34           HA1      GLY  34 -29.166  14.253   0.166
  134    H    ALA  35           H        ALA  35 -27.740  14.194  -0.807
  135    HA   ALA  35           HA       ALA  35 -25.702  12.414   0.104
  136    HB1  ALA  35           HB1      ALA  35 -26.517  13.160  -2.338
  137    HB2  ALA  35           HB2      ALA  35 -25.113  14.214  -2.161
  138    HB3  ALA  35           HB3      ALA  35 -24.927  12.466  -2.018
  139    H    ARG  36           H        ARG  36 -23.974  12.854   1.302
  140    HA   ARG  36           HA       ARG  36 -23.362  15.637   1.931
  141    HB2  ARG  36           HB1      ARG  36 -22.705  12.989   3.176
  142    HB3  ARG  36           HB2      ARG  36 -21.719  14.407   3.559
  143    HG2  ARG  36           HG1      ARG  36 -23.986  15.551   4.090
  144    HG3  ARG  36           HG2      ARG  36 -24.591  13.889   4.187
  145    HD2  ARG  36           HD1      ARG  36 -22.111  14.687   5.680
  146    HD3  ARG  36           HD2      ARG  36 -23.713  15.049   6.335
  147    HE   ARG  36           HE       ARG  36 -23.743  12.370   5.651
  148   HH11  ARG  36          HH11      ARG  36 -21.972  14.444   7.815
  149   HH12  ARG  36          HH12      ARG  36 -21.680  13.196   8.981
  150   HH21  ARG  36          HH21      ARG  36 -23.365  10.719   7.178
  151   HH22  ARG  36          HH22      ARG  36 -22.472  11.077   8.617
  152    H    LYS  37           H        LYS  37 -22.029  16.595   0.533
  153    HA   LYS  37           HA       LYS  37 -19.923  15.083  -0.783
  154    HB2  LYS  37           HB1      LYS  37 -21.303  16.691  -2.059
  155    HB3  LYS  37           HB2      LYS  37 -20.671  18.001  -1.049
  156    HG2  LYS  37           HG1      LYS  37 -19.140  18.262  -2.651
  157    HG3  LYS  37           HG2      LYS  37 -18.376  16.825  -1.947
  158    HD2  LYS  37           HD1      LYS  37 -19.984  15.504  -3.511
  159    HD3  LYS  37           HD2      LYS  37 -20.109  17.045  -4.379
  160    HE2  LYS  37           HE1      LYS  37 -17.471  15.726  -3.718
  161    HE3  LYS  37           HE2      LYS  37 -18.348  15.457  -5.230
  162    HZ1  LYS  37           HZ1      LYS  37 -16.674  17.167  -5.492
  163    HZ2  LYS  37           HZ2      LYS  37 -17.364  18.080  -4.248
  164    HZ3  LYS  37           HZ3      LYS  37 -18.218  17.832  -5.687
  165    H    GLY  38           H        GLY  38 -17.894  14.991  -0.079
  166    HA2  GLY  38           HA2      GLY  38 -16.816  17.223   1.487
  167    HA3  GLY  38           HA3      GLY  38 -16.794  15.621   2.211
  168    HA1  GLY  38           HA1      GLY  38 -16.801  17.038   0.626
  169    H    SER  39           H        SER  39 -15.231  14.187   1.638
  170    HA   SER  39           HA       SER  39 -13.363  15.023  -0.479
  171    HB2  SER  39           HB1      SER  39 -11.535  14.008   0.955
  172    HB3  SER  39           HB2      SER  39 -12.246  15.508   1.577
  173    HG   SER  39           HG       SER  39 -11.985  13.685   3.106
  174    H    GLN  40           H        GLN  40 -11.724  13.002  -0.751
  175    HA   GLN  40           HA       GLN  40 -13.476  10.776  -1.490
  176    HB2  GLN  40           HB1      GLN  40 -11.271  12.084  -2.744
  177    HB3  GLN  40           HB2      GLN  40 -10.823  10.396  -2.451
  178    HG2  GLN  40           HG1      GLN  40 -13.491  10.956  -3.650
  179    HG3  GLN  40           HG2      GLN  40 -12.049  11.138  -4.659
  180   HE21  GLN  40          HE21      GLN  40 -13.219   8.836  -2.220
  181   HE22  GLN  40          HE22      GLN  40 -12.869   7.419  -3.143
  182    H    CYS  41           H        CYS  41 -10.127  11.125  -0.301
  183    HA   CYS  41           HA       CYS  41 -10.613   8.805   1.447
  184    HB2  CYS  41           HB1      CYS  41  -8.434   7.944   1.012
  185    HB3  CYS  41           HB2      CYS  41  -9.180   8.272  -0.555
  186    H    LEU  42           H        LEU  42  -9.734   8.877   3.490
  187    HA   LEU  42           HA       LEU  42  -8.878  11.518   4.383
  188    HB2  LEU  42           HB1      LEU  42 -10.555   9.581   5.453
  189    HB3  LEU  42           HB2      LEU  42  -9.082   9.476   6.435
  190    HG   LEU  42           HG       LEU  42  -9.309  11.976   6.799
  191   HD11  LEU  42          HD11      LEU  42 -10.766  12.842   5.280
  192   HD12  LEU  42          HD12      LEU  42 -11.883  12.551   6.612
  193   HD13  LEU  42          HD13      LEU  42 -11.790  11.407   5.272
  194   HD21  LEU  42          HD21      LEU  42 -10.561   9.764   8.052
  195   HD22  LEU  42          HD22      LEU  42 -11.687  11.121   8.101
  196   HD23  LEU  42          HD23      LEU  42 -10.063  11.297   8.770
  197    H    SER  43           H        SER  43  -7.640   8.323   3.886
  198    HA   SER  43           HA       SER  43  -4.957   9.246   4.440
  199    HB2  SER  43           HB1      SER  43  -6.377   7.909   6.480
  200    HB3  SER  43           HB2      SER  43  -5.248   6.720   5.806
  201    HG   SER  43           HG       SER  43  -4.430   8.129   7.545
  202    H    ASP  44           H        ASP  44  -3.323   7.782   3.674
  203    HA   ASP  44           HA       ASP  44  -3.886   6.615   1.217
  204    HB2  ASP  44           HB1      ASP  44  -1.653   5.846   1.183
  205    HB3  ASP  44           HB2      ASP  44  -1.619   7.321   2.159
  206    HD2  ASP  44           HD       ASP  44  -0.225   4.148   3.783
  207    H    THR  45           H        THR  45  -4.144   5.309   4.415
  208    HA   THR  45           HA       THR  45  -4.103   2.557   3.744
  209    HB   THR  45           HB       THR  45  -5.800   3.033   6.011
  210    HG1  THR  45           HG1      THR  45  -4.243   4.249   7.241
  211   HG21  THR  45          HG21      THR  45  -3.745   2.033   7.175
  212   HG22  THR  45          HG22      THR  45  -3.045   1.919   5.561
  213   HG23  THR  45          HG23      THR  45  -4.535   1.056   5.937
  214    H    ASP  46           H        ASP  46  -6.521   5.019   3.512
  215    HA   ASP  46           HA       ASP  46  -8.811   3.347   3.481
  216    HB2  ASP  46           HB1      ASP  46  -8.690   5.897   3.805
  217    HB3  ASP  46           HB2      ASP  46  -8.605   5.984   2.041
  218    HD2  ASP  46           HD       ASP  46 -12.071   6.186   2.550
  219    H    CYS  47           H        CYS  47  -6.462   4.257   1.081
  220    HA   CYS  47           HA       CYS  47  -7.820   3.775  -1.277
  221    HB2  CYS  47           HB1      CYS  47  -5.314   4.490  -0.723
  222    HB3  CYS  47           HB2      CYS  47  -5.019   2.781  -1.050
  223    H    ASN  48           H        ASN  48  -7.580   1.889  -2.750
  224    HA   ASN  48           HA       ASN  48  -8.151  -0.566  -1.271
  225    HB2  ASN  48           HB1      ASN  48  -8.815   0.468  -3.997
  226    HB3  ASN  48           HB2      ASN  48  -8.743  -1.282  -3.759
  227   HD21  ASN  48          HD21      ASN  48 -10.349  -2.308  -2.698
  228   HD22  ASN  48          HD22      ASN  48 -11.760  -1.524  -2.080
  229    H    THR  49           H        THR  49  -5.416   0.542  -1.743
  230    HA   THR  49           HA       THR  49  -4.111  -1.910  -2.311
  231    HB   THR  49           HB       THR  49  -2.891  -0.312  -4.289
  232    HG1  THR  49           HG1      THR  49  -5.145   0.674  -4.189
  233   HG21  THR  49          HG21      THR  49  -3.064  -2.796  -4.176
  234   HG22  THR  49          HG22      THR  49  -3.471  -2.130  -5.759
  235   HG23  THR  49          HG23      THR  49  -4.752  -2.658  -4.667
  236    H    ARG  50           H        ARG  50  -1.626  -1.416  -2.678
  237    HA   ARG  50           HA       ARG  50  -0.832   0.175  -0.420
  238    HB2  ARG  50           HB1      ARG  50   0.944  -1.172  -2.463
  239    HB3  ARG  50           HB2      ARG  50   1.386  -0.663  -0.829
  240    HG2  ARG  50           HG1      ARG  50   0.973  -2.753  -0.193
  241    HG3  ARG  50           HG2      ARG  50  -0.742  -2.361  -0.405
  242    HD2  ARG  50           HD1      ARG  50  -0.877  -3.393  -2.474
  243    HD3  ARG  50           HD2      ARG  50   0.860  -3.228  -2.769
  244    HE   ARG  50           HE       ARG  50   0.502  -4.935  -0.580
  245   HH11  ARG  50          HH11      ARG  50  -0.080  -4.852  -4.012
  246   HH12  ARG  50          HH12      ARG  50   0.057  -6.568  -4.207
  247   HH21  ARG  50          HH21      ARG  50   0.684  -7.195  -0.825
  248   HH22  ARG  50          HH22      ARG  50   0.490  -7.900  -2.394
  249    H    LYS  51           H        LYS  51  -1.926   2.056  -1.758
  250    HA   LYS  51           HA       LYS  51   0.241   3.457  -3.182
  251    HB2  LYS  51           HB1      LYS  51  -2.712   3.917  -3.625
  252    HB3  LYS  51           HB2      LYS  51  -1.360   4.522  -4.597
  253    HG2  LYS  51           HG1      LYS  51  -0.835   2.221  -5.292
  254    HG3  LYS  51           HG2      LYS  51  -2.227   1.647  -4.357
  255    HD2  LYS  51           HD1      LYS  51  -3.722   3.043  -5.738
  256    HD3  LYS  51           HD2      LYS  51  -2.321   3.559  -6.692
  257    HE2  LYS  51           HE1      LYS  51  -1.917   1.034  -7.086
  258    HE3  LYS  51           HE2      LYS  51  -3.585   0.843  -6.529
  259    HZ1  LYS  51           HZ1      LYS  51  -4.386   2.147  -8.306
  260    HZ2  LYS  51           HZ2      LYS  51  -3.284   1.062  -8.991
  261    HZ3  LYS  51           HZ3      LYS  51  -2.837   2.674  -8.736
  262    H    PHE  52           H        PHE  52  -0.168   5.913  -3.167
  263    HA   PHE  52           HA       PHE  52  -0.759   6.673  -0.394
  264    HB2  PHE  52           HB1      PHE  52   0.521   8.770  -0.980
  265    HB3  PHE  52           HB2      PHE  52   1.465   7.278  -1.001
  266    HD1  PHE  52           HD1      PHE  52  -0.460   9.492  -3.292
  267    HD2  PHE  52           HD2      PHE  52   2.782   6.775  -2.825
  268    HE1  PHE  52           HE1      PHE  52   0.257   9.956  -5.600
  269    HE2  PHE  52           HE2      PHE  52   3.505   7.235  -5.131
  270    HZ   PHE  52           HZ       PHE  52   2.242   8.828  -6.522
  271    H    CYS  53           H        CYS  53  -2.008   8.521   0.070
  272    HA   CYS  53           HA       CYS  53  -4.164   8.955  -1.791
  273    HB2  CYS  53           HB1      CYS  53  -3.610   9.532   1.049
  274    HB3  CYS  53           HB2      CYS  53  -4.614  10.731   0.232
  275    H    LEU  54           H        LEU  54  -3.454  10.112  -3.533
  276    HA   LEU  54           HA       LEU  54  -1.911  12.535  -3.169
  277    HB2  LEU  54           HB1      LEU  54  -1.850  10.754  -5.118
  278    HB3  LEU  54           HB2      LEU  54  -3.137  11.779  -5.776
  279    HG   LEU  54           HG       LEU  54  -0.947  12.337  -6.716
  280   HD11  LEU  54          HD11      LEU  54  -2.594  14.089  -6.592
  281   HD12  LEU  54          HD12      LEU  54  -1.002  14.761  -6.240
  282   HD13  LEU  54          HD13      LEU  54  -2.136  14.450  -4.927
  283   HD21  LEU  54          HD21      LEU  54   0.142  13.678  -4.405
  284   HD22  LEU  54          HD22      LEU  54   0.900  12.513  -5.492
  285   HD23  LEU  54          HD23      LEU  54  -0.041  11.947  -4.111
  286    H    GLN  55           H        GLN  55  -2.947  14.280  -2.453
  287    HA   GLN  55           HA       GLN  55  -5.598  14.887  -3.589
  288    HB2  GLN  55           HB1      GLN  55  -5.901  14.524  -1.271
  289    HB3  GLN  55           HB2      GLN  55  -4.449  15.450  -0.862
  290    HG2  GLN  55           HG1      GLN  55  -5.555  17.378  -0.791
  291    HG3  GLN  55           HG2      GLN  55  -6.389  17.040  -2.314
  292   HE21  GLN  55          HE21      GLN  55  -8.487  17.214  -2.035
  293   HE22  GLN  55          HE22      GLN  55  -9.392  16.609  -0.693
  294    HA   PRO  56           HA       PRO  56  -2.848  18.156  -5.237
  295    HB2  PRO  56           HB1      PRO  56  -4.278  18.489  -7.549
  296    HB3  PRO  56           HB2      PRO  56  -3.055  17.238  -7.333
  297    HG2  PRO  56           HG1      PRO  56  -6.035  17.050  -7.058
  298    HG3  PRO  56           HG2      PRO  56  -4.894  15.932  -7.895
  299    HD2  PRO  56           HD1      PRO  56  -5.910  15.415  -5.432
  300    HD3  PRO  56           HD2      PRO  56  -4.279  14.921  -5.917
  301    H    ARG  57           H        ARG  57  -3.139  20.356  -5.236
  302    HA   ARG  57           HA       ARG  57  -5.568  21.329  -4.014
  303    HB2  ARG  57           HB1      ARG  57  -4.391  23.511  -3.973
  304    HB3  ARG  57           HB2      ARG  57  -3.464  22.207  -3.216
  305    HG2  ARG  57           HG1      ARG  57  -2.665  22.210  -5.898
  306    HG3  ARG  57           HG2      ARG  57  -2.749  23.912  -5.414
  307    HD2  ARG  57           HD1      ARG  57  -1.274  23.536  -3.553
  308    HD3  ARG  57           HD2      ARG  57  -1.318  21.789  -3.826
  309    HE   ARG  57           HE       ARG  57   0.319  22.047  -5.390
  310   HH11  ARG  57          HH11      ARG  57  -1.273  25.110  -4.934
  311   HH12  ARG  57          HH12      ARG  57  -0.186  25.976  -5.968
  312   HH21  ARG  57          HH21      ARG  57   1.757  23.179  -6.754
  313   HH22  ARG  57          HH22      ARG  57   1.536  24.877  -7.003
  314    H    ASP  58           H        ASP  58  -4.192  21.179  -7.173
  315    HA   ASP  58           HA       ASP  58  -6.009  23.207  -8.225
  316    HB2  ASP  58           HB1      ASP  58  -4.126  21.528  -9.874
  317    HB3  ASP  58           HB2      ASP  58  -4.754  23.147 -10.214
  318    HD2  ASP  58           HD       ASP  58  -1.462  22.813  -8.122
  319    H    GLU  59           H        GLU  59  -5.712  19.784  -7.938
  320    HA   GLU  59           HA       GLU  59  -8.088  19.453  -9.648
  321    HB2  GLU  59           HB1      GLU  59  -5.581  18.313 -10.042
  322    HB3  GLU  59           HB2      GLU  59  -6.530  17.022  -9.287
  323    HG2  GLU  59           HG1      GLU  59  -8.308  17.456 -11.027
  324    HG3  GLU  59           HG2      GLU  59  -7.123  18.488 -11.841
  325    HE2  GLU  59           HE       GLU  59  -5.158  15.688 -12.712
  326    H    LYS  60           H        LYS  60  -8.986  17.060  -9.087
  327    HA   LYS  60           HA       LYS  60  -9.853  17.283  -6.337
  328    HB2  LYS  60           HB1      LYS  60 -11.321  15.338  -6.935
  329    HB3  LYS  60           HB2      LYS  60 -11.552  16.776  -7.943
  330    HG2  LYS  60           HG1      LYS  60 -10.835  15.760  -9.822
  331    HG3  LYS  60           HG2      LYS  60  -9.607  14.814  -8.959
  332    HD2  LYS  60           HD1      LYS  60 -10.947  13.033  -8.806
  333    HD3  LYS  60           HD2      LYS  60 -12.289  14.020  -8.201
  334    HE2  LYS  60           HE1      LYS  60 -12.567  14.786 -10.654
  335    HE3  LYS  60           HE2      LYS  60 -11.553  13.387 -11.041
  336    HZ1  LYS  60           HZ1      LYS  60 -14.265  13.446  -9.907
  337    HZ2  LYS  60           HZ2      LYS  60 -13.259  12.128  -9.577
  338    HZ3  LYS  60           HZ3      LYS  60 -13.655  12.510 -11.177
  339    HA   PRO  61           HA       PRO  61  -7.238  14.253  -4.533
  340    HB2  PRO  61           HB1      PRO  61  -8.910  13.127  -2.680
  341    HB3  PRO  61           HB2      PRO  61  -8.240  14.751  -2.526
  342    HG2  PRO  61           HG1      PRO  61 -10.926  13.891  -3.547
  343    HG3  PRO  61           HG2      PRO  61 -10.513  15.224  -2.404
  344    HD2  PRO  61           HD1      PRO  61 -11.073  15.662  -5.025
  345    HD3  PRO  61           HD2      PRO  61  -9.905  16.639  -4.118
  346    H    PHE  62           H        PHE  62  -6.560  12.368  -5.314
  347    HA   PHE  62           HA       PHE  62  -8.490  10.221  -5.790
  348    HB2  PHE  62           HB1      PHE  62  -7.215   9.710  -7.960
  349    HB3  PHE  62           HB2      PHE  62  -8.354  11.056  -7.982
  350    HD1  PHE  62           HD1      PHE  62  -7.678  12.961  -9.050
  351    HD2  PHE  62           HD2      PHE  62  -4.750  10.515  -7.162
  352    HE1  PHE  62           HE1      PHE  62  -5.907  14.480  -9.834
  353    HE2  PHE  62           HE2      PHE  62  -2.976  12.030  -7.942
  354    HZ   PHE  62           HZ       PHE  62  -3.553  14.017  -9.279
  355    H    CYS  63           H        CYS  63  -7.091   8.203  -6.608
  356    HA   CYS  63           HA       CYS  63  -4.930   7.926  -4.634
  357    HB2  CYS  63           HB1      CYS  63  -7.140   6.229  -5.450
  358    HB3  CYS  63           HB2      CYS  63  -5.599   5.380  -5.586
  359    H    ALA  64           H        ALA  64  -2.981   8.167  -5.500
  360    HA   ALA  64           HA       ALA  64  -2.509   7.208  -8.239
  361    HB1  ALA  64           HB1      ALA  64  -1.658   9.263  -8.454
  362    HB2  ALA  64           HB2      ALA  64  -1.554   9.503  -6.710
  363    HB3  ALA  64           HB3      ALA  64  -0.275   8.636  -7.558
  364    H    THR  65           H        THR  65  -1.156   5.562  -8.624
  365    HA   THR  65           HA       THR  65  -0.292   3.857  -6.582
  366    HB   THR  65           HB       THR  65   1.271   3.709  -9.074
  367    HG1  THR  65           HG1      THR  65  -0.487   3.252 -10.375
  368   HG21  THR  65          HG21      THR  65   0.409   1.988  -7.056
  369   HG22  THR  65          HG22      THR  65   1.246   1.540  -8.543
  370   HG23  THR  65          HG23      THR  65  -0.516   1.512  -8.480
  371    H    CYS  66           H        CYS  66   2.076   3.126  -6.405
  372    HA   CYS  66           HA       CYS  66   3.574   5.243  -5.297
  373    HB2  CYS  66           HB1      CYS  66   5.333   3.600  -4.949
  374    HB3  CYS  66           HB2      CYS  66   3.765   2.903  -4.539
  375    H    ARG  67           H        ARG  67   5.995   5.480  -5.933
  376    HA   ARG  67           HA       ARG  67   6.061   6.067  -8.815
  377    HB2  ARG  67           HB1      ARG  67   7.614   7.276  -6.515
  378    HB3  ARG  67           HB2      ARG  67   7.864   7.684  -8.219
  379    HG2  ARG  67           HG1      ARG  67   5.382   8.314  -8.261
  380    HG3  ARG  67           HG2      ARG  67   5.487   8.267  -6.493
  381    HD2  ARG  67           HD1      ARG  67   7.231   9.951  -6.496
  382    HD3  ARG  67           HD2      ARG  67   7.266   9.935  -8.265
  383    HE   ARG  67           HE       ARG  67   4.706  10.584  -7.750
  384   HH11  ARG  67          HH11      ARG  67   7.734  11.831  -6.569
  385   HH12  ARG  67          HH12      ARG  67   7.128  13.437  -6.330
  386   HH21  ARG  67          HH21      ARG  67   3.898  12.694  -7.439
  387   HH22  ARG  67          HH22      ARG  67   4.946  13.926  -6.824
  388    H    GLY  68           H        GLY  68   8.569   6.261  -9.490
  389    HA2  GLY  68           HA2      GLY  68   9.557   3.543  -9.241
  390    HA3  GLY  68           HA3      GLY  68  10.176   4.786 -10.319
  391    HA1  GLY  68           HA1      GLY  68   9.432   3.992  -8.493
  392    H    LEU  69           H        LEU  69  12.290   4.014  -9.643
  393    HA   LEU  69           HA       LEU  69  13.100   4.482  -6.909
  394    HB2  LEU  69           HB1      LEU  69  14.506   3.545  -9.399
  395    HB3  LEU  69           HB2      LEU  69  15.401   3.951  -7.923
  396    HG   LEU  69           HG       LEU  69  13.299   1.801  -8.175
  397   HD11  LEU  69          HD11      LEU  69  15.052   0.229  -8.093
  398   HD12  LEU  69          HD12      LEU  69  16.246   1.464  -7.692
  399   HD13  LEU  69          HD13      LEU  69  15.531   1.419  -9.303
  400   HD21  LEU  69          HD21      LEU  69  13.121   2.001  -5.966
  401   HD22  LEU  69          HD22      LEU  69  14.462   3.143  -5.887
  402   HD23  LEU  69          HD23      LEU  69  14.778   1.407  -5.866
  403    H    ARG  70           H        ARG  70  14.192   5.749 -10.064
  404    HA   ARG  70           HA       ARG  70  15.781   7.807  -9.088
  405    HB2  ARG  70           HB1      ARG  70  14.180   7.657 -11.652
  406    HB3  ARG  70           HB2      ARG  70  15.415   8.880 -11.317
  407    HG2  ARG  70           HG1      ARG  70  16.462   6.231 -10.859
  408    HG3  ARG  70           HG2      ARG  70  15.790   6.382 -12.491
  409    HD2  ARG  70           HD1      ARG  70  17.572   8.542 -11.418
  410    HD3  ARG  70           HD2      ARG  70  18.275   7.038 -12.030
  411    HE   ARG  70           HE       ARG  70  16.555   7.855 -13.997
  412   HH11  ARG  70          HH11      ARG  70  19.286   9.244 -12.345
  413   HH12  ARG  70          HH12      ARG  70  19.778  10.210 -13.697
  414   HH21  ARG  70          HH21      ARG  70  17.192   9.121 -15.784
  415   HH22  ARG  70          HH22      ARG  70  18.586  10.139 -15.652
  416    H    ARG  71           H        ARG  71  12.333   7.576  -9.325
  417    HA   ARG  71           HA       ARG  71  11.625  10.279  -9.317
  418    HB2  ARG  71           HB1      ARG  71  10.332   7.725  -8.803
  419    HB3  ARG  71           HB2      ARG  71   9.708   9.004  -7.748
  420    HG2  ARG  71           HG1      ARG  71   8.396   8.775  -9.814
  421    HG3  ARG  71           HG2      ARG  71   9.151  10.371  -9.661
  422    HD2  ARG  71           HD1      ARG  71  10.682   9.975 -11.349
  423    HD3  ARG  71           HD2      ARG  71  10.592   8.220 -11.141
  424    HE   ARG  71           HE       ARG  71   8.099   9.164 -12.029
  425   HH11  ARG  71          HH11      ARG  71  11.364   8.722 -13.155
  426   HH12  ARG  71          HH12      ARG  71  10.902   8.513 -14.812
  427   HH21  ARG  71          HH21      ARG  71   7.479   8.891 -14.208
  428   HH22  ARG  71          HH22      ARG  71   8.693   8.611 -15.410
  429    H    ARG  72           H        ARG  72  11.113  11.725  -7.660
  430    HA   ARG  72           HA       ARG  72  12.744  11.464  -5.305
  431    HB2  ARG  72           HB1      ARG  72  10.887  13.614  -6.325
  432    HB3  ARG  72           HB2      ARG  72  11.702  13.729  -4.759
  433    HG2  ARG  72           HG1      ARG  72  13.820  13.175  -6.332
  434    HG3  ARG  72           HG2      ARG  72  12.783  14.041  -7.478
  435    HD2  ARG  72           HD1      ARG  72  13.551  15.069  -4.738
  436    HD3  ARG  72           HD2      ARG  72  14.346  15.524  -6.252
  437    HE   ARG  72           HE       ARG  72  11.892  16.547  -5.248
  438   HH11  ARG  72          HH11      ARG  72  13.564  15.723  -8.188
  439   HH12  ARG  72          HH12      ARG  72  12.684  16.855  -9.160
  440   HH21  ARG  72          HH21      ARG  72  10.727  18.043  -6.517
  441   HH22  ARG  72          HH22      ARG  72  11.072  18.175  -8.209
  442    H    CYS  73           H        CYS  73  11.963  11.688  -3.125
  443    HA   CYS  73           HA       CYS  73   9.144  11.140  -2.655
  444    HB2  CYS  73           HB1      CYS  73   9.652   9.201  -1.194
  445    HB3  CYS  73           HB2      CYS  73  10.027   8.901  -2.893
  446    H    GLN  74           H        GLN  74   8.504  11.455  -0.452
  447    HA   GLN  74           HA       GLN  74  10.422  13.096   1.066
  448    HB2  GLN  74           HB1      GLN  74   7.493  13.352   0.558
  449    HB3  GLN  74           HB2      GLN  74   8.119  13.902   2.120
  450    HG2  GLN  74           HG1      GLN  74   9.566  15.489   1.089
  451    HG3  GLN  74           HG2      GLN  74   9.226  14.827  -0.516
  452   HE21  GLN  74          HE21      GLN  74   8.931  17.483  -0.082
  453   HE22  GLN  74          HE22      GLN  74   7.257  17.912  -0.100
  454    H    ARG  75           H        ARG  75   8.247  10.402   1.149
  455    HA   ARG  75           HA       ARG  75   9.089   9.858   3.912
  456    HB2  ARG  75           HB1      ARG  75   6.307   9.488   2.775
  457    HB3  ARG  75           HB2      ARG  75   6.836   8.913   4.362
  458    HG2  ARG  75           HG1      ARG  75   7.026  11.073   5.233
  459    HG3  ARG  75           HG2      ARG  75   7.033  11.808   3.622
  460    HD2  ARG  75           HD1      ARG  75   4.656  10.855   3.373
  461    HD3  ARG  75           HD2      ARG  75   4.724  10.616   5.125
  462    HE   ARG  75           HE       ARG  75   4.516  12.884   5.422
  463   HH11  ARG  75          HH11      ARG  75   5.231  12.204   2.084
  464   HH12  ARG  75          HH12      ARG  75   4.929  13.826   1.553
  465   HH21  ARG  75          HH21      ARG  75   4.116  15.022   4.736
  466   HH22  ARG  75          HH22      ARG  75   4.296  15.428   3.063
  467    H    ASP  76           H        ASP  76   8.544   7.487   4.481
  468    HA   ASP  76           HA       ASP  76   9.809   5.843   2.483
  469    HB2  ASP  76           HB1      ASP  76  10.454   5.507   4.778
  470    HB3  ASP  76           HB2      ASP  76   8.773   5.240   5.257
  471    HD2  ASP  76           HD       ASP  76  10.304   2.292   3.083
  472    H    ALA  77           H        ALA  77   6.587   6.437   3.610
  473    HA   ALA  77           HA       ALA  77   5.457   4.036   2.497
  474    HB1  ALA  77           HB1      ALA  77   3.401   4.781   3.301
  475    HB2  ALA  77           HB2      ALA  77   4.559   5.424   4.466
  476    HB3  ALA  77           HB3      ALA  77   3.878   6.477   3.226
  477    H    MET  78           H        MET  78   6.038   7.305   1.433
  478    HA   MET  78           HA       MET  78   4.255   7.547  -0.667
  479    HB2  MET  78           HB1      MET  78   6.827   8.739   0.087
  480    HB3  MET  78           HB2      MET  78   6.528   8.741  -1.658
  481    HG2  MET  78           HG1      MET  78   4.162   9.664  -0.889
  482    HG3  MET  78           HG2      MET  78   5.108  10.178   0.511
  483    HE1  MET  78           HE1      MET  78   4.492  10.486  -3.280
  484    HE2  MET  78           HE2      MET  78   5.762  11.581  -3.827
  485    HE3  MET  78           HE3      MET  78   6.168   9.936  -3.337
  486    H    CYS  79           H        CYS  79   7.136   5.614  -0.421
  487    HA   CYS  79           HA       CYS  79   6.999   4.928  -3.268
  488    HB2  CYS  79           HB1      CYS  79   9.158   5.455  -1.686
  489    HB3  CYS  79           HB2      CYS  79   9.098   3.693  -1.603
  490    H    CYS  80           H        CYS  80   6.882   2.758  -3.961
  491    HA   CYS  80           HA       CYS  80   5.002   1.159  -2.725
  492    HB2  CYS  80           HB1      CYS  80   6.928   0.864  -4.921
  493    HB3  CYS  80           HB2      CYS  80   6.515  -0.663  -4.136
  494    HA   PRO  81           HA       PRO  81   6.947  -1.078   0.507
  495    HB2  PRO  81           HB1      PRO  81   5.855  -3.576   0.241
  496    HB3  PRO  81           HB2      PRO  81   4.953  -2.177   0.820
  497    HG2  PRO  81           HG1      PRO  81   5.067  -3.359  -1.935
  498    HG3  PRO  81           HG2      PRO  81   3.635  -2.806  -0.989
  499    HD2  PRO  81           HD1      PRO  81   4.749  -1.316  -2.964
  500    HD3  PRO  81           HD2      PRO  81   4.011  -0.597  -1.523
  501    H    GLY  82           H        GLY  82   9.047  -1.581   0.512
  502    HA2  GLY  82           HA2      GLY  82  10.455  -3.671   0.171
  503    HA3  GLY  82           HA3      GLY  82  10.036  -3.476  -1.525
  504    HA1  GLY  82           HA1      GLY  82  10.431  -2.839   0.466
  505    H    THR  83           H        THR  83  10.195  -0.451  -0.980
  506    HA   THR  83           HA       THR  83  13.132  -0.275  -1.187
  507    HB   THR  83           HB       THR  83  12.533   1.937  -2.444
  508    HG1  THR  83           HG1      THR  83  10.253   0.469  -3.219
  509   HG21  THR  83          HG21      THR  83  13.508   0.683  -4.012
  510   HG22  THR  83          HG22      THR  83  11.900   0.106  -4.454
  511   HG23  THR  83          HG23      THR  83  12.878  -0.802  -3.300
  512    H    LEU  84           H        LEU  84  13.881   2.081  -0.751
  513    HA   LEU  84           HA       LEU  84  12.419   3.182   1.551
  514    HB2  LEU  84           HB1      LEU  84  15.130   2.086   1.432
  515    HB3  LEU  84           HB2      LEU  84  15.052   3.719   2.117
  516    HG   LEU  84           HG       LEU  84  13.371   1.438   3.138
  517   HD11  LEU  84          HD11      LEU  84  14.978   0.888   4.705
  518   HD12  LEU  84          HD12      LEU  84  15.850   2.406   4.500
  519   HD13  LEU  84          HD13      LEU  84  15.947   1.159   3.256
  520   HD21  LEU  84          HD21      LEU  84  13.766   3.162   5.189
  521   HD22  LEU  84          HD22      LEU  84  12.374   3.206   4.105
  522   HD23  LEU  84          HD23      LEU  84  13.751   4.273   3.819
  523    H    CYS  85           H        CYS  85  13.062   5.427   2.076
  524    HA   CYS  85           HA       CYS  85  13.533   6.923  -0.401
  525    HB2  CYS  85           HB1      CYS  85  11.461   7.315   1.014
  526    HB3  CYS  85           HB2      CYS  85  12.532   8.015   2.229
  527    H    VAL  86           H        VAL  86  15.578   7.488  -0.729
  528    HA   VAL  86           HA       VAL  86  17.124   8.522   1.556
  529    HB   VAL  86           HB       VAL  86  18.259   6.936  -0.751
  530   HG11  VAL  86          HG11      VAL  86  20.259   6.895   0.867
  531   HG12  VAL  86          HG12      VAL  86  19.952   8.375  -0.044
  532   HG13  VAL  86          HG13      VAL  86  19.469   8.262   1.649
  533   HG21  VAL  86          HG21      VAL  86  18.612   5.140   0.831
  534   HG22  VAL  86          HG22      VAL  86  17.895   6.100   2.125
  535   HG23  VAL  86          HG23      VAL  86  16.899   5.555   0.776
  536    H    ASN  87           H        ASN  87  18.111  10.438   1.267
  537    HA   ASN  87           HA       ASN  87  18.594  12.461   0.341
  538    HB2  ASN  87           HB1      ASN  87  19.146  10.862  -2.171
  539    HB3  ASN  87           HB2      ASN  87  19.828  12.433  -1.733
  540   HD21  ASN  87          HD21      ASN  87  21.149   9.890  -2.351
  541   HD22  ASN  87          HD22      ASN  87  22.148   9.537  -0.984
  542    H    ASP  88           H        ASP  88  15.863  11.684   0.265
  543    HA   ASP  88           HA       ASP  88  13.878  12.396  -0.586
  544    HB2  ASP  88           HB1      ASP  88  15.544  14.523  -0.864
  545    HB3  ASP  88           HB2      ASP  88  15.072  14.257  -2.548
  546    HD2  ASP  88           HD       ASP  88  12.255  15.414  -0.002
  547    H    VAL  89           H        VAL  89  15.480  10.264  -1.893
  548    HA   VAL  89           HA       VAL  89  13.934  10.155  -4.372
  549    HB   VAL  89           HB       VAL  89  16.893   9.550  -4.286
  550   HG11  VAL  89          HG11      VAL  89  16.677   9.221  -6.695
  551   HG12  VAL  89          HG12      VAL  89  15.637   8.103  -5.808
  552   HG13  VAL  89          HG13      VAL  89  14.943   9.525  -6.588
  553   HG21  VAL  89          HG21      VAL  89  15.344  11.942  -5.145
  554   HG22  VAL  89          HG22      VAL  89  16.916  11.839  -4.353
  555   HG23  VAL  89          HG23      VAL  89  16.771  11.484  -6.075
  556    H    CYS  90           H        CYS  90  13.205   8.148  -4.884
  557    HA   CYS  90           HA       CYS  90  13.189   6.151  -2.897
  558    HB2  CYS  90           HB1      CYS  90  12.295   6.296  -5.757
  559    HB3  CYS  90           HB2      CYS  90  12.309   4.736  -4.934
  560    H    THR  91           H        THR  91  14.232   4.191  -2.731
  561    HA   THR  91           HA       THR  91  16.202   3.415  -4.715
  562    HB   THR  91           HB       THR  91  17.490   4.966  -3.330
  563    HG1  THR  91           HG1      THR  91  19.159   3.620  -3.276
  564   HG21  THR  91          HG21      THR  91  16.826   5.142  -1.189
  565   HG22  THR  91          HG22      THR  91  17.879   3.756  -0.908
  566   HG23  THR  91          HG23      THR  91  16.151   3.513  -1.167
  567    H    THR  92           H        THR  92  17.031   1.275  -4.389
  568    HA   THR  92           HA       THR  92  15.094  -0.487  -3.223
  569    HB   THR  92           HB       THR  92  17.421  -1.961  -3.858
  570    HG1  THR  92           HG1      THR  92  17.399  -1.068  -6.189
  571   HG21  THR  92          HG21      THR  92  16.025  -2.735  -5.766
  572   HG22  THR  92          HG22      THR  92  14.862  -1.465  -5.382
  573   HG23  THR  92          HG23      THR  92  15.173  -2.757  -4.223
  574    H    MET  93           H        MET  93  15.650  -2.219  -1.706
  575    HA   MET  93           HA       MET  93  16.846  -1.197   0.646
  576    HB2  MET  93           HB1      MET  93  15.398  -3.579  -0.166
  577    HB3  MET  93           HB2      MET  93  16.723  -3.971   0.941
  578    HG2  MET  93           HG1      MET  93  15.814  -2.116   2.443
  579    HG3  MET  93           HG2      MET  93  14.378  -2.167   1.417
  580    HE1  MET  93           HE1      MET  93  15.227  -3.151   4.807
  581    HE2  MET  93           HE2      MET  93  13.749  -2.425   4.178
  582    HE3  MET  93           HE3      MET  93  13.694  -4.010   4.950
  583    H    GLU  94           H        GLU  94  18.054  -3.065  -2.020
  584    HA   GLU  94           HA       GLU  94  20.409  -4.000  -0.673
  585    HB2  GLU  94           HB1      GLU  94  19.784  -3.836  -3.632
  586    HB3  GLU  94           HB2      GLU  94  21.134  -4.723  -2.908
  587    HG2  GLU  94           HG1      GLU  94  19.711  -6.310  -1.904
  588    HG3  GLU  94           HG2      GLU  94  18.279  -5.315  -2.207
  589    HE2  GLU  94           HE       GLU  94  18.518  -7.929  -4.752
  590    H    ASP  95           H        ASP  95  19.504  -1.173  -2.470
  591    HA   ASP  95           HA       ASP  95  22.191  -0.285  -2.968
  592    HB2  ASP  95           HB1      ASP  95  19.449   0.750  -3.447
  593    HB3  ASP  95           HB2      ASP  95  20.731   1.959  -3.293
  594    HD2  ASP  95           HD       ASP  95  21.716  -0.520  -6.166
  595    H    ALA  96           H        ALA  96  19.585   0.749  -0.772
  596    HA   ALA  96           HA       ALA  96  21.099   2.708   0.575
  597    HB1  ALA  96           HB1      ALA  96  18.957   3.097   1.109
  598    HB2  ALA  96           HB2      ALA  96  18.499   1.403   0.930
  599    HB3  ALA  96           HB3      ALA  96  19.251   1.959   2.425
  600    H    THR  97           H        THR  97  22.637   2.545   2.068
  601    HA   THR  97           HA       THR  97  24.058   1.699   3.633
  602    HB   THR  97           HB       THR  97  21.934  -0.364   4.231
  603    HG1  THR  97           HG1      THR  97  20.935   1.138   5.465
  604   HG21  THR  97          HG21      THR  97  23.695   0.875   6.283
  605   HG22  THR  97          HG22      THR  97  24.402  -0.327   5.204
  606   HG23  THR  97          HG23      THR  97  23.016  -0.750   6.210
  607    H    GLU  98           H        GLU  98  25.654   0.942   2.283
  608    HA   GLU  98           HA       GLU  98  25.786  -1.957   2.010
  609    HB2  GLU  98           HB1      GLU  98  24.804  -1.170  -0.106
  610    HB3  GLU  98           HB2      GLU  98  26.186  -0.087  -0.333
  611    HG2  GLU  98           HG1      GLU  98  26.887  -1.800  -1.633
  612    HG3  GLU  98           HG2      GLU  98  27.532  -2.352  -0.081
  613    HE2  GLU  98           HE       GLU  98  24.364  -4.271  -1.530
  614    H    ASN  99           H        ASN  99  27.638  -2.515   2.925
  615    HA   ASN  99           HA       ASN  99  29.931  -0.683   2.715
  616    HB2  ASN  99           HB1      ASN  99  28.806  -1.667   4.981
  617    HB3  ASN  99           HB2      ASN  99  30.038  -2.897   4.673
  618   HD21  ASN  99          HD21      ASN  99  29.778  -0.791   6.757
  619   HD22  ASN  99          HD22      ASN  99  31.272   0.075   6.703
  620    H    LEU 100           H        LEU 100  32.077  -2.063   3.075
  621    HA   LEU 100           HA       LEU 100  32.001  -4.503   1.468
  622    HB2  LEU 100           HB1      LEU 100  33.273  -1.932   0.718
  623    HB3  LEU 100           HB2      LEU 100  34.215  -3.404   0.429
  624    HG   LEU 100           HG       LEU 100  31.410  -3.214  -0.593
  625   HD11  LEU 100          HD11      LEU 100  33.003  -2.522  -2.730
  626   HD12  LEU 100          HD12      LEU 100  33.646  -1.547  -1.409
  627   HD13  LEU 100          HD13      LEU 100  31.937  -1.440  -1.832
  628   HD21  LEU 100          HD21      LEU 100  33.807  -4.509  -1.851
  629   HD22  LEU 100          HD22      LEU 100  32.098  -4.850  -2.117
  630   HD23  LEU 100          HD23      LEU 100  32.866  -5.319  -0.598
  631    H    TYR 101           H        TYR 101  34.269  -5.512   1.401
  632    HA   TYR 101           HA       TYR 101  35.815  -4.929   3.816
  633    HB2  TYR 101           HB1      TYR 101  34.328  -7.455   3.220
  634    HB3  TYR 101           HB2      TYR 101  35.891  -7.571   4.035
  635    HD1  TYR 101           HD1      TYR 101  32.572  -5.909   4.314
  636    HD2  TYR 101           HD2      TYR 101  36.061  -7.254   6.343
  637    HE1  TYR 101           HE1      TYR 101  31.504  -5.407   6.471
  638    HE2  TYR 101           HE2      TYR 101  35.002  -6.757   8.506
  639    HH   TYR 101           HH       TYR 101  33.266  -5.725   9.512
  640    H    PHE 102           H        PHE 102  37.863  -6.275   3.860
  641    HA   PHE 102           HA       PHE 102  38.805  -7.076   1.219
  642    HB2  PHE 102           HB1      PHE 102  40.705  -5.639   1.204
  643    HB3  PHE 102           HB2      PHE 102  39.301  -4.621   1.529
  644    HD1  PHE 102           HD1      PHE 102  42.334  -6.075   2.969
  645    HD2  PHE 102           HD2      PHE 102  38.977  -3.552   3.660
  646    HE1  PHE 102           HE1      PHE 102  43.406  -5.212   5.009
  647    HE2  PHE 102           HE2      PHE 102  40.044  -2.683   5.699
  648    HZ   PHE 102           HZ       PHE 102  42.261  -3.512   6.376
  649    H    GLN 103           H        GLN 103  41.297  -7.702   1.533
  650    HA   GLN 103           HA       GLN 103  41.758  -8.974   4.108
  651    HB2  GLN 103           HB1      GLN 103  40.852 -10.400   1.735
  652    HB3  GLN 103           HB2      GLN 103  42.401 -11.015   2.336
  653    HG2  GLN 103           HG1      GLN 103  40.657 -10.632   4.559
  654    HG3  GLN 103           HG2      GLN 103  39.807 -11.550   3.308
  655   HE21  GLN 103          HE21      GLN 103  41.150 -13.350   2.322
  656   HE22  GLN 103          HE22      GLN 103  42.064 -14.316   3.424
  657    H    SER 104           H        SER 104  43.929  -9.629   4.437
  658    HA   SER 104           HA       SER 104  45.812  -8.393   2.541
  659    HB2  SER 104           HB1      SER 104  45.533  -7.603   5.050
  660    HB3  SER 104           HB2      SER 104  46.580  -9.000   5.369
  661    HG   SER 104           HG       SER 104  47.164  -6.865   3.589
  662    H    LEU 105           H        LEU 105  47.545  -9.531   1.797
  663    HA   LEU 105           HA       LEU 105  47.598 -12.393   2.478
  664    HB2  LEU 105           HB1      LEU 105  48.792 -12.652   0.294
  665    HB3  LEU 105           HB2      LEU 105  47.118 -12.086   0.178
  666    HG   LEU 105           HG       LEU 105  48.830  -9.809   0.254
  667   HD11  LEU 105          HD11      LEU 105  49.692 -12.010  -1.592
  668   HD12  LEU 105          HD12      LEU 105  50.678 -11.004  -0.531
  669   HD13  LEU 105          HD13      LEU 105  49.957 -10.311  -1.983
  670   HD21  LEU 105          HD21      LEU 105  47.881  -9.767  -2.208
  671   HD22  LEU 105          HD22      LEU 105  46.841  -9.467  -0.816
  672   HD23  LEU 105          HD23      LEU 105  46.852 -11.055  -1.584
  673    H    GLU 106           H        GLU 106  49.573  -9.511   2.107
  674    HA   GLU 106           HA       GLU 106  51.697  -9.006   2.745
  675    HB2  GLU 106           HB1      GLU 106  50.504 -10.272   4.864
  676    HB3  GLU 106           HB2      GLU 106  51.976 -11.229   4.644
  677    HG2  GLU 106           HG1      GLU 106  53.168  -8.918   4.584
  678    HG3  GLU 106           HG2      GLU 106  51.690  -8.351   5.374
  679    HE2  GLU 106           HE       GLU 106  54.328  -9.961   7.627
  680    H    HIS 107           H        HIS 107  53.916 -10.305   3.412
  681    HA   HIS 107           HA       HIS 107  54.476 -11.879   1.032
  682    HB2  HIS 107           HB1      HIS 107  56.784 -11.518   1.487
  683    HB3  HIS 107           HB2      HIS 107  55.960  -9.988   1.802
  684    HD1  HIS 107           HD1      HIS 107  57.920 -12.648   3.483
  685    HD2  HIS 107           HD2      HIS 107  55.797  -9.236   4.533
  686    HE1  HIS 107           HE1      HIS 107  58.588 -12.145   5.854
  687    HE2  HIS 107           HE2      HIS 107  57.290 -10.058   6.497
  688    H    HIS 108           H        HIS 108  56.069 -13.751   1.348
  689    HA   HIS 108           HA       HIS 108  55.273 -15.346   3.695
  690    HB2  HIS 108           HB1      HIS 108  55.280 -16.052   0.786
  691    HB3  HIS 108           HB2      HIS 108  55.643 -17.315   1.968
  692    HD1  HIS 108           HD1      HIS 108  53.652 -18.615   2.599
  693    HD2  HIS 108           HD2      HIS 108  52.686 -14.676   1.702
  694    HE1  HIS 108           HE1      HIS 108  51.159 -18.454   2.883
  695    HE2  HIS 108           HE2      HIS 108  50.566 -16.047   2.335
  696    H    HIS 109           H        HIS 109  56.793 -17.421   3.722
  697    HA   HIS 109           HA       HIS 109  58.873 -18.229   4.168
  698    HB2  HIS 109           HB1      HIS 109  58.995 -17.182   1.603
  699    HB3  HIS 109           HB2      HIS 109  60.389 -16.457   2.412
  700    HD1  HIS 109           HD1      HIS 109  58.926 -19.975   2.220
  701    HD2  HIS 109           HD2      HIS 109  62.580 -17.998   2.154
  702    HE1  HIS 109           HE1      HIS 109  60.657 -21.773   1.915
  703    HE2  HIS 109           HE2      HIS 109  62.892 -20.566   1.875
  704    H    HIS 110           H        HIS 110  59.199 -17.552   6.238
  705    HA   HIS 110           HA       HIS 110  59.897 -14.870   6.917
  706    HB2  HIS 110           HB1      HIS 110  59.802 -17.475   8.413
  707    HB3  HIS 110           HB2      HIS 110  60.520 -16.044   9.158
  708    HD1  HIS 110           HD1      HIS 110  57.457 -17.738   9.151
  709    HD2  HIS 110           HD2      HIS 110  58.499 -13.730   8.823
  710    HE1  HIS 110           HE1      HIS 110  55.391 -16.452   9.787
  711    HE2  HIS 110           HE2      HIS 110  56.029 -14.001   9.589
  712    H    HIS 111           H        HIS 111  61.932 -14.629   8.434
  713    HA   HIS 111           HA       HIS 111  64.206 -15.050   6.740
  714    HB2  HIS 111           HB1      HIS 111  63.938 -13.869   9.512
  715    HB3  HIS 111           HB2      HIS 111  65.450 -13.906   8.599
  716    HD1  HIS 111           HD1      HIS 111  63.895 -11.279   9.489
  717    HD2  HIS 111           HD2      HIS 111  63.877 -12.988   5.703
  718    HE1  HIS 111           HE1      HIS 111  63.308  -9.411   7.912
  719    HE2  HIS 111           HE2      HIS 111  63.296 -10.453   5.597
  720    H    HIS 112           H        HIS 112  63.324 -16.137  10.015
  721    HA   HIS 112           HA       HIS 112  64.048 -17.878  11.290
  722    HB2  HIS 112           HB1      HIS 112  63.082 -19.018   9.187
  723    HB3  HIS 112           HB2      HIS 112  64.766 -19.299   8.736
  724    HD1  HIS 112           HD1      HIS 112  62.121 -20.498  11.035
  725    HD2  HIS 112           HD2      HIS 112  66.181 -21.112  10.405
  726    HE1  HIS 112           HE1      HIS 112  62.699 -22.568  12.342
  727    HE2  HIS 112           HE2      HIS 112  65.181 -22.943  11.957
  Start of MODEL   44
    1    H1   MET  18           H        MET  18 -54.598 -35.258  12.221
    2    HA   MET  18           HA       MET  18 -51.992 -34.054  12.863
    3    HB2  MET  18           HB1      MET  18 -54.510 -32.486  12.266
    4    HB3  MET  18           HB2      MET  18 -52.891 -31.837  12.569
    5    HG2  MET  18           HG1      MET  18 -52.632 -31.774  10.362
    6    HG3  MET  18           HG2      MET  18 -52.485 -33.532  10.445
    7    HE1  MET  18           HE1      MET  18 -54.334 -31.726   7.574
    8    HE2  MET  18           HE2      MET  18 -52.876 -32.597   8.052
    9    HE3  MET  18           HE3      MET  18 -54.246 -33.477   7.370
   10    H    LEU  19           H        LEU  19 -51.867 -34.757  14.947
   11    HA   LEU  19           HA       LEU  19 -54.142 -34.278  16.727
   12    HB2  LEU  19           HB1      LEU  19 -52.185 -36.316  16.524
   13    HB3  LEU  19           HB2      LEU  19 -51.915 -35.472  18.057
   14    HG   LEU  19           HG       LEU  19 -53.354 -37.454  18.300
   15   HD11  LEU  19          HD11      LEU  19 -55.354 -36.113  19.311
   16   HD12  LEU  19          HD12      LEU  19 -54.348 -34.716  18.933
   17   HD13  LEU  19          HD13      LEU  19 -53.742 -35.973  20.010
   18   HD21  LEU  19          HD21      LEU  19 -54.437 -36.787  15.931
   19   HD22  LEU  19          HD22      LEU  19 -55.651 -36.116  17.021
   20   HD23  LEU  19          HD23      LEU  19 -55.234 -37.828  17.109
   21    H    VAL  20           H        VAL  20 -50.702 -33.525  16.374
   22    HA   VAL  20           HA       VAL  20 -50.988 -31.478  18.472
   23    HB   VAL  20           HB       VAL  20 -48.578 -31.533  18.734
   24   HG11  VAL  20          HG11      VAL  20 -48.393 -33.581  19.851
   25   HG12  VAL  20          HG12      VAL  20 -50.124 -33.240  19.852
   26   HG13  VAL  20          HG13      VAL  20 -49.453 -34.403  18.707
   27   HG21  VAL  20          HG21      VAL  20 -47.697 -33.768  17.358
   28   HG22  VAL  20          HG22      VAL  20 -48.704 -32.917  16.188
   29   HG23  VAL  20          HG23      VAL  20 -47.351 -32.086  16.956
   30    H    LEU  21           H        LEU  21 -50.361 -29.374  18.087
   31    HA   LEU  21           HA       LEU  21 -50.300 -28.592  15.292
   32    HB2  LEU  21           HB1      LEU  21 -50.970 -27.340  17.852
   33    HB3  LEU  21           HB2      LEU  21 -50.053 -26.285  16.762
   34    HG   LEU  21           HG       LEU  21 -51.839 -26.904  15.006
   35   HD11  LEU  21          HD11      LEU  21 -53.787 -27.222  17.161
   36   HD12  LEU  21          HD12      LEU  21 -52.707 -28.601  16.959
   37   HD13  LEU  21          HD13      LEU  21 -53.676 -28.032  15.599
   38   HD21  LEU  21          HD21      LEU  21 -51.723 -24.920  17.072
   39   HD22  LEU  21          HD22      LEU  21 -53.404 -25.305  16.706
   40   HD23  LEU  21          HD23      LEU  21 -52.319 -24.776  15.419
   41    H    ASP  22           H        ASP  22 -48.660 -27.421  14.305
   42    HA   ASP  22           HA       ASP  22 -46.177 -27.014  15.799
   43    HB2  ASP  22           HB1      ASP  22 -46.171 -29.273  14.616
   44    HB3  ASP  22           HB2      ASP  22 -46.161 -28.362  13.099
   45    HD2  ASP  22           HD       ASP  22 -42.934 -27.568  15.228
   46    H    PHE  23           H        PHE  23 -46.111 -24.845  15.641
   47    HA   PHE  23           HA       PHE  23 -45.375 -23.643  13.189
   48    HB2  PHE  23           HB1      PHE  23 -47.818 -23.889  12.784
   49    HB3  PHE  23           HB2      PHE  23 -48.123 -22.892  14.208
   50    HD1  PHE  23           HD1      PHE  23 -47.618 -20.509  14.219
   51    HD2  PHE  23           HD2      PHE  23 -47.042 -22.884  10.734
   52    HE1  PHE  23           HE1      PHE  23 -47.473 -18.466  12.855
   53    HE2  PHE  23           HE2      PHE  23 -46.896 -20.845   9.364
   54    HZ   PHE  23           HZ       PHE  23 -47.110 -18.633  10.424
   55    H    ASN  24           H        ASN  24 -43.747 -22.556  14.125
   56    HA   ASN  24           HA       ASN  24 -44.391 -20.330  15.844
   57    HB2  ASN  24           HB1      ASN  24 -43.936 -22.560  17.227
   58    HB3  ASN  24           HB2      ASN  24 -42.254 -22.094  16.946
   59   HD21  ASN  24          HD21      ASN  24 -42.923 -22.163  19.466
   60   HD22  ASN  24          HD22      ASN  24 -43.165 -20.585  20.127
   61    H    ASN  25           H        ASN  25 -42.371 -19.046  16.362
   62    HA   ASN  25           HA       ASN  25 -40.618 -17.824  15.578
   63    HB2  ASN  25           HB1      ASN  25 -39.630 -20.219  16.040
   64    HB3  ASN  25           HB2      ASN  25 -39.478 -20.271  14.280
   65   HD21  ASN  25          HD21      ASN  25 -37.351 -20.087  13.982
   66   HD22  ASN  25          HD22      ASN  25 -36.383 -18.768  14.540
   67    H    ILE  26           H        ILE  26 -42.031 -16.732  14.085
   68    HA   ILE  26           HA       ILE  26 -41.568 -17.504  11.278
   69    HB   ILE  26           HB       ILE  26 -43.643 -16.228  10.746
   70   HG12  ILE  26          HG11      ILE  26 -44.389 -16.419  13.644
   71   HG13  ILE  26          HG12      ILE  26 -43.457 -15.022  13.077
   72   HG21  ILE  26          HG21      ILE  26 -43.394 -18.788  11.389
   73   HG22  ILE  26          HG22      ILE  26 -44.478 -18.306  12.692
   74   HG23  ILE  26          HG23      ILE  26 -44.960 -18.068  11.013
   75   HD11  ILE  26          HD11      ILE  26 -45.173 -14.298  11.661
   76   HD12  ILE  26          HD12      ILE  26 -46.027 -15.837  11.771
   77   HD13  ILE  26          HD13      ILE  26 -45.972 -14.756  13.164
   78    H    ARG  27           H        ARG  27 -40.994 -15.919   9.804
   79    HA   ARG  27           HA       ARG  27 -39.961 -14.034   9.062
   80    HB2  ARG  27           HB1      ARG  27 -41.990 -13.079  10.989
   81    HB3  ARG  27           HB2      ARG  27 -40.703 -11.929  10.600
   82    HG2  ARG  27           HG1      ARG  27 -41.665 -13.138   8.182
   83    HG3  ARG  27           HG2      ARG  27 -43.018 -12.482   9.118
   84    HD2  ARG  27           HD1      ARG  27 -41.696 -10.339   9.346
   85    HD3  ARG  27           HD2      ARG  27 -40.562 -11.021   8.172
   86    HE   ARG  27           HE       ARG  27 -42.059 -10.556   6.509
   87   HH11  ARG  27          HH11      ARG  27 -43.708 -10.465   9.575
   88   HH12  ARG  27          HH12      ARG  27 -45.187  -9.857   8.909
   89   HH21  ARG  27          HH21      ARG  27 -44.002  -9.755   5.621
   90   HH22  ARG  27          HH22      ARG  27 -45.354  -9.456   6.659
   91    H    SER  28           H        SER  28 -38.592 -12.060   9.882
   92    HA   SER  28           HA       SER  28 -37.187 -12.641  12.365
   93    HB2  SER  28           HB1      SER  28 -35.928 -12.792   9.624
   94    HB3  SER  28           HB2      SER  28 -34.968 -12.443  11.073
   95    HG   SER  28           HG       SER  28 -35.173 -14.730  10.419
   96    H    SER  29           H        SER  29 -36.556 -10.832  13.371
   97    HA   SER  29           HA       SER  29 -37.047  -8.291  12.050
   98    HB2  SER  29           HB1      SER  29 -36.563  -9.139  14.899
   99    HB3  SER  29           HB2      SER  29 -36.431  -7.434  14.431
  100    HG   SER  29           HG       SER  29 -38.650  -8.924  14.833
  101    H    ALA  30           H        ALA  30 -35.294  -8.231  10.596
  102    HA   ALA  30           HA       ALA  30 -32.653  -7.867  11.852
  103    HB1  ALA  30           HB1      ALA  30 -31.802  -8.301   9.483
  104    HB2  ALA  30           HB2      ALA  30 -32.451  -9.676  10.379
  105    HB3  ALA  30           HB3      ALA  30 -33.429  -8.890   9.140
  106    H    ASP  31           H        ASP  31 -31.646  -5.957  11.655
  107    HA   ASP  31           HA       ASP  31 -32.039  -4.147   9.512
  108    HB2  ASP  31           HB1      ASP  31 -33.049  -2.297  10.947
  109    HB3  ASP  31           HB2      ASP  31 -34.143  -3.592  10.444
  110    HD2  ASP  31           HD       ASP  31 -34.616  -4.673  13.694
  111    H    LEU  32           H        LEU  32 -30.784  -2.175   9.762
  112    HA   LEU  32           HA       LEU  32 -29.187  -1.668  12.038
  113    HB2  LEU  32           HB1      LEU  32 -28.265  -3.842  10.754
  114    HB3  LEU  32           HB2      LEU  32 -27.430  -2.574   9.840
  115    HG   LEU  32           HG       LEU  32 -27.194  -2.250  12.734
  116   HD11  LEU  32          HD11      LEU  32 -26.565  -4.847  11.471
  117   HD12  LEU  32          HD12      LEU  32 -26.964  -4.462  13.145
  118   HD13  LEU  32          HD13      LEU  32 -25.336  -4.162  12.535
  119   HD21  LEU  32          HD21      LEU  32 -25.053  -1.573  12.204
  120   HD22  LEU  32          HD22      LEU  32 -25.936  -1.158  10.734
  121   HD23  LEU  32          HD23      LEU  32 -24.955  -2.624  10.790
  122    H    HIS  33           H        HIS  33 -28.379   0.354  11.936
  123    HA   HIS  33           HA       HIS  33 -28.046   1.621   9.315
  124    HB2  HIS  33           HB1      HIS  33 -30.310   2.058  10.786
  125    HB3  HIS  33           HB2      HIS  33 -29.266   3.367  11.350
  126    HD1  HIS  33           HD1      HIS  33 -31.623   2.642   8.764
  127    HD2  HIS  33           HD2      HIS  33 -28.136   4.887   9.015
  128    HE1  HIS  33           HE1      HIS  33 -31.704   4.229   6.815
  129    HE2  HIS  33           HE2      HIS  33 -29.574   5.603   6.969
  130    H    GLY  34           H        GLY  34 -26.262   2.846   9.182
  131    HA2  GLY  34           HA2      GLY  34 -24.423   2.913  11.354
  132    HA3  GLY  34           HA3      GLY  34 -24.226   3.718   9.804
  133    HA1  GLY  34           HA1      GLY  34 -25.246   3.143  11.578
  134    H    ALA  35           H        ALA  35 -23.893   5.815  10.067
  135    HA   ALA  35           HA       ALA  35 -25.759   7.433  11.527
  136    HB1  ALA  35           HB1      ALA  35 -22.945   7.153  12.566
  137    HB2  ALA  35           HB2      ALA  35 -24.063   8.430  13.045
  138    HB3  ALA  35           HB3      ALA  35 -24.439   6.746  13.408
  139    H    ARG  36           H        ARG  36 -22.314   7.765  10.663
  140    HA   ARG  36           HA       ARG  36 -23.055   9.704   8.599
  141    HB2  ARG  36           HB1      ARG  36 -21.444  10.226  11.052
  142    HB3  ARG  36           HB2      ARG  36 -20.920  10.990   9.543
  143    HG2  ARG  36           HG1      ARG  36 -23.663  11.457   9.635
  144    HG3  ARG  36           HG2      ARG  36 -23.097  11.692  11.298
  145    HD2  ARG  36           HD1      ARG  36 -21.196  13.090  10.197
  146    HD3  ARG  36           HD2      ARG  36 -22.290  13.142   8.808
  147    HE   ARG  36           HE       ARG  36 -22.593  14.539  11.304
  148   HH11  ARG  36          HH11      ARG  36 -24.230  13.285   8.500
  149   HH12  ARG  36          HH12      ARG  36 -25.568  14.378   8.630
  150   HH21  ARG  36          HH21      ARG  36 -24.348  15.984  11.487
  151   HH22  ARG  36          HH22      ARG  36 -25.633  15.914  10.329
  152    H    LYS  37           H        LYS  37 -21.025  10.363   7.327
  153    HA   LYS  37           HA       LYS  37 -18.787   8.613   7.302
  154    HB2  LYS  37           HB1      LYS  37 -20.579   7.117   6.385
  155    HB3  LYS  37           HB2      LYS  37 -20.743   8.244   5.028
  156    HG2  LYS  37           HG1      LYS  37 -18.076   7.785   4.961
  157    HG3  LYS  37           HG2      LYS  37 -18.673   6.233   5.573
  158    HD2  LYS  37           HD1      LYS  37 -20.439   6.871   3.518
  159    HD3  LYS  37           HD2      LYS  37 -18.849   7.359   2.906
  160    HE2  LYS  37           HE1      LYS  37 -18.235   4.951   3.996
  161    HE3  LYS  37           HE2      LYS  37 -19.910   4.674   3.497
  162    HZ1  LYS  37           HZ1      LYS  37 -18.905   4.160   1.562
  163    HZ2  LYS  37           HZ2      LYS  37 -17.543   5.115   1.865
  164    HZ3  LYS  37           HZ3      LYS  37 -18.971   5.832   1.312
  165    H    GLY  38           H        GLY  38 -18.117  10.931   7.393
  166    HA2  GLY  38           HA2      GLY  38 -18.273  12.337   4.833
  167    HA3  GLY  38           HA3      GLY  38 -17.667  12.997   6.344
  168    HA1  GLY  38           HA1      GLY  38 -17.954  11.516   4.846
  169    H    SER  39           H        SER  39 -15.883  13.796   5.053
  170    HA   SER  39           HA       SER  39 -13.719  13.744   4.351
  171    HB2  SER  39           HB1      SER  39 -13.163  11.014   5.348
  172    HB3  SER  39           HB2      SER  39 -12.308  12.535   5.659
  173    HG   SER  39           HG       SER  39 -13.397  11.671   7.521
  174    H    GLN  40           H        GLN  40 -12.076  12.289   3.101
  175    HA   GLN  40           HA       GLN  40 -13.605  10.874   1.025
  176    HB2  GLN  40           HB1      GLN  40 -11.537  11.360  -0.399
  177    HB3  GLN  40           HB2      GLN  40 -12.578  12.732   0.013
  178    HG2  GLN  40           HG1      GLN  40 -10.261  12.118   1.785
  179    HG3  GLN  40           HG2      GLN  40  -9.968  12.889   0.219
  180   HE21  GLN  40          HE21      GLN  40 -10.097  13.643   3.265
  181   HE22  GLN  40          HE22      GLN  40 -10.861  15.193   3.221
  182    H    CYS  41           H        CYS  41 -10.755  10.743   3.076
  183    HA   CYS  41           HA       CYS  41 -10.748   7.885   3.030
  184    HB2  CYS  41           HB1      CYS  41  -8.647   7.477   1.984
  185    HB3  CYS  41           HB2      CYS  41  -9.589   8.471   0.871
  186    H    LEU  42           H        LEU  42  -9.613   7.021   4.736
  187    HA   LEU  42           HA       LEU  42  -8.746   8.921   6.747
  188    HB2  LEU  42           HB1      LEU  42  -9.876   6.306   6.724
  189    HB3  LEU  42           HB2      LEU  42  -8.323   6.237   7.576
  190    HG   LEU  42           HG       LEU  42  -9.700   8.487   8.582
  191   HD11  LEU  42          HD11      LEU  42 -11.666   7.134   7.527
  192   HD12  LEU  42          HD12      LEU  42 -11.820   7.804   9.151
  193   HD13  LEU  42          HD13      LEU  42 -11.446   6.094   8.935
  194   HD21  LEU  42          HD21      LEU  42  -9.339   5.769   9.835
  195   HD22  LEU  42          HD22      LEU  42  -9.532   7.313  10.667
  196   HD23  LEU  42          HD23      LEU  42  -8.073   6.992   9.728
  197    H    SER  43           H        SER  43  -7.355   6.642   4.526
  198    HA   SER  43           HA       SER  43  -4.772   7.693   4.715
  199    HB2  SER  43           HB1      SER  43  -5.416   5.685   6.727
  200    HB3  SER  43           HB2      SER  43  -4.056   5.186   5.706
  201    HG   SER  43           HG       SER  43  -4.289   7.508   7.300
  202    H    ASP  44           H        ASP  44  -3.120   5.850   3.865
  203    HA   ASP  44           HA       ASP  44  -3.867   5.308   1.242
  204    HB2  ASP  44           HB1      ASP  44  -1.898   3.641   1.333
  205    HB3  ASP  44           HB2      ASP  44  -1.559   5.349   1.649
  206    HD2  ASP  44           HD       ASP  44  -0.766   2.761   4.443
  207    H    THR  45           H        THR  45  -4.439   3.512   4.143
  208    HA   THR  45           HA       THR  45  -4.805   0.938   3.160
  209    HB   THR  45           HB       THR  45  -6.578   0.793   5.059
  210    HG1  THR  45           HG1      THR  45  -6.571   2.511   6.472
  211   HG21  THR  45          HG21      THR  45  -3.692   1.504   5.595
  212   HG22  THR  45          HG22      THR  45  -4.346  -0.107   5.294
  213   HG23  THR  45          HG23      THR  45  -4.779   0.759   6.768
  214    H    ASP  46           H        ASP  46  -6.758   3.763   2.771
  215    HA   ASP  46           HA       ASP  46  -9.215   2.489   2.156
  216    HB2  ASP  46           HB1      ASP  46  -8.827   4.943   2.773
  217    HB3  ASP  46           HB2      ASP  46  -8.335   5.168   1.090
  218    HD2  ASP  46           HD       ASP  46 -12.163   4.284   1.708
  219    H    CYS  47           H        CYS  47  -6.318   3.073   0.361
  220    HA   CYS  47           HA       CYS  47  -7.624   2.457  -2.181
  221    HB2  CYS  47           HB1      CYS  47  -5.683   4.247  -1.615
  222    HB3  CYS  47           HB2      CYS  47  -4.690   2.859  -2.068
  223    H    ASN  48           H        ASN  48  -7.418   0.426  -0.134
  224    HA   ASN  48           HA       ASN  48  -7.025  -1.816  -0.035
  225    HB2  ASN  48           HB1      ASN  48  -6.771  -1.171  -2.826
  226    HB3  ASN  48           HB2      ASN  48  -5.570  -2.395  -2.394
  227   HD21  ASN  48          HD21      ASN  48  -6.243  -4.374  -2.723
  228   HD22  ASN  48          HD22      ASN  48  -7.859  -4.953  -2.530
  229    H    THR  49           H        THR  49  -4.226  -0.861  -2.004
  230    HA   THR  49           HA       THR  49  -2.378  -0.620   0.088
  231    HB   THR  49           HB       THR  49  -1.263  -2.968  -0.867
  232    HG1  THR  49           HG1      THR  49  -2.964  -4.029  -1.599
  233   HG21  THR  49          HG21      THR  49  -2.889  -3.109   1.613
  234   HG22  THR  49          HG22      THR  49  -1.650  -1.857   1.525
  235   HG23  THR  49          HG23      THR  49  -1.206  -3.553   1.336
  236    H    ARG  50           H        ARG  50  -0.065  -0.832  -0.738
  237    HA   ARG  50           HA       ARG  50   1.508  -0.044  -2.184
  238    HB2  ARG  50           HB1      ARG  50  -0.167  -1.435  -4.284
  239    HB3  ARG  50           HB2      ARG  50   1.563  -1.065  -4.367
  240    HG2  ARG  50           HG1      ARG  50   2.080  -2.996  -3.414
  241    HG3  ARG  50           HG2      ARG  50   1.047  -2.618  -2.025
  242    HD2  ARG  50           HD1      ARG  50  -0.018  -4.502  -2.756
  243    HD3  ARG  50           HD2      ARG  50  -0.870  -3.290  -3.720
  244    HE   ARG  50           HE       ARG  50   1.238  -4.017  -5.286
  245   HH11  ARG  50          HH11      ARG  50  -1.341  -5.732  -3.697
  246   HH12  ARG  50          HH12      ARG  50  -1.408  -6.994  -4.882
  247   HH21  ARG  50          HH21      ARG  50   1.161  -5.673  -6.853
  248   HH22  ARG  50          HH22      ARG  50   0.016  -6.960  -6.676
  249    H    LYS  51           H        LYS  51  -0.865   1.613  -1.694
  250    HA   LYS  51           HA       LYS  51  -0.433   3.513  -3.834
  251    HB2  LYS  51           HB1      LYS  51  -3.114   2.235  -3.308
  252    HB3  LYS  51           HB2      LYS  51  -2.964   3.821  -4.081
  253    HG2  LYS  51           HG1      LYS  51  -1.274   2.436  -5.634
  254    HG3  LYS  51           HG2      LYS  51  -2.369   1.131  -5.143
  255    HD2  LYS  51           HD1      LYS  51  -4.175   2.031  -6.225
  256    HD3  LYS  51           HD2      LYS  51  -3.579   3.692  -6.049
  257    HE2  LYS  51           HE1      LYS  51  -2.320   3.603  -7.946
  258    HE3  LYS  51           HE2      LYS  51  -1.961   1.881  -7.739
  259    HZ1  LYS  51           HZ1      LYS  51  -4.733   2.354  -8.259
  260    HZ2  LYS  51           HZ2      LYS  51  -3.651   1.319  -9.046
  261    HZ3  LYS  51           HZ3      LYS  51  -3.747   2.945  -9.501
  262    H    PHE  52           H        PHE  52  -0.691   5.603  -3.182
  263    HA   PHE  52           HA       PHE  52  -1.466   5.986  -0.371
  264    HB2  PHE  52           HB1      PHE  52  -0.166   8.156  -0.598
  265    HB3  PHE  52           HB2      PHE  52   0.786   6.671  -0.666
  266    HD1  PHE  52           HD1      PHE  52   2.302   6.359  -2.372
  267    HD2  PHE  52           HD2      PHE  52  -0.908   9.098  -2.927
  268    HE1  PHE  52           HE1      PHE  52   3.264   7.044  -4.531
  269    HE2  PHE  52           HE2      PHE  52   0.047   9.787  -5.086
  270    HZ   PHE  52           HZ       PHE  52   2.135   8.758  -5.892
  271    H    CYS  53           H        CYS  53  -2.825   7.689   0.217
  272    HA   CYS  53           HA       CYS  53  -4.794   8.385  -1.753
  273    HB2  CYS  53           HB1      CYS  53  -5.129   7.887   0.771
  274    HB3  CYS  53           HB2      CYS  53  -4.651   9.569   1.006
  275    H    LEU  54           H        LEU  54  -3.825   9.710  -3.268
  276    HA   LEU  54           HA       LEU  54  -2.364  12.062  -2.492
  277    HB2  LEU  54           HB1      LEU  54  -2.284  10.540  -4.686
  278    HB3  LEU  54           HB2      LEU  54  -3.435  11.767  -5.242
  279    HG   LEU  54           HG       LEU  54  -1.154  12.276  -5.951
  280   HD11  LEU  54          HD11      LEU  54  -2.342  14.145  -3.912
  281   HD12  LEU  54          HD12      LEU  54  -2.606  14.144  -5.655
  282   HD13  LEU  54          HD13      LEU  54  -1.026  14.582  -5.003
  283   HD21  LEU  54          HD21      LEU  54   0.010  13.165  -3.534
  284   HD22  LEU  54          HD22      LEU  54   0.567  11.883  -4.609
  285   HD23  LEU  54          HD23      LEU  54  -0.528  11.505  -3.279
  286    H    GLN  55           H        GLN  55  -3.326  13.822  -1.741
  287    HA   GLN  55           HA       GLN  55  -5.895  14.633  -2.930
  288    HB2  GLN  55           HB1      GLN  55  -5.091  15.056  -0.045
  289    HB3  GLN  55           HB2      GLN  55  -6.656  15.430  -0.785
  290    HG2  GLN  55           HG1      GLN  55  -7.096  13.071  -1.146
  291    HG3  GLN  55           HG2      GLN  55  -5.509  12.665  -0.477
  292   HE21  GLN  55          HE21      GLN  55  -8.288  14.671   0.462
  293   HE22  GLN  55          HE22      GLN  55  -8.370  14.093   2.088
  294    HA   PRO  56           HA       PRO  56  -2.924  18.045  -3.642
  295    HB2  PRO  56           HB1      PRO  56  -4.066  18.832  -6.004
  296    HB3  PRO  56           HB2      PRO  56  -2.893  17.522  -5.878
  297    HG2  PRO  56           HG1      PRO  56  -5.888  17.386  -5.984
  298    HG3  PRO  56           HG2      PRO  56  -4.670  16.398  -6.872
  299    HD2  PRO  56           HD1      PRO  56  -5.976  15.485  -4.675
  300    HD3  PRO  56           HD2      PRO  56  -4.305  15.033  -5.052
  301    H    ARG  57           H        ARG  57  -3.201  20.270  -3.436
  302    HA   ARG  57           HA       ARG  57  -5.699  21.082  -2.231
  303    HB2  ARG  57           HB1      ARG  57  -3.230  22.743  -2.785
  304    HB3  ARG  57           HB2      ARG  57  -4.553  23.142  -1.680
  305    HG2  ARG  57           HG1      ARG  57  -3.469  22.154  -0.024
  306    HG3  ARG  57           HG2      ARG  57  -3.566  20.617  -0.899
  307    HD2  ARG  57           HD1      ARG  57  -1.459  22.585  -1.691
  308    HD3  ARG  57           HD2      ARG  57  -1.243  21.646  -0.207
  309    HE   ARG  57           HE       ARG  57  -1.034  20.683  -2.894
  310   HH11  ARG  57          HH11      ARG  57  -1.790  19.789   0.385
  311   HH12  ARG  57          HH12      ARG  57  -1.384  18.120   0.162
  312   HH21  ARG  57          HH21      ARG  57  -0.496  18.488  -3.201
  313   HH22  ARG  57          HH22      ARG  57  -0.647  17.381  -1.878
  314    H    ASP  58           H        ASP  58  -3.828  21.867  -5.127
  315    HA   ASP  58           HA       ASP  58  -5.721  23.833  -6.035
  316    HB2  ASP  58           HB1      ASP  58  -3.121  23.517  -6.546
  317    HB3  ASP  58           HB2      ASP  58  -3.766  22.596  -7.913
  318    HD2  ASP  58           HD       ASP  58  -5.451  25.659  -8.954
  319    H    GLU  59           H        GLU  59  -5.327  20.422  -6.330
  320    HA   GLU  59           HA       GLU  59  -7.484  20.354  -8.339
  321    HB2  GLU  59           HB1      GLU  59  -4.910  19.130  -8.374
  322    HB3  GLU  59           HB2      GLU  59  -6.123  17.849  -8.228
  323    HG2  GLU  59           HG1      GLU  59  -6.366  17.956 -10.429
  324    HG3  GLU  59           HG2      GLU  59  -7.158  19.517 -10.174
  325    HE2  GLU  59           HE       GLU  59  -3.745  19.477 -12.020
  326    H    LYS  60           H        LYS  60  -8.441  17.927  -8.242
  327    HA   LYS  60           HA       LYS  60  -9.599  17.747  -5.583
  328    HB2  LYS  60           HB1      LYS  60 -10.284  16.707  -8.296
  329    HB3  LYS  60           HB2      LYS  60 -10.891  15.822  -6.886
  330    HG2  LYS  60           HG1      LYS  60 -12.404  17.399  -6.371
  331    HG3  LYS  60           HG2      LYS  60 -11.301  18.725  -6.781
  332    HD2  LYS  60           HD1      LYS  60 -12.438  17.022  -8.969
  333    HD3  LYS  60           HD2      LYS  60 -13.431  18.293  -8.235
  334    HE2  LYS  60           HE1      LYS  60 -11.504  19.890  -8.686
  335    HE3  LYS  60           HE2      LYS  60 -10.803  18.596  -9.671
  336    HZ1  LYS  60           HZ1      LYS  60 -12.482  20.453 -10.606
  337    HZ2  LYS  60           HZ2      LYS  60 -13.571  19.207 -10.257
  338    HZ3  LYS  60           HZ3      LYS  60 -12.276  18.928 -11.309
  339    HA   PRO  61           HA       PRO  61  -7.414  14.216  -4.165
  340    HB2  PRO  61           HB1      PRO  61  -9.372  12.770  -2.911
  341    HB3  PRO  61           HB2      PRO  61  -8.720  14.280  -2.276
  342    HG2  PRO  61           HG1      PRO  61 -11.214  13.806  -3.874
  343    HG3  PRO  61           HG2      PRO  61 -10.980  14.816  -2.398
  344    HD2  PRO  61           HD1      PRO  61 -11.110  15.876  -4.893
  345    HD3  PRO  61           HD2      PRO  61 -10.092  16.561  -3.615
  346    H    PHE  62           H        PHE  62  -6.775  12.230  -4.846
  347    HA   PHE  62           HA       PHE  62  -8.555  10.408  -6.172
  348    HB2  PHE  62           HB1      PHE  62  -7.125  10.359  -8.283
  349    HB3  PHE  62           HB2      PHE  62  -8.217  11.734  -8.099
  350    HD1  PHE  62           HD1      PHE  62  -7.402  13.820  -8.576
  351    HD2  PHE  62           HD2      PHE  62  -4.707  10.819  -7.218
  352    HE1  PHE  62           HE1      PHE  62  -5.523  15.383  -8.860
  353    HE2  PHE  62           HE2      PHE  62  -2.824  12.377  -7.500
  354    HZ   PHE  62           HZ       PHE  62  -3.231  14.663  -8.321
  355    H    CYS  63           H        CYS  63  -7.547   8.366  -6.663
  356    HA   CYS  63           HA       CYS  63  -5.382   7.780  -4.825
  357    HB2  CYS  63           HB1      CYS  63  -7.551   6.308  -6.089
  358    HB3  CYS  63           HB2      CYS  63  -6.022   5.435  -6.193
  359    H    ALA  64           H        ALA  64  -3.336   7.908  -5.440
  360    HA   ALA  64           HA       ALA  64  -2.675   7.402  -8.266
  361    HB1  ALA  64           HB1      ALA  64  -1.759   9.435  -8.138
  362    HB2  ALA  64           HB2      ALA  64  -1.816   9.447  -6.375
  363    HB3  ALA  64           HB3      ALA  64  -0.477   8.657  -7.209
  364    H    THR  65           H        THR  65  -0.731   6.254  -8.741
  365    HA   THR  65           HA       THR  65  -0.172   4.174  -6.784
  366    HB   THR  65           HB       THR  65  -0.627   3.550  -9.137
  367    HG1  THR  65           HG1      THR  65   0.600   2.084  -8.008
  368   HG21  THR  65          HG21      THR  65   2.058   4.339 -10.046
  369   HG22  THR  65          HG22      THR  65   0.924   5.671  -9.819
  370   HG23  THR  65          HG23      THR  65   0.520   4.346 -10.909
  371    H    CYS  66           H        CYS  66   2.189   3.392  -6.742
  372    HA   CYS  66           HA       CYS  66   3.788   5.570  -5.777
  373    HB2  CYS  66           HB1      CYS  66   5.366   3.897  -5.084
  374    HB3  CYS  66           HB2      CYS  66   3.744   3.313  -4.711
  375    H    ARG  67           H        ARG  67   6.187   5.609  -6.407
  376    HA   ARG  67           HA       ARG  67   6.339   5.646  -9.343
  377    HB2  ARG  67           HB1      ARG  67   8.025   7.169  -7.343
  378    HB3  ARG  67           HB2      ARG  67   8.062   7.347  -9.102
  379    HG2  ARG  67           HG1      ARG  67   5.688   7.973  -7.344
  380    HG3  ARG  67           HG2      ARG  67   6.829   9.160  -8.000
  381    HD2  ARG  67           HD1      ARG  67   6.206   8.557 -10.278
  382    HD3  ARG  67           HD2      ARG  67   5.120   7.307  -9.655
  383    HE   ARG  67           HE       ARG  67   4.406   9.793  -8.547
  384   HH11  ARG  67          HH11      ARG  67   4.346   8.066 -11.569
  385   HH12  ARG  67          HH12      ARG  67   2.956   8.907 -12.171
  386   HH21  ARG  67          HH21      ARG  67   2.576  10.907  -9.328
  387   HH22  ARG  67          HH22      ARG  67   1.950  10.523 -10.896
  388    H    GLY  68           H        GLY  68   8.641   5.374 -10.193
  389    HA2  GLY  68           HA2      GLY  68   9.577   2.806  -9.382
  390    HA3  GLY  68           HA3      GLY  68  10.313   3.844 -10.595
  391    HA1  GLY  68           HA1      GLY  68   9.446   3.367  -8.713
  392    H    LEU  69           H        LEU  69  12.332   3.018  -9.669
  393    HA   LEU  69           HA       LEU  69  13.047   3.886  -7.009
  394    HB2  LEU  69           HB1      LEU  69  14.538   2.494  -9.228
  395    HB3  LEU  69           HB2      LEU  69  15.330   3.020  -7.732
  396    HG   LEU  69           HG       LEU  69  13.092   1.007  -7.944
  397   HD11  LEU  69          HD11      LEU  69  16.051   0.809  -7.747
  398   HD12  LEU  69          HD12      LEU  69  14.905  -0.197  -8.632
  399   HD13  LEU  69          HD13      LEU  69  15.070  -0.377  -6.885
  400   HD21  LEU  69          HD21      LEU  69  14.521   2.218  -5.598
  401   HD22  LEU  69          HD22      LEU  69  13.752   0.633  -5.504
  402   HD23  LEU  69          HD23      LEU  69  12.787   2.062  -5.876
  403    H    ARG  70           H        ARG  70  14.289   4.572 -10.285
  404    HA   ARG  70           HA       ARG  70  16.038   6.616  -9.596
  405    HB2  ARG  70           HB1      ARG  70  14.547   5.898 -12.092
  406    HB3  ARG  70           HB2      ARG  70  15.429   7.431 -12.025
  407    HG2  ARG  70           HG1      ARG  70  17.334   6.399 -12.475
  408    HG3  ARG  70           HG2      ARG  70  17.131   5.371 -11.047
  409    HD2  ARG  70           HD1      ARG  70  16.052   3.680 -12.253
  410    HD3  ARG  70           HD2      ARG  70  15.661   4.772 -13.588
  411    HE   ARG  70           HE       ARG  70  18.414   4.658 -13.490
  412   HH11  ARG  70          HH11      ARG  70  15.792   2.413 -13.945
  413   HH12  ARG  70          HH12      ARG  70  16.712   1.341 -14.947
  414   HH21  ARG  70          HH21      ARG  70  19.636   3.253 -14.807
  415   HH22  ARG  70          HH22      ARG  70  18.898   1.819 -15.436
  416    H    ARG  71           H        ARG  71  12.581   6.629  -9.849
  417    HA   ARG  71           HA       ARG  71  12.102   9.358 -10.233
  418    HB2  ARG  71           HB1      ARG  71  10.584   7.043  -9.187
  419    HB3  ARG  71           HB2      ARG  71  10.008   8.635  -8.675
  420    HG2  ARG  71           HG1      ARG  71  10.569   8.212 -11.570
  421    HG3  ARG  71           HG2      ARG  71   9.113   7.484 -10.868
  422    HD2  ARG  71           HD1      ARG  71   8.741   9.869  -9.853
  423    HD3  ARG  71           HD2      ARG  71   9.843  10.369 -11.143
  424    HE   ARG  71           HE       ARG  71   7.845   8.754 -12.261
  425   HH11  ARG  71          HH11      ARG  71   8.222  11.878 -10.771
  426   HH12  ARG  71          HH12      ARG  71   6.901  12.594 -11.635
  427   HH21  ARG  71          HH21      ARG  71   6.104   9.686 -13.403
  428   HH22  ARG  71          HH22      ARG  71   5.696  11.345 -13.130
  429    H    ARG  72           H        ARG  72  11.744  11.065  -8.817
  430    HA   ARG  72           HA       ARG  72  13.281  10.961  -6.383
  431    HB2  ARG  72           HB1      ARG  72  11.594  13.243  -7.425
  432    HB3  ARG  72           HB2      ARG  72  12.916  13.334  -6.252
  433    HG2  ARG  72           HG1      ARG  72  14.118  12.179  -8.448
  434    HG3  ARG  72           HG2      ARG  72  13.000  13.357  -9.154
  435    HD2  ARG  72           HD1      ARG  72  14.626  14.255  -6.830
  436    HD3  ARG  72           HD2      ARG  72  15.467  14.002  -8.367
  437    HE   ARG  72           HE       ARG  72  13.330  15.510  -9.071
  438   HH11  ARG  72          HH11      ARG  72  15.818  15.841  -6.659
  439   HH12  ARG  72          HH12      ARG  72  15.802  17.574  -6.692
  440   HH21  ARG  72          HH21      ARG  72  13.299  17.791  -9.124
  441   HH22  ARG  72          HH22      ARG  72  14.368  18.681  -8.093
  442    H    CYS  73           H        CYS  73  12.490  11.532  -4.292
  443    HA   CYS  73           HA       CYS  73   9.598  11.355  -3.896
  444    HB2  CYS  73           HB1      CYS  73   9.939   9.726  -2.030
  445    HB3  CYS  73           HB2      CYS  73  10.280   9.067  -3.631
  446    H    GLN  74           H        GLN  74   8.925  12.013  -1.730
  447    HA   GLN  74           HA       GLN  74  10.860  13.869  -0.509
  448    HB2  GLN  74           HB1      GLN  74   8.199  14.291  -1.506
  449    HB3  GLN  74           HB2      GLN  74   8.234  14.607   0.236
  450    HG2  GLN  74           HG1      GLN  74  10.179  15.825  -1.719
  451    HG3  GLN  74           HG2      GLN  74   8.667  16.593  -1.217
  452   HE21  GLN  74          HE21      GLN  74   8.868  18.012   0.346
  453   HE22  GLN  74          HE22      GLN  74  10.068  18.003   1.589
  454    H    ARG  75           H        ARG  75   8.586  11.308   0.008
  455    HA   ARG  75           HA       ARG  75   9.385  11.220   2.831
  456    HB2  ARG  75           HB1      ARG  75   6.569  10.621   1.914
  457    HB3  ARG  75           HB2      ARG  75   7.164  10.775   3.575
  458    HG2  ARG  75           HG1      ARG  75   7.541  13.157   3.261
  459    HG3  ARG  75           HG2      ARG  75   7.013  13.021   1.575
  460    HD2  ARG  75           HD1      ARG  75   4.792  12.703   2.139
  461    HD3  ARG  75           HD2      ARG  75   5.195  12.086   3.747
  462    HE   ARG  75           HE       ARG  75   5.122  14.224   4.544
  463   HH11  ARG  75          HH11      ARG  75   5.443  14.324   1.079
  464   HH12  ARG  75          HH12      ARG  75   5.241  16.042   0.979
  465   HH21  ARG  75          HH21      ARG  75   4.856  16.487   4.426
  466   HH22  ARG  75          HH22      ARG  75   4.908  17.271   2.884
  467    H    ASP  76           H        ASP  76   8.703   9.039   3.813
  468    HA   ASP  76           HA       ASP  76   9.875   6.981   2.219
  469    HB2  ASP  76           HB1      ASP  76   9.221   5.515   4.199
  470    HB3  ASP  76           HB2      ASP  76  10.314   6.862   4.542
  471    HD2  ASP  76           HD       ASP  76   7.943   8.497   6.480
  472    H    ALA  77           H        ALA  77   6.616   7.422   3.592
  473    HA   ALA  77           HA       ALA  77   5.468   5.160   2.378
  474    HB1  ALA  77           HB1      ALA  77   4.592   6.715   4.282
  475    HB2  ALA  77           HB2      ALA  77   3.836   7.592   2.950
  476    HB3  ALA  77           HB3      ALA  77   3.453   5.891   3.217
  477    H    MET  78           H        MET  78   6.200   8.318   1.161
  478    HA   MET  78           HA       MET  78   4.403   8.594  -0.924
  479    HB2  MET  78           HB1      MET  78   7.133   9.567  -0.335
  480    HB3  MET  78           HB2      MET  78   6.656   9.612  -2.040
  481    HG2  MET  78           HG1      MET  78   4.454  10.674  -0.787
  482    HG3  MET  78           HG2      MET  78   5.795  11.279   0.188
  483    HE1  MET  78           HE1      MET  78   6.093  11.425  -4.283
  484    HE2  MET  78           HE2      MET  78   5.211  10.252  -3.306
  485    HE3  MET  78           HE3      MET  78   4.407  11.722  -3.858
  486    H    CYS  79           H        CYS  79   7.134   6.459  -0.624
  487    HA   CYS  79           HA       CYS  79   6.799   5.598  -3.415
  488    HB2  CYS  79           HB1      CYS  79   9.091   6.277  -2.226
  489    HB3  CYS  79           HB2      CYS  79   9.042   4.583  -1.737
  490    H    CYS  80           H        CYS  80   6.817   3.305  -3.872
  491    HA   CYS  80           HA       CYS  80   4.949   1.843  -2.459
  492    HB2  CYS  80           HB1      CYS  80   6.891   1.310  -4.593
  493    HB3  CYS  80           HB2      CYS  80   6.504  -0.114  -3.626
  494    HA   PRO  81           HA       PRO  81   6.907   0.054   1.035
  495    HB2  PRO  81           HB1      PRO  81   5.856  -2.474   1.075
  496    HB3  PRO  81           HB2      PRO  81   4.928  -1.029   1.472
  497    HG2  PRO  81           HG1      PRO  81   5.078  -2.542  -1.113
  498    HG3  PRO  81           HG2      PRO  81   3.631  -1.899  -0.251
  499    HD2  PRO  81           HD1      PRO  81   4.739  -0.647  -2.391
  500    HD3  PRO  81           HD2      PRO  81   3.978   0.233  -1.053
  501    H    GLY  82           H        GLY  82   8.638  -1.210   1.690
  502    HA2  GLY  82           HA2      GLY  82  10.186  -3.007   1.437
  503    HA3  GLY  82           HA3      GLY  82   9.787  -3.067  -0.274
  504    HA1  GLY  82           HA1      GLY  82  10.172  -2.140   1.599
  505    H    THR  83           H        THR  83   9.992  -0.004  -0.216
  506    HA   THR  83           HA       THR  83  12.933   0.099  -0.392
  507    HB   THR  83           HB       THR  83  12.608   1.912  -2.083
  508    HG1  THR  83           HG1      THR  83  10.245   2.086  -1.296
  509   HG21  THR  83          HG21      THR  83  12.904   0.291  -3.582
  510   HG22  THR  83          HG22      THR  83  11.194  -0.131  -3.502
  511   HG23  THR  83          HG23      THR  83  12.341  -0.884  -2.394
  512    H    LEU  84           H        LEU  84  13.710   2.486  -0.329
  513    HA   LEU  84           HA       LEU  84  12.203   4.009   1.677
  514    HB2  LEU  84           HB1      LEU  84  14.818   2.741   1.975
  515    HB3  LEU  84           HB2      LEU  84  14.833   4.475   2.344
  516    HG   LEU  84           HG       LEU  84  12.683   3.708   3.782
  517   HD11  LEU  84          HD11      LEU  84  14.576   1.410   4.143
  518   HD12  LEU  84          HD12      LEU  84  13.207   1.317   3.035
  519   HD13  LEU  84          HD13      LEU  84  12.932   1.601   4.754
  520   HD21  LEU  84          HD21      LEU  84  15.589   3.937   4.411
  521   HD22  LEU  84          HD22      LEU  84  14.472   3.412   5.672
  522   HD23  LEU  84          HD23      LEU  84  14.246   4.976   4.889
  523    H    CYS  85           H        CYS  85  12.954   6.270   1.869
  524    HA   CYS  85           HA       CYS  85  13.586   7.319  -0.778
  525    HB2  CYS  85           HB1      CYS  85  11.638   8.119   0.710
  526    HB3  CYS  85           HB2      CYS  85  12.876   8.961   1.644
  527    H    VAL  86           H        VAL  86  15.722   7.367  -1.156
  528    HA   VAL  86           HA       VAL  86  17.448   8.594   0.897
  529    HB   VAL  86           HB       VAL  86  18.266   6.594  -1.214
  530   HG11  VAL  86          HG11      VAL  86  19.782   8.479   0.230
  531   HG12  VAL  86          HG12      VAL  86  20.128   6.897   0.932
  532   HG13  VAL  86          HG13      VAL  86  20.368   7.168  -0.794
  533   HG21  VAL  86          HG21      VAL  86  18.767   5.307   1.047
  534   HG22  VAL  86          HG22      VAL  86  17.441   6.316   1.626
  535   HG23  VAL  86          HG23      VAL  86  17.189   5.226   0.262
  536    H    ASN  87           H        ASN  87  18.521  10.390   0.355
  537    HA   ASN  87           HA       ASN  87  19.181  12.212  -0.837
  538    HB2  ASN  87           HB1      ASN  87  20.607  10.259  -1.795
  539    HB3  ASN  87           HB2      ASN  87  19.575  10.423  -3.220
  540   HD21  ASN  87          HD21      ASN  87  21.383  12.524  -1.001
  541   HD22  ASN  87          HD22      ASN  87  22.044  13.539  -2.233
  542    H    ASP  88           H        ASP  88  16.396  11.676  -0.825
  543    HA   ASP  88           HA       ASP  88  14.475  12.433  -1.783
  544    HB2  ASP  88           HB1      ASP  88  16.060  13.878  -3.887
  545    HB3  ASP  88           HB2      ASP  88  14.564  14.368  -3.083
  546    HD2  ASP  88           HD       ASP  88  17.915  15.598  -1.585
  547    H    VAL  89           H        VAL  89  15.858  10.000  -2.755
  548    HA   VAL  89           HA       VAL  89  14.327   9.702  -5.233
  549    HB   VAL  89           HB       VAL  89  17.207   8.834  -4.943
  550   HG11  VAL  89          HG11      VAL  89  16.219   7.165  -6.228
  551   HG12  VAL  89          HG12      VAL  89  15.120   8.294  -7.023
  552   HG13  VAL  89          HG13      VAL  89  16.835   8.293  -7.435
  553   HG21  VAL  89          HG21      VAL  89  15.960  10.890  -6.765
  554   HG22  VAL  89          HG22      VAL  89  16.954  11.238  -5.350
  555   HG23  VAL  89          HG23      VAL  89  17.658  10.415  -6.742
  556    H    CYS  90           H        CYS  90  13.439   7.698  -5.534
  557    HA   CYS  90           HA       CYS  90  13.096   6.051  -3.267
  558    HB2  CYS  90           HB1      CYS  90  12.387   5.770  -6.179
  559    HB3  CYS  90           HB2      CYS  90  12.085   4.453  -5.043
  560    H    THR  91           H        THR  91  14.747   4.939  -2.431
  561    HA   THR  91           HA       THR  91  16.403   3.331  -4.265
  562    HB   THR  91           HB       THR  91  17.225   4.362  -1.545
  563    HG1  THR  91           HG1      THR  91  17.551   5.387  -4.152
  564   HG21  THR  91          HG21      THR  91  19.433   3.598  -2.133
  565   HG22  THR  91          HG22      THR  91  18.885   3.122  -3.739
  566   HG23  THR  91          HG23      THR  91  18.306   2.255  -2.317
  567    H    THR  92           H        THR  92  16.437   1.187  -3.979
  568    HA   THR  92           HA       THR  92  14.611  -0.097  -2.277
  569    HB   THR  92           HB       THR  92  16.725  -1.905  -2.958
  570    HG1  THR  92           HG1      THR  92  17.436  -0.976  -4.722
  571   HG21  THR  92          HG21      THR  92  15.013  -3.136  -3.850
  572   HG22  THR  92          HG22      THR  92  14.217  -1.725  -4.549
  573   HG23  THR  92          HG23      THR  92  14.081  -2.050  -2.821
  574    H    MET  93           H        MET  93  14.969  -1.471  -0.472
  575    HA   MET  93           HA       MET  93  16.652  -0.395   1.505
  576    HB2  MET  93           HB1      MET  93  14.518  -2.115   1.477
  577    HB3  MET  93           HB2      MET  93  15.854  -3.191   1.910
  578    HG2  MET  93           HG1      MET  93  16.313  -1.042   3.543
  579    HG3  MET  93           HG2      MET  93  14.550  -1.097   3.469
  580    HE1  MET  93           HE1      MET  93  15.525  -1.406   6.270
  581    HE2  MET  93           HE2      MET  93  13.866  -1.763   5.790
  582    HE3  MET  93           HE3      MET  93  14.753  -2.898   6.809
  583    H    GLU  94           H        GLU  94  17.006  -3.188  -0.626
  584    HA   GLU  94           HA       GLU  94  19.228  -4.390   0.509
  585    HB2  GLU  94           HB1      GLU  94  18.525  -4.112  -2.422
  586    HB3  GLU  94           HB2      GLU  94  19.719  -5.245  -1.768
  587    HG2  GLU  94           HG1      GLU  94  18.067  -6.502  -0.634
  588    HG3  GLU  94           HG2      GLU  94  16.841  -5.258  -0.916
  589    HE2  GLU  94           HE       GLU  94  16.891  -6.263  -4.425
  590    H    ASP  95           H        ASP  95  19.010  -1.517  -1.473
  591    HA   ASP  95           HA       ASP  95  21.891  -1.308  -1.750
  592    HB2  ASP  95           HB1      ASP  95  19.526   0.205  -2.787
  593    HB3  ASP  95           HB2      ASP  95  21.094   1.018  -2.736
  594    HD2  ASP  95           HD       ASP  95  21.988  -0.509  -5.650
  595    H    ALA  96           H        ALA  96  19.272   0.506  -0.174
  596    HA   ALA  96           HA       ALA  96  21.120   2.260   1.172
  597    HB1  ALA  96           HB1      ALA  96  19.137   3.218   2.218
  598    HB2  ALA  96           HB2      ALA  96  18.918   3.063   0.474
  599    HB3  ALA  96           HB3      ALA  96  18.150   1.910   1.565
  600    H    THR  97           H        THR  97  22.419   0.851   2.389
  601    HA   THR  97           HA       THR  97  21.227   0.063   4.923
  602    HB   THR  97           HB       THR  97  22.789  -1.935   3.276
  603    HG1  THR  97           HG1      THR  97  20.880  -2.862   2.815
  604   HG21  THR  97          HG21      THR  97  21.316  -3.032   5.479
  605   HG22  THR  97          HG22      THR  97  22.373  -1.742   6.055
  606   HG23  THR  97          HG23      THR  97  23.048  -3.100   5.156
  607    H    GLU  98           H        GLU  98  24.281  -0.611   3.204
  608    HA   GLU  98           HA       GLU  98  25.731   1.167   4.972
  609    HB2  GLU  98           HB1      GLU  98  27.338  -0.637   5.643
  610    HB3  GLU  98           HB2      GLU  98  25.726  -0.781   6.360
  611    HG2  GLU  98           HG1      GLU  98  25.223  -2.687   5.235
  612    HG3  GLU  98           HG2      GLU  98  26.203  -2.238   3.832
  613    HE2  GLU  98           HE       GLU  98  27.907  -4.283   6.752
  614    H    ASN  99           H        ASN  99  28.108   1.175   4.410
  615    HA   ASN  99           HA       ASN  99  28.346   1.184   1.514
  616    HB2  ASN  99           HB1      ASN  99  29.595   2.587   3.747
  617    HB3  ASN  99           HB2      ASN  99  30.782   2.017   2.568
  618   HD21  ASN  99          HD21      ASN  99  27.764   3.821   2.852
  619   HD22  ASN  99          HD22      ASN  99  28.051   4.859   1.502
  620    H    LEU 100           H        LEU 100  30.106   0.203   0.392
  621    HA   LEU 100           HA       LEU 100  31.037  -2.259   1.697
  622    HB2  LEU 100           HB1      LEU 100  31.557  -2.942  -0.706
  623    HB3  LEU 100           HB2      LEU 100  29.854  -2.833  -0.228
  624    HG   LEU 100           HG       LEU 100  31.043  -0.434  -1.501
  625   HD11  LEU 100          HD11      LEU 100  30.230  -1.751  -3.703
  626   HD12  LEU 100          HD12      LEU 100  30.928  -3.083  -2.783
  627   HD13  LEU 100          HD13      LEU 100  31.910  -1.671  -3.171
  628   HD21  LEU 100          HD21      LEU 100  28.896   0.038  -2.015
  629   HD22  LEU 100          HD22      LEU 100  28.562  -1.084  -0.696
  630   HD23  LEU 100          HD23      LEU 100  28.495  -1.642  -2.368
  631    H    TYR 101           H        TYR 101  33.180  -2.800   1.776
  632    HA   TYR 101           HA       TYR 101  35.149  -1.102   0.472
  633    HB2  TYR 101           HB1      TYR 101  36.388  -0.724   2.595
  634    HB3  TYR 101           HB2      TYR 101  34.822   0.090   2.547
  635    HD1  TYR 101           HD1      TYR 101  33.109  -0.406   4.115
  636    HD2  TYR 101           HD2      TYR 101  36.618  -2.809   3.974
  637    HE1  TYR 101           HE1      TYR 101  32.455  -1.475   6.232
  638    HE2  TYR 101           HE2      TYR 101  35.973  -3.885   6.089
  639    HH   TYR 101           HH       TYR 101  33.921  -2.720   8.194
  640    H    PHE 102           H        PHE 102  37.448  -1.932   1.410
  641    HA   PHE 102           HA       PHE 102  37.353  -4.871   1.239
  642    HB2  PHE 102           HB1      PHE 102  39.442  -4.833   0.018
  643    HB3  PHE 102           HB2      PHE 102  38.274  -3.791  -0.797
  644    HD1  PHE 102           HD1      PHE 102  41.424  -3.908   1.001
  645    HD2  PHE 102           HD2      PHE 102  38.479  -1.350  -0.704
  646    HE1  PHE 102           HE1      PHE 102  43.011  -2.029   1.086
  647    HE2  PHE 102           HE2      PHE 102  40.062   0.533  -0.622
  648    HZ   PHE 102           HZ       PHE 102  42.332   0.193   0.273
  649    H    GLN 103           H        GLN 103  38.573  -6.049   2.643
  650    HA   GLN 103           HA       GLN 103  39.659  -4.609   4.922
  651    HB2  GLN 103           HB1      GLN 103  38.141  -6.782   4.879
  652    HB3  GLN 103           HB2      GLN 103  39.712  -7.586   4.743
  653    HG2  GLN 103           HG1      GLN 103  40.378  -6.988   6.847
  654    HG3  GLN 103           HG2      GLN 103  39.356  -5.544   6.869
  655   HE21  GLN 103          HE21      GLN 103  39.638  -8.792   7.770
  656   HE22  GLN 103          HE22      GLN 103  38.049  -9.006   8.414
  657    H    SER 104           H        SER 104  41.751  -4.241   5.232
  658    HA   SER 104           HA       SER 104  43.689  -5.053   3.308
  659    HB2  SER 104           HB1      SER 104  45.084  -3.539   4.303
  660    HB3  SER 104           HB2      SER 104  43.555  -2.961   4.987
  661    HG   SER 104           HG       SER 104  45.682  -4.091   6.243
  662    H    LEU 105           H        LEU 105  45.925  -5.826   4.370
  663    HA   LEU 105           HA       LEU 105  45.314  -8.445   5.506
  664    HB2  LEU 105           HB1      LEU 105  47.956  -7.394   4.484
  665    HB3  LEU 105           HB2      LEU 105  47.539  -9.077   4.849
  666    HG   LEU 105           HG       LEU 105  45.700  -8.596   2.968
  667   HD11  LEU 105          HD11      LEU 105  46.149  -6.416   2.345
  668   HD12  LEU 105          HD12      LEU 105  47.057  -7.343   1.150
  669   HD13  LEU 105          HD13      LEU 105  47.894  -6.614   2.522
  670   HD21  LEU 105          HD21      LEU 105  47.045  -9.839   1.494
  671   HD22  LEU 105          HD22      LEU 105  47.540 -10.345   3.109
  672   HD23  LEU 105          HD23      LEU 105  48.537  -9.213   2.195
  673    H    GLU 106           H        GLU 106  46.505  -9.296   7.295
  674    HA   GLU 106           HA       GLU 106  47.847  -7.312   8.987
  675    HB2  GLU 106           HB1      GLU 106  46.622  -7.989  10.951
  676    HB3  GLU 106           HB2      GLU 106  45.476  -7.484   9.700
  677    HG2  GLU 106           HG1      GLU 106  45.157  -9.892   9.112
  678    HG3  GLU 106           HG2      GLU 106  46.142 -10.296  10.527
  679    HE2  GLU 106           HE       GLU 106  42.949  -8.372  11.750
  680    H    HIS 107           H        HIS 107  49.569  -8.076  10.099
  681    HA   HIS 107           HA       HIS 107  50.267 -10.892   9.663
  682    HB2  HIS 107           HB1      HIS 107  51.755  -8.394   9.691
  683    HB3  HIS 107           HB2      HIS 107  52.482  -9.592  10.767
  684    HD1  HIS 107           HD1      HIS 107  51.886  -8.873   7.166
  685    HD2  HIS 107           HD2      HIS 107  53.528 -11.888   9.505
  686    HE1  HIS 107           HE1      HIS 107  53.136 -10.358   5.568
  687    HE2  HIS 107           HE2      HIS 107  54.139 -12.202   6.996
  688    H    HIS 108           H        HIS 108  51.741 -11.779  11.494
  689    HA   HIS 108           HA       HIS 108  50.882 -10.923  14.144
  690    HB2  HIS 108           HB1      HIS 108  50.033 -13.424  12.802
  691    HB3  HIS 108           HB2      HIS 108  50.569 -13.591  14.478
  692    HD1  HIS 108           HD1      HIS 108  47.656 -12.722  12.512
  693    HD2  HIS 108           HD2      HIS 108  49.078 -11.826  16.312
  694    HE1  HIS 108           HE1      HIS 108  45.669 -11.857  13.787
  695    HE2  HIS 108           HE2      HIS 108  46.536 -11.309  16.110
  696    H    HIS 109           H        HIS 109  51.937 -12.564  15.812
  697    HA   HIS 109           HA       HIS 109  54.775 -12.522  15.198
  698    HB2  HIS 109           HB1      HIS 109  55.106 -13.004  17.565
  699    HB3  HIS 109           HB2      HIS 109  53.989 -11.652  17.361
  700    HD1  HIS 109           HD1      HIS 109  51.754 -11.834  18.459
  701    HD2  HIS 109           HD2      HIS 109  53.724 -15.486  18.271
  702    HE1  HIS 109           HE1      HIS 109  50.349 -13.426  19.808
  703    HE2  HIS 109           HE2      HIS 109  51.553 -15.659  19.693
  704    H    HIS 110           H        HIS 110  56.162 -14.357  15.619
  705    HA   HIS 110           HA       HIS 110  54.799 -16.951  15.326
  706    HB2  HIS 110           HB1      HIS 110  57.365 -16.133  13.942
  707    HB3  HIS 110           HB2      HIS 110  56.523 -17.677  13.767
  708    HD1  HIS 110           HD1      HIS 110  54.427 -17.747  12.275
  709    HD2  HIS 110           HD2      HIS 110  56.204 -14.000  12.509
  710    HE1  HIS 110           HE1      HIS 110  53.361 -16.382  10.452
  711    HE2  HIS 110           HE2      HIS 110  54.448 -14.092  10.592
  712    H    HIS 111           H        HIS 111  55.749 -18.713  16.337
  713    HA   HIS 111           HA       HIS 111  57.545 -18.031  18.519
  714    HB2  HIS 111           HB1      HIS 111  57.062 -20.300  19.346
  715    HB3  HIS 111           HB2      HIS 111  55.584 -19.386  19.033
  716    HD1  HIS 111           HD1      HIS 111  57.625 -22.203  17.582
  717    HD2  HIS 111           HD2      HIS 111  53.869 -20.475  17.173
  718    HE1  HIS 111           HE1      HIS 111  56.325 -23.763  16.098
  719    HE2  HIS 111           HE2      HIS 111  54.029 -22.707  15.847
  720    H    HIS 112           H        HIS 112  59.622 -18.676  18.718
  721    HA   HIS 112           HA       HIS 112  61.679 -19.453  18.142
  722    HB2  HIS 112           HB1      HIS 112  59.878 -21.610  17.789
  723    HB3  HIS 112           HB2      HIS 112  60.991 -21.647  16.419
  724    HD1  HIS 112           HD1      HIS 112  61.824 -20.734  20.008
  725    HD2  HIS 112           HD2      HIS 112  62.724 -23.613  17.150
  726    HE1  HIS 112           HE1      HIS 112  63.637 -22.148  21.025
  727    HE2  HIS 112           HE2      HIS 112  64.187 -23.908  19.279
  Start of MODEL   45
    1    H1   MET  18           H        MET  18   8.960  -7.007  49.092
    2    HA   MET  18           HA       MET  18   9.096  -4.874  50.284
    3    HB2  MET  18           HB1      MET  18  10.507  -4.020  47.744
    4    HB3  MET  18           HB2      MET  18  10.079  -2.951  49.086
    5    HG2  MET  18           HG1      MET  18  11.700  -5.329  49.776
    6    HG3  MET  18           HG2      MET  18  12.488  -4.081  48.808
    7    HE1  MET  18           HE1      MET  18  13.611  -1.989  49.875
    8    HE2  MET  18           HE2      MET  18  13.981  -2.192  51.587
    9    HE3  MET  18           HE3      MET  18  14.264  -3.519  50.460
   10    H    LEU  19           H        LEU  19   8.372  -5.580  46.926
   11    HA   LEU  19           HA       LEU  19   5.721  -4.430  47.281
   12    HB2  LEU  19           HB1      LEU  19   7.799  -3.126  45.810
   13    HB3  LEU  19           HB2      LEU  19   6.545  -3.671  44.682
   14    HG   LEU  19           HG       LEU  19   5.329  -2.375  46.940
   15   HD11  LEU  19          HD11      LEU  19   6.213  -0.072  46.312
   16   HD12  LEU  19          HD12      LEU  19   7.578  -0.919  45.586
   17   HD13  LEU  19          HD13      LEU  19   7.253  -1.088  47.311
   18   HD21  LEU  19          HD21      LEU  19   4.072  -1.352  45.317
   19   HD22  LEU  19          HD22      LEU  19   4.632  -2.778  44.442
   20   HD23  LEU  19          HD23      LEU  19   5.426  -1.222  44.194
   21    H    VAL  20           H        VAL  20   4.253  -5.013  45.479
   22    HA   VAL  20           HA       VAL  20   5.005  -7.633  44.362
   23    HB   VAL  20           HB       VAL  20   2.554  -8.070  44.221
   24   HG11  VAL  20          HG11      VAL  20   2.408  -7.862  46.946
   25   HG12  VAL  20          HG12      VAL  20   3.183  -9.178  46.062
   26   HG13  VAL  20          HG13      VAL  20   4.147  -7.826  46.658
   27   HG21  VAL  20          HG21      VAL  20   1.023  -6.650  45.486
   28   HG22  VAL  20          HG22      VAL  20   2.341  -5.534  45.844
   29   HG23  VAL  20          HG23      VAL  20   1.792  -5.746  44.182
   30    H    LEU  21           H        LEU  21   4.896  -7.977  42.214
   31    HA   LEU  21           HA       LEU  21   4.774  -5.787  40.440
   32    HB2  LEU  21           HB1      LEU  21   4.757  -7.567  38.656
   33    HB3  LEU  21           HB2      LEU  21   6.101  -7.629  39.811
   34    HG   LEU  21           HG       LEU  21   3.909  -9.309  40.671
   35   HD11  LEU  21          HD11      LEU  21   3.263  -9.776  38.506
   36   HD12  LEU  21          HD12      LEU  21   4.480 -11.018  38.798
   37   HD13  LEU  21          HD13      LEU  21   4.895  -9.580  37.864
   38   HD21  LEU  21          HD21      LEU  21   6.790  -9.821  39.943
   39   HD22  LEU  21          HD22      LEU  21   5.722 -10.984  40.729
   40   HD23  LEU  21          HD23      LEU  21   6.150  -9.484  41.551
   41    H    ASP  22           H        ASP  22   3.118  -4.852  39.430
   42    HA   ASP  22           HA       ASP  22   0.714  -6.290  38.773
   43    HB2  ASP  22           HB1      ASP  22  -0.666  -4.429  40.014
   44    HB3  ASP  22           HB2      ASP  22  -0.107  -5.861  40.890
   45    HD2  ASP  22           HD       ASP  22   1.246  -3.663  43.148
   46    H    PHE  23           H        PHE  23   1.151  -5.670  36.666
   47    HA   PHE  23           HA       PHE  23   1.142  -2.788  36.096
   48    HB2  PHE  23           HB1      PHE  23   2.611  -4.993  35.029
   49    HB3  PHE  23           HB2      PHE  23   1.610  -4.323  33.740
   50    HD1  PHE  23           HD1      PHE  23   4.522  -3.822  35.800
   51    HD2  PHE  23           HD2      PHE  23   1.805  -1.913  33.136
   52    HE1  PHE  23           HE1      PHE  23   6.135  -1.994  35.472
   53    HE2  PHE  23           HE2      PHE  23   3.415  -0.082  32.803
   54    HZ   PHE  23           HZ       PHE  23   5.582  -0.121  33.970
   55    H    ASN  24           H        ASN  24  -0.080  -2.066  34.188
   56    HA   ASN  24           HA       ASN  24  -2.256  -3.734  33.276
   57    HB2  ASN  24           HB1      ASN  24  -4.042  -2.240  34.022
   58    HB3  ASN  24           HB2      ASN  24  -3.139  -2.869  35.406
   59   HD21  ASN  24          HD21      ASN  24  -2.487  -1.467  36.867
   60   HD22  ASN  24          HD22      ASN  24  -2.338   0.240  36.641
   61    H    ASN  25           H        ASN  25  -3.143  -3.034  31.357
   62    HA   ASN  25           HA       ASN  25  -2.872  -0.420  30.321
   63    HB2  ASN  25           HB1      ASN  25  -1.172  -0.671  28.680
   64    HB3  ASN  25           HB2      ASN  25  -0.479  -1.254  30.199
   65   HD21  ASN  25          HD21      ASN  25  -0.689  -3.633  30.577
   66   HD22  ASN  25          HD22      ASN  25  -0.435  -4.671  29.219
   67    H    ILE  26           H        ILE  26  -3.745  -0.211  28.170
   68    HA   ILE  26           HA       ILE  26  -5.959  -1.850  27.691
   69    HB   ILE  26           HB       ILE  26  -5.789   0.464  26.868
   70   HG12  ILE  26          HG11      ILE  26  -6.729   0.057  24.590
   71   HG13  ILE  26          HG12      ILE  26  -6.245  -1.641  24.743
   72   HG21  ILE  26          HG21      ILE  26  -3.327  -0.101  26.043
   73   HG22  ILE  26          HG22      ILE  26  -4.180  -0.371  24.525
   74   HG23  ILE  26          HG23      ILE  26  -4.285   1.194  25.329
   75   HD11  ILE  26          HD11      ILE  26  -8.094  -2.129  25.851
   76   HD12  ILE  26          HD12      ILE  26  -7.779  -0.859  27.034
   77   HD13  ILE  26          HD13      ILE  26  -8.655  -0.484  25.551
   78    H    ARG  27           H        ARG  27  -6.313  -3.611  26.450
   79    HA   ARG  27           HA       ARG  27  -4.444  -4.475  24.444
   80    HB2  ARG  27           HB1      ARG  27  -4.024  -6.694  25.512
   81    HB3  ARG  27           HB2      ARG  27  -3.254  -5.334  26.343
   82    HG2  ARG  27           HG1      ARG  27  -5.183  -5.318  27.946
   83    HG3  ARG  27           HG2      ARG  27  -5.725  -6.825  27.187
   84    HD2  ARG  27           HD1      ARG  27  -3.029  -7.271  27.715
   85    HD3  ARG  27           HD2      ARG  27  -3.617  -6.383  29.127
   86    HE   ARG  27           HE       ARG  27  -5.366  -8.519  28.393
   87   HH11  ARG  27          HH11      ARG  27  -2.415  -7.745  30.070
   88   HH12  ARG  27          HH12      ARG  27  -2.499  -9.118  31.123
   89   HH21  ARG  27          HH21      ARG  27  -5.489 -10.331  29.774
   90   HH22  ARG  27          HH22      ARG  27  -4.247 -10.589  30.953
   91    H    SER  28           H        SER  28  -5.348  -5.898  23.005
   92    HA   SER  28           HA       SER  28  -6.981  -7.017  21.884
   93    HB2  SER  28           HB1      SER  28  -7.022  -8.026  24.541
   94    HB3  SER  28           HB2      SER  28  -8.706  -7.847  24.020
   95    HG   SER  28           HG       SER  28  -8.352  -9.211  22.341
   96    H    SER  29           H        SER  29  -7.949  -5.297  20.869
   97    HA   SER  29           HA       SER  29 -10.565  -4.543  21.907
   98    HB2  SER  29           HB1      SER  29  -8.349  -2.819  22.153
   99    HB3  SER  29           HB2      SER  29  -9.305  -2.191  20.798
  100    HG   SER  29           HG       SER  29 -10.112  -2.603  23.474
  101    H    ALA  30           H        ALA  30  -8.218  -4.239  19.269
  102    HA   ALA  30           HA       ALA  30  -8.445  -4.335  17.006
  103    HB1  ALA  30           HB1      ALA  30  -9.870  -6.381  17.839
  104    HB2  ALA  30           HB2      ALA  30 -11.209  -5.419  17.213
  105    HB3  ALA  30           HB3      ALA  30  -9.887  -5.890  16.146
  106    H    ASP  31           H        ASP  31  -8.711  -1.887  17.664
  107    HA   ASP  31           HA       ASP  31 -11.297  -0.867  16.731
  108    HB2  ASP  31           HB1      ASP  31 -10.389  -0.026  18.895
  109    HB3  ASP  31           HB2      ASP  31  -9.013   0.646  18.012
  110    HD2  ASP  31           HD       ASP  31 -12.472   2.539  17.842
  111    H    LEU  32           H        LEU  32 -11.510   0.359  14.918
  112    HA   LEU  32           HA       LEU  32  -9.271   1.462  13.519
  113    HB2  LEU  32           HB1      LEU  32  -9.850   0.090  11.406
  114    HB3  LEU  32           HB2      LEU  32  -8.810  -0.623  12.651
  115    HG   LEU  32           HG       LEU  32 -11.575  -1.288  13.135
  116   HD11  LEU  32          HD11      LEU  32 -10.534  -2.430  10.573
  117   HD12  LEU  32          HD12      LEU  32 -11.491  -0.949  10.579
  118   HD13  LEU  32          HD13      LEU  32 -12.175  -2.442  11.217
  119   HD21  LEU  32          HD21      LEU  32  -9.640  -2.448  14.081
  120   HD22  LEU  32          HD22      LEU  32  -9.155  -2.961  12.464
  121   HD23  LEU  32          HD23      LEU  32 -10.667  -3.548  13.161
  122    H    HIS  33           H        HIS  33 -12.635   0.365  13.244
  123    HA   HIS  33           HA       HIS  33 -14.514   1.396  12.482
  124    HB2  HIS  33           HB1      HIS  33 -12.798   3.573  13.437
  125    HB3  HIS  33           HB2      HIS  33 -13.961   4.084  12.210
  126    HD1  HIS  33           HD1      HIS  33 -13.969   2.256  15.540
  127    HD2  HIS  33           HD2      HIS  33 -16.457   4.579  13.157
  128    HE1  HIS  33           HE1      HIS  33 -16.041   2.646  16.911
  129    HE2  HIS  33           HE2      HIS  33 -17.563   4.066  15.456
  130    H    GLY  34           H        GLY  34 -15.273   3.044  10.679
  131    HA2  GLY  34           HA2      GLY  34 -13.442   2.985   8.391
  132    HA3  GLY  34           HA3      GLY  34 -14.982   2.153   8.234
  133    HA1  GLY  34           HA1      GLY  34 -13.625   3.601   8.995
  134    H    ALA  35           H        ALA  35 -13.810   4.535   6.847
  135    HA   ALA  35           HA       ALA  35 -16.208   6.165   6.974
  136    HB1  ALA  35           HB1      ALA  35 -13.530   7.132   7.851
  137    HB2  ALA  35           HB2      ALA  35 -14.613   8.244   7.014
  138    HB3  ALA  35           HB3      ALA  35 -15.126   7.475   8.516
  139    H    ARG  36           H        ARG  36 -16.802   6.094   4.903
  140    HA   ARG  36           HA       ARG  36 -14.754   6.630   2.852
  141    HB2  ARG  36           HB1      ARG  36 -16.885   4.590   3.018
  142    HB3  ARG  36           HB2      ARG  36 -16.731   5.400   1.453
  143    HG2  ARG  36           HG1      ARG  36 -14.424   4.737   1.258
  144    HG3  ARG  36           HG2      ARG  36 -14.459   4.048   2.890
  145    HD2  ARG  36           HD1      ARG  36 -15.838   2.265   2.255
  146    HD3  ARG  36           HD2      ARG  36 -16.365   3.094   0.785
  147    HE   ARG  36           HE       ARG  36 -13.987   1.509   1.121
  148   HH11  ARG  36          HH11      ARG  36 -15.533   4.011  -0.740
  149   HH12  ARG  36          HH12      ARG  36 -14.566   3.740  -2.152
  150   HH21  ARG  36          HH21      ARG  36 -12.708   1.140  -0.731
  151   HH22  ARG  36          HH22      ARG  36 -12.960   2.105  -2.146
  152    H    LYS  37           H        LYS  37 -15.016   8.484   1.815
  153    HA   LYS  37           HA       LYS  37 -17.492   9.387   0.793
  154    HB2  LYS  37           HB1      LYS  37 -17.859  11.364   2.129
  155    HB3  LYS  37           HB2      LYS  37 -17.848   9.944   3.187
  156    HG2  LYS  37           HG1      LYS  37 -15.367  10.504   3.584
  157    HG3  LYS  37           HG2      LYS  37 -15.779  12.088   2.905
  158    HD2  LYS  37           HD1      LYS  37 -17.239  12.612   4.643
  159    HD3  LYS  37           HD2      LYS  37 -17.430  10.913   5.112
  160    HE2  LYS  37           HE1      LYS  37 -15.072  10.878   5.877
  161    HE3  LYS  37           HE2      LYS  37 -14.953  12.597   5.476
  162    HZ1  LYS  37           HZ1      LYS  37 -16.521  13.146   7.136
  163    HZ2  LYS  37           HZ2      LYS  37 -15.422  12.083   7.862
  164    HZ3  LYS  37           HZ3      LYS  37 -16.949  11.528   7.388
  165    H    GLY  38           H        GLY  38 -17.145  11.987   0.345
  166    HA2  GLY  38           HA2      GLY  38 -15.704  13.639  -0.506
  167    HA3  GLY  38           HA3      GLY  38 -14.380  12.484  -0.443
  168    HA1  GLY  38           HA1      GLY  38 -16.370  13.140  -0.803
  169    H    SER  39           H        SER  39 -13.600  12.290  -2.436
  170    HA   SER  39           HA       SER  39 -15.517  12.003  -4.656
  171    HB2  SER  39           HB1      SER  39 -12.719  13.145  -4.564
  172    HB3  SER  39           HB2      SER  39 -13.497  12.676  -6.085
  173    HG   SER  39           HG       SER  39 -14.246  14.703  -4.274
  174    H    GLN  40           H        GLN  40 -12.265  10.962  -3.631
  175    HA   GLN  40           HA       GLN  40 -12.845   8.325  -4.799
  176    HB2  GLN  40           HB1      GLN  40 -10.343   9.988  -5.070
  177    HB3  GLN  40           HB2      GLN  40 -10.342   8.236  -5.329
  178    HG2  GLN  40           HG1      GLN  40 -12.287   9.966  -6.808
  179    HG3  GLN  40           HG2      GLN  40 -10.608   9.838  -7.347
  180   HE21  GLN  40          HE21      GLN  40 -12.296   9.025  -9.133
  181   HE22  GLN  40          HE22      GLN  40 -12.401   7.303  -9.228
  182    H    CYS  41           H        CYS  41 -10.354   9.939  -2.812
  183    HA   CYS  41           HA       CYS  41 -10.823   7.988  -0.692
  184    HB2  CYS  41           HB1      CYS  41  -8.342   7.640  -0.457
  185    HB3  CYS  41           HB2      CYS  41  -9.063   6.908  -1.891
  186    H    LEU  42           H        LEU  42 -10.360   8.731   1.353
  187    HA   LEU  42           HA       LEU  42  -9.678  11.584   1.522
  188    HB2  LEU  42           HB1      LEU  42 -11.897  10.558   2.415
  189    HB3  LEU  42           HB2      LEU  42 -10.883  10.005   3.758
  190    HG   LEU  42           HG       LEU  42 -10.378  12.772   3.393
  191   HD11  LEU  42          HD11      LEU  42 -12.553  12.785   2.195
  192   HD12  LEU  42          HD12      LEU  42 -12.548  13.753   3.670
  193   HD13  LEU  42          HD13      LEU  42 -13.318  12.166   3.659
  194   HD21  LEU  42          HD21      LEU  42 -10.090  11.959   5.524
  195   HD22  LEU  42          HD22      LEU  42 -11.570  10.999   5.476
  196   HD23  LEU  42          HD23      LEU  42 -11.659  12.750   5.673
  197    H    SER  43           H        SER  43  -8.714   8.406   2.502
  198    HA   SER  43           HA       SER  43  -6.274   9.511   3.649
  199    HB2  SER  43           HB1      SER  43  -8.385   8.121   5.193
  200    HB3  SER  43           HB2      SER  43  -6.732   7.548   5.474
  201    HG   SER  43           HG       SER  43  -7.608   9.430   6.760
  202    H    ASP  44           H        ASP  44  -4.628   7.807   4.033
  203    HA   ASP  44           HA       ASP  44  -4.228   6.232   1.780
  204    HB2  ASP  44           HB1      ASP  44  -2.360   5.244   2.945
  205    HB3  ASP  44           HB2      ASP  44  -2.452   6.957   3.374
  206    HD2  ASP  44           HD       ASP  44  -2.457   4.447   6.268
  207    H    THR  45           H        THR  45  -5.998   5.564   4.680
  208    HA   THR  45           HA       THR  45  -6.005   2.770   4.666
  209    HB   THR  45           HB       THR  45  -8.355   3.088   5.729
  210    HG1  THR  45           HG1      THR  45  -8.531   5.283   4.850
  211   HG21  THR  45          HG21      THR  45  -5.718   3.988   6.810
  212   HG22  THR  45          HG22      THR  45  -6.686   2.579   7.241
  213   HG23  THR  45          HG23      THR  45  -7.169   4.182   7.791
  214    H    ASP  46           H        ASP  46  -7.927   5.090   2.848
  215    HA   ASP  46           HA       ASP  46  -9.706   3.123   1.759
  216    HB2  ASP  46           HB1      ASP  46  -9.395   6.012   1.670
  217    HB3  ASP  46           HB2      ASP  46  -9.766   5.349   0.074
  218    HD2  ASP  46           HD       ASP  46 -13.045   4.949   0.921
  219    H    CYS  47           H        CYS  47  -6.640   4.504   0.857
  220    HA   CYS  47           HA       CYS  47  -6.633   3.822  -1.874
  221    HB2  CYS  47           HB1      CYS  47  -4.711   4.746   0.117
  222    HB3  CYS  47           HB2      CYS  47  -3.986   3.634  -1.045
  223    H    ASN  48           H        ASN  48  -4.663   2.254  -2.574
  224    HA   ASN  48           HA       ASN  48  -5.486  -0.374  -1.597
  225    HB2  ASN  48           HB1      ASN  48  -4.158   0.633  -4.092
  226    HB3  ASN  48           HB2      ASN  48  -3.973  -1.064  -3.633
  227   HD21  ASN  48          HD21      ASN  48  -5.607  -2.461  -3.956
  228   HD22  ASN  48          HD22      ASN  48  -7.133  -2.034  -4.646
  229    H    THR  49           H        THR  49  -3.589   1.514  -0.206
  230    HA   THR  49           HA       THR  49  -1.797   1.245   1.186
  231    HB   THR  49           HB       THR  49  -1.291  -1.505   0.084
  232    HG1  THR  49           HG1      THR  49  -3.418  -0.619   1.714
  233   HG21  THR  49          HG21      THR  49  -0.895  -1.767   2.671
  234   HG22  THR  49          HG22      THR  49  -0.709  -0.014   2.603
  235   HG23  THR  49          HG23      THR  49   0.343  -1.052   1.639
  236    H    ARG  50           H        ARG  50  -0.898  -0.728  -1.647
  237    HA   ARG  50           HA       ARG  50   1.729   0.151  -1.824
  238    HB2  ARG  50           HB1      ARG  50  -0.127  -0.813  -4.015
  239    HB3  ARG  50           HB2      ARG  50   1.624  -0.624  -4.196
  240    HG2  ARG  50           HG1      ARG  50   1.700  -2.791  -3.638
  241    HG3  ARG  50           HG2      ARG  50   1.508  -2.184  -1.985
  242    HD2  ARG  50           HD1      ARG  50  -0.654  -2.876  -1.818
  243    HD3  ARG  50           HD2      ARG  50  -0.977  -2.583  -3.532
  244    HE   ARG  50           HE       ARG  50   0.788  -4.753  -3.305
  245   HH11  ARG  50          HH11      ARG  50  -2.525  -3.910  -2.645
  246   HH12  ARG  50          HH12      ARG  50  -3.113  -5.528  -2.840
  247   HH21  ARG  50          HH21      ARG  50   0.027  -6.888  -3.565
  248   HH22  ARG  50          HH22      ARG  50  -1.660  -7.221  -3.362
  249    H    LYS  51           H        LYS  51  -1.203   1.694  -2.826
  250    HA   LYS  51           HA       LYS  51   0.358   3.822  -4.136
  251    HB2  LYS  51           HB1      LYS  51  -2.565   3.112  -4.497
  252    HB3  LYS  51           HB2      LYS  51  -1.706   4.418  -5.331
  253    HG2  LYS  51           HG1      LYS  51  -0.158   2.647  -6.267
  254    HG3  LYS  51           HG2      LYS  51  -1.315   1.457  -5.644
  255    HD2  LYS  51           HD1      LYS  51  -3.093   2.824  -6.937
  256    HD3  LYS  51           HD2      LYS  51  -1.703   3.510  -7.795
  257    HE2  LYS  51           HE1      LYS  51  -0.994   1.312  -8.526
  258    HE3  LYS  51           HE2      LYS  51  -2.271   0.558  -7.561
  259    HZ1  LYS  51           HZ1      LYS  51  -3.100   2.544  -9.531
  260    HZ2  LYS  51           HZ2      LYS  51  -3.864   1.115  -9.049
  261    HZ3  LYS  51           HZ3      LYS  51  -2.559   1.055 -10.124
  262    H    PHE  52           H        PHE  52   0.140   5.907  -3.462
  263    HA   PHE  52           HA       PHE  52  -1.234   6.297  -0.919
  264    HB2  PHE  52           HB1      PHE  52  -0.004   8.476  -0.886
  265    HB3  PHE  52           HB2      PHE  52   1.043   7.057  -0.955
  266    HD1  PHE  52           HD1      PHE  52  -0.459   9.703  -3.074
  267    HD2  PHE  52           HD2      PHE  52   2.621   6.796  -2.651
  268    HE1  PHE  52           HE1      PHE  52   0.658  10.600  -5.075
  269    HE2  PHE  52           HE2      PHE  52   3.744   7.689  -4.650
  270    HZ   PHE  52           HZ       PHE  52   2.764   9.594  -5.864
  271    H    CYS  53           H        CYS  53  -2.592   8.136  -0.539
  272    HA   CYS  53           HA       CYS  53  -4.279   8.730  -2.832
  273    HB2  CYS  53           HB1      CYS  53  -5.247   8.024  -0.644
  274    HB3  CYS  53           HB2      CYS  53  -4.642   9.522   0.064
  275    H    LEU  54           H        LEU  54  -3.239  10.233  -4.071
  276    HA   LEU  54           HA       LEU  54  -2.012  12.564  -2.908
  277    HB2  LEU  54           HB1      LEU  54  -1.039  11.622  -4.895
  278    HB3  LEU  54           HB2      LEU  54  -2.578  11.771  -5.758
  279    HG   LEU  54           HG       LEU  54  -2.052  14.369  -5.041
  280   HD11  LEU  54          HD11      LEU  54   0.508  13.832  -6.247
  281   HD12  LEU  54          HD12      LEU  54   0.365  13.030  -4.684
  282   HD13  LEU  54          HD13      LEU  54   0.117  14.770  -4.807
  283   HD21  LEU  54          HD21      LEU  54  -2.683  14.336  -7.181
  284   HD22  LEU  54          HD22      LEU  54  -2.018  12.723  -7.443
  285   HD23  LEU  54          HD23      LEU  54  -0.972  14.138  -7.558
  286    H    GLN  55           H        GLN  55  -3.050  14.343  -2.326
  287    HA   GLN  55           HA       GLN  55  -5.666  14.912  -3.555
  288    HB2  GLN  55           HB1      GLN  55  -4.689  15.925  -0.881
  289    HB3  GLN  55           HB2      GLN  55  -6.338  15.975  -1.524
  290    HG2  GLN  55           HG1      GLN  55  -6.186  13.401  -1.546
  291    HG3  GLN  55           HG2      GLN  55  -4.812  13.637  -0.456
  292   HE21  GLN  55          HE21      GLN  55  -5.209  13.830   1.637
  293   HE22  GLN  55          HE22      GLN  55  -6.755  14.130   2.347
  294    HA   PRO  56           HA       PRO  56  -2.970  18.285  -5.088
  295    HB2  PRO  56           HB1      PRO  56  -4.342  18.597  -7.439
  296    HB3  PRO  56           HB2      PRO  56  -3.084  17.385  -7.200
  297    HG2  PRO  56           HG1      PRO  56  -6.064  17.097  -7.017
  298    HG3  PRO  56           HG2      PRO  56  -4.863  16.026  -7.830
  299    HD2  PRO  56           HD1      PRO  56  -5.935  15.447  -5.404
  300    HD3  PRO  56           HD2      PRO  56  -4.275  15.014  -5.846
  301    H    ARG  57           H        ARG  57  -3.368  20.497  -5.247
  302    HA   ARG  57           HA       ARG  57  -5.807  21.388  -3.978
  303    HB2  ARG  57           HB1      ARG  57  -3.301  22.812  -4.879
  304    HB3  ARG  57           HB2      ARG  57  -4.688  23.658  -4.179
  305    HG2  ARG  57           HG1      ARG  57  -4.339  22.818  -2.074
  306    HG3  ARG  57           HG2      ARG  57  -3.509  21.375  -2.680
  307    HD2  ARG  57           HD1      ARG  57  -1.501  22.351  -2.547
  308    HD3  ARG  57           HD2      ARG  57  -2.086  23.795  -3.385
  309    HE   ARG  57           HE       ARG  57  -3.105  24.015  -0.859
  310   HH11  ARG  57          HH11      ARG  57   0.077  23.629  -2.216
  311   HH12  ARG  57          HH12      ARG  57   0.869  24.486  -0.936
  312   HH21  ARG  57          HH21      ARG  57  -2.074  25.145   0.833
  313   HH22  ARG  57          HH22      ARG  57  -0.356  25.348   0.798
  314    H    ASP  58           H        ASP  58  -4.464  21.262  -7.166
  315    HA   ASP  58           HA       ASP  58  -6.404  23.151  -8.235
  316    HB2  ASP  58           HB1      ASP  58  -3.932  21.842  -9.214
  317    HB3  ASP  58           HB2      ASP  58  -5.180  22.144 -10.430
  318    HD2  ASP  58           HD       ASP  58  -2.977  25.117  -9.407
  319    H    GLU  59           H        GLU  59  -5.975  19.754  -7.841
  320    HA   GLU  59           HA       GLU  59  -8.394  19.281  -9.455
  321    HB2  GLU  59           HB1      GLU  59  -5.859  18.233  -9.922
  322    HB3  GLU  59           HB2      GLU  59  -6.726  16.925  -9.104
  323    HG2  GLU  59           HG1      GLU  59  -7.151  16.507 -11.338
  324    HG3  GLU  59           HG2      GLU  59  -8.596  17.377 -10.806
  325    HE2  GLU  59           HE       GLU  59  -7.010  18.816 -13.881
  326    H    LYS  60           H        LYS  60  -9.170  16.870  -8.803
  327    HA   LYS  60           HA       LYS  60  -9.872  17.113  -5.996
  328    HB2  LYS  60           HB1      LYS  60 -10.914  15.633  -8.354
  329    HB3  LYS  60           HB2      LYS  60 -11.173  14.893  -6.766
  330    HG2  LYS  60           HG1      LYS  60 -12.586  16.552  -6.051
  331    HG3  LYS  60           HG2      LYS  60 -11.871  17.762  -7.130
  332    HD2  LYS  60           HD1      LYS  60 -13.087  17.067  -8.965
  333    HD3  LYS  60           HD2      LYS  60 -13.301  15.430  -8.323
  334    HE2  LYS  60           HE1      LYS  60 -15.008  16.085  -6.853
  335    HE3  LYS  60           HE2      LYS  60 -14.559  17.792  -6.970
  336    HZ1  LYS  60           HZ1      LYS  60 -15.999  16.136  -8.945
  337    HZ2  LYS  60           HZ2      LYS  60 -15.222  17.566  -9.409
  338    HZ3  LYS  60           HZ3      LYS  60 -16.464  17.612  -8.261
  339    HA   PRO  61           HA       PRO  61  -7.241  13.996  -4.379
  340    HB2  PRO  61           HB1      PRO  61  -8.868  12.714  -2.587
  341    HB3  PRO  61           HB2      PRO  61  -8.239  14.342  -2.338
  342    HG2  PRO  61           HG1      PRO  61 -10.910  13.477  -3.394
  343    HG3  PRO  61           HG2      PRO  61 -10.523  14.746  -2.174
  344    HD2  PRO  61           HD1      PRO  61 -11.115  15.331  -4.757
  345    HD3  PRO  61           HD2      PRO  61  -9.965  16.280  -3.801
  346    H    PHE  62           H        PHE  62  -6.590  11.919  -4.737
  347    HA   PHE  62           HA       PHE  62  -8.374   9.796  -5.386
  348    HB2  PHE  62           HB1      PHE  62  -7.562   9.440  -7.720
  349    HB3  PHE  62           HB2      PHE  62  -8.550  10.888  -7.524
  350    HD1  PHE  62           HD1      PHE  62  -7.784  12.954  -8.242
  351    HD2  PHE  62           HD2      PHE  62  -5.005   9.784  -7.656
  352    HE1  PHE  62           HE1      PHE  62  -6.005  14.334  -9.234
  353    HE2  PHE  62           HE2      PHE  62  -3.222  11.160  -8.646
  354    HZ   PHE  62           HZ       PHE  62  -3.721  13.438  -9.436
  355    H    CYS  63           H        CYS  63  -7.187   7.794  -5.986
  356    HA   CYS  63           HA       CYS  63  -4.732   7.645  -4.450
  357    HB2  CYS  63           HB1      CYS  63  -6.743   5.970  -4.465
  358    HB3  CYS  63           HB2      CYS  63  -5.948   5.317  -5.898
  359    H    ALA  64           H        ALA  64  -2.888   8.151  -5.430
  360    HA   ALA  64           HA       ALA  64  -2.543   7.467  -8.266
  361    HB1  ALA  64           HB1      ALA  64  -0.362   8.996  -7.517
  362    HB2  ALA  64           HB2      ALA  64  -1.797   9.562  -8.373
  363    HB3  ALA  64           HB3      ALA  64  -1.707   9.699  -6.617
  364    H    THR  65           H        THR  65  -0.727   6.344  -8.986
  365    HA   THR  65           HA       THR  65   0.153   4.200  -7.486
  366    HB   THR  65           HB       THR  65   2.160   4.224  -9.147
  367    HG1  THR  65           HG1      THR  65   0.513   5.929 -10.658
  368   HG21  THR  65          HG21      THR  65  -0.095   2.946  -9.244
  369   HG22  THR  65          HG22      THR  65   0.872   3.080 -10.713
  370   HG23  THR  65          HG23      THR  65  -0.525   4.130 -10.477
  371    H    CYS  66           H        CYS  66   2.544   3.739  -7.009
  372    HA   CYS  66           HA       CYS  66   3.437   5.743  -5.125
  373    HB2  CYS  66           HB1      CYS  66   5.106   4.062  -4.457
  374    HB3  CYS  66           HB2      CYS  66   3.469   3.402  -4.454
  375    H    ARG  67           H        ARG  67   5.948   5.993  -4.998
  376    HA   ARG  67           HA       ARG  67   6.761   7.113  -7.555
  377    HB2  ARG  67           HB1      ARG  67   8.107   7.233  -4.846
  378    HB3  ARG  67           HB2      ARG  67   8.579   8.157  -6.279
  379    HG2  ARG  67           HG1      ARG  67   5.872   8.387  -4.970
  380    HG3  ARG  67           HG2      ARG  67   7.251   9.430  -4.587
  381    HD2  ARG  67           HD1      ARG  67   6.302  10.740  -6.187
  382    HD3  ARG  67           HD2      ARG  67   7.274   9.700  -7.238
  383    HE   ARG  67           HE       ARG  67   4.883   8.395  -6.997
  384   HH11  ARG  67          HH11      ARG  67   5.887  11.562  -8.035
  385   HH12  ARG  67          HH12      ARG  67   4.579  11.751  -9.156
  386   HH21  ARG  67          HH21      ARG  67   3.157   8.632  -8.470
  387   HH22  ARG  67          HH22      ARG  67   3.027  10.085  -9.403
  388    H    GLY  68           H        GLY  68   8.058   6.095  -8.930
  389    HA2  GLY  68           HA2      GLY  68   9.140   3.533  -8.378
  390    HA3  GLY  68           HA3      GLY  68   9.468   4.505  -9.805
  391    HA1  GLY  68           HA1      GLY  68   9.269   4.112  -7.726
  392    H    LEU  69           H        LEU  69  11.526   3.092  -8.991
  393    HA   LEU  69           HA       LEU  69  13.148   4.127  -6.961
  394    HB2  LEU  69           HB1      LEU  69  13.565   2.445  -9.376
  395    HB3  LEU  69           HB2      LEU  69  14.996   3.183  -8.635
  396    HG   LEU  69           HG       LEU  69  13.053   1.339  -7.245
  397   HD11  LEU  69          HD11      LEU  69  15.001   0.674  -9.065
  398   HD12  LEU  69          HD12      LEU  69  14.335  -0.390  -7.826
  399   HD13  LEU  69          HD13      LEU  69  15.826   0.499  -7.516
  400   HD21  LEU  69          HD21      LEU  69  15.585   2.686  -6.322
  401   HD22  LEU  69          HD22      LEU  69  14.833   1.330  -5.483
  402   HD23  LEU  69          HD23      LEU  69  13.964   2.857  -5.648
  403    H    ARG  70           H        ARG  70  12.506   5.261 -10.169
  404    HA   ARG  70           HA       ARG  70  14.729   7.164 -10.040
  405    HB2  ARG  70           HB1      ARG  70  12.846   6.347 -12.255
  406    HB3  ARG  70           HB2      ARG  70  13.949   7.722 -12.399
  407    HG2  ARG  70           HG1      ARG  70  15.347   5.359 -11.487
  408    HG3  ARG  70           HG2      ARG  70  14.496   5.071 -13.013
  409    HD2  ARG  70           HD1      ARG  70  16.597   5.864 -13.685
  410    HD3  ARG  70           HD2      ARG  70  15.536   7.274 -13.800
  411    HE   ARG  70           HE       ARG  70  16.734   8.281 -12.125
  412   HH11  ARG  70          HH11      ARG  70  17.509   4.888 -12.217
  413   HH12  ARG  70          HH12      ARG  70  18.814   5.021 -11.086
  414   HH21  ARG  70          HH21      ARG  70  18.451   8.470 -10.635
  415   HH22  ARG  70          HH22      ARG  70  19.348   7.059 -10.187
  416    H    ARG  71           H        ARG  71  11.931   7.133  -8.638
  417    HA   ARG  71           HA       ARG  71  11.116   9.846  -9.432
  418    HB2  ARG  71           HB1      ARG  71   9.612   7.641  -8.012
  419    HB3  ARG  71           HB2      ARG  71   8.999   9.292  -8.174
  420    HG2  ARG  71           HG1      ARG  71   9.648   7.416 -10.449
  421    HG3  ARG  71           HG2      ARG  71   8.031   7.833  -9.858
  422    HD2  ARG  71           HD1      ARG  71   8.536  10.236 -10.387
  423    HD3  ARG  71           HD2      ARG  71  10.031   9.679 -11.151
  424    HE   ARG  71           HE       ARG  71   8.811   8.973 -12.954
  425   HH11  ARG  71          HH11      ARG  71   6.664   9.531 -10.271
  426   HH12  ARG  71          HH12      ARG  71   5.224   9.325 -11.211
  427   HH21  ARG  71          HH21      ARG  71   6.922   8.700 -14.203
  428   HH22  ARG  71          HH22      ARG  71   5.372   8.851 -13.449
  429    H    ARG  72           H        ARG  72  11.121  11.493  -7.984
  430    HA   ARG  72           HA       ARG  72  12.731  11.238  -5.656
  431    HB2  ARG  72           HB1      ARG  72  10.905  13.531  -6.412
  432    HB3  ARG  72           HB2      ARG  72  12.281  13.589  -5.302
  433    HG2  ARG  72           HG1      ARG  72  12.499  12.965  -8.248
  434    HG3  ARG  72           HG2      ARG  72  12.751  14.565  -7.529
  435    HD2  ARG  72           HD1      ARG  72  14.516  13.497  -6.050
  436    HD3  ARG  72           HD2      ARG  72  14.367  12.067  -7.081
  437    HE   ARG  72           HE       ARG  72  15.538  13.158  -8.721
  438   HH11  ARG  72          HH11      ARG  72  14.492  15.458  -6.325
  439   HH12  ARG  72          HH12      ARG  72  15.425  16.761  -6.980
  440   HH21  ARG  72          HH21      ARG  72  16.771  14.867  -9.593
  441   HH22  ARG  72          HH22      ARG  72  16.720  16.425  -8.840
  442    H    CYS  73           H        CYS  73  12.146  11.521  -3.472
  443    HA   CYS  73           HA       CYS  73   9.335  11.480  -2.750
  444    HB2  CYS  73           HB1      CYS  73   9.366   9.420  -1.563
  445    HB3  CYS  73           HB2      CYS  73  10.003   9.084  -3.176
  446    H    GLN  74           H        GLN  74   9.193  11.235  -0.235
  447    HA   GLN  74           HA       GLN  74  11.450  12.635   1.022
  448    HB2  GLN  74           HB1      GLN  74   8.521  13.345   1.324
  449    HB3  GLN  74           HB2      GLN  74   9.847  14.059   2.255
  450    HG2  GLN  74           HG1      GLN  74  10.750  15.137   0.356
  451    HG3  GLN  74           HG2      GLN  74   9.726  14.201  -0.740
  452   HE21  GLN  74          HE21      GLN  74   8.913  16.084  -1.677
  453   HE22  GLN  74          HE22      GLN  74   7.753  17.078  -0.869
  454    H    ARG  75           H        ARG  75   8.507  10.731   1.463
  455    HA   ARG  75           HA       ARG  75   9.616   9.747   4.010
  456    HB2  ARG  75           HB1      ARG  75   6.722  10.055   3.178
  457    HB3  ARG  75           HB2      ARG  75   7.261   9.265   4.667
  458    HG2  ARG  75           HG1      ARG  75   7.676  11.209   5.722
  459    HG3  ARG  75           HG2      ARG  75   8.301  11.981   4.255
  460    HD2  ARG  75           HD1      ARG  75   5.935  12.137   3.420
  461    HD3  ARG  75           HD2      ARG  75   5.414  11.569   5.012
  462    HE   ARG  75           HE       ARG  75   6.389  14.195   4.343
  463   HH11  ARG  75          HH11      ARG  75   5.867  11.877   6.887
  464   HH12  ARG  75          HH12      ARG  75   5.821  13.070   8.142
  465   HH21  ARG  75          HH21      ARG  75   6.330  15.775   5.986
  466   HH22  ARG  75          HH22      ARG  75   6.083  15.288   7.629
  467    H    ASP  76           H        ASP  76   9.808   7.586   4.297
  468    HA   ASP  76           HA       ASP  76   9.912   5.876   2.094
  469    HB2  ASP  76           HB1      ASP  76  11.208   5.349   4.031
  470    HB3  ASP  76           HB2      ASP  76   9.765   5.299   5.053
  471    HD2  ASP  76           HD       ASP  76   9.212   2.003   4.326
  472    H    ALA  77           H        ALA  77   7.275   6.733   4.170
  473    HA   ALA  77           HA       ALA  77   5.601   4.504   3.631
  474    HB1  ALA  77           HB1      ALA  77   5.457   6.903   5.163
  475    HB2  ALA  77           HB2      ALA  77   3.995   6.760   4.186
  476    HB3  ALA  77           HB3      ALA  77   4.459   5.453   5.277
  477    H    MET  78           H        MET  78   6.363   7.400   1.895
  478    HA   MET  78           HA       MET  78   4.046   7.351   0.200
  479    HB2  MET  78           HB1      MET  78   6.531   8.956   0.420
  480    HB3  MET  78           HB2      MET  78   5.784   8.875  -1.182
  481    HG2  MET  78           HG1      MET  78   3.964   9.465   1.073
  482    HG3  MET  78           HG2      MET  78   5.147  10.710   0.664
  483    HE1  MET  78           HE1      MET  78   4.981  12.289  -1.393
  484    HE2  MET  78           HE2      MET  78   5.608  10.865  -2.225
  485    HE3  MET  78           HE3      MET  78   4.255  11.765  -2.913
  486    H    CYS  79           H        CYS  79   7.182   5.883   0.192
  487    HA   CYS  79           HA       CYS  79   7.071   5.174  -2.616
  488    HB2  CYS  79           HB1      CYS  79   9.043   4.903  -0.403
  489    HB3  CYS  79           HB2      CYS  79   9.129   3.713  -1.703
  490    H    CYS  80           H        CYS  80   6.902   3.060  -3.421
  491    HA   CYS  80           HA       CYS  80   4.961   1.439  -2.259
  492    HB2  CYS  80           HB1      CYS  80   6.801   1.272  -4.544
  493    HB3  CYS  80           HB2      CYS  80   6.350  -0.299  -3.878
  494    HA   PRO  81           HA       PRO  81   6.959  -1.119   0.690
  495    HB2  PRO  81           HB1      PRO  81   5.784  -3.555   0.257
  496    HB3  PRO  81           HB2      PRO  81   4.946  -2.187   0.988
  497    HG2  PRO  81           HG1      PRO  81   4.920  -3.131  -1.859
  498    HG3  PRO  81           HG2      PRO  81   3.541  -2.624  -0.813
  499    HD2  PRO  81           HD1      PRO  81   4.625  -0.998  -2.698
  500    HD3  PRO  81           HD2      PRO  81   3.964  -0.387  -1.173
  501    H    GLY  82           H        GLY  82   9.042  -1.674   0.565
  502    HA2  GLY  82           HA2      GLY  82  10.407  -3.728   0.019
  503    HA3  GLY  82           HA3      GLY  82   9.879  -3.459  -1.635
  504    HA1  GLY  82           HA1      GLY  82  10.413  -2.908   0.346
  505    H    THR  83           H        THR  83  10.117  -0.457  -0.949
  506    HA   THR  83           HA       THR  83  13.030  -0.305  -1.374
  507    HB   THR  83           HB       THR  83  12.183   2.053  -2.375
  508    HG1  THR  83           HG1      THR  83  10.263   1.713  -3.515
  509   HG21  THR  83          HG21      THR  83  13.544   0.955  -3.823
  510   HG22  THR  83          HG22      THR  83  12.015   0.581  -4.617
  511   HG23  THR  83          HG23      THR  83  12.764  -0.601  -3.545
  512    H    LEU  84           H        LEU  84  13.845   2.019  -0.876
  513    HA   LEU  84           HA       LEU  84  12.563   3.048   1.559
  514    HB2  LEU  84           HB1      LEU  84  15.018   1.626   1.425
  515    HB3  LEU  84           HB2      LEU  84  15.392   3.321   1.782
  516    HG   LEU  84           HG       LEU  84  13.428   1.692   3.386
  517   HD11  LEU  84          HD11      LEU  84  15.491   1.883   5.038
  518   HD12  LEU  84          HD12      LEU  84  16.386   1.861   3.519
  519   HD13  LEU  84          HD13      LEU  84  15.305   0.528   3.925
  520   HD21  LEU  84          HD21      LEU  84  13.163   4.111   3.537
  521   HD22  LEU  84          HD22      LEU  84  14.870   4.283   3.945
  522   HD23  LEU  84          HD23      LEU  84  13.778   3.446   5.051
  523    H    CYS  85           H        CYS  85  12.818   5.247   1.943
  524    HA   CYS  85           HA       CYS  85  13.410   6.821  -0.407
  525    HB2  CYS  85           HB1      CYS  85  12.107   7.278   2.226
  526    HB3  CYS  85           HB2      CYS  85  12.852   8.680   1.457
  527    H    VAL  86           H        VAL  86  15.515   7.120  -0.825
  528    HA   VAL  86           HA       VAL  86  17.185   8.218   1.338
  529    HB   VAL  86           HB       VAL  86  18.092   6.288  -0.803
  530   HG11  VAL  86          HG11      VAL  86  19.795   7.960  -0.298
  531   HG12  VAL  86          HG12      VAL  86  19.651   7.597   1.424
  532   HG13  VAL  86          HG13      VAL  86  20.267   6.374   0.311
  533   HG21  VAL  86          HG21      VAL  86  16.822   5.721   1.569
  534   HG22  VAL  86          HG22      VAL  86  17.856   4.616   0.663
  535   HG23  VAL  86          HG23      VAL  86  18.529   5.568   1.987
  536    H    ASN  87           H        ASN  87  18.526   9.901   0.805
  537    HA   ASN  87           HA       ASN  87  19.241  11.740  -0.325
  538    HB2  ASN  87           HB1      ASN  87  19.243   9.632  -2.471
  539    HB3  ASN  87           HB2      ASN  87  19.657  11.306  -2.862
  540   HD21  ASN  87          HD21      ASN  87  21.775  11.347  -3.139
  541   HD22  ASN  87          HD22      ASN  87  22.948  10.725  -2.034
  542    H    ASP  88           H        ASP  88  16.395  11.353   0.040
  543    HA   ASP  88           HA       ASP  88  14.444  12.384  -0.513
  544    HB2  ASP  88           HB1      ASP  88  16.435  14.197  -1.163
  545    HB3  ASP  88           HB2      ASP  88  15.471  14.101  -2.643
  546    HD2  ASP  88           HD       ASP  88  13.072  16.097  -1.273
  547    H    VAL  89           H        VAL  89  15.535  10.069  -2.052
  548    HA   VAL  89           HA       VAL  89  13.572  10.163  -4.201
  549    HB   VAL  89           HB       VAL  89  15.669  10.909  -5.266
  550   HG11  VAL  89          HG11      VAL  89  16.697   8.249  -4.294
  551   HG12  VAL  89          HG12      VAL  89  17.492   9.213  -5.541
  552   HG13  VAL  89          HG13      VAL  89  17.320   9.853  -3.906
  553   HG21  VAL  89          HG21      VAL  89  14.823   8.140  -6.114
  554   HG22  VAL  89          HG22      VAL  89  13.990   9.636  -6.536
  555   HG23  VAL  89          HG23      VAL  89  15.628   9.342  -7.122
  556    H    CYS  90           H        CYS  90  12.853   8.125  -4.879
  557    HA   CYS  90           HA       CYS  90  12.891   6.103  -2.912
  558    HB2  CYS  90           HB1      CYS  90  11.316   6.694  -5.077
  559    HB3  CYS  90           HB2      CYS  90  12.163   5.249  -5.632
  560    H    THR  91           H        THR  91  14.638   4.948  -2.430
  561    HA   THR  91           HA       THR  91  16.214   3.817  -4.649
  562    HB   THR  91           HB       THR  91  17.252   4.721  -1.956
  563    HG1  THR  91           HG1      THR  91  17.601   6.523  -2.991
  564   HG21  THR  91          HG21      THR  91  18.724   3.488  -4.289
  565   HG22  THR  91          HG22      THR  91  18.387   2.695  -2.750
  566   HG23  THR  91          HG23      THR  91  19.458   4.095  -2.805
  567    H    THR  92           H        THR  92  16.881   1.694  -4.464
  568    HA   THR  92           HA       THR  92  15.245  -0.038  -2.951
  569    HB   THR  92           HB       THR  92  17.534  -1.498  -3.676
  570    HG1  THR  92           HG1      THR  92  18.397  -0.328  -5.209
  571   HG21  THR  92          HG21      THR  92  16.084  -2.570  -5.209
  572   HG22  THR  92          HG22      THR  92  15.078  -1.131  -5.379
  573   HG23  THR  92          HG23      THR  92  15.061  -2.046  -3.872
  574    H    MET  93           H        MET  93  15.901  -1.574  -1.324
  575    HA   MET  93           HA       MET  93  17.449  -0.354   0.748
  576    HB2  MET  93           HB1      MET  93  15.986  -2.966   0.460
  577    HB3  MET  93           HB2      MET  93  17.026  -2.660   1.859
  578    HG2  MET  93           HG1      MET  93  15.649  -1.032   2.722
  579    HG3  MET  93           HG2      MET  93  14.957  -0.647   1.145
  580    HE1  MET  93           HE1      MET  93  12.230  -2.091   3.812
  581    HE2  MET  93           HE2      MET  93  13.865  -2.052   4.473
  582    HE3  MET  93           HE3      MET  93  13.260  -0.686   3.534
  583    H    GLU  94           H        GLU  94  17.972  -2.920  -1.589
  584    HA   GLU  94           HA       GLU  94  20.303  -4.021  -0.453
  585    HB2  GLU  94           HB1      GLU  94  19.485  -3.888  -3.367
  586    HB3  GLU  94           HB2      GLU  94  20.716  -4.962  -2.686
  587    HG2  GLU  94           HG1      GLU  94  19.197  -6.372  -1.752
  588    HG3  GLU  94           HG2      GLU  94  18.004  -5.089  -1.506
  589    HE2  GLU  94           HE       GLU  94  16.883  -5.433  -4.861
  590    H    ASP  95           H        ASP  95  19.758  -1.248  -2.518
  591    HA   ASP  95           HA       ASP  95  22.557  -0.838  -3.069
  592    HB2  ASP  95           HB1      ASP  95  20.021   0.282  -3.954
  593    HB3  ASP  95           HB2      ASP  95  21.214   1.545  -3.624
  594    HD2  ASP  95           HD       ASP  95  22.471  -1.070  -6.324
  595    H    ALA  96           H        ALA  96  20.181   0.357  -0.791
  596    HA   ALA  96           HA       ALA  96  21.830   2.480   0.209
  597    HB1  ALA  96           HB1      ALA  96  19.331   2.466   0.295
  598    HB2  ALA  96           HB2      ALA  96  19.440   1.234   1.553
  599    HB3  ALA  96           HB3      ALA  96  20.117   2.839   1.830
  600    H    THR  97           H        THR  97  21.792   2.353   2.884
  601    HA   THR  97           HA       THR  97  23.337  -0.077   3.515
  602    HB   THR  97           HB       THR  97  24.629   1.300   5.125
  603    HG1  THR  97           HG1      THR  97  24.029   3.291   5.502
  604   HG21  THR  97          HG21      THR  97  25.554   2.867   3.105
  605   HG22  THR  97          HG22      THR  97  24.682   1.626   2.205
  606   HG23  THR  97          HG23      THR  97  25.970   1.168   3.318
  607    H    GLU  98           H        GLU  98  21.577  -1.180   4.403
  608    HA   GLU  98           HA       GLU  98  21.000  -0.499   7.139
  609    HB2  GLU  98           HB1      GLU  98  19.142   0.210   5.038
  610    HB3  GLU  98           HB2      GLU  98  18.419  -0.968   6.145
  611    HG2  GLU  98           HG1      GLU  98  19.686   1.647   6.964
  612    HG3  GLU  98           HG2      GLU  98  17.950   1.346   6.798
  613    HE2  GLU  98           HE       GLU  98  19.097   0.795  10.268
  614    H    ASN  99           H        ASN  99  19.889  -2.210   8.276
  615    HA   ASN  99           HA       ASN  99  19.557  -4.392   8.822
  616    HB2  ASN  99           HB1      ASN  99  18.644  -4.188   6.010
  617    HB3  ASN  99           HB2      ASN  99  18.976  -5.823   6.594
  618   HD21  ASN  99          HD21      ASN  99  17.632  -6.772   8.042
  619   HD22  ASN  99          HD22      ASN  99  16.158  -6.059   8.595
  620    H    LEU 100           H        LEU 100  21.811  -4.554   9.355
  621    HA   LEU 100           HA       LEU 100  23.344  -6.181   7.432
  622    HB2  LEU 100           HB1      LEU 100  24.359  -4.288   9.562
  623    HB3  LEU 100           HB2      LEU 100  25.374  -5.320   8.538
  624    HG   LEU 100           HG       LEU 100  24.042  -3.959   6.635
  625   HD11  LEU 100          HD11      LEU 100  22.849  -2.640   8.382
  626   HD12  LEU 100          HD12      LEU 100  23.772  -1.666   7.238
  627   HD13  LEU 100          HD13      LEU 100  24.405  -1.959   8.858
  628   HD21  LEU 100          HD21      LEU 100  26.120  -2.275   7.071
  629   HD22  LEU 100          HD22      LEU 100  26.258  -3.845   6.279
  630   HD23  LEU 100          HD23      LEU 100  26.630  -3.687   7.996
  631    H    TYR 101           H        TYR 101  24.970  -7.633   8.507
  632    HA   TYR 101           HA       TYR 101  24.077  -8.597  11.129
  633    HB2  TYR 101           HB1      TYR 101  24.148 -10.127   8.554
  634    HB3  TYR 101           HB2      TYR 101  24.513 -10.970  10.062
  635    HD1  TYR 101           HD1      TYR 101  21.891  -9.118   8.245
  636    HD2  TYR 101           HD2      TYR 101  22.808 -11.502  11.648
  637    HE1  TYR 101           HE1      TYR 101  19.488  -9.387   8.697
  638    HE2  TYR 101           HE2      TYR 101  20.408 -11.778  12.109
  639    HH   TYR 101           HH       TYR 101  18.279 -10.513  11.599
  640    H    PHE 102           H        PHE 102  25.643 -10.331  11.954
  641    HA   PHE 102           HA       PHE 102  28.393  -9.625  11.167
  642    HB2  PHE 102           HB1      PHE 102  27.071  -9.577  13.805
  643    HB3  PHE 102           HB2      PHE 102  28.652 -10.361  13.786
  644    HD1  PHE 102           HD1      PHE 102  30.673  -9.127  13.295
  645    HD2  PHE 102           HD2      PHE 102  26.879  -7.200  13.351
  646    HE1  PHE 102           HE1      PHE 102  31.791  -6.936  13.367
  647    HE2  PHE 102           HE2      PHE 102  27.990  -5.006  13.422
  648    HZ   PHE 102           HZ       PHE 102  30.449  -4.872  13.428
  649    H    GLN 103           H        GLN 103  29.817 -11.266  10.906
  650    HA   GLN 103           HA       GLN 103  28.998 -13.965  11.715
  651    HB2  GLN 103           HB1      GLN 103  29.737 -14.872   9.557
  652    HB3  GLN 103           HB2      GLN 103  28.397 -13.732   9.363
  653    HG2  GLN 103           HG1      GLN 103  30.168 -11.969   8.865
  654    HG3  GLN 103           HG2      GLN 103  31.292 -13.325   8.704
  655   HE21  GLN 103          HE21      GLN 103  30.270 -11.366   6.735
  656   HE22  GLN 103          HE22      GLN 103  29.620 -12.314   5.447
  657    H    SER 104           H        SER 104  30.909 -15.538  11.313
  658    HA   SER 104           HA       SER 104  33.461 -14.209  11.906
  659    HB2  SER 104           HB1      SER 104  31.965 -15.465  13.846
  660    HB3  SER 104           HB2      SER 104  33.067 -16.752  13.322
  661    HG   SER 104           HG       SER 104  33.914 -15.406  15.024
  662    H    LEU 105           H        LEU 105  35.241 -16.059  11.975
  663    HA   LEU 105           HA       LEU 105  34.885 -17.595   9.489
  664    HB2  LEU 105           HB1      LEU 105  37.004 -15.913  10.503
  665    HB3  LEU 105           HB2      LEU 105  37.602 -17.546  10.155
  666    HG   LEU 105           HG       LEU 105  37.959 -16.110   8.246
  667   HD11  LEU 105          HD11      LEU 105  37.197 -18.544   8.016
  668   HD12  LEU 105          HD12      LEU 105  37.109 -17.513   6.587
  669   HD13  LEU 105          HD13      LEU 105  35.647 -17.871   7.507
  670   HD21  LEU 105          HD21      LEU 105  35.146 -15.761   7.544
  671   HD22  LEU 105          HD22      LEU 105  36.488 -14.619   7.461
  672   HD23  LEU 105          HD23      LEU 105  35.634 -14.870   8.986
  673    H    GLU 106           H        GLU 106  35.940 -19.690   9.356
  674    HA   GLU 106           HA       GLU 106  35.887 -21.073  11.949
  675    HB2  GLU 106           HB1      GLU 106  35.044 -21.783   9.210
  676    HB3  GLU 106           HB2      GLU 106  35.870 -23.072  10.101
  677    HG2  GLU 106           HG1      GLU 106  34.261 -22.824  11.944
  678    HG3  GLU 106           HG2      GLU 106  33.415 -21.585  11.007
  679    HE2  GLU 106           HE       GLU 106  31.550 -24.030   9.524
  680    H    HIS 107           H        HIS 107  37.668 -22.006  12.738
  681    HA   HIS 107           HA       HIS 107  40.123 -21.829  11.167
  682    HB2  HIS 107           HB1      HIS 107  39.582 -22.324  14.099
  683    HB3  HIS 107           HB2      HIS 107  41.194 -22.456  13.390
  684    HD1  HIS 107           HD1      HIS 107  38.448 -19.831  13.630
  685    HD2  HIS 107           HD2      HIS 107  42.587 -20.138  13.422
  686    HE1  HIS 107           HE1      HIS 107  39.311 -17.481  13.877
  687    HE2  HIS 107           HE2      HIS 107  41.840 -17.668  13.748
  688    H    HIS 108           H        HIS 108  39.130 -23.648   9.833
  689    HA   HIS 108           HA       HIS 108  39.289 -26.280  11.041
  690    HB2  HIS 108           HB1      HIS 108  38.106 -25.114   8.660
  691    HB3  HIS 108           HB2      HIS 108  39.006 -26.584   8.274
  692    HD1  HIS 108           HD1      HIS 108  37.059 -26.080  11.470
  693    HD2  HIS 108           HD2      HIS 108  36.872 -28.282   7.951
  694    HE1  HIS 108           HE1      HIS 108  35.184 -27.722  11.804
  695    HE2  HIS 108           HE2      HIS 108  35.069 -29.069   9.653
  696    H    HIS 109           H        HIS 109  40.721 -27.920  10.391
  697    HA   HIS 109           HA       HIS 109  43.036 -27.088   8.796
  698    HB2  HIS 109           HB1      HIS 109  44.523 -28.267  10.458
  699    HB3  HIS 109           HB2      HIS 109  43.816 -26.749  11.024
  700    HD1  HIS 109           HD1      HIS 109  43.521 -30.469  11.512
  701    HD2  HIS 109           HD2      HIS 109  42.152 -26.940  13.223
  702    HE1  HIS 109           HE1      HIS 109  42.435 -31.148  13.676
  703    HE2  HIS 109           HE2      HIS 109  41.598 -28.993  14.722
  704    H    HIS 110           H        HIS 110  44.293 -28.866   7.951
  705    HA   HIS 110           HA       HIS 110  42.605 -31.144   7.319
  706    HB2  HIS 110           HB1      HIS 110  45.139 -29.991   6.214
  707    HB3  HIS 110           HB2      HIS 110  44.756 -31.684   5.884
  708    HD1  HIS 110           HD1      HIS 110  43.697 -28.221   5.025
  709    HD2  HIS 110           HD2      HIS 110  42.539 -32.124   4.200
  710    HE1  HIS 110           HE1      HIS 110  42.091 -28.051   3.098
  711    HE2  HIS 110           HE2      HIS 110  41.381 -30.436   2.591
  712    H    HIS 111           H        HIS 111  42.609 -32.267   9.293
  713    HA   HIS 111           HA       HIS 111  45.195 -33.441  10.070
  714    HB2  HIS 111           HB1      HIS 111  42.956 -32.381  11.595
  715    HB3  HIS 111           HB2      HIS 111  43.348 -34.032  12.080
  716    HD1  HIS 111           HD1      HIS 111  45.568 -31.048  11.238
  717    HD2  HIS 111           HD2      HIS 111  44.990 -33.892  14.210
  718    HE1  HIS 111           HE1      HIS 111  47.351 -30.599  12.954
  719    HE2  HIS 111           HE2      HIS 111  46.998 -32.336  14.771
  720    H    HIS 112           H        HIS 112  45.049 -35.693  10.941
  721    HA   HIS 112           HA       HIS 112  42.904 -37.281   9.740
  722    HB2  HIS 112           HB1      HIS 112  45.846 -37.525   9.156
  723    HB3  HIS 112           HB2      HIS 112  44.782 -38.928   9.026
  724    HD1  HIS 112           HD1      HIS 112  45.361 -35.555   7.455
  725    HD2  HIS 112           HD2      HIS 112  43.190 -39.031   6.774
  726    HE1  HIS 112           HE1      HIS 112  44.433 -35.323   5.130
  727    HE2  HIS 112           HE2      HIS 112  43.104 -37.447   4.712
  Start of MODEL   46
    1    H1   MET  18           H        MET  18 -24.577  41.675 -14.243
    2    HA   MET  18           HA       MET  18 -23.912  43.216 -16.041
    3    HB2  MET  18           HB1      MET  18 -26.020  43.685 -14.852
    4    HB3  MET  18           HB2      MET  18 -25.125  44.659 -13.676
    5    HG2  MET  18           HG1      MET  18 -24.359  45.799 -16.045
    6    HG3  MET  18           HG2      MET  18 -26.030  45.331 -16.370
    7    HE1  MET  18           HE1      MET  18 -27.952  46.618 -13.520
    8    HE2  MET  18           HE2      MET  18 -28.218  47.397 -15.079
    9    HE3  MET  18           HE3      MET  18 -27.854  45.673 -15.006
   10    H    LEU  19           H        LEU  19 -21.586  43.249 -16.020
   11    HA   LEU  19           HA       LEU  19 -20.540  45.827 -15.385
   12    HB2  LEU  19           HB1      LEU  19 -20.262  43.731 -13.441
   13    HB3  LEU  19           HB2      LEU  19 -18.671  44.166 -14.091
   14    HG   LEU  19           HG       LEU  19 -20.054  46.572 -13.466
   15   HD11  LEU  19          HD11      LEU  19 -20.640  46.363 -11.216
   16   HD12  LEU  19          HD12      LEU  19 -19.851  44.794 -11.060
   17   HD13  LEU  19          HD13      LEU  19 -21.348  44.940 -11.981
   18   HD21  LEU  19          HD21      LEU  19 -17.897  45.526 -11.725
   19   HD22  LEU  19          HD22      LEU  19 -18.077  47.107 -12.483
   20   HD23  LEU  19          HD23      LEU  19 -17.530  45.727 -13.439
   21    H    VAL  20           H        VAL  20 -18.292  46.077 -16.103
   22    HA   VAL  20           HA       VAL  20 -17.848  44.867 -18.602
   23    HB   VAL  20           HB       VAL  20 -15.648  45.965 -18.564
   24   HG11  VAL  20          HG11      VAL  20 -16.754  47.777 -19.208
   25   HG12  VAL  20          HG12      VAL  20 -18.188  47.212 -18.347
   26   HG13  VAL  20          HG13      VAL  20 -17.005  48.231 -17.523
   27   HG21  VAL  20          HG21      VAL  20 -15.037  47.349 -16.596
   28   HG22  VAL  20          HG22      VAL  20 -16.363  46.603 -15.704
   29   HG23  VAL  20          HG23      VAL  20 -15.014  45.616 -16.268
   30    H    LEU  21           H        LEU  21 -16.633  43.170 -19.252
   31    HA   LEU  21           HA       LEU  21 -15.955  41.161 -17.372
   32    HB2  LEU  21           HB1      LEU  21 -15.796  41.524 -20.304
   33    HB3  LEU  21           HB2      LEU  21 -14.656  40.365 -19.596
   34    HG   LEU  21           HG       LEU  21 -16.533  39.104 -18.644
   35   HD11  LEU  21          HD11      LEU  21 -18.815  39.628 -19.224
   36   HD12  LEU  21          HD12      LEU  21 -18.290  41.031 -20.154
   37   HD13  LEU  21          HD13      LEU  21 -18.082  41.007 -18.403
   38   HD21  LEU  21          HD21      LEU  21 -17.354  38.167 -20.715
   39   HD22  LEU  21          HD22      LEU  21 -15.642  38.558 -20.879
   40   HD23  LEU  21          HD23      LEU  21 -16.861  39.612 -21.599
   41    H    ASP  22           H        ASP  22 -13.946  40.384 -16.725
   42    HA   ASP  22           HA       ASP  22 -11.793  42.367 -16.845
   43    HB2  ASP  22           HB1      ASP  22 -12.822  41.079 -14.701
   44    HB3  ASP  22           HB2      ASP  22 -11.506  39.974 -15.122
   45    HD2  ASP  22           HD       ASP  22 -10.526  43.042 -13.096
   46    H    PHE  23           H        PHE  23 -10.809  41.985 -18.794
   47    HA   PHE  23           HA       PHE  23  -9.457  39.384 -19.042
   48    HB2  PHE  23           HB1      PHE  23 -11.471  39.818 -20.633
   49    HB3  PHE  23           HB2      PHE  23 -10.365  40.913 -21.464
   50    HD1  PHE  23           HD1      PHE  23 -10.132  37.474 -20.022
   51    HD2  PHE  23           HD2      PHE  23  -9.397  40.037 -23.340
   52    HE1  PHE  23           HE1      PHE  23  -9.162  35.584 -21.264
   53    HE2  PHE  23           HE2      PHE  23  -8.427  38.152 -24.587
   54    HZ   PHE  23           HZ       PHE  23  -8.309  35.921 -23.549
   55    H    ASN  24           H        ASN  24  -7.353  39.722 -18.822
   56    HA   ASN  24           HA       ASN  24  -5.986  41.633 -20.474
   57    HB2  ASN  24           HB1      ASN  24  -6.863  42.699 -18.149
   58    HB3  ASN  24           HB2      ASN  24  -5.313  42.038 -17.617
   59   HD21  ASN  24          HD21      ASN  24  -6.858  44.587 -19.180
   60   HD22  ASN  24          HD22      ASN  24  -5.454  45.419 -19.750
   61    H    ASN  25           H        ASN  25  -5.650  39.612 -17.562
   62    HA   ASN  25           HA       ASN  25  -3.442  38.202 -18.850
   63    HB2  ASN  25           HB1      ASN  25  -2.176  38.316 -16.622
   64    HB3  ASN  25           HB2      ASN  25  -2.168  39.766 -17.633
   65   HD21  ASN  25          HD21      ASN  25  -3.236  38.358 -14.675
   66   HD22  ASN  25          HD22      ASN  25  -3.869  39.801 -13.968
   67    H    ILE  26           H        ILE  26  -3.175  36.087 -18.164
   68    HA   ILE  26           HA       ILE  26  -5.455  34.967 -16.754
   69    HB   ILE  26           HB       ILE  26  -3.119  33.557 -18.051
   70   HG12  ILE  26          HG11      ILE  26  -4.428  34.836 -19.671
   71   HG13  ILE  26          HG12      ILE  26  -4.687  33.098 -19.890
   72   HG21  ILE  26          HG21      ILE  26  -5.257  32.632 -16.364
   73   HG22  ILE  26          HG22      ILE  26  -5.364  31.895 -17.963
   74   HG23  ILE  26          HG23      ILE  26  -3.881  31.743 -17.019
   75   HD11  ILE  26          HD11      ILE  26  -6.617  35.129 -19.461
   76   HD12  ILE  26          HD12      ILE  26  -6.866  33.405 -19.733
   77   HD13  ILE  26          HD13      ILE  26  -6.661  34.019 -18.092
   78    H    ARG  27           H        ARG  27  -5.222  35.360 -14.596
   79    HA   ARG  27           HA       ARG  27  -3.135  33.851 -13.240
   80    HB2  ARG  27           HB1      ARG  27  -3.031  36.696 -13.529
   81    HB3  ARG  27           HB2      ARG  27  -3.336  36.307 -11.829
   82    HG2  ARG  27           HG1      ARG  27  -1.361  34.946 -11.706
   83    HG3  ARG  27           HG2      ARG  27  -1.094  35.123 -13.449
   84    HD2  ARG  27           HD1      ARG  27  -0.780  37.547 -13.160
   85    HD3  ARG  27           HD2      ARG  27  -1.033  37.355 -11.421
   86    HE   ARG  27           HE       ARG  27   1.068  35.677 -12.332
   87   HH11  ARG  27          HH11      ARG  27   0.302  38.981 -11.548
   88   HH12  ARG  27          HH12      ARG  27   1.933  39.398 -11.136
   89   HH21  ARG  27          HH21      ARG  27   3.219  36.214 -11.793
   90   HH22  ARG  27          HH22      ARG  27   3.591  37.824 -11.276
   91    H    SER  28           H        SER  28  -3.540  33.737 -10.866
   92    HA   SER  28           HA       SER  28  -6.395  34.063 -10.224
   93    HB2  SER  28           HB1      SER  28  -4.998  31.764  -8.977
   94    HB3  SER  28           HB2      SER  28  -6.653  31.890  -9.595
   95    HG   SER  28           HG       SER  28  -6.010  31.082 -11.421
   96    H    SER  29           H        SER  29  -6.642  33.549  -7.718
   97    HA   SER  29           HA       SER  29  -4.423  34.689  -6.199
   98    HB2  SER  29           HB1      SER  29  -6.121  36.492  -7.015
   99    HB3  SER  29           HB2      SER  29  -7.179  35.808  -5.769
  100    HG   SER  29           HG       SER  29  -5.568  37.634  -5.268
  101    H    ALA  30           H        ALA  30  -7.797  33.570  -5.957
  102    HA   ALA  30           HA       ALA  30  -8.846  32.190  -4.481
  103    HB1  ALA  30           HB1      ALA  30  -6.052  31.080  -4.313
  104    HB2  ALA  30           HB2      ALA  30  -7.444  30.336  -3.526
  105    HB3  ALA  30           HB3      ALA  30  -7.400  30.484  -5.282
  106    H    ASP  31           H        ASP  31  -8.563  34.571  -3.392
  107    HA   ASP  31           HA       ASP  31  -7.522  34.099  -0.677
  108    HB2  ASP  31           HB1      ASP  31  -6.972  36.193  -2.456
  109    HB3  ASP  31           HB2      ASP  31  -8.080  36.882  -1.262
  110    HD2  ASP  31           HD       ASP  31  -4.450  35.850  -0.082
  111    H    LEU  32           H        LEU  32 -10.238  35.194  -2.591
  112    HA   LEU  32           HA       LEU  32 -11.823  36.020  -0.350
  113    HB2  LEU  32           HB1      LEU  32 -11.947  36.286  -3.135
  114    HB3  LEU  32           HB2      LEU  32 -13.364  35.322  -2.687
  115    HG   LEU  32           HG       LEU  32 -14.011  37.620  -2.775
  116   HD11  LEU  32          HD11      LEU  32 -14.867  37.955  -0.544
  117   HD12  LEU  32          HD12      LEU  32 -13.678  36.832   0.115
  118   HD13  LEU  32          HD13      LEU  32 -14.949  36.242  -0.957
  119   HD21  LEU  32          HD21      LEU  32 -12.761  39.355  -2.113
  120   HD22  LEU  32          HD22      LEU  32 -11.437  38.190  -2.066
  121   HD23  LEU  32          HD23      LEU  32 -12.320  38.581  -0.591
  122    H    HIS  33           H        HIS  33 -11.948  33.232  -2.564
  123    HA   HIS  33           HA       HIS  33 -13.282  31.715  -0.424
  124    HB2  HIS  33           HB1      HIS  33 -13.922  31.579  -3.383
  125    HB3  HIS  33           HB2      HIS  33 -14.644  30.570  -2.127
  126    HD1  HIS  33           HD1      HIS  33 -15.580  32.400  -0.033
  127    HD2  HIS  33           HD2      HIS  33 -15.763  33.447  -4.049
  128    HE1  HIS  33           HE1      HIS  33 -17.341  34.189  -0.181
  129    HE2  HIS  33           HE2      HIS  33 -17.452  34.830  -2.635
  130    H    GLY  34           H        GLY  34 -12.619  29.623  -0.136
  131    HA2  GLY  34           HA2      GLY  34 -10.758  28.459  -2.074
  132    HA3  GLY  34           HA3      GLY  34 -10.171  28.718  -0.438
  133    HA1  GLY  34           HA1      GLY  34 -11.628  28.374  -1.948
  134    H    ALA  35           H        ALA  35 -13.235  27.493  -1.788
  135    HA   ALA  35           HA       ALA  35 -12.749  24.924  -0.481
  136    HB1  ALA  35           HB1      ALA  35 -15.332  25.185   0.180
  137    HB2  ALA  35           HB2      ALA  35 -14.009  25.645   1.254
  138    HB3  ALA  35           HB3      ALA  35 -14.831  26.874   0.291
  139    H    ARG  36           H        ARG  36 -13.657  23.197  -1.517
  140    HA   ARG  36           HA       ARG  36 -15.184  23.804  -3.963
  141    HB2  ARG  36           HB1      ARG  36 -14.264  21.576  -4.777
  142    HB3  ARG  36           HB2      ARG  36 -13.110  22.911  -4.649
  143    HG2  ARG  36           HG1      ARG  36 -12.319  22.032  -2.497
  144    HG3  ARG  36           HG2      ARG  36 -13.452  20.681  -2.657
  145    HD2  ARG  36           HD1      ARG  36 -11.754  19.595  -3.645
  146    HD3  ARG  36           HD2      ARG  36 -12.135  20.600  -5.050
  147    HE   ARG  36           HE       ARG  36 -10.202  21.783  -4.697
  148   HH11  ARG  36          HH11      ARG  36 -10.917  19.872  -1.878
  149   HH12  ARG  36          HH12      ARG  36  -9.397  20.194  -1.112
  150   HH21  ARG  36          HH21      ARG  36  -8.196  22.215  -3.700
  151   HH22  ARG  36          HH22      ARG  36  -7.851  21.529  -2.150
  152    H    LYS  37           H        LYS  37 -16.262  21.558  -4.712
  153    HA   LYS  37           HA       LYS  37 -17.712  20.493  -2.379
  154    HB2  LYS  37           HB1      LYS  37 -18.718  21.685  -4.905
  155    HB3  LYS  37           HB2      LYS  37 -19.564  20.243  -4.319
  156    HG2  LYS  37           HG1      LYS  37 -19.097  22.179  -2.198
  157    HG3  LYS  37           HG2      LYS  37 -20.040  22.845  -3.544
  158    HD2  LYS  37           HD1      LYS  37 -21.721  21.946  -2.258
  159    HD3  LYS  37           HD2      LYS  37 -21.361  20.587  -3.337
  160    HE2  LYS  37           HE1      LYS  37 -20.848  19.293  -1.598
  161    HE3  LYS  37           HE2      LYS  37 -19.607  20.450  -1.096
  162    HZ1  LYS  37           HZ1      LYS  37 -20.869  21.117   0.583
  163    HZ2  LYS  37           HZ2      LYS  37 -21.940  19.857   0.232
  164    HZ3  LYS  37           HZ3      LYS  37 -22.200  21.394  -0.424
  165    H    GLY  38           H        GLY  38 -16.634  18.564  -2.225
  166    HA2  GLY  38           HA2      GLY  38 -17.344  16.279  -3.261
  167    HA3  GLY  38           HA3      GLY  38 -16.435  16.896  -4.633
  168    HA1  GLY  38           HA1      GLY  38 -16.965  16.697  -2.584
  169    H    SER  39           H        SER  39 -15.861  14.510  -3.175
  170    HA   SER  39           HA       SER  39 -13.086  15.037  -2.563
  171    HB2  SER  39           HB1      SER  39 -15.079  14.230  -0.463
  172    HB3  SER  39           HB2      SER  39 -13.406  13.649  -0.360
  173    HG   SER  39           HG       SER  39 -14.060  15.788   0.662
  174    H    GLN  40           H        GLN  40 -11.951  13.483  -3.499
  175    HA   GLN  40           HA       GLN  40 -13.211  11.107  -4.483
  176    HB2  GLN  40           HB1      GLN  40 -10.989  12.590  -5.189
  177    HB3  GLN  40           HB2      GLN  40 -10.290  11.109  -4.514
  178    HG2  GLN  40           HG1      GLN  40 -10.515  10.349  -6.614
  179    HG3  GLN  40           HG2      GLN  40 -12.178  10.042  -6.096
  180   HE21  GLN  40          HE21      GLN  40 -10.110  12.399  -7.701
  181   HE22  GLN  40          HE22      GLN  40 -11.350  13.089  -8.685
  182    H    CYS  41           H        CYS  41 -10.477  11.624  -2.246
  183    HA   CYS  41           HA       CYS  41 -11.407   9.456  -0.567
  184    HB2  CYS  41           HB1      CYS  41  -9.463   8.085  -0.725
  185    HB3  CYS  41           HB2      CYS  41 -10.027   8.371  -2.372
  186    H    LEU  42           H        LEU  42 -10.614   9.553   1.518
  187    HA   LEU  42           HA       LEU  42  -9.139  12.004   2.159
  188    HB2  LEU  42           HB1      LEU  42 -11.263  10.457   3.439
  189    HB3  LEU  42           HB2      LEU  42  -9.958  10.912   4.548
  190    HG   LEU  42           HG       LEU  42 -10.530  13.263   3.192
  191   HD11  LEU  42          HD11      LEU  42 -13.136  12.000   4.005
  192   HD12  LEU  42          HD12      LEU  42 -12.576  12.081   2.336
  193   HD13  LEU  42          HD13      LEU  42 -12.881  13.567   3.236
  194   HD21  LEU  42          HD21      LEU  42 -11.872  12.637   5.777
  195   HD22  LEU  42          HD22      LEU  42 -10.979  14.078   5.288
  196   HD23  LEU  42          HD23      LEU  42 -10.111  12.596   5.698
  197    H    SER  43           H        SER  43  -8.948   8.544   2.313
  198    HA   SER  43           HA       SER  43  -6.194   8.760   3.261
  199    HB2  SER  43           HB1      SER  43  -8.384   7.743   4.854
  200    HB3  SER  43           HB2      SER  43  -7.197   6.465   4.544
  201    HG   SER  43           HG       SER  43  -6.067   7.379   6.052
  202    H    ASP  44           H        ASP  44  -4.895   6.908   2.774
  203    HA   ASP  44           HA       ASP  44  -5.292   5.837   0.242
  204    HB2  ASP  44           HB1      ASP  44  -3.490   4.206   0.859
  205    HB3  ASP  44           HB2      ASP  44  -3.084   5.896   1.185
  206    HD2  ASP  44           HD       ASP  44  -3.576   3.467   4.278
  207    H    THR  45           H        THR  45  -6.304   4.660   3.372
  208    HA   THR  45           HA       THR  45  -6.864   2.002   2.772
  209    HB   THR  45           HB       THR  45  -8.762   3.502   4.524
  210    HG1  THR  45           HG1      THR  45  -7.219   3.818   6.068
  211   HG21  THR  45          HG21      THR  45  -7.591   0.798   4.318
  212   HG22  THR  45          HG22      THR  45  -9.199   1.302   4.840
  213   HG23  THR  45          HG23      THR  45  -7.835   1.411   5.952
  214    H    ASP  46           H        ASP  46  -8.514   4.897   1.831
  215    HA   ASP  46           HA       ASP  46 -11.033   3.745   1.218
  216    HB2  ASP  46           HB1      ASP  46 -10.135   6.285   1.393
  217    HB3  ASP  46           HB2      ASP  46 -10.120   6.080  -0.363
  218    HD2  ASP  46           HD       ASP  46 -13.502   6.492  -0.523
  219    H    CYS  47           H        CYS  47  -7.999   3.942  -0.468
  220    HA   CYS  47           HA       CYS  47  -8.941   3.436  -3.083
  221    HB2  CYS  47           HB1      CYS  47  -6.270   2.963  -1.753
  222    HB3  CYS  47           HB2      CYS  47  -6.557   2.632  -3.463
  223    H    ASN  48           H        ASN  48  -8.326   1.388  -0.345
  224    HA   ASN  48           HA       ASN  48  -8.686  -0.825   0.035
  225    HB2  ASN  48           HB1      ASN  48 -10.723  -0.007  -1.690
  226    HB3  ASN  48           HB2      ASN  48 -10.097  -1.490  -2.419
  227   HD21  ASN  48          HD21      ASN  48 -11.386  -3.098  -1.896
  228   HD22  ASN  48          HD22      ASN  48 -12.004  -3.433  -0.317
  229    H    THR  49           H        THR  49  -6.432   0.150  -1.669
  230    HA   THR  49           HA       THR  49  -5.569  -2.473  -2.584
  231    HB   THR  49           HB       THR  49  -4.666  -0.721  -4.606
  232    HG1  THR  49           HG1      THR  49  -6.290   0.583  -4.924
  233   HG21  THR  49          HG21      THR  49  -6.210  -2.199  -6.016
  234   HG22  THR  49          HG22      THR  49  -6.618  -3.007  -4.502
  235   HG23  THR  49          HG23      THR  49  -4.952  -3.006  -5.081
  236    H    ARG  50           H        ARG  50  -3.204  -2.190  -3.511
  237    HA   ARG  50           HA       ARG  50  -1.686  -1.009  -1.372
  238    HB2  ARG  50           HB1      ARG  50   0.281  -1.911  -2.623
  239    HB3  ARG  50           HB2      ARG  50  -0.942  -3.125  -2.218
  240    HG2  ARG  50           HG1      ARG  50  -1.653  -2.144  -4.752
  241    HG3  ARG  50           HG2      ARG  50   0.102  -2.389  -4.782
  242    HD2  ARG  50           HD1      ARG  50  -0.101  -4.679  -4.179
  243    HD3  ARG  50           HD2      ARG  50  -1.805  -4.474  -3.753
  244    HE   ARG  50           HE       ARG  50  -2.365  -4.693  -5.968
  245   HH11  ARG  50          HH11      ARG  50   1.069  -4.190  -5.680
  246   HH12  ARG  50          HH12      ARG  50   1.391  -4.540  -7.345
  247   HH21  ARG  50          HH21      ARG  50  -1.952  -5.154  -8.163
  248   HH22  ARG  50          HH22      ARG  50  -0.328  -5.087  -8.758
  249    H    LYS  51           H        LYS  51  -2.712   1.160  -2.118
  250    HA   LYS  51           HA       LYS  51  -0.637   2.573  -3.599
  251    HB2  LYS  51           HB1      LYS  51  -3.552   2.991  -4.278
  252    HB3  LYS  51           HB2      LYS  51  -2.137   3.668  -5.102
  253    HG2  LYS  51           HG1      LYS  51  -1.504   1.463  -5.906
  254    HG3  LYS  51           HG2      LYS  51  -2.875   0.747  -5.039
  255    HD2  LYS  51           HD1      LYS  51  -4.441   1.607  -6.499
  256    HD3  LYS  51           HD2      LYS  51  -3.392   2.950  -6.985
  257    HE2  LYS  51           HE1      LYS  51  -2.890   1.782  -8.822
  258    HE3  LYS  51           HE2      LYS  51  -2.004   0.671  -7.766
  259    HZ1  LYS  51           HZ1      LYS  51  -3.410  -0.849  -8.560
  260    HZ2  LYS  51           HZ2      LYS  51  -4.519   0.299  -9.119
  261    HZ3  LYS  51           HZ3      LYS  51  -4.546  -0.183  -7.498
  262    H    PHE  52           H        PHE  52  -0.801   4.932  -3.347
  263    HA   PHE  52           HA       PHE  52  -1.939   5.596  -0.723
  264    HB2  PHE  52           HB1      PHE  52  -0.350   7.529  -0.779
  265    HB3  PHE  52           HB2      PHE  52   0.435   5.949  -0.801
  266    HD1  PHE  52           HD1      PHE  52   1.883   5.321  -2.530
  267    HD2  PHE  52           HD2      PHE  52  -0.570   8.772  -2.973
  268    HE1  PHE  52           HE1      PHE  52   3.118   5.934  -4.567
  269    HE2  PHE  52           HE2      PHE  52   0.662   9.390  -5.011
  270    HZ   PHE  52           HZ       PHE  52   2.507   7.970  -5.812
  271    H    CYS  53           H        CYS  53  -2.849   7.749  -0.426
  272    HA   CYS  53           HA       CYS  53  -4.455   8.515  -2.741
  273    HB2  CYS  53           HB1      CYS  53  -4.739   8.686   0.194
  274    HB3  CYS  53           HB2      CYS  53  -5.367  10.072  -0.699
  275    H    LEU  54           H        LEU  54  -3.273   9.838  -4.023
  276    HA   LEU  54           HA       LEU  54  -1.602  11.915  -2.925
  277    HB2  LEU  54           HB1      LEU  54  -1.378  10.506  -5.153
  278    HB3  LEU  54           HB2      LEU  54  -2.356  11.833  -5.803
  279    HG   LEU  54           HG       LEU  54   0.029  12.173  -6.215
  280   HD11  LEU  54          HD11      LEU  54  -1.118  14.115  -4.213
  281   HD12  LEU  54          HD12      LEU  54  -1.426  14.114  -5.949
  282   HD13  LEU  54          HD13      LEU  54   0.196  14.444  -5.342
  283   HD21  LEU  54          HD21      LEU  54   0.474  11.033  -3.821
  284   HD22  LEU  54          HD22      LEU  54   0.618  12.735  -3.378
  285   HD23  LEU  54          HD23      LEU  54   1.646  12.062  -4.644
  286    H    GLN  55           H        GLN  55  -2.522  13.670  -2.088
  287    HA   GLN  55           HA       GLN  55  -4.850  14.827  -3.471
  288    HB2  GLN  55           HB1      GLN  55  -5.292  15.976  -1.269
  289    HB3  GLN  55           HB2      GLN  55  -5.497  14.217  -1.266
  290    HG2  GLN  55           HG1      GLN  55  -2.794  14.859  -0.562
  291    HG3  GLN  55           HG2      GLN  55  -3.915  15.778   0.451
  292   HE21  GLN  55          HE21      GLN  55  -3.266  14.565   2.259
  293   HE22  GLN  55          HE22      GLN  55  -3.834  12.955   2.513
  294    HA   PRO  56           HA       PRO  56  -1.488  17.830  -4.281
  295    HB2  PRO  56           HB1      PRO  56  -2.512  18.650  -6.687
  296    HB3  PRO  56           HB2      PRO  56  -1.503  17.216  -6.496
  297    HG2  PRO  56           HG1      PRO  56  -4.492  17.433  -6.630
  298    HG3  PRO  56           HG2      PRO  56  -3.395  16.272  -7.465
  299    HD2  PRO  56           HD1      PRO  56  -4.817  15.611  -5.248
  300    HD3  PRO  56           HD2      PRO  56  -3.209  14.948  -5.587
  301    H    ARG  57           H        ARG  57  -1.498  20.074  -4.148
  302    HA   ARG  57           HA       ARG  57  -3.896  21.226  -3.022
  303    HB2  ARG  57           HB1      ARG  57  -2.529  23.152  -2.513
  304    HB3  ARG  57           HB2      ARG  57  -1.659  21.678  -2.061
  305    HG2  ARG  57           HG1      ARG  57  -0.313  21.815  -4.090
  306    HG3  ARG  57           HG2      ARG  57  -1.199  23.271  -4.575
  307    HD2  ARG  57           HD1      ARG  57   0.480  24.373  -3.558
  308    HD3  ARG  57           HD2      ARG  57  -0.400  23.966  -2.078
  309    HE   ARG  57           HE       ARG  57   1.335  21.851  -2.726
  310   HH11  ARG  57          HH11      ARG  57   1.407  25.142  -1.591
  311   HH12  ARG  57          HH12      ARG  57   2.889  24.945  -0.716
  312   HH21  ARG  57          HH21      ARG  57   3.288  21.580  -1.578
  313   HH22  ARG  57          HH22      ARG  57   3.959  22.919  -0.710
  314    H    ASP  58           H        ASP  58  -2.083  21.398  -6.003
  315    HA   ASP  58           HA       ASP  58  -3.605  23.658  -6.993
  316    HB2  ASP  58           HB1      ASP  58  -1.081  22.737  -7.518
  317    HB3  ASP  58           HB2      ASP  58  -1.981  22.132  -8.914
  318    HD2  ASP  58           HD       ASP  58  -2.881  25.735  -9.331
  319    H    GLU  59           H        GLU  59  -3.736  20.215  -7.083
  320    HA   GLU  59           HA       GLU  59  -5.931  20.364  -9.044
  321    HB2  GLU  59           HB1      GLU  59  -3.547  18.899  -9.234
  322    HB3  GLU  59           HB2      GLU  59  -4.793  17.715  -8.808
  323    HG2  GLU  59           HG1      GLU  59  -5.656  17.736 -10.851
  324    HG3  GLU  59           HG2      GLU  59  -5.721  19.504 -10.872
  325    HE2  GLU  59           HE       GLU  59  -2.341  17.903 -12.230
  326    H    LYS  60           H        LYS  60  -7.182  18.077  -8.831
  327    HA   LYS  60           HA       LYS  60  -8.282  18.146  -6.146
  328    HB2  LYS  60           HB1      LYS  60  -9.145  17.119  -8.799
  329    HB3  LYS  60           HB2      LYS  60  -9.778  16.287  -7.370
  330    HG2  LYS  60           HG1      LYS  60 -11.001  18.094  -6.665
  331    HG3  LYS  60           HG2      LYS  60  -9.934  19.256  -7.476
  332    HD2  LYS  60           HD1      LYS  60 -11.481  19.376  -9.085
  333    HD3  LYS  60           HD2      LYS  60 -10.958  17.750  -9.559
  334    HE2  LYS  60           HE1      LYS  60 -13.197  17.353  -9.285
  335    HE3  LYS  60           HE2      LYS  60 -12.625  17.029  -7.641
  336    HZ1  LYS  60           HZ1      LYS  60 -14.615  18.706  -8.219
  337    HZ2  LYS  60           HZ2      LYS  60 -13.318  19.790  -8.184
  338    HZ3  LYS  60           HZ3      LYS  60 -13.658  18.833  -6.831
  339    HA   PRO  61           HA       PRO  61  -6.477  14.465  -4.583
  340    HB2  PRO  61           HB1      PRO  61  -8.558  13.313  -3.224
  341    HB3  PRO  61           HB2      PRO  61  -7.726  14.770  -2.680
  342    HG2  PRO  61           HG1      PRO  61 -10.292  14.505  -4.210
  343    HG3  PRO  61           HG2      PRO  61  -9.913  15.552  -2.792
  344    HD2  PRO  61           HD1      PRO  61  -9.977  16.495  -5.337
  345    HD3  PRO  61           HD2      PRO  61  -8.861  17.122  -4.112
  346    H    PHE  62           H        PHE  62  -6.008  12.475  -5.318
  347    HA   PHE  62           HA       PHE  62  -8.036  10.776  -6.482
  348    HB2  PHE  62           HB1      PHE  62  -7.102  10.584  -8.663
  349    HB3  PHE  62           HB2      PHE  62  -7.280  12.309  -8.343
  350    HD1  PHE  62           HD1      PHE  62  -5.122   9.927  -9.633
  351    HD2  PHE  62           HD2      PHE  62  -5.131  13.399  -7.168
  352    HE1  PHE  62           HE1      PHE  62  -2.740  10.287 -10.135
  353    HE2  PHE  62           HE2      PHE  62  -2.751  13.764  -7.668
  354    HZ   PHE  62           HZ       PHE  62  -1.551  12.209  -9.153
  355    H    CYS  63           H        CYS  63  -7.343   8.607  -6.771
  356    HA   CYS  63           HA       CYS  63  -5.238   7.849  -4.952
  357    HB2  CYS  63           HB1      CYS  63  -7.449   6.654  -5.157
  358    HB3  CYS  63           HB2      CYS  63  -6.902   6.053  -6.723
  359    H    ALA  64           H        ALA  64  -3.183   7.715  -5.531
  360    HA   ALA  64           HA       ALA  64  -2.544   7.068  -8.334
  361    HB1  ALA  64           HB1      ALA  64  -1.776   9.272  -7.724
  362    HB2  ALA  64           HB2      ALA  64  -0.940   8.625  -6.311
  363    HB3  ALA  64           HB3      ALA  64  -0.387   8.205  -7.931
  364    H    THR  65           H        THR  65  -1.195   5.400  -8.797
  365    HA   THR  65           HA       THR  65  -0.882   3.323  -6.927
  366    HB   THR  65           HB       THR  65  -0.951   2.960  -9.376
  367    HG1  THR  65           HG1      THR  65   0.426   1.244  -9.269
  368   HG21  THR  65          HG21      THR  65   0.834   4.951  -9.604
  369   HG22  THR  65          HG22      THR  65   0.628   3.702 -10.832
  370   HG23  THR  65          HG23      THR  65   1.932   3.571  -9.652
  371    H    CYS  66           H        CYS  66   1.343   2.276  -6.555
  372    HA   CYS  66           HA       CYS  66   2.846   3.898  -4.866
  373    HB2  CYS  66           HB1      CYS  66   2.904   1.181  -5.787
  374    HB3  CYS  66           HB2      CYS  66   4.545   1.831  -5.813
  375    H    ARG  67           H        ARG  67   5.338   4.104  -5.161
  376    HA   ARG  67           HA       ARG  67   5.779   5.435  -7.747
  377    HB2  ARG  67           HB1      ARG  67   7.364   5.853  -5.210
  378    HB3  ARG  67           HB2      ARG  67   7.339   6.872  -6.657
  379    HG2  ARG  67           HG1      ARG  67   4.686   6.814  -5.840
  380    HG3  ARG  67           HG2      ARG  67   5.616   6.921  -4.336
  381    HD2  ARG  67           HD1      ARG  67   5.738   9.124  -4.720
  382    HD3  ARG  67           HD2      ARG  67   6.900   8.712  -5.988
  383    HE   ARG  67           HE       ARG  67   4.336   8.497  -7.073
  384   HH11  ARG  67          HH11      ARG  67   6.472  10.938  -5.808
  385   HH12  ARG  67          HH12      ARG  67   5.821  12.204  -6.795
  386   HH21  ARG  67          HH21      ARG  67   3.470  10.156  -8.377
  387   HH22  ARG  67          HH22      ARG  67   4.114  11.759  -8.255
  388    H    GLY  68           H        GLY  68   7.968   5.348  -8.643
  389    HA2  GLY  68           HA2      GLY  68   9.117   2.673  -8.245
  390    HA3  GLY  68           HA3      GLY  68   9.314   3.670  -9.679
  391    HA1  GLY  68           HA1      GLY  68   9.141   3.272  -7.598
  392    H    LEU  69           H        LEU  69  11.592   2.807  -9.105
  393    HA   LEU  69           HA       LEU  69  12.993   4.050  -6.965
  394    HB2  LEU  69           HB1      LEU  69  13.963   2.718  -9.498
  395    HB3  LEU  69           HB2      LEU  69  15.024   3.268  -8.188
  396    HG   LEU  69           HG       LEU  69  12.958   1.077  -8.036
  397   HD11  LEU  69          HD11      LEU  69  14.614  -0.367  -8.398
  398   HD12  LEU  69          HD12      LEU  69  15.701   0.478  -7.297
  399   HD13  LEU  69          HD13      LEU  69  15.551   1.012  -8.971
  400   HD21  LEU  69          HD21      LEU  69  14.693   2.308  -5.904
  401   HD22  LEU  69          HD22      LEU  69  13.903   0.739  -5.739
  402   HD23  LEU  69          HD23      LEU  69  12.933   2.201  -5.936
  403    H    ARG  70           H        ARG  70  12.215   4.982 -10.211
  404    HA   ARG  70           HA       ARG  70  14.125   7.189 -10.170
  405    HB2  ARG  70           HB1      ARG  70  12.190   6.234 -12.294
  406    HB3  ARG  70           HB2      ARG  70  13.286   7.612 -12.482
  407    HG2  ARG  70           HG1      ARG  70  14.685   5.213 -11.621
  408    HG3  ARG  70           HG2      ARG  70  13.823   4.993 -13.153
  409    HD2  ARG  70           HD1      ARG  70  14.909   7.021 -14.048
  410    HD3  ARG  70           HD2      ARG  70  15.793   7.189 -12.525
  411    HE   ARG  70           HE       ARG  70  16.441   4.689 -13.331
  412   HH11  ARG  70          HH11      ARG  70  16.531   7.806 -14.881
  413   HH12  ARG  70          HH12      ARG  70  17.882   7.409 -15.891
  414   HH21  ARG  70          HH21      ARG  70  18.219   4.156 -14.656
  415   HH22  ARG  70          HH22      ARG  70  18.840   5.333 -15.764
  416    H    ARG  71           H        ARG  71  11.432   6.806  -8.618
  417    HA   ARG  71           HA       ARG  71  10.210   9.368  -9.385
  418    HB2  ARG  71           HB1      ARG  71   9.169   6.839  -8.249
  419    HB3  ARG  71           HB2      ARG  71   8.458   8.329  -7.609
  420    HG2  ARG  71           HG1      ARG  71   8.684   8.056 -10.565
  421    HG3  ARG  71           HG2      ARG  71   7.456   7.099  -9.719
  422    HD2  ARG  71           HD1      ARG  71   7.071   9.518  -8.554
  423    HD3  ARG  71           HD2      ARG  71   7.613  10.007 -10.165
  424    HE   ARG  71           HE       ARG  71   5.094   8.862  -9.490
  425   HH11  ARG  71          HH11      ARG  71   7.490   9.063 -12.007
  426   HH12  ARG  71          HH12      ARG  71   6.361   8.764 -13.286
  427   HH21  ARG  71          HH21      ARG  71   3.597   8.467 -11.165
  428   HH22  ARG  71          HH22      ARG  71   4.146   8.426 -12.806
  429    H    ARG  72           H        ARG  72   9.738  10.929  -7.803
  430    HA   ARG  72           HA       ARG  72  11.648  11.019  -5.648
  431    HB2  ARG  72           HB1      ARG  72   9.452  12.961  -6.408
  432    HB3  ARG  72           HB2      ARG  72  10.748  13.271  -5.243
  433    HG2  ARG  72           HG1      ARG  72  11.828  12.416  -7.785
  434    HG3  ARG  72           HG2      ARG  72  10.774  13.828  -7.965
  435    HD2  ARG  72           HD1      ARG  72  13.134  13.572  -6.087
  436    HD3  ARG  72           HD2      ARG  72  13.058  14.537  -7.567
  437    HE   ARG  72           HE       ARG  72  11.009  15.257  -5.715
  438   HH11  ARG  72          HH11      ARG  72  14.381  15.669  -6.475
  439   HH12  ARG  72          HH12      ARG  72  14.506  17.206  -5.684
  440   HH21  ARG  72          HH21      ARG  72  11.161  17.280  -4.670
  441   HH22  ARG  72          HH22      ARG  72  12.674  18.121  -4.657
  442    H    CYS  73           H        CYS  73  11.050  11.512  -3.424
  443    HA   CYS  73           HA       CYS  73   8.365  10.811  -2.578
  444    HB2  CYS  73           HB1      CYS  73   8.981   8.979  -1.173
  445    HB3  CYS  73           HB2      CYS  73   9.604   8.637  -2.788
  446    H    GLN  74           H        GLN  74   7.877  11.480  -0.472
  447    HA   GLN  74           HA       GLN  74   9.891  13.266   0.721
  448    HB2  GLN  74           HB1      GLN  74   6.871  13.388   0.889
  449    HB3  GLN  74           HB2      GLN  74   7.987  14.507   1.687
  450    HG2  GLN  74           HG1      GLN  74   8.681  15.460  -0.340
  451    HG3  GLN  74           HG2      GLN  74   7.995  14.131  -1.285
  452   HE21  GLN  74          HE21      GLN  74   7.575  17.250  -0.587
  453   HE22  GLN  74          HE22      GLN  74   5.861  17.388  -0.762
  454    H    ARG  75           H        ARG  75   7.657  10.658   1.310
  455    HA   ARG  75           HA       ARG  75   8.681  10.469   4.066
  456    HB2  ARG  75           HB1      ARG  75   5.937   9.614   3.118
  457    HB3  ARG  75           HB2      ARG  75   6.545   9.576   4.780
  458    HG2  ARG  75           HG1      ARG  75   6.540  11.939   4.951
  459    HG3  ARG  75           HG2      ARG  75   6.281  12.121   3.208
  460    HD2  ARG  75           HD1      ARG  75   4.049  11.388   3.335
  461    HD3  ARG  75           HD2      ARG  75   4.295  10.690   4.943
  462    HE   ARG  75           HE       ARG  75   4.667  13.544   4.835
  463   HH11  ARG  75          HH11      ARG  75   2.387  10.950   5.268
  464   HH12  ARG  75          HH12      ARG  75   1.254  11.918   6.152
  465   HH21  ARG  75          HH21      ARG  75   3.184  14.830   5.997
  466   HH22  ARG  75          HH22      ARG  75   1.708  14.125   6.565
  467    H    ASP  76           H        ASP  76   9.122   8.404   4.864
  468    HA   ASP  76           HA       ASP  76  10.059   6.529   2.967
  469    HB2  ASP  76           HB1      ASP  76   9.520   5.888   5.866
  470    HB3  ASP  76           HB2      ASP  76  10.778   5.235   4.809
  471    HD2  ASP  76           HD       ASP  76  12.334   8.566   5.079
  472    H    ALA  77           H        ALA  77   7.036   6.918   4.618
  473    HA   ALA  77           HA       ALA  77   6.117   4.234   4.090
  474    HB1  ALA  77           HB1      ALA  77   4.353   4.721   5.419
  475    HB2  ALA  77           HB2      ALA  77   5.417   6.021   5.956
  476    HB3  ALA  77           HB3      ALA  77   4.163   6.346   4.761
  477    H    MET  78           H        MET  78   6.020   7.325   2.516
  478    HA   MET  78           HA       MET  78   3.809   6.949   0.832
  479    HB2  MET  78           HB1      MET  78   6.235   8.674   0.817
  480    HB3  MET  78           HB2      MET  78   5.355   8.501  -0.708
  481    HG2  MET  78           HG1      MET  78   3.267   9.177   0.518
  482    HG3  MET  78           HG2      MET  78   4.297   9.554   1.901
  483    HE1  MET  78           HE1      MET  78   3.880   9.862  -1.752
  484    HE2  MET  78           HE2      MET  78   3.827  11.597  -2.066
  485    HE3  MET  78           HE3      MET  78   5.372  10.743  -2.086
  486    H    CYS  79           H        CYS  79   7.145   5.885   0.578
  487    HA   CYS  79           HA       CYS  79   6.747   4.849  -2.105
  488    HB2  CYS  79           HB1      CYS  79   9.014   5.443  -0.372
  489    HB3  CYS  79           HB2      CYS  79   9.176   3.871  -1.156
  490    H    CYS  80           H        CYS  80   6.789   2.670  -2.675
  491    HA   CYS  80           HA       CYS  80   5.422   0.894  -1.034
  492    HB2  CYS  80           HB1      CYS  80   6.841   0.771  -3.602
  493    HB3  CYS  80           HB2      CYS  80   6.817  -0.766  -2.732
  494    HA   PRO  81           HA       PRO  81   8.329  -0.933   1.695
  495    HB2  PRO  81           HB1      PRO  81   7.566  -3.563   1.701
  496    HB3  PRO  81           HB2      PRO  81   6.628  -2.277   2.457
  497    HG2  PRO  81           HG1      PRO  81   6.293  -3.541  -0.241
  498    HG3  PRO  81           HG2      PRO  81   5.042  -3.149   0.997
  499    HD2  PRO  81           HD1      PRO  81   5.472  -1.601  -1.192
  500    HD3  PRO  81           HD2      PRO  81   4.978  -0.932   0.374
  501    H    GLY  82           H        GLY  82  10.319  -1.907   1.739
  502    HA2  GLY  82           HA2      GLY  82  11.864  -3.590   0.925
  503    HA3  GLY  82           HA3      GLY  82  11.131  -3.414  -0.663
  504    HA1  GLY  82           HA1      GLY  82  11.823  -2.766   1.239
  505    H    THR  83           H        THR  83  11.112  -0.411  -0.189
  506    HA   THR  83           HA       THR  83  13.963   0.038  -0.791
  507    HB   THR  83           HB       THR  83  12.820   2.169  -1.968
  508    HG1  THR  83           HG1      THR  83  10.689   1.487  -1.557
  509   HG21  THR  83          HG21      THR  83  13.935   1.238  -3.656
  510   HG22  THR  83          HG22      THR  83  12.621   0.083  -3.882
  511   HG23  THR  83          HG23      THR  83  13.961  -0.304  -2.802
  512    H    LEU  84           H        LEU  84  14.547   2.445  -0.513
  513    HA   LEU  84           HA       LEU  84  13.252   3.523   1.899
  514    HB2  LEU  84           HB1      LEU  84  16.217   3.348   1.338
  515    HB3  LEU  84           HB2      LEU  84  15.486   4.224   2.695
  516    HG   LEU  84           HG       LEU  84  15.172   1.255   2.296
  517   HD11  LEU  84          HD11      LEU  84  17.229   2.762   3.899
  518   HD12  LEU  84          HD12      LEU  84  17.522   1.670   2.546
  519   HD13  LEU  84          HD13      LEU  84  16.893   1.039   4.068
  520   HD21  LEU  84          HD21      LEU  84  13.692   2.882   3.824
  521   HD22  LEU  84          HD22      LEU  84  15.021   2.566   4.941
  522   HD23  LEU  84          HD23      LEU  84  14.085   1.224   4.281
  523    H    CYS  85           H        CYS  85  13.492   5.816   2.203
  524    HA   CYS  85           HA       CYS  85  13.478   7.240  -0.327
  525    HB2  CYS  85           HB1      CYS  85  12.509   7.739   2.428
  526    HB3  CYS  85           HB2      CYS  85  13.030   9.165   1.530
  527    H    VAL  86           H        VAL  86  15.457   7.693  -1.092
  528    HA   VAL  86           HA       VAL  86  17.385   8.954   0.749
  529    HB   VAL  86           HB       VAL  86  17.972   7.388  -1.768
  530   HG11  VAL  86          HG11      VAL  86  20.347   7.594  -0.934
  531   HG12  VAL  86          HG12      VAL  86  19.625   9.074  -1.566
  532   HG13  VAL  86          HG13      VAL  86  19.760   8.831   0.176
  533   HG21  VAL  86          HG21      VAL  86  19.031   5.780  -0.208
  534   HG22  VAL  86          HG22      VAL  86  18.382   6.711   1.143
  535   HG23  VAL  86          HG23      VAL  86  17.286   5.915   0.013
  536    H    ASN  87           H        ASN  87  17.954  10.990   0.340
  537    HA   ASN  87           HA       ASN  87  18.019  13.047  -0.634
  538    HB2  ASN  87           HB1      ASN  87  19.435  11.336  -2.219
  539    HB3  ASN  87           HB2      ASN  87  18.275  11.994  -3.379
  540   HD21  ASN  87          HD21      ASN  87  21.076  12.411  -3.417
  541   HD22  ASN  87          HD22      ASN  87  21.356  14.104  -3.218
  542    H    ASP  88           H        ASP  88  15.439  12.017  -0.266
  543    HA   ASP  88           HA       ASP  88  13.275  12.461  -0.809
  544    HB2  ASP  88           HB1      ASP  88  14.740  14.706  -1.617
  545    HB3  ASP  88           HB2      ASP  88  13.697  14.323  -2.993
  546    HD2  ASP  88           HD       ASP  88  12.021  15.646   0.331
  547    H    VAL  89           H        VAL  89  14.880  10.452  -2.291
  548    HA   VAL  89           HA       VAL  89  13.002  10.085  -4.508
  549    HB   VAL  89           HB       VAL  89  15.994   9.776  -4.795
  550   HG11  VAL  89          HG11      VAL  89  13.732   9.194  -6.698
  551   HG12  VAL  89          HG12      VAL  89  15.426   9.293  -7.179
  552   HG13  VAL  89          HG13      VAL  89  14.902   8.051  -6.041
  553   HG21  VAL  89          HG21      VAL  89  15.907  11.612  -6.324
  554   HG22  VAL  89          HG22      VAL  89  14.147  11.677  -6.231
  555   HG23  VAL  89          HG23      VAL  89  15.121  12.120  -4.829
  556    H    CYS  90           H        CYS  90  12.504   7.962  -4.970
  557    HA   CYS  90           HA       CYS  90  12.881   6.079  -2.881
  558    HB2  CYS  90           HB1      CYS  90  11.096   6.385  -4.958
  559    HB3  CYS  90           HB2      CYS  90  12.030   4.975  -5.462
  560    H    THR  91           H        THR  91  14.768   5.126  -2.502
  561    HA   THR  91           HA       THR  91  16.270   4.047  -4.797
  562    HB   THR  91           HB       THR  91  17.502   5.075  -2.236
  563    HG1  THR  91           HG1      THR  91  17.236   6.266  -4.808
  564   HG21  THR  91          HG21      THR  91  19.609   4.898  -3.530
  565   HG22  THR  91          HG22      THR  91  18.706   4.146  -4.845
  566   HG23  THR  91          HG23      THR  91  18.826   3.338  -3.282
  567    H    THR  92           H        THR  92  17.222   2.031  -4.550
  568    HA   THR  92           HA       THR  92  15.913   0.250  -2.759
  569    HB   THR  92           HB       THR  92  18.113  -1.137  -3.723
  570    HG1  THR  92           HG1      THR  92  17.989  -0.469  -6.021
  571   HG21  THR  92          HG21      THR  92  16.239  -1.584  -5.640
  572   HG22  THR  92          HG22      THR  92  15.250  -0.889  -4.356
  573   HG23  THR  92          HG23      THR  92  16.222  -2.326  -4.041
  574    H    MET  93           H        MET  93  16.752  -0.923  -1.026
  575    HA   MET  93           HA       MET  93  18.446   0.444   0.725
  576    HB2  MET  93           HB1      MET  93  16.801  -1.211   1.468
  577    HB3  MET  93           HB2      MET  93  17.740  -2.496   0.693
  578    HG2  MET  93           HG1      MET  93  19.470  -2.365   2.255
  579    HG3  MET  93           HG2      MET  93  18.967  -0.762   2.796
  580    HE1  MET  93           HE1      MET  93  18.400  -2.475   6.059
  581    HE2  MET  93           HE2      MET  93  19.395  -3.513   5.039
  582    HE3  MET  93           HE3      MET  93  19.594  -1.761   4.975
  583    H    GLU  94           H        GLU  94  19.105  -2.192  -1.534
  584    HA   GLU  94           HA       GLU  94  21.748  -2.715  -0.728
  585    HB2  GLU  94           HB1      GLU  94  20.398  -3.066  -3.414
  586    HB3  GLU  94           HB2      GLU  94  22.001  -3.704  -3.013
  587    HG2  GLU  94           HG1      GLU  94  19.578  -4.404  -1.380
  588    HG3  GLU  94           HG2      GLU  94  20.005  -5.287  -2.853
  589    HE2  GLU  94           HE       GLU  94  21.835  -7.243  -0.663
  590    H    ASP  95           H        ASP  95  20.374  -0.330  -2.898
  591    HA   ASP  95           HA       ASP  95  22.869   0.516  -4.006
  592    HB2  ASP  95           HB1      ASP  95  20.050   1.223  -4.264
  593    HB3  ASP  95           HB2      ASP  95  21.100   2.645  -4.281
  594    HD2  ASP  95           HD       ASP  95  21.900   2.029  -7.537
  595    H    ALA  96           H        ALA  96  20.979   1.378  -1.205
  596    HA   ALA  96           HA       ALA  96  22.530   3.761  -0.656
  597    HB1  ALA  96           HB1      ALA  96  20.004   2.803   0.112
  598    HB2  ALA  96           HB2      ALA  96  20.967   2.900   1.586
  599    HB3  ALA  96           HB3      ALA  96  20.768   4.326   0.569
  600    H    THR  97           H        THR  97  23.379   3.979   1.674
  601    HA   THR  97           HA       THR  97  24.797   3.326   3.343
  602    HB   THR  97           HB       THR  97  24.465   0.442   2.565
  603    HG1  THR  97           HG1      THR  97  22.489   0.399   3.429
  604   HG21  THR  97          HG21      THR  97  26.054   1.333   4.397
  605   HG22  THR  97          HG22      THR  97  24.994  -0.021   4.790
  606   HG23  THR  97          HG23      THR  97  24.581   1.607   5.327
  607    H    GLU  98           H        GLU  98  25.302   0.814   0.861
  608    HA   GLU  98           HA       GLU  98  28.156   1.228   0.964
  609    HB2  GLU  98           HB1      GLU  98  26.647  -0.959   0.484
  610    HB3  GLU  98           HB2      GLU  98  26.995  -0.455  -1.177
  611    HG2  GLU  98           HG1      GLU  98  29.320  -0.683  -0.888
  612    HG3  GLU  98           HG2      GLU  98  29.160  -0.788   0.872
  613    HE2  GLU  98           HE       GLU  98  27.559  -4.056  -0.449
  614    H    ASN  99           H        ASN  99  29.362   1.345  -1.186
  615    HA   ASN  99           HA       ASN  99  28.041   2.818  -3.291
  616    HB2  ASN  99           HB1      ASN  99  29.860   4.663  -3.095
  617    HB3  ASN  99           HB2      ASN  99  28.448   4.740  -2.035
  618   HD21  ASN  99          HD21      ASN  99  28.659   4.217   0.153
  619   HD22  ASN  99          HD22      ASN  99  30.200   4.204   0.937
  620    H    LEU 100           H        LEU 100  29.328   3.030  -5.188
  621    HA   LEU 100           HA       LEU 100  31.379   0.974  -5.373
  622    HB2  LEU 100           HB1      LEU 100  29.359   1.509  -7.012
  623    HB3  LEU 100           HB2      LEU 100  30.557   2.611  -7.713
  624    HG   LEU 100           HG       LEU 100  32.025   0.367  -7.642
  625   HD11  LEU 100          HD11      LEU 100  30.555  -1.210  -6.833
  626   HD12  LEU 100          HD12      LEU 100  30.346  -1.390  -8.574
  627   HD13  LEU 100          HD13      LEU 100  29.163  -0.482  -7.634
  628   HD21  LEU 100          HD21      LEU 100  31.439   1.899  -9.565
  629   HD22  LEU 100          HD22      LEU 100  30.034   0.869  -9.839
  630   HD23  LEU 100          HD23      LEU 100  31.660   0.197  -9.969
  631    H    TYR 101           H        TYR 101  33.428   1.355  -6.375
  632    HA   TYR 101           HA       TYR 101  34.730   3.679  -5.429
  633    HB2  TYR 101           HB1      TYR 101  35.590   1.496  -7.334
  634    HB3  TYR 101           HB2      TYR 101  36.662   2.806  -6.834
  635    HD1  TYR 101           HD1      TYR 101  36.174  -0.471  -6.259
  636    HD2  TYR 101           HD2      TYR 101  36.314   3.162  -4.048
  637    HE1  TYR 101           HE1      TYR 101  36.802  -1.730  -4.242
  638    HE2  TYR 101           HE2      TYR 101  36.943   1.913  -2.025
  639    HH   TYR 101           HH       TYR 101  37.168  -0.119  -1.111
  640    H    PHE 102           H        PHE 102  35.831   5.305  -6.662
  641    HA   PHE 102           HA       PHE 102  35.212   5.679  -9.440
  642    HB2  PHE 102           HB1      PHE 102  33.936   7.726  -9.235
  643    HB3  PHE 102           HB2      PHE 102  33.109   6.434  -8.361
  644    HD1  PHE 102           HD1      PHE 102  34.396   9.729  -8.141
  645    HD2  PHE 102           HD2      PHE 102  33.520   6.266  -5.828
  646    HE1  PHE 102           HE1      PHE 102  34.358  11.105  -6.102
  647    HE2  PHE 102           HE2      PHE 102  33.480   7.636  -3.785
  648    HZ   PHE 102           HZ       PHE 102  33.898  10.059  -3.921
  649    H    GLN 103           H        GLN 103  35.916   8.054 -10.064
  650    HA   GLN 103           HA       GLN 103  37.680   9.466 -10.328
  651    HB2  GLN 103           HB1      GLN 103  36.764  10.189  -8.076
  652    HB3  GLN 103           HB2      GLN 103  38.059   9.227  -7.345
  653    HG2  GLN 103           HG1      GLN 103  39.738  10.629  -8.126
  654    HG3  GLN 103           HG2      GLN 103  38.695  11.328  -9.371
  655   HE21  GLN 103          HE21      GLN 103  39.369  11.242  -5.936
  656   HE22  GLN 103          HE22      GLN 103  38.631  12.758  -5.559
  657    H    SER 104           H        SER 104  38.570   7.336 -11.281
  658    HA   SER 104           HA       SER 104  40.897   6.376  -9.783
  659    HB2  SER 104           HB1      SER 104  40.861   4.896 -12.091
  660    HB3  SER 104           HB2      SER 104  40.061   4.430 -10.579
  661    HG   SER 104           HG       SER 104  38.965   5.260 -12.959
  662    H    LEU 105           H        LEU 105  42.851   7.142 -10.210
  663    HA   LEU 105           HA       LEU 105  43.260   8.825 -12.545
  664    HB2  LEU 105           HB1      LEU 105  44.265   8.747  -9.899
  665    HB3  LEU 105           HB2      LEU 105  45.632   8.465 -10.990
  666    HG   LEU 105           HG       LEU 105  43.976  10.706 -11.835
  667   HD11  LEU 105          HD11      LEU 105  45.453  11.025  -9.233
  668   HD12  LEU 105          HD12      LEU 105  43.707  10.798  -9.337
  669   HD13  LEU 105          HD13      LEU 105  44.456  12.215 -10.071
  670   HD21  LEU 105          HD21      LEU 105  46.065  10.486 -12.848
  671   HD22  LEU 105          HD22      LEU 105  46.879  10.158 -11.317
  672   HD23  LEU 105          HD23      LEU 105  46.300  11.785 -11.678
  673    H    GLU 106           H        GLU 106  45.752   8.583 -13.318
  674    HA   GLU 106           HA       GLU 106  46.538   5.825 -13.666
  675    HB2  GLU 106           HB1      GLU 106  44.822   7.025 -15.568
  676    HB3  GLU 106           HB2      GLU 106  46.429   6.944 -16.307
  677    HG2  GLU 106           HG1      GLU 106  46.459   4.496 -15.549
  678    HG3  GLU 106           HG2      GLU 106  44.719   4.699 -15.308
  679    HE2  GLU 106           HE       GLU 106  44.978   3.546 -18.661
  680    H    HIS 107           H        HIS 107  48.491   5.725 -15.209
  681    HA   HIS 107           HA       HIS 107  50.183   8.078 -14.678
  682    HB2  HIS 107           HB1      HIS 107  50.560   5.388 -13.978
  683    HB3  HIS 107           HB2      HIS 107  51.665   5.675 -15.324
  684    HD1  HIS 107           HD1      HIS 107  50.797   7.408 -12.044
  685    HD2  HIS 107           HD2      HIS 107  54.040   6.690 -14.540
  686    HE1  HIS 107           HE1      HIS 107  52.785   8.398 -10.865
  687    HE2  HIS 107           HE2      HIS 107  54.768   7.960 -12.390
  688    H    HIS 108           H        HIS 108  51.876   8.528 -16.260
  689    HA   HIS 108           HA       HIS 108  51.406   7.473 -18.944
  690    HB2  HIS 108           HB1      HIS 108  50.889  10.260 -18.047
  691    HB3  HIS 108           HB2      HIS 108  51.701  10.066 -19.603
  692    HD1  HIS 108           HD1      HIS 108  50.379   8.418 -21.348
  693    HD2  HIS 108           HD2      HIS 108  48.179  10.038 -18.218
  694    HE1  HIS 108           HE1      HIS 108  47.969   8.194 -22.033
  695    HE2  HIS 108           HE2      HIS 108  46.624   9.185 -20.120
  696    H    HIS 109           H        HIS 109  53.264  10.038 -17.294
  697    HA   HIS 109           HA       HIS 109  55.477  10.566 -17.318
  698    HB2  HIS 109           HB1      HIS 109  55.295   7.717 -17.040
  699    HB3  HIS 109           HB2      HIS 109  56.711   8.107 -18.023
  700    HD1  HIS 109           HD1      HIS 109  56.259   7.253 -14.787
  701    HD2  HIS 109           HD2      HIS 109  57.871  10.689 -16.475
  702    HE1  HIS 109           HE1      HIS 109  57.721   8.256 -13.004
  703    HE2  HIS 109           HE2      HIS 109  58.707  10.356 -14.035
  704    H    HIS 110           H        HIS 110  57.619  10.076 -18.734
  705    HA   HIS 110           HA       HIS 110  57.128   9.628 -21.519
  706    HB2  HIS 110           HB1      HIS 110  56.574  12.198 -20.612
  707    HB3  HIS 110           HB2      HIS 110  58.203  12.327 -21.283
  708    HD1  HIS 110           HD1      HIS 110  57.743  10.225 -23.614
  709    HD2  HIS 110           HD2      HIS 110  55.313  13.476 -22.727
  710    HE1  HIS 110           HE1      HIS 110  56.524  10.754 -25.748
  711    HE2  HIS 110           HE2      HIS 110  55.036  12.742 -25.207
  712    H    HIS 111           H        HIS 111  58.919   8.801 -19.309
  713    HA   HIS 111           HA       HIS 111  61.103   8.264 -18.963
  714    HB2  HIS 111           HB1      HIS 111  60.668   7.492 -21.391
  715    HB3  HIS 111           HB2      HIS 111  61.620   8.906 -21.856
  716    HD1  HIS 111           HD1      HIS 111  62.153   5.519 -21.600
  717    HD2  HIS 111           HD2      HIS 111  64.172   8.777 -19.998
  718    HE1  HIS 111           HE1      HIS 111  64.466   4.683 -21.072
  719    HE2  HIS 111           HE2      HIS 111  65.700   6.673 -20.093
  720    H    HIS 112           H        HIS 112  61.067  10.378 -17.752
  721    HA   HIS 112           HA       HIS 112  63.368  11.929 -18.565
  722    HB2  HIS 112           HB1      HIS 112  60.621  12.937 -18.803
  723    HB3  HIS 112           HB2      HIS 112  61.687  13.994 -17.871
  724    HD1  HIS 112           HD1      HIS 112  60.874  13.027 -21.306
  725    HD2  HIS 112           HD2      HIS 112  64.019  14.896 -19.338
  726    HE1  HIS 112           HE1      HIS 112  62.215  14.160 -23.106
  727    HE2  HIS 112           HE2      HIS 112  64.136  15.304 -21.905
  Start of MODEL   47
    1    H1   MET  18           H        MET  18 -61.893 -32.030  17.331
    2    HA   MET  18           HA       MET  18 -61.805 -33.176  15.098
    3    HB2  MET  18           HB1      MET  18 -64.509 -33.572  15.852
    4    HB3  MET  18           HB2      MET  18 -64.516 -32.572  14.392
    5    HG2  MET  18           HG1      MET  18 -63.907 -34.266  13.075
    6    HG3  MET  18           HG2      MET  18 -62.664 -34.800  14.209
    7    HE1  MET  18           HE1      MET  18 -62.792 -37.270  14.759
    8    HE2  MET  18           HE2      MET  18 -64.217 -38.208  14.311
    9    HE3  MET  18           HE3      MET  18 -63.411 -37.198  13.108
   10    H    LEU  19           H        LEU  19 -61.732 -31.927  13.172
   11    HA   LEU  19           HA       LEU  19 -61.347 -30.002  12.021
   12    HB2  LEU  19           HB1      LEU  19 -63.864 -29.283  13.520
   13    HB3  LEU  19           HB2      LEU  19 -63.119 -28.214  12.319
   14    HG   LEU  19           HG       LEU  19 -63.974 -31.017  11.645
   15   HD11  LEU  19          HD11      LEU  19 -66.005 -30.125  12.324
   16   HD12  LEU  19          HD12      LEU  19 -65.970 -29.768  10.598
   17   HD13  LEU  19          HD13      LEU  19 -65.594 -28.503  11.767
   18   HD21  LEU  19          HD21      LEU  19 -62.984 -30.501   9.725
   19   HD22  LEU  19          HD22      LEU  19 -62.699 -28.842  10.252
   20   HD23  LEU  19          HD23      LEU  19 -64.226 -29.272   9.480
   21    H    VAL  20           H        VAL  20 -59.385 -29.782  13.346
   22    HA   VAL  20           HA       VAL  20 -59.375 -27.990  15.581
   23    HB   VAL  20           HB       VAL  20 -56.889 -28.087  15.337
   24   HG11  VAL  20          HG11      VAL  20 -57.597 -29.667  16.830
   25   HG12  VAL  20          HG12      VAL  20 -58.622 -30.484  15.649
   26   HG13  VAL  20          HG13      VAL  20 -56.874 -30.712  15.607
   27   HG21  VAL  20          HG21      VAL  20 -57.418 -28.755  12.734
   28   HG22  VAL  20          HG22      VAL  20 -55.860 -28.938  13.539
   29   HG23  VAL  20          HG23      VAL  20 -56.968 -30.307  13.441
   30    H    LEU  21           H        LEU  21 -58.722 -25.869  15.679
   31    HA   LEU  21           HA       LEU  21 -58.853 -24.403  13.166
   32    HB2  LEU  21           HB1      LEU  21 -58.812 -23.468  16.041
   33    HB3  LEU  21           HB2      LEU  21 -58.954 -22.405  14.630
   34    HG   LEU  21           HG       LEU  21 -61.066 -23.826  14.094
   35   HD11  LEU  21          HD11      LEU  21 -60.958 -25.570  15.640
   36   HD12  LEU  21          HD12      LEU  21 -62.161 -24.473  16.318
   37   HD13  LEU  21          HD13      LEU  21 -60.521 -24.492  16.965
   38   HD21  LEU  21          HD21      LEU  21 -60.792 -21.714  16.205
   39   HD22  LEU  21          HD22      LEU  21 -62.369 -22.357  15.745
   40   HD23  LEU  21          HD23      LEU  21 -61.358 -21.554  14.542
   41    H    ASP  22           H        ASP  22 -57.276 -22.930  12.481
   42    HA   ASP  22           HA       ASP  22 -54.697 -22.996  13.870
   43    HB2  ASP  22           HB1      ASP  22 -55.141 -24.573  11.670
   44    HB3  ASP  22           HB2      ASP  22 -54.474 -23.108  10.940
   45    HD2  ASP  22           HD       ASP  22 -51.321 -24.020  11.860
   46    H    PHE  23           H        PHE  23 -53.610 -21.102  13.842
   47    HA   PHE  23           HA       PHE  23 -54.720 -18.940  12.174
   48    HB2  PHE  23           HB1      PHE  23 -54.092 -17.370  13.994
   49    HB3  PHE  23           HB2      PHE  23 -55.315 -18.542  14.486
   50    HD1  PHE  23           HD1      PHE  23 -51.941 -17.350  15.035
   51    HD2  PHE  23           HD2      PHE  23 -54.734 -20.424  15.966
   52    HE1  PHE  23           HE1      PHE  23 -50.549 -18.032  16.946
   53    HE2  PHE  23           HE2      PHE  23 -53.347 -21.109  17.879
   54    HZ   PHE  23           HZ       PHE  23 -51.251 -19.913  18.371
   55    H    ASN  24           H        ASN  24 -53.127 -17.085  11.921
   56    HA   ASN  24           HA       ASN  24 -50.336 -17.638  12.129
   57    HB2  ASN  24           HB1      ASN  24 -49.904 -17.601   9.646
   58    HB3  ASN  24           HB2      ASN  24 -50.671 -19.077  10.247
   59   HD21  ASN  24          HD21      ASN  24 -50.917 -16.454   8.112
   60   HD22  ASN  24          HD22      ASN  24 -52.486 -16.806   7.480
   61    H    ASN  25           H        ASN  25 -49.087 -15.821  11.791
   62    HA   ASN  25           HA       ASN  25 -49.961 -13.518  10.398
   63    HB2  ASN  25           HB1      ASN  25 -51.343 -13.653  12.658
   64    HB3  ASN  25           HB2      ASN  25 -49.863 -12.960  13.331
   65   HD21  ASN  25          HD21      ASN  25 -51.630 -11.285  13.758
   66   HD22  ASN  25          HD22      ASN  25 -51.769 -10.026  12.582
   67    H    ILE  26           H        ILE  26 -48.265 -12.212   9.973
   68    HA   ILE  26           HA       ILE  26 -45.849 -12.494  11.628
   69    HB   ILE  26           HB       ILE  26 -45.792 -12.343   8.615
   70   HG12  ILE  26          HG11      ILE  26 -44.771 -14.793   9.242
   71   HG13  ILE  26          HG12      ILE  26 -46.060 -14.639  10.447
   72   HG21  ILE  26          HG21      ILE  26 -43.857 -11.672  10.399
   73   HG22  ILE  26          HG22      ILE  26 -43.488 -13.372  10.110
   74   HG23  ILE  26          HG23      ILE  26 -43.553 -12.242   8.758
   75   HD11  ILE  26          HD11      ILE  26 -46.788 -13.953   7.674
   76   HD12  ILE  26          HD12      ILE  26 -46.466 -15.653   8.016
   77   HD13  ILE  26          HD13      ILE  26 -47.710 -14.792   8.922
   78    H    ARG  27           H        ARG  27 -47.163 -10.632   8.880
   79    HA   ARG  27           HA       ARG  27 -47.082  -8.414   8.371
   80    HB2  ARG  27           HB1      ARG  27 -47.798  -8.649  11.170
   81    HB3  ARG  27           HB2      ARG  27 -46.940  -7.133  10.854
   82    HG2  ARG  27           HG1      ARG  27 -48.548  -6.644   9.027
   83    HG3  ARG  27           HG2      ARG  27 -49.443  -8.100   9.491
   84    HD2  ARG  27           HD1      ARG  27 -50.608  -6.502  10.668
   85    HD3  ARG  27           HD2      ARG  27 -49.408  -7.000  11.869
   86    HE   ARG  27           HE       ARG  27 -48.433  -4.926  11.721
   87   HH11  ARG  27          HH11      ARG  27 -50.663  -5.356   9.083
   88   HH12  ARG  27          HH12      ARG  27 -50.581  -3.702   8.573
   89   HH21  ARG  27          HH21      ARG  27 -48.315  -2.746  11.058
   90   HH22  ARG  27          HH22      ARG  27 -49.245  -2.219   9.697
   91    H    SER  28           H        SER  28 -45.041  -8.353   7.432
   92    HA   SER  28           HA       SER  28 -42.911  -7.270   9.157
   93    HB2  SER  28           HB1      SER  28 -42.529  -9.627   8.277
   94    HB3  SER  28           HB2      SER  28 -42.436  -8.906   6.662
   95    HG   SER  28           HG       SER  28 -40.393  -9.192   7.905
   96    H    SER  29           H        SER  29 -41.196  -6.109   7.768
   97    HA   SER  29           HA       SER  29 -42.547  -4.514   5.692
   98    HB2  SER  29           HB1      SER  29 -42.399  -3.127   7.654
   99    HB3  SER  29           HB2      SER  29 -40.697  -3.561   7.886
  100    HG   SER  29           HG       SER  29 -41.849  -1.874   5.957
  101    H    ALA  30           H        ALA  30 -39.270  -4.989   7.026
  102    HA   ALA  30           HA       ALA  30 -37.259  -5.368   6.029
  103    HB1  ALA  30           HB1      ALA  30 -39.166  -6.957   4.582
  104    HB2  ALA  30           HB2      ALA  30 -37.881  -6.409   3.506
  105    HB3  ALA  30           HB3      ALA  30 -37.482  -7.306   4.969
  106    H    ASP  31           H        ASP  31 -36.111  -5.052   3.712
  107    HA   ASP  31           HA       ASP  31 -35.301  -3.497   2.263
  108    HB2  ASP  31           HB1      ASP  31 -38.202  -3.572   1.865
  109    HB3  ASP  31           HB2      ASP  31 -37.473  -2.038   1.369
  110    HD2  ASP  31           HD       ASP  31 -36.967  -5.145  -0.916
  111    H    LEU  32           H        LEU  32 -34.155  -2.242   3.726
  112    HA   LEU  32           HA       LEU  32 -34.958   0.470   3.940
  113    HB2  LEU  32           HB1      LEU  32 -36.164  -0.968   5.838
  114    HB3  LEU  32           HB2      LEU  32 -34.609  -0.698   6.644
  115    HG   LEU  32           HG       LEU  32 -36.221   0.955   7.361
  116   HD11  LEU  32          HD11      LEU  32 -34.456   2.517   5.546
  117   HD12  LEU  32          HD12      LEU  32 -33.716   1.481   6.766
  118   HD13  LEU  32          HD13      LEU  32 -34.824   2.763   7.253
  119   HD21  LEU  32          HD21      LEU  32 -37.306   2.471   5.889
  120   HD22  LEU  32          HD22      LEU  32 -37.585   0.850   5.255
  121   HD23  LEU  32          HD23      LEU  32 -36.377   1.895   4.506
  122    H    HIS  33           H        HIS  33 -33.035   1.233   3.310
  123    HA   HIS  33           HA       HIS  33 -30.832   1.227   5.082
  124    HB2  HIS  33           HB1      HIS  33 -30.946  -1.065   3.529
  125    HB3  HIS  33           HB2      HIS  33 -29.828  -0.024   2.640
  126    HD1  HIS  33           HD1      HIS  33 -27.481  -0.372   3.293
  127    HD2  HIS  33           HD2      HIS  33 -30.069  -1.043   6.472
  128    HE1  HIS  33           HE1      HIS  33 -26.015  -1.046   5.221
  129    HE2  HIS  33           HE2      HIS  33 -27.595  -1.457   7.165
  130    H    GLY  34           H        GLY  34 -28.785   2.099   3.816
  131    HA2  GLY  34           HA2      GLY  34 -28.661   3.387   1.489
  132    HA3  GLY  34           HA3      GLY  34 -29.748   4.441   2.380
  133    HA1  GLY  34           HA1      GLY  34 -28.210   2.995   2.138
  134    H    ALA  35           H        ALA  35 -27.034   4.922   1.320
  135    HA   ALA  35           HA       ALA  35 -26.005   6.356   3.547
  136    HB1  ALA  35           HB1      ALA  35 -23.984   4.384   2.669
  137    HB2  ALA  35           HB2      ALA  35 -24.234   5.129   4.248
  138    HB3  ALA  35           HB3      ALA  35 -25.265   3.797   3.729
  139    H    ARG  36           H        ARG  36 -24.054   7.584   3.000
  140    HA   ARG  36           HA       ARG  36 -23.771   7.922   0.086
  141    HB2  ARG  36           HB1      ARG  36 -24.405   9.812   2.178
  142    HB3  ARG  36           HB2      ARG  36 -22.921  10.286   1.339
  143    HG2  ARG  36           HG1      ARG  36 -24.139  11.156  -0.293
  144    HG3  ARG  36           HG2      ARG  36 -24.753   9.534  -0.656
  145    HD2  ARG  36           HD1      ARG  36 -26.768  10.428  -0.184
  146    HD3  ARG  36           HD2      ARG  36 -26.271  10.180   1.495
  147    HE   ARG  36           HE       ARG  36 -25.448  12.712   0.400
  148   HH11  ARG  36          HH11      ARG  36 -27.989  10.968   2.020
  149   HH12  ARG  36          HH12      ARG  36 -28.701  12.387   2.711
  150   HH21  ARG  36          HH21      ARG  36 -26.377  14.589   1.303
  151   HH22  ARG  36          HH22      ARG  36 -27.785  14.447   2.302
  152    H    LYS  37           H        LYS  37 -21.672   8.823  -0.611
  153    HA   LYS  37           HA       LYS  37 -19.511   7.497   0.824
  154    HB2  LYS  37           HB1      LYS  37 -19.939   8.498  -1.948
  155    HB3  LYS  37           HB2      LYS  37 -18.275   8.456  -1.342
  156    HG2  LYS  37           HG1      LYS  37 -18.146   6.296  -1.807
  157    HG3  LYS  37           HG2      LYS  37 -19.484   5.981  -0.688
  158    HD2  LYS  37           HD1      LYS  37 -20.944   6.834  -2.726
  159    HD3  LYS  37           HD2      LYS  37 -19.521   6.313  -3.647
  160    HE2  LYS  37           HE1      LYS  37 -19.677   4.075  -2.743
  161    HE3  LYS  37           HE2      LYS  37 -20.995   4.576  -1.672
  162    HZ1  LYS  37           HZ1      LYS  37 -21.445   5.079  -4.489
  163    HZ2  LYS  37           HZ2      LYS  37 -22.495   4.457  -3.318
  164    HZ3  LYS  37           HZ3      LYS  37 -21.363   3.444  -4.060
  165    H    GLY  38           H        GLY  38 -18.330   8.581   2.250
  166    HA2  GLY  38           HA2      GLY  38 -18.463  11.406   2.539
  167    HA3  GLY  38           HA3      GLY  38 -17.370  10.329   3.396
  168    HA1  GLY  38           HA1      GLY  38 -18.366  11.143   1.703
  169    H    SER  39           H        SER  39 -15.298  10.719   3.056
  170    HA   SER  39           HA       SER  39 -14.387  12.522   1.075
  171    HB2  SER  39           HB1      SER  39 -12.201  12.157   1.938
  172    HB3  SER  39           HB2      SER  39 -13.297  12.017   3.323
  173    HG   SER  39           HG       SER  39 -12.489  10.109   3.599
  174    H    GLN  40           H        GLN  40 -12.136  11.547  -0.038
  175    HA   GLN  40           HA       GLN  40 -13.177   9.880  -2.137
  176    HB2  GLN  40           HB1      GLN  40 -11.145  11.792  -1.906
  177    HB3  GLN  40           HB2      GLN  40 -10.310  10.265  -2.236
  178    HG2  GLN  40           HG1      GLN  40 -10.670  11.111  -4.354
  179    HG3  GLN  40           HG2      GLN  40 -12.021   9.987  -4.138
  180   HE21  GLN  40          HE21      GLN  40 -14.094  10.766  -3.967
  181   HE22  GLN  40          HE22      GLN  40 -14.511  12.409  -4.296
  182    H    CYS  41           H        CYS  41 -10.389   9.580   0.071
  183    HA   CYS  41           HA       CYS  41 -10.798   6.671   0.058
  184    HB2  CYS  41           HB1      CYS  41  -8.432   6.251  -0.143
  185    HB3  CYS  41           HB2      CYS  41  -8.949   7.257  -1.498
  186    H    LEU  42           H        LEU  42 -10.453   5.649   1.984
  187    HA   LEU  42           HA       LEU  42 -10.249   7.355   4.318
  188    HB2  LEU  42           HB1      LEU  42 -11.407   4.810   3.683
  189    HB3  LEU  42           HB2      LEU  42 -10.319   4.635   5.069
  190    HG   LEU  42           HG       LEU  42 -12.231   6.887   5.192
  191   HD11  LEU  42          HD11      LEU  42 -14.155   5.712   5.371
  192   HD12  LEU  42          HD12      LEU  42 -13.348   4.268   5.983
  193   HD13  LEU  42          HD13      LEU  42 -13.318   4.629   4.257
  194   HD21  LEU  42          HD21      LEU  42 -11.959   4.907   7.354
  195   HD22  LEU  42          HD22      LEU  42 -11.926   6.669   7.413
  196   HD23  LEU  42          HD23      LEU  42 -10.486   5.776   6.923
  197    H    SER  43           H        SER  43  -8.270   5.142   2.532
  198    HA   SER  43           HA       SER  43  -5.915   5.924   3.896
  199    HB2  SER  43           HB1      SER  43  -7.275   4.023   5.315
  200    HB3  SER  43           HB2      SER  43  -6.212   3.020   4.312
  201    HG   SER  43           HG       SER  43  -5.379   5.161   5.982
  202    H    ASP  44           H        ASP  44  -4.033   4.381   3.231
  203    HA   ASP  44           HA       ASP  44  -3.818   4.404   0.464
  204    HB2  ASP  44           HB1      ASP  44  -1.732   3.398   0.720
  205    HB3  ASP  44           HB2      ASP  44  -1.989   4.168   2.293
  206    HD2  ASP  44           HD       ASP  44  -2.002   1.155   3.939
  207    H    THR  45           H        THR  45  -4.972   1.885   2.611
  208    HA   THR  45           HA       THR  45  -4.991  -0.216   0.704
  209    HB   THR  45           HB       THR  45  -7.070  -0.450   2.729
  210    HG1  THR  45           HG1      THR  45  -5.292  -0.575   4.412
  211   HG21  THR  45          HG21      THR  45  -5.287  -2.332   3.355
  212   HG22  THR  45          HG22      THR  45  -4.721  -1.962   1.726
  213   HG23  THR  45          HG23      THR  45  -6.383  -2.492   1.983
  214    H    ASP  46           H        ASP  46  -7.102   2.445   1.326
  215    HA   ASP  46           HA       ASP  46  -9.469   1.380   0.183
  216    HB2  ASP  46           HB1      ASP  46  -9.040   3.538   1.653
  217    HB3  ASP  46           HB2      ASP  46  -8.874   4.308   0.070
  218    HD2  ASP  46           HD       ASP  46 -12.450   3.569   1.364
  219    H    CYS  47           H        CYS  47  -6.573   2.716  -1.150
  220    HA   CYS  47           HA       CYS  47  -7.687   3.348  -3.720
  221    HB2  CYS  47           HB1      CYS  47  -5.600   4.370  -2.617
  222    HB3  CYS  47           HB2      CYS  47  -4.764   2.906  -3.137
  223    H    ASN  48           H        ASN  48  -8.670   0.998  -3.526
  224    HA   ASN  48           HA       ASN  48  -8.869  -1.003  -4.599
  225    HB2  ASN  48           HB1      ASN  48  -6.996   0.480  -6.199
  226    HB3  ASN  48           HB2      ASN  48  -6.518  -1.221  -6.159
  227   HD21  ASN  48          HD21      ASN  48  -8.349   0.983  -7.757
  228   HD22  ASN  48          HD22      ASN  48  -9.475  -0.078  -8.526
  229    H    THR  49           H        THR  49  -5.325  -0.787  -4.517
  230    HA   THR  49           HA       THR  49  -4.892  -2.240  -2.175
  231    HB   THR  49           HB       THR  49  -5.923  -4.157  -3.121
  232    HG1  THR  49           HG1      THR  49  -4.292  -5.382  -2.564
  233   HG21  THR  49          HG21      THR  49  -6.151  -4.236  -5.343
  234   HG22  THR  49          HG22      THR  49  -4.507  -4.871  -5.398
  235   HG23  THR  49          HG23      THR  49  -4.791  -3.142  -5.592
  236    H    ARG  50           H        ARG  50  -2.751  -2.278  -1.675
  237    HA   ARG  50           HA       ARG  50  -0.562  -1.659  -1.794
  238    HB2  ARG  50           HB1      ARG  50  -0.902  -3.000  -4.484
  239    HB3  ARG  50           HB2      ARG  50   0.664  -2.519  -3.814
  240    HG2  ARG  50           HG1      ARG  50   0.628  -4.138  -2.169
  241    HG3  ARG  50           HG2      ARG  50  -1.136  -4.287  -2.224
  242    HD2  ARG  50           HD1      ARG  50  -1.056  -5.451  -4.320
  243    HD3  ARG  50           HD2      ARG  50   0.676  -5.122  -4.480
  244    HE   ARG  50           HE       ARG  50   0.506  -6.515  -2.156
  245   HH11  ARG  50          HH11      ARG  50  -0.606  -7.080  -5.406
  246   HH12  ARG  50          HH12      ARG  50  -0.484  -8.805  -5.288
  247   HH21  ARG  50          HH21      ARG  50   0.671  -8.784  -1.988
  248   HH22  ARG  50          HH22      ARG  50   0.241  -9.772  -3.342
  249    H    LYS  51           H        LYS  51  -2.064   0.500  -2.165
  250    HA   LYS  51           HA       LYS  51  -0.500   2.052  -4.073
  251    HB2  LYS  51           HB1      LYS  51  -3.490   1.737  -4.142
  252    HB3  LYS  51           HB2      LYS  51  -2.725   3.224  -4.722
  253    HG2  LYS  51           HG1      LYS  51  -1.429   1.955  -6.352
  254    HG3  LYS  51           HG2      LYS  51  -2.163   0.453  -5.761
  255    HD2  LYS  51           HD1      LYS  51  -4.420   1.506  -6.322
  256    HD3  LYS  51           HD2      LYS  51  -3.493   2.728  -7.210
  257    HE2  LYS  51           HE1      LYS  51  -3.227   1.362  -8.955
  258    HE3  LYS  51           HE2      LYS  51  -2.571   0.096  -7.905
  259    HZ1  LYS  51           HZ1      LYS  51  -4.671  -0.443  -9.185
  260    HZ2  LYS  51           HZ2      LYS  51  -5.480   0.585  -8.112
  261    HZ3  LYS  51           HZ3      LYS  51  -4.686  -0.789  -7.529
  262    H    PHE  52           H        PHE  52  -0.292   4.225  -3.538
  263    HA   PHE  52           HA       PHE  52  -1.170   4.889  -0.817
  264    HB2  PHE  52           HB1      PHE  52   0.635   6.505  -0.761
  265    HB3  PHE  52           HB2      PHE  52   1.265   4.935  -1.262
  266    HD1  PHE  52           HD1      PHE  52   2.059   4.546  -3.510
  267    HD2  PHE  52           HD2      PHE  52   0.540   8.347  -2.343
  268    HE1  PHE  52           HE1      PHE  52   3.037   5.553  -5.531
  269    HE2  PHE  52           HE2      PHE  52   1.515   9.360  -4.362
  270    HZ   PHE  52           HZ       PHE  52   2.765   7.962  -5.960
  271    H    CYS  53           H        CYS  53  -2.490   6.569  -0.410
  272    HA   CYS  53           HA       CYS  53  -3.735   7.888  -2.668
  273    HB2  CYS  53           HB1      CYS  53  -4.725   6.993  -0.314
  274    HB3  CYS  53           HB2      CYS  53  -4.457   8.689   0.091
  275    H    LEU  54           H        LEU  54  -2.427   9.425  -3.518
  276    HA   LEU  54           HA       LEU  54  -0.875  11.204  -1.884
  277    HB2  LEU  54           HB1      LEU  54  -0.087  10.514  -4.082
  278    HB3  LEU  54           HB2      LEU  54  -1.509  11.261  -4.831
  279    HG   LEU  54           HG       LEU  54  -0.451  13.397  -3.548
  280   HD11  LEU  54          HD11      LEU  54   1.997  13.330  -4.076
  281   HD12  LEU  54          HD12      LEU  54   1.835  11.588  -4.297
  282   HD13  LEU  54          HD13      LEU  54   1.497  12.312  -2.726
  283   HD21  LEU  54          HD21      LEU  54   0.830  13.530  -5.943
  284   HD22  LEU  54          HD22      LEU  54  -0.873  13.913  -5.691
  285   HD23  LEU  54          HD23      LEU  54  -0.406  12.315  -6.273
  286    H    GLN  55           H        GLN  55  -1.269  13.309  -1.362
  287    HA   GLN  55           HA       GLN  55  -3.782  14.509  -2.292
  288    HB2  GLN  55           HB1      GLN  55  -2.844  14.566   0.585
  289    HB3  GLN  55           HB2      GLN  55  -4.345  15.248  -0.059
  290    HG2  GLN  55           HG1      GLN  55  -5.392  13.347   0.354
  291    HG3  GLN  55           HG2      GLN  55  -4.308  12.520  -0.773
  292   HE21  GLN  55          HE21      GLN  55  -5.409  12.557   2.324
  293   HE22  GLN  55          HE22      GLN  55  -4.132  11.688   3.095
  294    HA   PRO  56           HA       PRO  56  -0.366  17.507  -2.863
  295    HB2  PRO  56           HB1      PRO  56  -1.450  18.632  -5.114
  296    HB3  PRO  56           HB2      PRO  56  -0.474  17.163  -5.132
  297    HG2  PRO  56           HG1      PRO  56  -3.458  17.466  -5.132
  298    HG3  PRO  56           HG2      PRO  56  -2.422  16.387  -6.137
  299    HD2  PRO  56           HD1      PRO  56  -3.787  15.500  -3.964
  300    HD3  PRO  56           HD2      PRO  56  -2.210  14.844  -4.438
  301    H    ARG  57           H        ARG  57  -0.319  19.749  -2.541
  302    HA   ARG  57           HA       ARG  57  -2.616  20.804  -1.141
  303    HB2  ARG  57           HB1      ARG  57   0.129  21.139  -0.923
  304    HB3  ARG  57           HB2      ARG  57  -0.429  22.674  -1.603
  305    HG2  ARG  57           HG1      ARG  57  -2.256  22.360   0.350
  306    HG3  ARG  57           HG2      ARG  57  -0.870  21.520   1.068
  307    HD2  ARG  57           HD1      ARG  57  -0.324  23.602   1.779
  308    HD3  ARG  57           HD2      ARG  57   0.370  23.719   0.157
  309    HE   ARG  57           HE       ARG  57  -2.175  24.555  -0.212
  310   HH11  ARG  57          HH11      ARG  57   0.338  25.453   2.025
  311   HH12  ARG  57          HH12      ARG  57  -0.199  27.094   2.172
  312   HH21  ARG  57          HH21      ARG  57  -2.891  26.713  -0.027
  313   HH22  ARG  57          HH22      ARG  57  -2.036  27.808   1.004
  314    H    ASP  58           H        ASP  58  -0.736  21.645  -4.032
  315    HA   ASP  58           HA       ASP  58  -2.389  23.866  -4.726
  316    HB2  ASP  58           HB1      ASP  58   0.085  22.858  -5.553
  317    HB3  ASP  58           HB2      ASP  58  -0.959  22.706  -6.971
  318    HD2  ASP  58           HD       ASP  58  -0.582  26.421  -5.616
  319    H    GLU  59           H        GLU  59  -2.558  20.463  -5.238
  320    HA   GLU  59           HA       GLU  59  -4.823  20.860  -7.081
  321    HB2  GLU  59           HB1      GLU  59  -2.487  19.176  -7.298
  322    HB3  GLU  59           HB2      GLU  59  -3.961  18.196  -7.307
  323    HG2  GLU  59           HG1      GLU  59  -4.013  18.610  -9.496
  324    HG3  GLU  59           HG2      GLU  59  -4.623  20.203  -9.024
  325    HE2  GLU  59           HE       GLU  59  -0.794  19.999 -10.088
  326    H    LYS  60           H        LYS  60  -6.126  18.593  -7.057
  327    HA   LYS  60           HA       LYS  60  -7.052  18.356  -4.298
  328    HB2  LYS  60           HB1      LYS  60  -8.233  17.944  -6.986
  329    HB3  LYS  60           HB2      LYS  60  -8.805  16.860  -5.708
  330    HG2  LYS  60           HG1      LYS  60  -9.323  18.877  -4.321
  331    HG3  LYS  60           HG2      LYS  60  -8.939  19.865  -5.740
  332    HD2  LYS  60           HD1      LYS  60 -10.664  18.129  -6.865
  333    HD3  LYS  60           HD2      LYS  60 -11.282  18.143  -5.204
  334    HE2  LYS  60           HE1      LYS  60 -10.657  20.816  -6.232
  335    HE3  LYS  60           HE2      LYS  60 -11.902  19.968  -7.161
  336    HZ1  LYS  60           HZ1      LYS  60 -12.545  19.529  -4.524
  337    HZ2  LYS  60           HZ2      LYS  60 -13.320  20.588  -5.591
  338    HZ3  LYS  60           HZ3      LYS  60 -12.085  21.156  -4.585
  339    HA   PRO  61           HA       PRO  61  -5.507  14.315  -3.569
  340    HB2  PRO  61           HB1      PRO  61  -7.573  13.121  -2.227
  341    HB3  PRO  61           HB2      PRO  61  -6.558  14.381  -1.528
  342    HG2  PRO  61           HG1      PRO  61  -9.256  14.611  -2.820
  343    HG3  PRO  61           HG2      PRO  61  -8.657  15.354  -1.290
  344    HD2  PRO  61           HD1      PRO  61  -8.834  16.738  -3.619
  345    HD3  PRO  61           HD2      PRO  61  -7.564  17.039  -2.421
  346    H    PHE  62           H        PHE  62  -5.522  12.190  -4.308
  347    HA   PHE  62           HA       PHE  62  -7.725  11.001  -5.644
  348    HB2  PHE  62           HB1      PHE  62  -6.632  10.922  -7.925
  349    HB3  PHE  62           HB2      PHE  62  -7.295  12.487  -7.451
  350    HD1  PHE  62           HD1      PHE  62  -6.018  14.374  -7.739
  351    HD2  PHE  62           HD2      PHE  62  -4.077  10.611  -7.302
  352    HE1  PHE  62           HE1      PHE  62  -3.845  15.450  -8.153
  353    HE2  PHE  62           HE2      PHE  62  -1.900  11.682  -7.713
  354    HZ   PHE  62           HZ       PHE  62  -1.782  14.104  -8.138
  355    H    CYS  63           H        CYS  63  -6.936   8.996  -6.926
  356    HA   CYS  63           HA       CYS  63  -5.242   7.505  -5.155
  357    HB2  CYS  63           HB1      CYS  63  -7.134   6.946  -7.290
  358    HB3  CYS  63           HB2      CYS  63  -5.684   5.951  -7.436
  359    H    ALA  64           H        ALA  64  -3.243   6.589  -5.584
  360    HA   ALA  64           HA       ALA  64  -1.876   7.485  -8.030
  361    HB1  ALA  64           HB1      ALA  64   0.056   8.161  -6.847
  362    HB2  ALA  64           HB2      ALA  64  -1.313   8.905  -6.019
  363    HB3  ALA  64           HB3      ALA  64  -0.541   7.474  -5.335
  364    H    THR  65           H        THR  65  -0.508   6.031  -8.954
  365    HA   THR  65           HA       THR  65  -0.696   3.300  -8.046
  366    HB   THR  65           HB       THR  65   1.126   4.045 -10.280
  367    HG1  THR  65           HG1      THR  65  -1.695   4.365 -10.290
  368   HG21  THR  65          HG21      THR  65  -0.388   2.081 -11.230
  369   HG22  THR  65          HG22      THR  65  -0.662   1.797  -9.511
  370   HG23  THR  65          HG23      THR  65   0.978   1.767 -10.160
  371    H    CYS  66           H        CYS  66   1.193   1.904  -7.814
  372    HA   CYS  66           HA       CYS  66   2.974   2.754  -5.883
  373    HB2  CYS  66           HB1      CYS  66   2.449   0.379  -6.508
  374    HB3  CYS  66           HB2      CYS  66   3.519   0.568  -7.899
  375    H    ARG  67           H        ARG  67   5.017   3.585  -5.853
  376    HA   ARG  67           HA       ARG  67   5.960   4.738  -8.372
  377    HB2  ARG  67           HB1      ARG  67   6.363   5.394  -5.476
  378    HB3  ARG  67           HB2      ARG  67   7.554   5.938  -6.667
  379    HG2  ARG  67           HG1      ARG  67   5.354   6.792  -7.905
  380    HG3  ARG  67           HG2      ARG  67   4.767   6.828  -6.235
  381    HD2  ARG  67           HD1      ARG  67   5.948   8.664  -5.760
  382    HD3  ARG  67           HD2      ARG  67   7.422   7.945  -6.424
  383    HE   ARG  67           HE       ARG  67   7.064   9.073  -8.392
  384   HH11  ARG  67          HH11      ARG  67   4.199   9.223  -6.420
  385   HH12  ARG  67          HH12      ARG  67   3.410  10.393  -7.427
  386   HH21  ARG  67          HH21      ARG  67   6.036  10.612  -9.725
  387   HH22  ARG  67          HH22      ARG  67   4.455  11.181  -9.307
  388    H    GLY  68           H        GLY  68   7.761   4.064  -9.363
  389    HA2  GLY  68           HA2      GLY  68   9.148   1.760  -8.318
  390    HA3  GLY  68           HA3      GLY  68   9.438   2.542  -9.865
  391    HA1  GLY  68           HA1      GLY  68   9.083   2.449  -7.770
  392    H    LEU  69           H        LEU  69  11.679   1.874  -8.914
  393    HA   LEU  69           HA       LEU  69  12.808   3.530  -6.899
  394    HB2  LEU  69           HB1      LEU  69  14.046   1.800  -9.042
  395    HB3  LEU  69           HB2      LEU  69  14.986   2.665  -7.814
  396    HG   LEU  69           HG       LEU  69  12.980   0.469  -7.305
  397   HD11  LEU  69          HD11      LEU  69  15.984   0.574  -7.227
  398   HD12  LEU  69          HD12      LEU  69  14.956  -0.480  -8.197
  399   HD13  LEU  69          HD13      LEU  69  15.041  -0.697  -6.449
  400   HD21  LEU  69          HD21      LEU  69  14.020   2.532  -5.589
  401   HD22  LEU  69          HD22      LEU  69  14.534   0.940  -5.032
  402   HD23  LEU  69          HD23      LEU  69  12.818   1.289  -5.247
  403    H    ARG  70           H        ARG  70  12.331   3.869 -10.313
  404    HA   ARG  70           HA       ARG  70  14.183   6.111 -10.499
  405    HB2  ARG  70           HB1      ARG  70  12.348   4.976 -12.621
  406    HB3  ARG  70           HB2      ARG  70  13.694   6.097 -12.870
  407    HG2  ARG  70           HG1      ARG  70  15.112   4.179 -11.779
  408    HG3  ARG  70           HG2      ARG  70  13.747   3.176 -12.299
  409    HD2  ARG  70           HD1      ARG  70  14.217   4.699 -14.534
  410    HD3  ARG  70           HD2      ARG  70  15.845   4.464 -13.883
  411    HE   ARG  70           HE       ARG  70  14.499   1.995 -13.902
  412   HH11  ARG  70          HH11      ARG  70  15.878   4.327 -16.089
  413   HH12  ARG  70          HH12      ARG  70  16.241   3.157 -17.314
  414   HH21  ARG  70          HH21      ARG  70  14.973   0.445 -15.507
  415   HH22  ARG  70          HH22      ARG  70  15.725   0.950 -16.983
  416    H    ARG  71           H        ARG  71  11.401   5.923  -9.078
  417    HA   ARG  71           HA       ARG  71  10.164   8.265 -10.346
  418    HB2  ARG  71           HB1      ARG  71   9.153   6.030  -8.650
  419    HB3  ARG  71           HB2      ARG  71   8.339   7.597  -8.528
  420    HG2  ARG  71           HG1      ARG  71   8.814   6.298 -11.194
  421    HG3  ARG  71           HG2      ARG  71   7.417   5.880 -10.188
  422    HD2  ARG  71           HD1      ARG  71   6.757   8.263 -10.134
  423    HD3  ARG  71           HD2      ARG  71   8.122   8.633 -11.196
  424    HE   ARG  71           HE       ARG  71   6.898   7.872 -12.970
  425   HH11  ARG  71          HH11      ARG  71   5.468   6.694 -10.022
  426   HH12  ARG  71          HH12      ARG  71   4.077   6.029 -10.810
  427   HH21  ARG  71          HH21      ARG  71   5.071   6.998 -14.019
  428   HH22  ARG  71          HH22      ARG  71   3.852   6.201 -13.083
  429    H    ARG  72           H        ARG  72   9.953  10.181  -9.298
  430    HA   ARG  72           HA       ARG  72  11.631  10.644  -7.022
  431    HB2  ARG  72           HB1      ARG  72   9.642  12.567  -8.238
  432    HB3  ARG  72           HB2      ARG  72  11.087  12.956  -7.292
  433    HG2  ARG  72           HG1      ARG  72  12.213  11.577  -9.324
  434    HG3  ARG  72           HG2      ARG  72  10.819  12.299 -10.145
  435    HD2  ARG  72           HD1      ARG  72  12.035  14.276  -8.461
  436    HD3  ARG  72           HD2      ARG  72  13.274  13.523  -9.475
  437    HE   ARG  72           HE       ARG  72  11.228  15.309 -10.329
  438   HH11  ARG  72          HH11      ARG  72  13.139  12.576 -11.325
  439   HH12  ARG  72          HH12      ARG  72  13.030  12.948 -13.014
  440   HH21  ARG  72          HH21      ARG  72  11.076  15.810 -12.549
  441   HH22  ARG  72          HH22      ARG  72  11.856  14.788 -13.709
  442    H    CYS  73           H        CYS  73  10.969  11.516  -4.994
  443    HA   CYS  73           HA       CYS  73   8.156  11.316  -4.280
  444    HB2  CYS  73           HB1      CYS  73   8.653   9.865  -2.320
  445    HB3  CYS  73           HB2      CYS  73   8.882   9.053  -3.870
  446    H    GLN  74           H        GLN  74   7.682  12.240  -2.182
  447    HA   GLN  74           HA       GLN  74   9.719  14.205  -1.371
  448    HB2  GLN  74           HB1      GLN  74   7.026  14.540  -2.140
  449    HB3  GLN  74           HB2      GLN  74   7.084  14.831  -0.393
  450    HG2  GLN  74           HG1      GLN  74   8.537  16.633  -0.597
  451    HG3  GLN  74           HG2      GLN  74   9.050  16.148  -2.220
  452   HE21  GLN  74          HE21      GLN  74   8.292  18.721  -1.711
  453   HE22  GLN  74          HE22      GLN  74   6.796  19.059  -2.507
  454    H    ARG  75           H        ARG  75   7.329  11.894  -0.207
  455    HA   ARG  75           HA       ARG  75   8.496  12.134   2.489
  456    HB2  ARG  75           HB1      ARG  75   5.717  11.738   1.524
  457    HB3  ARG  75           HB2      ARG  75   6.192  10.829   2.966
  458    HG2  ARG  75           HG1      ARG  75   6.334  12.675   4.274
  459    HG3  ARG  75           HG2      ARG  75   6.861  13.707   2.933
  460    HD2  ARG  75           HD1      ARG  75   4.100  12.643   2.753
  461    HD3  ARG  75           HD2      ARG  75   4.407  13.828   4.028
  462    HE   ARG  75           HE       ARG  75   5.509  14.923   1.770
  463   HH11  ARG  75          HH11      ARG  75   2.358  13.779   2.708
  464   HH12  ARG  75          HH12      ARG  75   1.507  14.883   1.680
  465   HH21  ARG  75          HH21      ARG  75   4.401  16.381   0.411
  466   HH22  ARG  75          HH22      ARG  75   2.670  16.362   0.373
  467    H    ASP  76           H        ASP  76   8.823  10.201   3.693
  468    HA   ASP  76           HA       ASP  76   9.900   8.071   2.178
  469    HB2  ASP  76           HB1      ASP  76   9.231   8.263   5.126
  470    HB3  ASP  76           HB2      ASP  76  10.152   6.942   4.393
  471    HD2  ASP  76           HD       ASP  76  12.706   9.447   3.610
  472    H    ALA  77           H        ALA  77   6.827   8.541   3.814
  473    HA   ALA  77           HA       ALA  77   5.968   5.820   3.409
  474    HB1  ALA  77           HB1      ALA  77   5.210   7.145   5.342
  475    HB2  ALA  77           HB2      ALA  77   4.352   8.226   4.244
  476    HB3  ALA  77           HB3      ALA  77   3.867   6.536   4.374
  477    H    MET  78           H        MET  78   5.783   8.824   1.687
  478    HA   MET  78           HA       MET  78   3.553   8.431   0.083
  479    HB2  MET  78           HB1      MET  78   5.997  10.050  -0.020
  480    HB3  MET  78           HB2      MET  78   5.335   9.662  -1.614
  481    HG2  MET  78           HG1      MET  78   3.130  10.543  -0.869
  482    HG3  MET  78           HG2      MET  78   3.900  11.042   0.639
  483    HE1  MET  78           HE1      MET  78   5.455  11.558  -3.227
  484    HE2  MET  78           HE2      MET  78   3.729  11.235  -3.067
  485    HE3  MET  78           HE3      MET  78   4.287  12.850  -3.504
  486    H    CYS  79           H        CYS  79   6.696   6.945  -0.049
  487    HA   CYS  79           HA       CYS  79   6.188   5.780  -2.671
  488    HB2  CYS  79           HB1      CYS  79   8.513   6.366  -1.086
  489    HB3  CYS  79           HB2      CYS  79   8.508   4.650  -1.498
  490    H    CYS  80           H        CYS  80   6.274   3.482  -3.026
  491    HA   CYS  80           HA       CYS  80   4.571   2.009  -1.398
  492    HB2  CYS  80           HB1      CYS  80   6.474   1.343  -3.601
  493    HB3  CYS  80           HB2      CYS  80   5.810   0.013  -2.649
  494    HA   PRO  81           HA       PRO  81   6.952   0.367   1.901
  495    HB2  PRO  81           HB1      PRO  81   5.999  -2.192   2.105
  496    HB3  PRO  81           HB2      PRO  81   5.069  -0.768   2.570
  497    HG2  PRO  81           HG1      PRO  81   4.995  -2.336   0.013
  498    HG3  PRO  81           HG2      PRO  81   3.627  -1.720   1.015
  499    HD2  PRO  81           HD1      PRO  81   4.453  -0.483  -1.257
  500    HD3  PRO  81           HD2      PRO  81   3.812   0.403   0.136
  501    H    GLY  82           H        GLY  82   8.806  -0.785   2.370
  502    HA2  GLY  82           HA2      GLY  82  10.365  -2.560   1.991
  503    HA3  GLY  82           HA3      GLY  82   9.799  -2.656   0.330
  504    HA1  GLY  82           HA1      GLY  82  10.342  -1.693   2.146
  505    H    THR  83           H        THR  83   9.903   0.405   0.311
  506    HA   THR  83           HA       THR  83  12.817   0.626  -0.082
  507    HB   THR  83           HB       THR  83  12.071   2.476  -1.780
  508    HG1  THR  83           HG1      THR  83   9.745   1.816  -1.063
  509   HG21  THR  83          HG21      THR  83  11.489   0.122  -3.237
  510   HG22  THR  83          HG22      THR  83  12.669  -0.310  -2.000
  511   HG23  THR  83          HG23      THR  83  13.020   0.989  -3.140
  512    H    LEU  84           H        LEU  84  13.511   3.010  -0.163
  513    HA   LEU  84           HA       LEU  84  12.024   4.583   1.826
  514    HB2  LEU  84           HB1      LEU  84  14.261   3.283   2.505
  515    HB3  LEU  84           HB2      LEU  84  14.983   4.754   1.827
  516    HG   LEU  84           HG       LEU  84  13.574   6.074   3.436
  517   HD11  LEU  84          HD11      LEU  84  12.522   5.002   5.268
  518   HD12  LEU  84          HD12      LEU  84  13.177   3.429   4.813
  519   HD13  LEU  84          HD13      LEU  84  11.944   4.194   3.811
  520   HD21  LEU  84          HD21      LEU  84  15.351   6.112   4.783
  521   HD22  LEU  84          HD22      LEU  84  16.015   4.833   3.767
  522   HD23  LEU  84          HD23      LEU  84  15.141   4.423   5.243
  523    H    CYS  85           H        CYS  85  12.000   6.781   1.523
  524    HA   CYS  85           HA       CYS  85  12.636   7.706  -1.121
  525    HB2  CYS  85           HB1      CYS  85  10.606   8.374   0.265
  526    HB3  CYS  85           HB2      CYS  85  11.703   9.391   1.202
  527    H    VAL  86           H        VAL  86  14.768   7.939  -1.518
  528    HA   VAL  86           HA       VAL  86  16.318   9.618   0.345
  529    HB   VAL  86           HB       VAL  86  17.389   7.514  -1.540
  530   HG11  VAL  86          HG11      VAL  86  18.659   9.526   0.248
  531   HG12  VAL  86          HG12      VAL  86  19.428   7.947   0.072
  532   HG13  VAL  86          HG13      VAL  86  19.154   8.959  -1.347
  533   HG21  VAL  86          HG21      VAL  86  16.726   6.084   0.047
  534   HG22  VAL  86          HG22      VAL  86  18.040   6.752   1.017
  535   HG23  VAL  86          HG23      VAL  86  16.401   7.378   1.202
  536    H    ASN  87           H        ASN  87  17.331  11.390  -0.435
  537    HA   ASN  87           HA       ASN  87  17.775  13.129  -1.834
  538    HB2  ASN  87           HB1      ASN  87  19.089  10.957  -2.807
  539    HB3  ASN  87           HB2      ASN  87  18.119  11.410  -4.213
  540   HD21  ASN  87          HD21      ASN  87  21.062  11.702  -3.113
  541   HD22  ASN  87          HD22      ASN  87  21.485  13.287  -3.658
  542    H    ASP  88           H        ASP  88  15.043  12.442  -1.563
  543    HA   ASP  88           HA       ASP  88  13.011  12.963  -2.444
  544    HB2  ASP  88           HB1      ASP  88  14.485  14.349  -4.688
  545    HB3  ASP  88           HB2      ASP  88  12.878  14.718  -4.048
  546    HD2  ASP  88           HD       ASP  88  14.440  16.126  -1.120
  547    H    VAL  89           H        VAL  89  14.507  10.557  -3.311
  548    HA   VAL  89           HA       VAL  89  12.792   9.891  -5.574
  549    HB   VAL  89           HB       VAL  89  15.773   9.409  -5.644
  550   HG11  VAL  89          HG11      VAL  89  13.650   8.757  -7.685
  551   HG12  VAL  89          HG12      VAL  89  15.384   8.469  -7.849
  552   HG13  VAL  89          HG13      VAL  89  14.453   7.589  -6.635
  553   HG21  VAL  89          HG21      VAL  89  14.046  11.235  -7.311
  554   HG22  VAL  89          HG22      VAL  89  15.225  11.738  -6.099
  555   HG23  VAL  89          HG23      VAL  89  15.763  10.928  -7.571
  556    H    CYS  90           H        CYS  90  12.158   7.774  -5.622
  557    HA   CYS  90           HA       CYS  90  12.303   6.276  -3.252
  558    HB2  CYS  90           HB1      CYS  90  10.796   6.196  -5.565
  559    HB3  CYS  90           HB2      CYS  90  11.732   4.702  -5.655
  560    H    THR  91           H        THR  91  14.123   5.428  -2.480
  561    HA   THR  91           HA       THR  91  15.867   3.950  -4.342
  562    HB   THR  91           HB       THR  91  16.756   5.372  -1.826
  563    HG1  THR  91           HG1      THR  91  17.423   6.129  -4.471
  564   HG21  THR  91          HG21      THR  91  18.263   3.932  -4.008
  565   HG22  THR  91          HG22      THR  91  18.177   3.498  -2.301
  566   HG23  THR  91          HG23      THR  91  19.025   4.962  -2.797
  567    H    THR  92           H        THR  92  16.246   1.872  -3.882
  568    HA   THR  92           HA       THR  92  14.802   0.490  -1.932
  569    HB   THR  92           HB       THR  92  16.980  -1.148  -2.450
  570    HG1  THR  92           HG1      THR  92  17.388  -0.839  -4.669
  571   HG21  THR  92          HG21      THR  92  15.487  -2.317  -3.934
  572   HG22  THR  92          HG22      THR  92  14.499  -0.872  -4.148
  573   HG23  THR  92          HG23      THR  92  14.550  -1.682  -2.583
  574    H    MET  93           H        MET  93  15.177  -0.058   0.138
  575    HA   MET  93           HA       MET  93  16.998   1.329   1.713
  576    HB2  MET  93           HB1      MET  93  14.890  -0.379   2.172
  577    HB3  MET  93           HB2      MET  93  16.274  -1.304   2.778
  578    HG2  MET  93           HG1      MET  93  16.598   1.317   3.754
  579    HG3  MET  93           HG2      MET  93  14.899   0.895   3.982
  580    HE1  MET  93           HE1      MET  93  16.286   0.792   7.284
  581    HE2  MET  93           HE2      MET  93  17.930   0.566   6.687
  582    HE3  MET  93           HE3      MET  93  16.863   1.736   5.910
  583    H    GLU  94           H        GLU  94  17.369  -1.643  -0.061
  584    HA   GLU  94           HA       GLU  94  19.612  -2.697   1.254
  585    HB2  GLU  94           HB1      GLU  94  18.798  -2.908  -1.655
  586    HB3  GLU  94           HB2      GLU  94  20.033  -3.908  -0.874
  587    HG2  GLU  94           HG1      GLU  94  18.366  -5.361  -0.558
  588    HG3  GLU  94           HG2      GLU  94  17.931  -4.299   0.789
  589    HE2  GLU  94           HE       GLU  94  15.789  -3.612  -2.479
  590    H    ASP  95           H        ASP  95  19.330  -0.359  -1.379
  591    HA   ASP  95           HA       ASP  95  22.201  -0.109  -1.639
  592    HB2  ASP  95           HB1      ASP  95  19.809   0.957  -3.052
  593    HB3  ASP  95           HB2      ASP  95  21.277   1.941  -3.109
  594    HD2  ASP  95           HD       ASP  95  22.145  -0.021  -5.794
  595    H    ALA  96           H        ALA  96  19.529   1.693  -0.232
  596    HA   ALA  96           HA       ALA  96  20.961   4.056   0.361
  597    HB1  ALA  96           HB1      ALA  96  18.372   3.445   0.431
  598    HB2  ALA  96           HB2      ALA  96  18.741   3.236   2.143
  599    HB3  ALA  96           HB3      ALA  96  19.054   4.783   1.356
  600    H    THR  97           H        THR  97  22.340   4.546   1.951
  601    HA   THR  97           HA       THR  97  23.774   4.278   3.701
  602    HB   THR  97           HB       THR  97  21.655   2.700   5.129
  603    HG1  THR  97           HG1      THR  97  21.656   5.531   4.781
  604   HG21  THR  97          HG21      THR  97  23.965   4.409   5.837
  605   HG22  THR  97          HG22      THR  97  23.321   2.981   6.647
  606   HG23  THR  97          HG23      THR  97  22.540   4.548   6.866
  607    H    GLU  98           H        GLU  98  24.875   2.738   2.156
  608    HA   GLU  98           HA       GLU  98  24.623  -0.076   2.695
  609    HB2  GLU  98           HB1      GLU  98  25.692   1.495   0.634
  610    HB3  GLU  98           HB2      GLU  98  27.077   0.655   1.348
  611    HG2  GLU  98           HG1      GLU  98  25.539  -1.453   1.159
  612    HG3  GLU  98           HG2      GLU  98  24.699  -0.471  -0.048
  613    HE2  GLU  98           HE       GLU  98  27.013  -1.527  -2.334
  614    H    ASN  99           H        ASN  99  26.238  -1.426   3.603
  615    HA   ASN  99           HA       ASN  99  28.174  -0.039   5.334
  616    HB2  ASN  99           HB1      ASN  99  25.948  -1.248   6.305
  617    HB3  ASN  99           HB2      ASN  99  27.080  -2.605   6.319
  618   HD21  ASN  99          HD21      ASN  99  26.600   0.689   7.444
  619   HD22  ASN  99          HD22      ASN  99  27.634   0.564   8.824
  620    H    LEU 100           H        LEU 100  29.901  -1.569   6.145
  621    HA   LEU 100           HA       LEU 100  31.036  -2.928   3.879
  622    HB2  LEU 100           HB1      LEU 100  31.978  -1.746   6.288
  623    HB3  LEU 100           HB2      LEU 100  32.506  -3.439   6.263
  624    HG   LEU 100           HG       LEU 100  33.200  -2.656   3.760
  625   HD11  LEU 100          HD11      LEU 100  32.601  -0.365   4.014
  626   HD12  LEU 100          HD12      LEU 100  34.361  -0.461   4.061
  627   HD13  LEU 100          HD13      LEU 100  33.450  -0.252   5.556
  628   HD21  LEU 100          HD21      LEU 100  35.445  -2.039   5.193
  629   HD22  LEU 100          HD22      LEU 100  34.945  -3.667   4.730
  630   HD23  LEU 100          HD23      LEU 100  34.540  -3.042   6.329
  631    H    TYR 101           H        TYR 101  31.922  -5.129   4.031
  632    HA   TYR 101           HA       TYR 101  30.127  -6.884   5.574
  633    HB2  TYR 101           HB1      TYR 101  30.900  -6.852   2.777
  634    HB3  TYR 101           HB2      TYR 101  31.290  -8.403   3.526
  635    HD1  TYR 101           HD1      TYR 101  29.276  -9.205   5.219
  636    HD2  TYR 101           HD2      TYR 101  28.844  -6.821   1.722
  637    HE1  TYR 101           HE1      TYR 101  26.931  -9.922   5.028
  638    HE2  TYR 101           HE2      TYR 101  26.497  -7.530   1.521
  639    HH   TYR 101           HH       TYR 101  24.779  -8.906   3.942
  640    H    PHE 102           H        PHE 102  31.260  -9.231   5.582
  641    HA   PHE 102           HA       PHE 102  33.764  -8.802   7.030
  642    HB2  PHE 102           HB1      PHE 102  31.495 -10.478   7.421
  643    HB3  PHE 102           HB2      PHE 102  32.890 -11.524   7.143
  644    HD1  PHE 102           HD1      PHE 102  32.485  -8.274   8.931
  645    HD2  PHE 102           HD2      PHE 102  33.682 -12.354   9.129
  646    HE1  PHE 102           HE1      PHE 102  33.220  -7.941  11.255
  647    HE2  PHE 102           HE2      PHE 102  34.419 -12.028  11.453
  648    HZ   PHE 102           HZ       PHE 102  34.188  -9.820  12.520
  649    H    GLN 103           H        GLN 103  33.511  -8.855   4.059
  650    HA   GLN 103           HA       GLN 103  34.659  -9.638   2.259
  651    HB2  GLN 103           HB1      GLN 103  36.511  -9.260   4.066
  652    HB3  GLN 103           HB2      GLN 103  36.581 -11.029   4.089
  653    HG2  GLN 103           HG1      GLN 103  37.073 -11.068   1.702
  654    HG3  GLN 103           HG2      GLN 103  36.976  -9.302   1.656
  655   HE21  GLN 103          HE21      GLN 103  38.847 -12.041   2.667
  656   HE22  GLN 103          HE22      GLN 103  40.298 -11.176   3.028
  657    H    SER 104           H        SER 104  32.537 -11.257   3.374
  658    HA   SER 104           HA       SER 104  31.598 -13.322   3.178
  659    HB2  SER 104           HB1      SER 104  33.668 -14.003   1.102
  660    HB3  SER 104           HB2      SER 104  31.948 -14.428   1.147
  661    HG   SER 104           HG       SER 104  31.537 -12.131   0.858
  662    H    LEU 105           H        LEU 105  32.460 -13.820   5.318
  663    HA   LEU 105           HA       LEU 105  34.890 -15.262   5.632
  664    HB2  LEU 105           HB1      LEU 105  33.555 -13.939   7.383
  665    HB3  LEU 105           HB2      LEU 105  32.557 -15.399   7.514
  666    HG   LEU 105           HG       LEU 105  35.042 -16.441   7.858
  667   HD11  LEU 105          HD11      LEU 105  35.144 -13.908   9.444
  668   HD12  LEU 105          HD12      LEU 105  35.839 -13.986   7.825
  669   HD13  LEU 105          HD13      LEU 105  36.433 -15.060   9.092
  670   HD21  LEU 105          HD21      LEU 105  32.953 -16.732   9.216
  671   HD22  LEU 105          HD22      LEU 105  33.395 -15.264  10.088
  672   HD23  LEU 105          HD23      LEU 105  34.449 -16.678  10.149
  673    H    GLU 106           H        GLU 106  35.293 -17.420   5.683
  674    HA   GLU 106           HA       GLU 106  33.262 -19.405   5.842
  675    HB2  GLU 106           HB1      GLU 106  32.950 -18.570   3.500
  676    HB3  GLU 106           HB2      GLU 106  34.596 -19.116   3.148
  677    HG2  GLU 106           HG1      GLU 106  34.011 -21.279   3.019
  678    HG3  GLU 106           HG2      GLU 106  32.856 -21.147   4.351
  679    HE2  GLU 106           HE       GLU 106  30.261 -21.057   2.135
  680    H    HIS 107           H        HIS 107  34.107 -21.536   5.932
  681    HA   HIS 107           HA       HIS 107  36.815 -22.177   5.462
  682    HB2  HIS 107           HB1      HIS 107  37.163 -20.689   7.402
  683    HB3  HIS 107           HB2      HIS 107  36.097 -21.717   8.366
  684    HD1  HIS 107           HD1      HIS 107  39.514 -21.687   6.814
  685    HD2  HIS 107           HD2      HIS 107  37.221 -24.068   9.333
  686    HE1  HIS 107           HE1      HIS 107  41.103 -23.391   7.761
  687    HE2  HIS 107           HE2      HIS 107  39.702 -24.846   9.301
  688    H    HIS 108           H        HIS 108  36.703 -24.259   4.979
  689    HA   HIS 108           HA       HIS 108  35.355 -26.113   6.752
  690    HB2  HIS 108           HB1      HIS 108  34.270 -25.296   4.134
  691    HB3  HIS 108           HB2      HIS 108  34.374 -27.043   4.375
  692    HD1  HIS 108           HD1      HIS 108  33.135 -27.960   6.606
  693    HD2  HIS 108           HD2      HIS 108  32.091 -24.149   5.322
  694    HE1  HIS 108           HE1      HIS 108  30.954 -27.439   7.747
  695    HE2  HIS 108           HE2      HIS 108  30.317 -25.110   6.963
  696    H    HIS 109           H        HIS 109  35.502 -28.423   5.604
  697    HA   HIS 109           HA       HIS 109  36.926 -30.123   5.087
  698    HB2  HIS 109           HB1      HIS 109  37.639 -28.008   3.070
  699    HB3  HIS 109           HB2      HIS 109  38.514 -29.542   3.106
  700    HD1  HIS 109           HD1      HIS 109  34.799 -29.261   3.691
  701    HD2  HIS 109           HD2      HIS 109  37.458 -30.611   0.799
  702    HE1  HIS 109           HE1      HIS 109  33.393 -30.483   2.003
  703    HE2  HIS 109           HE2      HIS 109  35.016 -31.310   0.234
  704    H    HIS 110           H        HIS 110  38.001 -30.154   7.089
  705    HA   HIS 110           HA       HIS 110  40.765 -29.167   6.954
  706    HB2  HIS 110           HB1      HIS 110  40.638 -28.679   9.411
  707    HB3  HIS 110           HB2      HIS 110  39.666 -27.606   8.400
  708    HD1  HIS 110           HD1      HIS 110  37.075 -27.854   8.525
  709    HD2  HIS 110           HD2      HIS 110  39.170 -30.254  11.191
  710    HE1  HIS 110           HE1      HIS 110  35.365 -28.678  10.174
  711    HE2  HIS 110           HE2      HIS 110  36.645 -30.146  11.804
  712    H    HIS 111           H        HIS 111  40.024 -31.726   6.265
  713    HA   HIS 111           HA       HIS 111  40.688 -33.374   8.601
  714    HB2  HIS 111           HB1      HIS 111  38.678 -33.761   6.905
  715    HB3  HIS 111           HB2      HIS 111  39.939 -34.584   5.979
  716    HD1  HIS 111           HD1      HIS 111  37.559 -35.168   8.629
  717    HD2  HIS 111           HD2      HIS 111  41.267 -36.707   7.560
  718    HE1  HIS 111           HE1      HIS 111  37.754 -37.360   9.847
  719    HE2  HIS 111           HE2      HIS 111  40.020 -38.301   9.195
  720    H    HIS 112           H        HIS 112  42.410 -34.814   8.577
  721    HA   HIS 112           HA       HIS 112  44.322 -34.479   6.360
  722    HB2  HIS 112           HB1      HIS 112  44.647 -34.002   9.218
  723    HB3  HIS 112           HB2      HIS 112  45.845 -35.139   8.592
  724    HD1  HIS 112           HD1      HIS 112  47.289 -34.245   6.492
  725    HD2  HIS 112           HD2      HIS 112  45.217 -31.379   8.674
  726    HE1  HIS 112           HE1      HIS 112  48.338 -32.043   5.877
  727    HE2  HIS 112           HE2      HIS 112  47.072 -30.290   7.209
  Start of MODEL   48
    1    H1   MET  18           H        MET  18 -66.563  36.593  13.090
    2    HA   MET  18           HA       MET  18 -66.814  36.783  10.594
    3    HB2  MET  18           HB1      MET  18 -66.153  39.252  10.823
    4    HB3  MET  18           HB2      MET  18 -64.482  38.670  10.859
    5    HG2  MET  18           HG1      MET  18 -64.855  37.571   8.662
    6    HG3  MET  18           HG2      MET  18 -66.463  38.299   8.627
    7    HE1  MET  18           HE1      MET  18 -62.439  40.151   8.736
    8    HE2  MET  18           HE2      MET  18 -62.898  38.465   8.495
    9    HE3  MET  18           HE3      MET  18 -62.726  39.539   7.106
   10    H    LEU  19           H        LEU  19 -64.011  36.809  12.728
   11    HA   LEU  19           HA       LEU  19 -63.001  34.439  11.304
   12    HB2  LEU  19           HB1      LEU  19 -61.737  36.777  11.151
   13    HB3  LEU  19           HB2      LEU  19 -61.085  36.224  12.703
   14    HG   LEU  19           HG       LEU  19 -60.769  34.050  10.984
   15   HD11  LEU  19          HD11      LEU  19 -59.303  35.317   9.237
   16   HD12  LEU  19          HD12      LEU  19 -60.403  36.652   9.575
   17   HD13  LEU  19          HD13      LEU  19 -61.035  35.121   8.970
   18   HD21  LEU  19          HD21      LEU  19 -59.093  36.021  12.387
   19   HD22  LEU  19          HD22      LEU  19 -58.312  35.168  11.053
   20   HD23  LEU  19          HD23      LEU  19 -59.021  34.259  12.389
   21    H    VAL  20           H        VAL  20 -63.614  32.859  12.676
   22    HA   VAL  20           HA       VAL  20 -63.428  33.169  15.537
   23    HB   VAL  20           HB       VAL  20 -64.024  30.671  13.947
   24   HG11  VAL  20          HG11      VAL  20 -64.110  31.369  16.845
   25   HG12  VAL  20          HG12      VAL  20 -65.290  30.226  16.200
   26   HG13  VAL  20          HG13      VAL  20 -63.564  29.887  16.057
   27   HG21  VAL  20          HG21      VAL  20 -66.416  31.382  14.859
   28   HG22  VAL  20          HG22      VAL  20 -65.701  32.990  14.735
   29   HG23  VAL  20          HG23      VAL  20 -65.796  31.955  13.311
   30    H    LEU  21           H        LEU  21 -61.798  32.571  16.821
   31    HA   LEU  21           HA       LEU  21 -59.336  31.666  15.670
   32    HB2  LEU  21           HB1      LEU  21 -60.182  32.101  18.539
   33    HB3  LEU  21           HB2      LEU  21 -58.535  31.687  18.027
   34    HG   LEU  21           HG       LEU  21 -59.070  33.923  16.529
   35   HD11  LEU  21          HD11      LEU  21 -60.109  34.525  19.280
   36   HD12  LEU  21          HD12      LEU  21 -61.179  34.141  17.933
   37   HD13  LEU  21          HD13      LEU  21 -60.125  35.552  17.846
   38   HD21  LEU  21          HD21      LEU  21 -57.011  34.006  17.434
   39   HD22  LEU  21          HD22      LEU  21 -57.526  33.254  18.943
   40   HD23  LEU  21          HD23      LEU  21 -57.810  34.974  18.673
   41    H    ASP  22           H        ASP  22 -58.800  29.632  15.280
   42    HA   ASP  22           HA       ASP  22 -60.076  27.506  16.873
   43    HB2  ASP  22           HB1      ASP  22 -59.597  27.809  13.979
   44    HB3  ASP  22           HB2      ASP  22 -59.168  26.223  14.637
   45    HD2  ASP  22           HD       ASP  22 -63.001  27.266  14.774
   46    H    PHE  23           H        PHE  23 -57.211  27.780  14.765
   47    HA   PHE  23           HA       PHE  23 -55.515  26.948  16.992
   48    HB2  PHE  23           HB1      PHE  23 -55.707  25.483  14.348
   49    HB3  PHE  23           HB2      PHE  23 -54.397  25.251  15.508
   50    HD1  PHE  23           HD1      PHE  23 -57.910  24.598  14.797
   51    HD2  PHE  23           HD2      PHE  23 -54.774  24.143  17.639
   52    HE1  PHE  23           HE1      PHE  23 -59.244  22.912  15.994
   53    HE2  PHE  23           HE2      PHE  23 -56.102  22.456  18.840
   54    HZ   PHE  23           HZ       PHE  23 -58.339  21.838  18.018
   55    H    ASN  24           H        ASN  24 -53.177  27.120  16.438
   56    HA   ASN  24           HA       ASN  24 -52.667  29.085  14.312
   57    HB2  ASN  24           HB1      ASN  24 -51.788  29.237  17.203
   58    HB3  ASN  24           HB2      ASN  24 -51.034  30.188  15.920
   59   HD21  ASN  24          HD21      ASN  24 -52.034  31.968  15.142
   60   HD22  ASN  24          HD22      ASN  24 -53.531  32.580  15.751
   61    H    ASN  25           H        ASN  25 -50.430  29.188  13.618
   62    HA   ASN  25           HA       ASN  25 -48.489  28.245  12.902
   63    HB2  ASN  25           HB1      ASN  25 -48.326  28.130  15.567
   64    HB3  ASN  25           HB2      ASN  25 -48.341  26.394  15.231
   65   HD21  ASN  25          HD21      ASN  25 -46.184  26.489  16.168
   66   HD22  ASN  25          HD22      ASN  25 -44.849  26.894  15.149
   67    H    ILE  26           H        ILE  26 -47.408  25.964  12.549
   68    HA   ILE  26           HA       ILE  26 -49.555  24.150  11.663
   69    HB   ILE  26           HB       ILE  26 -46.786  24.459  10.494
   70   HG12  ILE  26          HG11      ILE  26 -48.229  26.403  10.057
   71   HG13  ILE  26          HG12      ILE  26 -47.908  25.481   8.579
   72   HG21  ILE  26          HG21      ILE  26 -47.487  22.221  10.172
   73   HG22  ILE  26          HG22      ILE  26 -49.126  22.720   9.754
   74   HG23  ILE  26          HG23      ILE  26 -47.792  23.059   8.650
   75   HD11  ILE  26          HD11      ILE  26 -50.071  25.236   8.210
   76   HD12  ILE  26          HD12      ILE  26 -50.291  24.488   9.792
   77   HD13  ILE  26          HD13      ILE  26 -50.398  26.240   9.623
   78    H    ARG  27           H        ARG  27 -49.533  22.068  12.297
   79    HA   ARG  27           HA       ARG  27 -47.162  21.095  13.748
   80    HB2  ARG  27           HB1      ARG  27 -50.037  20.503  14.484
   81    HB3  ARG  27           HB2      ARG  27 -48.587  19.996  15.363
   82    HG2  ARG  27           HG1      ARG  27 -48.238  22.685  15.344
   83    HG3  ARG  27           HG2      ARG  27 -50.003  22.565  15.388
   84    HD2  ARG  27           HD1      ARG  27 -49.626  22.462  17.628
   85    HD3  ARG  27           HD2      ARG  27 -49.433  20.744  17.250
   86    HE   ARG  27           HE       ARG  27 -47.215  20.913  17.781
   87   HH11  ARG  27          HH11      ARG  27 -48.501  24.106  17.260
   88   HH12  ARG  27          HH12      ARG  27 -47.064  24.914  17.794
   89   HH21  ARG  27          HH21      ARG  27 -45.318  21.965  18.485
   90   HH22  ARG  27          HH22      ARG  27 -45.254  23.694  18.490
   91    H    SER  28           H        SER  28 -47.545  18.578  14.147
   92    HA   SER  28           HA       SER  28 -47.495  16.515  13.188
   93    HB2  SER  28           HB1      SER  28 -50.025  17.713  12.444
   94    HB3  SER  28           HB2      SER  28 -49.454  16.615  11.175
   95    HG   SER  28           HG       SER  28 -50.541  15.340  12.585
   96    H    SER  29           H        SER  29 -45.477  16.697  12.220
   97    HA   SER  29           HA       SER  29 -45.535  16.760   9.315
   98    HB2  SER  29           HB1      SER  29 -44.441  18.925  10.948
   99    HB3  SER  29           HB2      SER  29 -43.247  18.241   9.832
  100    HG   SER  29           HG       SER  29 -44.649  19.996   9.012
  101    H    ALA  30           H        ALA  30 -44.259  15.229   8.494
  102    HA   ALA  30           HA       ALA  30 -41.973  14.272  10.067
  103    HB1  ALA  30           HB1      ALA  30 -44.143  12.529   8.910
  104    HB2  ALA  30           HB2      ALA  30 -42.597  11.927   9.511
  105    HB3  ALA  30           HB3      ALA  30 -43.720  12.726  10.611
  106    H    ASP  31           H        ASP  31 -40.396  13.084   8.816
  107    HA   ASP  31           HA       ASP  31 -40.596  12.958   5.964
  108    HB2  ASP  31           HB1      ASP  31 -38.864  14.561   5.403
  109    HB3  ASP  31           HB2      ASP  31 -40.164  15.378   6.282
  110    HD2  ASP  31           HD       ASP  31 -38.110  16.040   9.008
  111    H    LEU  32           H        LEU  32 -38.207  12.568   5.071
  112    HA   LEU  32           HA       LEU  32 -37.061  10.516   6.836
  113    HB2  LEU  32           HB1      LEU  32 -36.799  10.863   3.845
  114    HB3  LEU  32           HB2      LEU  32 -36.117   9.538   4.804
  115    HG   LEU  32           HG       LEU  32 -38.717   9.269   5.444
  116   HD11  LEU  32          HD11      LEU  32 -39.062   9.766   2.564
  117   HD12  LEU  32          HD12      LEU  32 -38.939  11.202   3.579
  118   HD13  LEU  32          HD13      LEU  32 -40.186   9.998   3.904
  119   HD21  LEU  32          HD21      LEU  32 -38.545   7.808   3.116
  120   HD22  LEU  32          HD22      LEU  32 -37.987   7.293   4.709
  121   HD23  LEU  32          HD23      LEU  32 -36.858   8.037   3.575
  122    H    HIS  33           H        HIS  33 -35.051  10.713   7.600
  123    HA   HIS  33           HA       HIS  33 -33.405  12.928   6.574
  124    HB2  HIS  33           HB1      HIS  33 -34.200  13.029   8.974
  125    HB3  HIS  33           HB2      HIS  33 -33.178  11.623   9.289
  126    HD1  HIS  33           HD1      HIS  33 -30.824  12.085   9.925
  127    HD2  HIS  33           HD2      HIS  33 -32.589  15.324   8.013
  128    HE1  HIS  33           HE1      HIS  33 -29.133  13.942  10.048
  129    HE2  HIS  33           HE2      HIS  33 -30.211  15.923   8.879
  130    H    GLY  34           H        GLY  34 -31.049  12.607   6.657
  131    HA2  GLY  34           HA2      GLY  34 -30.157   9.825   6.643
  132    HA3  GLY  34           HA3      GLY  34 -30.002  10.715   5.135
  133    HA1  GLY  34           HA1      GLY  34 -30.134  10.470   7.243
  134    H    ALA  35           H        ALA  35 -28.036  11.485   4.805
  135    HA   ALA  35           HA       ALA  35 -26.661  13.118   6.640
  136    HB1  ALA  35           HB1      ALA  35 -25.787  11.541   7.969
  137    HB2  ALA  35           HB2      ALA  35 -26.126  10.247   6.819
  138    HB3  ALA  35           HB3      ALA  35 -24.682  11.242   6.626
  139    H    ARG  36           H        ARG  36 -24.373  13.570   5.880
  140    HA   ARG  36           HA       ARG  36 -23.964  12.985   3.044
  141    HB2  ARG  36           HB1      ARG  36 -24.460  15.678   4.245
  142    HB3  ARG  36           HB2      ARG  36 -23.304  15.543   2.912
  143    HG2  ARG  36           HG1      ARG  36 -24.927  14.835   1.393
  144    HG3  ARG  36           HG2      ARG  36 -26.058  14.393   2.682
  145    HD2  ARG  36           HD1      ARG  36 -25.187  17.244   2.453
  146    HD3  ARG  36           HD2      ARG  36 -26.371  16.610   1.302
  147    HE   ARG  36           HE       ARG  36 -26.818  17.229   4.053
  148   HH11  ARG  36          HH11      ARG  36 -27.811  15.156   1.439
  149   HH12  ARG  36          HH12      ARG  36 -29.397  14.887   2.081
  150   HH21  ARG  36          HH21      ARG  36 -28.903  16.882   4.910
  151   HH22  ARG  36          HH22      ARG  36 -30.017  15.869   4.056
  152    H    LYS  37           H        LYS  37 -22.316  11.645   4.134
  153    HA   LYS  37           HA       LYS  37 -19.835  13.164   4.407
  154    HB2  LYS  37           HB1      LYS  37 -21.164  11.615   6.541
  155    HB3  LYS  37           HB2      LYS  37 -19.440  11.271   6.325
  156    HG2  LYS  37           HG1      LYS  37 -18.831  13.174   7.300
  157    HG3  LYS  37           HG2      LYS  37 -19.970  14.116   6.322
  158    HD2  LYS  37           HD1      LYS  37 -21.503  14.196   7.959
  159    HD3  LYS  37           HD2      LYS  37 -21.280  12.482   8.357
  160    HE2  LYS  37           HE1      LYS  37 -19.011  14.205   9.102
  161    HE3  LYS  37           HE2      LYS  37 -20.525  14.568   9.944
  162    HZ1  LYS  37           HZ1      LYS  37 -18.879  12.773  10.855
  163    HZ2  LYS  37           HZ2      LYS  37 -19.682  11.767   9.757
  164    HZ3  LYS  37           HZ3      LYS  37 -20.552  12.551  10.978
  165    H    GLY  38           H        GLY  38 -18.281  12.282   3.208
  166    HA2  GLY  38           HA2      GLY  38 -17.839   9.472   3.039
  167    HA3  GLY  38           HA3      GLY  38 -18.610  10.075   1.579
  168    HA1  GLY  38           HA1      GLY  38 -17.449  10.196   3.357
  169    H    SER  39           H        SER  39 -17.419  12.515   1.248
  170    HA   SER  39           HA       SER  39 -15.598  13.462   0.263
  171    HB2  SER  39           HB1      SER  39 -14.870  12.769   2.834
  172    HB3  SER  39           HB2      SER  39 -13.581  12.049   1.853
  173    HG   SER  39           HG       SER  39 -12.827  13.968   1.483
  174    H    GLN  40           H        GLN  40 -13.106  12.700  -0.388
  175    HA   GLN  40           HA       GLN  40 -13.583  10.731  -2.425
  176    HB2  GLN  40           HB1      GLN  40 -11.547  12.747  -1.809
  177    HB3  GLN  40           HB2      GLN  40 -10.884  11.258  -2.500
  178    HG2  GLN  40           HG1      GLN  40 -11.284  12.689  -4.323
  179    HG3  GLN  40           HG2      GLN  40 -12.582  11.487  -4.344
  180   HE21  GLN  40          HE21      GLN  40 -13.074  13.642  -5.750
  181   HE22  GLN  40          HE22      GLN  40 -14.184  14.702  -4.957
  182    H    CYS  41           H        CYS  41 -11.065  10.995   0.091
  183    HA   CYS  41           HA       CYS  41 -11.372   8.214   0.788
  184    HB2  CYS  41           HB1      CYS  41  -9.192   7.461   0.182
  185    HB3  CYS  41           HB2      CYS  41  -9.905   8.193  -1.256
  186    H    LEU  42           H        LEU  42 -10.538   7.733   2.792
  187    HA   LEU  42           HA       LEU  42  -9.668  10.033   4.362
  188    HB2  LEU  42           HB1      LEU  42 -10.801   7.334   4.994
  189    HB3  LEU  42           HB2      LEU  42  -9.903   8.224   6.237
  190    HG   LEU  42           HG       LEU  42 -11.633  10.137   5.494
  191   HD11  LEU  42          HD11      LEU  42 -13.873   8.780   5.433
  192   HD12  LEU  42          HD12      LEU  42 -12.852   7.533   4.719
  193   HD13  LEU  42          HD13      LEU  42 -12.981   9.113   3.948
  194   HD21  LEU  42          HD21      LEU  42 -12.866   9.624   7.475
  195   HD22  LEU  42          HD22      LEU  42 -11.176   9.209   7.766
  196   HD23  LEU  42          HD23      LEU  42 -12.351   7.937   7.423
  197    H    SER  43           H        SER  43  -8.489   6.987   3.154
  198    HA   SER  43           HA       SER  43  -5.784   7.717   3.800
  199    HB2  SER  43           HB1      SER  43  -6.982   6.452   5.839
  200    HB3  SER  43           HB2      SER  43  -6.500   5.038   4.885
  201    HG   SER  43           HG       SER  43  -4.772   7.115   5.765
  202    H    ASP  44           H        ASP  44  -4.287   5.767   3.187
  203    HA   ASP  44           HA       ASP  44  -4.684   5.231   0.467
  204    HB2  ASP  44           HB1      ASP  44  -2.920   3.568   2.266
  205    HB3  ASP  44           HB2      ASP  44  -2.687   3.960   0.557
  206    HD2  ASP  44           HD       ASP  44  -1.829   7.335   1.586
  207    H    THR  45           H        THR  45  -5.598   3.465   3.327
  208    HA   THR  45           HA       THR  45  -6.006   0.920   2.281
  209    HB   THR  45           HB       THR  45  -7.979   0.930   4.047
  210    HG1  THR  45           HG1      THR  45  -6.441   2.993   5.176
  211   HG21  THR  45          HG21      THR  45  -5.624  -0.109   4.143
  212   HG22  THR  45          HG22      THR  45  -6.456   0.200   5.667
  213   HG23  THR  45          HG23      THR  45  -5.197   1.301   5.111
  214    H    ASP  46           H        ASP  46  -7.829   3.835   1.842
  215    HA   ASP  46           HA       ASP  46 -10.265   2.640   0.991
  216    HB2  ASP  46           HB1      ASP  46  -9.080   5.391   0.565
  217    HB3  ASP  46           HB2      ASP  46 -10.685   4.928  -0.019
  218    HD2  ASP  46           HD       ASP  46 -12.082   5.318   3.084
  219    H    CYS  47           H        CYS  47  -7.246   3.360  -0.568
  220    HA   CYS  47           HA       CYS  47  -8.167   3.285  -3.251
  221    HB2  CYS  47           HB1      CYS  47  -5.428   2.781  -2.062
  222    HB3  CYS  47           HB2      CYS  47  -5.748   2.902  -3.794
  223    H    ASN  48           H        ASN  48  -6.830   1.521  -4.685
  224    HA   ASN  48           HA       ASN  48  -8.269  -0.829  -4.537
  225    HB2  ASN  48           HB1      ASN  48  -7.132  -0.222  -6.569
  226    HB3  ASN  48           HB2      ASN  48  -5.558  -0.307  -5.767
  227   HD21  ASN  48          HD21      ASN  48  -4.736  -1.824  -7.172
  228   HD22  ASN  48          HD22      ASN  48  -5.263  -3.470  -7.183
  229    H    THR  49           H        THR  49  -4.759  -0.765  -3.951
  230    HA   THR  49           HA       THR  49  -5.016  -2.152  -1.444
  231    HB   THR  49           HB       THR  49  -3.793  -3.623  -3.786
  232    HG1  THR  49           HG1      THR  49  -5.525  -5.097  -3.368
  233   HG21  THR  49          HG21      THR  49  -3.311  -3.817  -0.980
  234   HG22  THR  49          HG22      THR  49  -2.643  -4.799  -2.284
  235   HG23  THR  49          HG23      THR  49  -4.155  -5.272  -1.509
  236    H    ARG  50           H        ARG  50  -2.513  -2.144  -3.980
  237    HA   ARG  50           HA       ARG  50  -0.617  -1.081  -2.024
  238    HB2  ARG  50           HB1      ARG  50  -0.227  -2.311  -4.760
  239    HB3  ARG  50           HB2      ARG  50   1.088  -1.668  -3.765
  240    HG2  ARG  50           HG1      ARG  50  -0.742  -3.946  -3.003
  241    HG3  ARG  50           HG2      ARG  50   0.927  -4.093  -3.577
  242    HD2  ARG  50           HD1      ARG  50   1.616  -2.646  -1.617
  243    HD3  ARG  50           HD2      ARG  50  -0.034  -2.842  -1.013
  244    HE   ARG  50           HE       ARG  50   1.000  -5.384  -1.542
  245   HH11  ARG  50          HH11      ARG  50   1.532  -2.710   0.625
  246   HH12  ARG  50          HH12      ARG  50   2.133  -3.704   1.912
  247   HH21  ARG  50          HH21      ARG  50   1.789  -6.701   0.144
  248   HH22  ARG  50          HH22      ARG  50   2.280  -5.974   1.637
  249    H    LYS  51           H        LYS  51  -2.323   0.860  -2.636
  250    HA   LYS  51           HA       LYS  51  -0.699   2.670  -4.264
  251    HB2  LYS  51           HB1      LYS  51  -3.693   2.317  -4.555
  252    HB3  LYS  51           HB2      LYS  51  -2.743   3.603  -5.317
  253    HG2  LYS  51           HG1      LYS  51  -1.443   1.891  -6.538
  254    HG3  LYS  51           HG2      LYS  51  -2.490   0.647  -5.833
  255    HD2  LYS  51           HD1      LYS  51  -4.328   1.272  -7.081
  256    HD3  LYS  51           HD2      LYS  51  -3.746   2.934  -7.280
  257    HE2  LYS  51           HE1      LYS  51  -2.277   2.367  -8.995
  258    HE3  LYS  51           HE2      LYS  51  -2.239   0.664  -8.514
  259    HZ1  LYS  51           HZ1      LYS  51  -3.526   0.755 -10.454
  260    HZ2  LYS  51           HZ2      LYS  51  -4.402   2.104  -9.930
  261    HZ3  LYS  51           HZ3      LYS  51  -4.652   0.598  -9.201
  262    H    PHE  52           H        PHE  52  -0.480   4.651  -3.395
  263    HA   PHE  52           HA       PHE  52  -1.842   5.166  -0.867
  264    HB2  PHE  52           HB1      PHE  52  -0.182   6.938  -0.546
  265    HB3  PHE  52           HB2      PHE  52   0.598   5.400  -0.922
  266    HD1  PHE  52           HD1      PHE  52   1.832   5.068  -2.942
  267    HD2  PHE  52           HD2      PHE  52  -0.213   8.732  -2.226
  268    HE1  PHE  52           HE1      PHE  52   3.057   6.113  -4.804
  269    HE2  PHE  52           HE2      PHE  52   1.008   9.781  -4.086
  270    HZ   PHE  52           HZ       PHE  52   2.645   8.471  -5.379
  271    H    CYS  53           H        CYS  53  -3.095   6.959  -0.458
  272    HA   CYS  53           HA       CYS  53  -4.325   8.171  -2.786
  273    HB2  CYS  53           HB1      CYS  53  -5.302   7.369  -0.361
  274    HB3  CYS  53           HB2      CYS  53  -5.147   9.109  -0.118
  275    H    LEU  54           H        LEU  54  -3.098   9.736  -3.674
  276    HA   LEU  54           HA       LEU  54  -1.625  11.609  -2.039
  277    HB2  LEU  54           HB1      LEU  54  -0.728  10.756  -4.173
  278    HB3  LEU  54           HB2      LEU  54  -2.063  11.556  -5.023
  279    HG   LEU  54           HG       LEU  54  -0.752  13.534  -3.480
  280   HD11  LEU  54          HD11      LEU  54   1.496  13.358  -4.690
  281   HD12  LEU  54          HD12      LEU  54   1.100  11.653  -4.901
  282   HD13  LEU  54          HD13      LEU  54   1.237  12.331  -3.279
  283   HD21  LEU  54          HD21      LEU  54  -1.965  13.485  -5.802
  284   HD22  LEU  54          HD22      LEU  54  -0.332  13.219  -6.415
  285   HD23  LEU  54          HD23      LEU  54  -0.697  14.667  -5.476
  286    H    GLN  55           H        GLN  55  -2.256  13.584  -1.433
  287    HA   GLN  55           HA       GLN  55  -4.736  14.657  -2.609
  288    HB2  GLN  55           HB1      GLN  55  -3.755  15.190   0.198
  289    HB3  GLN  55           HB2      GLN  55  -5.345  15.564  -0.487
  290    HG2  GLN  55           HG1      GLN  55  -5.720  13.097  -0.751
  291    HG3  GLN  55           HG2      GLN  55  -4.233  12.852   0.177
  292   HE21  GLN  55          HE21      GLN  55  -4.307  12.933   2.337
  293   HE22  GLN  55          HE22      GLN  55  -5.705  13.346   3.263
  294    HA   PRO  56           HA       PRO  56  -1.476  17.710  -3.628
  295    HB2  PRO  56           HB1      PRO  56  -2.662  18.512  -5.964
  296    HB3  PRO  56           HB2      PRO  56  -1.621  17.094  -5.837
  297    HG2  PRO  56           HG1      PRO  56  -4.616  17.268  -5.783
  298    HG3  PRO  56           HG2      PRO  56  -3.556  16.120  -6.686
  299    HD2  PRO  56           HD1      PRO  56  -4.826  15.440  -4.385
  300    HD3  PRO  56           HD2      PRO  56  -3.233  14.802  -4.824
  301    H    ARG  57           H        ARG  57  -1.511  19.953  -3.491
  302    HA   ARG  57           HA       ARG  57  -3.855  21.070  -2.220
  303    HB2  ARG  57           HB1      ARG  57  -1.301  21.462  -1.696
  304    HB3  ARG  57           HB2      ARG  57  -1.463  22.713  -2.938
  305    HG2  ARG  57           HG1      ARG  57  -2.650  24.081  -1.610
  306    HG3  ARG  57           HG2      ARG  57  -3.560  22.743  -0.887
  307    HD2  ARG  57           HD1      ARG  57  -1.279  22.176   0.268
  308    HD3  ARG  57           HD2      ARG  57  -0.903  23.864  -0.106
  309    HE   ARG  57           HE       ARG  57  -3.363  23.936   1.104
  310   HH11  ARG  57          HH11      ARG  57  -0.195  22.765   1.949
  311   HH12  ARG  57          HH12      ARG  57  -0.405  23.034   3.647
  312   HH21  ARG  57          HH21      ARG  57  -3.652  24.297   3.338
  313   HH22  ARG  57          HH22      ARG  57  -2.373  23.905   4.436
  314    H    ASP  58           H        ASP  58  -2.330  21.145  -5.334
  315    HA   ASP  58           HA       ASP  58  -3.897  23.432  -6.223
  316    HB2  ASP  58           HB1      ASP  58  -1.547  21.951  -7.196
  317    HB3  ASP  58           HB2      ASP  58  -2.674  22.435  -8.469
  318    HD2  ASP  58           HD       ASP  58  -1.343  25.573  -8.414
  319    H    GLU  59           H        GLU  59  -4.008  19.987  -6.276
  320    HA   GLU  59           HA       GLU  59  -6.347  20.107  -8.065
  321    HB2  GLU  59           HB1      GLU  59  -3.973  18.700  -8.485
  322    HB3  GLU  59           HB2      GLU  59  -5.123  17.480  -7.918
  323    HG2  GLU  59           HG1      GLU  59  -6.730  18.386  -9.670
  324    HG3  GLU  59           HG2      GLU  59  -5.333  19.247 -10.332
  325    HE2  GLU  59           HE       GLU  59  -5.682  15.892 -11.833
  326    H    LYS  60           H        LYS  60  -7.557  17.818  -7.763
  327    HA   LYS  60           HA       LYS  60  -8.419  17.848  -4.992
  328    HB2  LYS  60           HB1      LYS  60  -9.541  17.016  -7.576
  329    HB3  LYS  60           HB2      LYS  60  -9.930  15.922  -6.239
  330    HG2  LYS  60           HG1      LYS  60 -11.327  17.383  -5.261
  331    HG3  LYS  60           HG2      LYS  60 -10.287  18.770  -5.633
  332    HD2  LYS  60           HD1      LYS  60 -11.050  18.532  -8.046
  333    HD3  LYS  60           HD2      LYS  60 -12.280  17.411  -7.434
  334    HE2  LYS  60           HE1      LYS  60 -13.528  19.057  -6.520
  335    HE3  LYS  60           HE2      LYS  60 -12.103  19.958  -5.981
  336    HZ1  LYS  60           HZ1      LYS  60 -12.708  21.362  -7.602
  337    HZ2  LYS  60           HZ2      LYS  60 -13.620  20.206  -8.433
  338    HZ3  LYS  60           HZ3      LYS  60 -11.941  20.261  -8.633
  339    HA   PRO  61           HA       PRO  61  -6.464  14.160  -3.642
  340    HB2  PRO  61           HB1      PRO  61  -8.411  12.977  -2.120
  341    HB3  PRO  61           HB2      PRO  61  -7.544  14.432  -1.632
  342    HG2  PRO  61           HG1      PRO  61 -10.233  14.168  -2.934
  343    HG3  PRO  61           HG2      PRO  61  -9.737  15.201  -1.542
  344    HD2  PRO  61           HD1      PRO  61 -10.028  16.175  -4.061
  345    HD3  PRO  61           HD2      PRO  61  -8.813  16.795  -2.929
  346    H    PHE  62           H        PHE  62  -6.130  12.065  -4.243
  347    HA   PHE  62           HA       PHE  62  -8.187  10.367  -5.248
  348    HB2  PHE  62           HB1      PHE  62  -7.591  10.235  -7.548
  349    HB3  PHE  62           HB2      PHE  62  -7.796  11.949  -7.179
  350    HD1  PHE  62           HD1      PHE  62  -5.721  13.335  -6.680
  351    HD2  PHE  62           HD2      PHE  62  -5.579   9.476  -8.469
  352    HE1  PHE  62           HE1      PHE  62  -3.463  13.817  -7.532
  353    HE2  PHE  62           HE2      PHE  62  -3.321   9.951  -9.323
  354    HZ   PHE  62           HZ       PHE  62  -2.260  12.124  -8.855
  355    H    CYS  63           H        CYS  63  -7.070   8.391  -6.410
  356    HA   CYS  63           HA       CYS  63  -4.942   7.543  -4.603
  357    HB2  CYS  63           HB1      CYS  63  -6.768   6.062  -6.498
  358    HB3  CYS  63           HB2      CYS  63  -5.411   5.276  -5.690
  359    H    ALA  64           H        ALA  64  -2.882   7.406  -5.198
  360    HA   ALA  64           HA       ALA  64  -2.236   7.669  -8.054
  361    HB1  ALA  64           HB1      ALA  64  -0.735   8.420  -5.565
  362    HB2  ALA  64           HB2      ALA  64   0.060   8.305  -7.135
  363    HB3  ALA  64           HB3      ALA  64  -1.256   9.454  -6.896
  364    H    THR  65           H        THR  65  -0.609   6.371  -8.985
  365    HA   THR  65           HA       THR  65  -0.565   3.678  -7.989
  366    HB   THR  65           HB       THR  65   1.238   4.491 -10.215
  367    HG1  THR  65           HG1      THR  65  -0.333   5.336 -11.340
  368   HG21  THR  65          HG21      THR  65   1.148   2.305 -10.633
  369   HG22  THR  65          HG22      THR  65  -0.609   2.367 -10.770
  370   HG23  THR  65          HG23      THR  65   0.144   2.105  -9.197
  371    H    CYS  66           H        CYS  66   1.468   2.434  -7.791
  372    HA   CYS  66           HA       CYS  66   3.172   3.557  -5.866
  373    HB2  CYS  66           HB1      CYS  66   2.744   1.131  -6.112
  374    HB3  CYS  66           HB2      CYS  66   3.670   1.137  -7.614
  375    H    ARG  67           H        ARG  67   5.198   4.427  -5.950
  376    HA   ARG  67           HA       ARG  67   6.050   5.418  -8.552
  377    HB2  ARG  67           HB1      ARG  67   6.431   6.206  -5.737
  378    HB3  ARG  67           HB2      ARG  67   7.848   6.435  -6.772
  379    HG2  ARG  67           HG1      ARG  67   6.665   8.479  -6.805
  380    HG3  ARG  67           HG2      ARG  67   6.356   7.689  -8.361
  381    HD2  ARG  67           HD1      ARG  67   4.170   7.043  -7.734
  382    HD3  ARG  67           HD2      ARG  67   4.489   7.388  -6.027
  383    HE   ARG  67           HE       ARG  67   3.930   9.568  -6.408
  384   HH11  ARG  67          HH11      ARG  67   4.658   8.048  -9.454
  385   HH12  ARG  67          HH12      ARG  67   4.169   9.414 -10.401
  386   HH21  ARG  67          HH21      ARG  67   3.283  11.373  -7.644
  387   HH22  ARG  67          HH22      ARG  67   3.388  11.305  -9.370
  388    H    GLY  68           H        GLY  68   8.038   5.012  -9.488
  389    HA2  GLY  68           HA2      GLY  68   9.247   2.491  -8.770
  390    HA3  GLY  68           HA3      GLY  68   9.676   3.504 -10.139
  391    HA1  GLY  68           HA1      GLY  68   9.174   3.080  -8.119
  392    H    LEU  69           H        LEU  69  11.817   2.575  -9.191
  393    HA   LEU  69           HA       LEU  69  12.863   3.848  -6.861
  394    HB2  LEU  69           HB1      LEU  69  14.036   2.200  -9.081
  395    HB3  LEU  69           HB2      LEU  69  15.081   3.007  -7.899
  396    HG   LEU  69           HG       LEU  69  12.957   0.968  -7.232
  397   HD11  LEU  69          HD11      LEU  69  14.832  -0.523  -6.760
  398   HD12  LEU  69          HD12      LEU  69  15.959   0.708  -7.327
  399   HD13  LEU  69          HD13      LEU  69  14.817  -0.027  -8.452
  400   HD21  LEU  69          HD21      LEU  69  14.983   2.439  -5.561
  401   HD22  LEU  69          HD22      LEU  69  14.157   0.977  -5.022
  402   HD23  LEU  69          HD23      LEU  69  13.228   2.433  -5.384
  403    H    ARG  70           H        ARG  70  12.624   4.699 -10.194
  404    HA   ARG  70           HA       ARG  70  14.646   6.791  -9.962
  405    HB2  ARG  70           HB1      ARG  70  12.897   6.055 -12.322
  406    HB3  ARG  70           HB2      ARG  70  14.290   7.148 -12.343
  407    HG2  ARG  70           HG1      ARG  70  15.461   4.930 -11.351
  408    HG3  ARG  70           HG2      ARG  70  14.195   4.208 -12.360
  409    HD2  ARG  70           HD1      ARG  70  14.979   5.712 -14.239
  410    HD3  ARG  70           HD2      ARG  70  16.361   6.120 -13.211
  411    HE   ARG  70           HE       ARG  70  16.220   3.340 -13.367
  412   HH11  ARG  70          HH11      ARG  70  16.804   6.062 -15.459
  413   HH12  ARG  70          HH12      ARG  70  17.831   5.178 -16.539
  414   HH21  ARG  70          HH21      ARG  70  17.571   2.166 -14.782
  415   HH22  ARG  70          HH22      ARG  70  18.264   2.961 -16.154
  416    H    ARG  71           H        ARG  71  11.765   6.620  -8.750
  417    HA   ARG  71           HA       ARG  71  10.696   9.136  -9.798
  418    HB2  ARG  71           HB1      ARG  71   9.578   6.899  -8.143
  419    HB3  ARG  71           HB2      ARG  71   8.813   8.495  -8.094
  420    HG2  ARG  71           HG1      ARG  71   9.289   6.916 -10.622
  421    HG3  ARG  71           HG2      ARG  71   7.771   6.933  -9.709
  422    HD2  ARG  71           HD1      ARG  71   7.740   9.442  -9.983
  423    HD3  ARG  71           HD2      ARG  71   9.102   9.251 -11.096
  424    HE   ARG  71           HE       ARG  71   7.276   7.574 -12.138
  425   HH11  ARG  71          HH11      ARG  71   7.097  10.893 -11.105
  426   HH12  ARG  71          HH12      ARG  71   5.870  11.321 -12.250
  427   HH21  ARG  71          HH21      ARG  71   5.659   8.124 -13.650
  428   HH22  ARG  71          HH22      ARG  71   5.052   9.744 -13.697
  429    H    ARG  72           H        ARG  72  10.969  11.002  -8.768
  430    HA   ARG  72           HA       ARG  72  12.552  11.212  -6.440
  431    HB2  ARG  72           HB1      ARG  72  10.745  13.241  -7.778
  432    HB3  ARG  72           HB2      ARG  72  11.910  13.617  -6.499
  433    HG2  ARG  72           HG1      ARG  72  12.846  12.257  -8.995
  434    HG3  ARG  72           HG2      ARG  72  12.545  14.002  -8.988
  435    HD2  ARG  72           HD1      ARG  72  13.998  13.597  -6.663
  436    HD3  ARG  72           HD2      ARG  72  14.740  12.489  -7.827
  437    HE   ARG  72           HE       ARG  72  15.642  14.293  -8.888
  438   HH11  ARG  72          HH11      ARG  72  12.925  15.365  -6.992
  439   HH12  ARG  72          HH12      ARG  72  13.191  17.045  -7.322
  440   HH21  ARG  72          HH21      ARG  72  16.002  16.501  -9.330
  441   HH22  ARG  72          HH22      ARG  72  14.940  17.690  -8.652
  442    H    CYS  73           H        CYS  73  12.047  11.260  -4.336
  443    HA   CYS  73           HA       CYS  73   9.266  11.693  -3.530
  444    HB2  CYS  73           HB1      CYS  73   9.162   9.746  -2.165
  445    HB3  CYS  73           HB2      CYS  73   9.702   9.221  -3.761
  446    H    GLN  74           H        GLN  74   9.007  12.367  -1.355
  447    HA   GLN  74           HA       GLN  74  11.492  13.383  -0.142
  448    HB2  GLN  74           HB1      GLN  74  10.003  15.156  -0.949
  449    HB3  GLN  74           HB2      GLN  74   8.691  14.506   0.047
  450    HG2  GLN  74           HG1      GLN  74   9.549  16.359   1.222
  451    HG3  GLN  74           HG2      GLN  74  10.148  14.915   2.052
  452   HE21  GLN  74          HE21      GLN  74  11.337  17.372   2.390
  453   HE22  GLN  74          HE22      GLN  74  12.915  17.347   1.685
  454    H    ARG  75           H        ARG  75   8.598  11.548   0.350
  455    HA   ARG  75           HA       ARG  75   9.475  10.971   3.098
  456    HB2  ARG  75           HB1      ARG  75   7.057  10.714   3.710
  457    HB3  ARG  75           HB2      ARG  75   7.552  12.373   3.340
  458    HG2  ARG  75           HG1      ARG  75   6.690  11.312   0.899
  459    HG3  ARG  75           HG2      ARG  75   5.519  10.757   2.108
  460    HD2  ARG  75           HD1      ARG  75   4.548  12.763   1.861
  461    HD3  ARG  75           HD2      ARG  75   5.902  13.377   2.820
  462    HE   ARG  75           HE       ARG  75   6.665  13.280   0.116
  463   HH11  ARG  75          HH11      ARG  75   4.548  15.032   2.253
  464   HH12  ARG  75          HH12      ARG  75   4.597  16.491   1.319
  465   HH21  ARG  75          HH21      ARG  75   6.738  15.194  -1.123
  466   HH22  ARG  75          HH22      ARG  75   5.843  16.580  -0.603
  467    H    ASP  76           H        ASP  76   9.700   8.872   3.551
  468    HA   ASP  76           HA       ASP  76   9.586   6.895   1.595
  469    HB2  ASP  76           HB1      ASP  76   9.312   6.322   4.546
  470    HB3  ASP  76           HB2      ASP  76  10.102   5.338   3.306
  471    HD2  ASP  76           HD       ASP  76  13.093   6.909   3.806
  472    H    ALA  77           H        ALA  77   7.106   8.154   3.641
  473    HA   ALA  77           HA       ALA  77   5.306   6.025   3.709
  474    HB1  ALA  77           HB1      ALA  77   4.879   7.892   5.095
  475    HB2  ALA  77           HB2      ALA  77   4.862   9.000   3.722
  476    HB3  ALA  77           HB3      ALA  77   3.556   7.833   3.931
  477    H    MET  78           H        MET  78   5.705   8.591   1.288
  478    HA   MET  78           HA       MET  78   3.558   7.719  -0.359
  479    HB2  MET  78           HB1      MET  78   4.283   9.333  -1.931
  480    HB3  MET  78           HB2      MET  78   4.612  10.025  -0.335
  481    HG2  MET  78           HG1      MET  78   6.702  10.390  -0.969
  482    HG3  MET  78           HG2      MET  78   6.933   8.641  -1.030
  483    HE1  MET  78           HE1      MET  78   4.598  10.775  -3.655
  484    HE2  MET  78           HE2      MET  78   5.802  11.765  -2.831
  485    HE3  MET  78           HE3      MET  78   5.975  11.413  -4.551
  486    H    CYS  79           H        CYS  79   6.763   6.620   0.104
  487    HA   CYS  79           HA       CYS  79   6.909   5.309  -2.492
  488    HB2  CYS  79           HB1      CYS  79   8.867   6.426  -1.166
  489    HB3  CYS  79           HB2      CYS  79   8.896   4.899  -0.282
  490    H    CYS  80           H        CYS  80   6.613   3.174  -2.848
  491    HA   CYS  80           HA       CYS  80   5.012   1.640  -1.206
  492    HB2  CYS  80           HB1      CYS  80   6.832   1.037  -3.496
  493    HB3  CYS  80           HB2      CYS  80   6.187  -0.319  -2.569
  494    HA   PRO  81           HA       PRO  81   7.497  -0.130   1.946
  495    HB2  PRO  81           HB1      PRO  81   6.532  -2.690   2.095
  496    HB3  PRO  81           HB2      PRO  81   5.631  -1.277   2.642
  497    HG2  PRO  81           HG1      PRO  81   5.453  -2.754   0.039
  498    HG3  PRO  81           HG2      PRO  81   4.127  -2.165   1.108
  499    HD2  PRO  81           HD1      PRO  81   4.880  -0.856  -1.148
  500    HD3  PRO  81           HD2      PRO  81   4.297  -0.014   0.298
  501    H    GLY  82           H        GLY  82   9.411  -1.187   2.247
  502    HA2  GLY  82           HA2      GLY  82  10.929  -3.000   1.771
  503    HA3  GLY  82           HA3      GLY  82  10.300  -3.034   0.130
  504    HA1  GLY  82           HA1      GLY  82  10.913  -2.137   1.957
  505    H    THR  83           H        THR  83  10.419   0.043   0.278
  506    HA   THR  83           HA       THR  83  13.298   0.244  -0.328
  507    HB   THR  83           HB       THR  83  12.607   2.176  -1.829
  508    HG1  THR  83           HG1      THR  83  10.050   0.950  -1.518
  509   HG21  THR  83          HG21      THR  83  12.554  -0.645  -2.276
  510   HG22  THR  83          HG22      THR  83  12.998   0.643  -3.396
  511   HG23  THR  83          HG23      THR  83  11.320   0.116  -3.278
  512    H    LEU  84           H        LEU  84  14.014   2.651  -0.282
  513    HA   LEU  84           HA       LEU  84  12.786   4.050   1.986
  514    HB2  LEU  84           HB1      LEU  84  15.532   2.973   1.763
  515    HB3  LEU  84           HB2      LEU  84  15.382   4.613   2.416
  516    HG   LEU  84           HG       LEU  84  15.489   2.994   4.213
  517   HD11  LEU  84          HD11      LEU  84  13.669   3.760   5.482
  518   HD12  LEU  84          HD12      LEU  84  12.642   3.939   4.060
  519   HD13  LEU  84          HD13      LEU  84  13.991   5.045   4.319
  520   HD21  LEU  84          HD21      LEU  84  14.363   1.057   4.281
  521   HD22  LEU  84          HD22      LEU  84  14.142   1.314   2.550
  522   HD23  LEU  84          HD23      LEU  84  12.873   1.786   3.681
  523    H    CYS  85           H        CYS  85  12.784   6.249   1.852
  524    HA   CYS  85           HA       CYS  85  13.339   7.400  -0.720
  525    HB2  CYS  85           HB1      CYS  85  12.037   8.263   1.803
  526    HB3  CYS  85           HB2      CYS  85  12.735   9.543   0.810
  527    H    VAL  86           H        VAL  86  15.429   7.680  -1.227
  528    HA   VAL  86           HA       VAL  86  17.073   9.258   0.638
  529    HB   VAL  86           HB       VAL  86  18.047   6.962  -1.067
  530   HG11  VAL  86          HG11      VAL  86  19.697   8.737  -0.948
  531   HG12  VAL  86          HG12      VAL  86  19.545   8.788   0.810
  532   HG13  VAL  86          HG13      VAL  86  20.214   7.359   0.022
  533   HG21  VAL  86          HG21      VAL  86  17.303   7.220   1.791
  534   HG22  VAL  86          HG22      VAL  86  17.165   5.838   0.705
  535   HG23  VAL  86          HG23      VAL  86  18.728   6.255   1.407
  536    H    ASN  87           H        ASN  87  18.383  10.815  -0.262
  537    HA   ASN  87           HA       ASN  87  19.027  12.398  -1.762
  538    HB2  ASN  87           HB1      ASN  87  19.830  10.012  -2.788
  539    HB3  ASN  87           HB2      ASN  87  18.819  10.611  -4.108
  540   HD21  ASN  87          HD21      ASN  87  21.869  10.624  -2.839
  541   HD22  ASN  87          HD22      ASN  87  22.505  12.008  -3.655
  542    H    ASP  88           H        ASP  88  16.201  12.041  -1.243
  543    HA   ASP  88           HA       ASP  88  14.212  12.901  -1.938
  544    HB2  ASP  88           HB1      ASP  88  16.166  14.558  -3.046
  545    HB3  ASP  88           HB2      ASP  88  15.088  14.182  -4.396
  546    HD2  ASP  88           HD       ASP  88  13.804  17.033  -2.462
  547    H    VAL  89           H        VAL  89  15.319  10.343  -3.008
  548    HA   VAL  89           HA       VAL  89  13.304   9.966  -5.075
  549    HB   VAL  89           HB       VAL  89  15.357  10.517  -6.328
  550   HG11  VAL  89          HG11      VAL  89  17.065   9.790  -4.829
  551   HG12  VAL  89          HG12      VAL  89  16.473   8.128  -4.869
  552   HG13  VAL  89          HG13      VAL  89  17.214   8.837  -6.304
  553   HG21  VAL  89          HG21      VAL  89  14.554   7.619  -6.571
  554   HG22  VAL  89          HG22      VAL  89  13.682   8.984  -7.270
  555   HG23  VAL  89          HG23      VAL  89  15.312   8.600  -7.824
  556    H    CYS  90           H        CYS  90  12.611   7.822  -5.303
  557    HA   CYS  90           HA       CYS  90  12.745   6.242  -2.972
  558    HB2  CYS  90           HB1      CYS  90  11.625   5.879  -5.725
  559    HB3  CYS  90           HB2      CYS  90  11.741   4.475  -4.663
  560    H    THR  91           H        THR  91  14.598   5.333  -2.333
  561    HA   THR  91           HA       THR  91  16.185   3.861  -4.334
  562    HB   THR  91           HB       THR  91  17.123   5.065  -1.722
  563    HG1  THR  91           HG1      THR  91  17.555   5.808  -4.440
  564   HG21  THR  91          HG21      THR  91  18.308   2.985  -2.323
  565   HG22  THR  91          HG22      THR  91  19.355   4.400  -2.422
  566   HG23  THR  91          HG23      THR  91  18.702   3.682  -3.894
  567    H    THR  92           H        THR  92  16.280   1.724  -4.133
  568    HA   THR  92           HA       THR  92  14.809   0.238  -2.336
  569    HB   THR  92           HB       THR  92  16.923  -1.449  -2.953
  570    HG1  THR  92           HG1      THR  92  16.444  -0.014  -5.324
  571   HG21  THR  92          HG21      THR  92  14.227  -0.878  -4.039
  572   HG22  THR  92          HG22      THR  92  14.894  -2.378  -3.393
  573   HG23  THR  92          HG23      THR  92  15.289  -1.871  -5.036
  574    H    MET  93           H        MET  93  15.340  -1.020  -0.509
  575    HA   MET  93           HA       MET  93  16.879   0.254   1.439
  576    HB2  MET  93           HB1      MET  93  15.057  -1.787   1.420
  577    HB3  MET  93           HB2      MET  93  16.556  -2.646   1.803
  578    HG2  MET  93           HG1      MET  93  16.774  -1.680   3.844
  579    HG3  MET  93           HG2      MET  93  16.028  -0.168   3.319
  580    HE1  MET  93           HE1      MET  93  14.017  -1.865   6.385
  581    HE2  MET  93           HE2      MET  93  15.719  -1.590   6.009
  582    HE3  MET  93           HE3      MET  93  14.564  -0.262   5.893
  583    H    GLU  94           H        GLU  94  17.689  -2.334  -0.801
  584    HA   GLU  94           HA       GLU  94  20.166  -3.041   0.370
  585    HB2  GLU  94           HB1      GLU  94  18.968  -3.407  -2.368
  586    HB3  GLU  94           HB2      GLU  94  20.630  -3.909  -2.021
  587    HG2  GLU  94           HG1      GLU  94  19.949  -5.521  -0.453
  588    HG3  GLU  94           HG2      GLU  94  18.314  -4.850  -0.367
  589    HE2  GLU  94           HE       GLU  94  17.694  -7.528  -2.513
  590    H    ASP  95           H        ASP  95  19.180  -0.465  -1.726
  591    HA   ASP  95           HA       ASP  95  21.915   0.219  -2.446
  592    HB2  ASP  95           HB1      ASP  95  19.195   1.221  -3.227
  593    HB3  ASP  95           HB2      ASP  95  20.615   2.238  -3.508
  594    HD2  ASP  95           HD       ASP  95  20.489   0.429  -6.512
  595    H    ALA  96           H        ALA  96  19.334   1.336  -0.347
  596    HA   ALA  96           HA       ALA  96  20.321   3.841   0.358
  597    HB1  ALA  96           HB1      ALA  96  18.708   1.852   1.941
  598    HB2  ALA  96           HB2      ALA  96  19.052   3.490   2.498
  599    HB3  ALA  96           HB3      ALA  96  18.120   3.239   1.022
  600    H    THR  97           H        THR  97  22.414   4.126   0.869
  601    HA   THR  97           HA       THR  97  23.389   2.900   3.320
  602    HB   THR  97           HB       THR  97  25.423   2.868   1.185
  603    HG1  THR  97           HG1      THR  97  24.431   1.497  -0.080
  604   HG21  THR  97          HG21      THR  97  26.409   1.475   2.626
  605   HG22  THR  97          HG22      THR  97  24.994   0.423   2.673
  606   HG23  THR  97          HG23      THR  97  25.092   1.820   3.745
  607    H    GLU  98           H        GLU  98  24.217   5.017   0.581
  608    HA   GLU  98           HA       GLU  98  25.309   7.012   0.472
  609    HB2  GLU  98           HB1      GLU  98  23.253   7.409   2.069
  610    HB3  GLU  98           HB2      GLU  98  24.517   7.606   3.294
  611    HG2  GLU  98           HG1      GLU  98  25.574   9.315   1.750
  612    HG3  GLU  98           HG2      GLU  98  24.074   9.242   0.817
  613    HE2  GLU  98           HE       GLU  98  22.379  10.526   3.786
  614    H    ASN  99           H        ASN  99  26.879   4.806   1.294
  615    HA   ASN  99           HA       ASN  99  28.745   6.047   3.203
  616    HB2  ASN  99           HB1      ASN  99  27.941   3.237   2.662
  617    HB3  ASN  99           HB2      ASN  99  29.644   3.512   3.054
  618   HD21  ASN  99          HD21      ASN  99  30.232   4.132   5.093
  619   HD22  ASN  99          HD22      ASN  99  29.134   4.153   6.427
  620    H    LEU 100           H        LEU 100  30.167   7.199   2.032
  621    HA   LEU 100           HA       LEU 100  31.628   5.776  -0.087
  622    HB2  LEU 100           HB1      LEU 100  30.353   8.476  -0.144
  623    HB3  LEU 100           HB2      LEU 100  31.874   8.231  -1.021
  624    HG   LEU 100           HG       LEU 100  30.337   6.116  -1.875
  625   HD11  LEU 100          HD11      LEU 100  28.297   6.803  -0.962
  626   HD12  LEU 100          HD12      LEU 100  28.233   7.340  -2.640
  627   HD13  LEU 100          HD13      LEU 100  28.588   8.498  -1.358
  628   HD21  LEU 100          HD21      LEU 100  29.914   8.001  -3.794
  629   HD22  LEU 100          HD22      LEU 100  31.394   7.058  -3.614
  630   HD23  LEU 100          HD23      LEU 100  31.291   8.679  -2.926
  631    H    TYR 101           H        TYR 101  32.093   6.421   2.830
  632    HA   TYR 101           HA       TYR 101  33.844   6.971   4.172
  633    HB2  TYR 101           HB1      TYR 101  34.956   5.996   1.767
  634    HB3  TYR 101           HB2      TYR 101  35.904   7.420   2.206
  635    HD1  TYR 101           HD1      TYR 101  37.841   6.921   3.339
  636    HD2  TYR 101           HD2      TYR 101  34.374   4.576   4.102
  637    HE1  TYR 101           HE1      TYR 101  39.102   5.607   4.992
  638    HE2  TYR 101           HE2      TYR 101  35.625   3.256   5.758
  639    HH   TYR 101           HH       TYR 101  39.048   3.928   6.438
  640    H    PHE 102           H        PHE 102  35.659   8.691   4.459
  641    HA   PHE 102           HA       PHE 102  34.884  11.221   3.189
  642    HB2  PHE 102           HB1      PHE 102  34.915  10.564   6.114
  643    HB3  PHE 102           HB2      PHE 102  35.323  12.200   5.596
  644    HD1  PHE 102           HD1      PHE 102  32.655   9.672   5.648
  645    HD2  PHE 102           HD2      PHE 102  33.676  13.712   4.784
  646    HE1  PHE 102           HE1      PHE 102  30.266  10.237   5.486
  647    HE2  PHE 102           HE2      PHE 102  31.290  14.284   4.621
  648    HZ   PHE 102           HZ       PHE 102  29.580  12.547   4.974
  649    H    GLN 103           H        GLN 103  36.915  10.491   2.039
  650    HA   GLN 103           HA       GLN 103  39.412  10.478   3.338
  651    HB2  GLN 103           HB1      GLN 103  38.927  11.297   0.471
  652    HB3  GLN 103           HB2      GLN 103  40.388  10.572   1.160
  653    HG2  GLN 103           HG1      GLN 103  38.504   8.685   1.755
  654    HG3  GLN 103           HG2      GLN 103  37.937   9.306   0.199
  655   HE21  GLN 103          HE21      GLN 103  39.747   6.981   1.546
  656   HE22  GLN 103          HE22      GLN 103  40.852   6.660   0.257
  657    H    SER 104           H        SER 104  40.362  12.101   4.361
  658    HA   SER 104           HA       SER 104  40.645  14.680   3.136
  659    HB2  SER 104           HB1      SER 104  38.328  14.568   4.389
  660    HB3  SER 104           HB2      SER 104  39.337  14.790   5.829
  661    HG   SER 104           HG       SER 104  39.807  16.485   3.668
  662    H    LEU 105           H        LEU 105  42.485  12.740   3.905
  663    HA   LEU 105           HA       LEU 105  44.006  14.235   5.907
  664    HB2  LEU 105           HB1      LEU 105  42.926  11.545   6.222
  665    HB3  LEU 105           HB2      LEU 105  44.683  11.613   6.443
  666    HG   LEU 105           HG       LEU 105  43.002  13.582   7.913
  667   HD11  LEU 105          HD11      LEU 105  43.281  11.451   9.658
  668   HD12  LEU 105          HD12      LEU 105  42.725  10.711   8.158
  669   HD13  LEU 105          HD13      LEU 105  41.787  12.005   8.903
  670   HD21  LEU 105          HD21      LEU 105  45.619  13.269   7.833
  671   HD22  LEU 105          HD22      LEU 105  45.278  12.037   9.048
  672   HD23  LEU 105          HD23      LEU 105  44.793  13.710   9.327
  673    H    GLU 106           H        GLU 106  46.302  13.819   5.837
  674    HA   GLU 106           HA       GLU 106  47.351  13.748   3.252
  675    HB2  GLU 106           HB1      GLU 106  48.317  14.261   5.818
  676    HB3  GLU 106           HB2      GLU 106  49.281  12.891   5.244
  677    HG2  GLU 106           HG1      GLU 106  50.537  14.250   4.038
  678    HG3  GLU 106           HG2      GLU 106  49.110  14.768   3.132
  679    HE2  GLU 106           HE       GLU 106  50.692  17.560   5.003
  680    H    HIS 107           H        HIS 107  48.546  12.196   2.119
  681    HA   HIS 107           HA       HIS 107  47.637   9.496   2.496
  682    HB2  HIS 107           HB1      HIS 107  49.012  11.039   0.407
  683    HB3  HIS 107           HB2      HIS 107  49.558   9.364   0.533
  684    HD1  HIS 107           HD1      HIS 107  46.766  11.418  -0.693
  685    HD2  HIS 107           HD2      HIS 107  47.496   7.404   0.093
  686    HE1  HIS 107           HE1      HIS 107  44.922  10.159  -1.851
  687    HE2  HIS 107           HE2      HIS 107  45.368   7.707  -1.371
  688    H    HIS 108           H        HIS 108  50.709  11.219   2.800
  689    HA   HIS 108           HA       HIS 108  52.399   9.058   3.248
  690    HB2  HIS 108           HB1      HIS 108  52.434  11.934   4.104
  691    HB3  HIS 108           HB2      HIS 108  53.654  10.823   4.735
  692    HD1  HIS 108           HD1      HIS 108  52.517  12.394   1.516
  693    HD2  HIS 108           HD2      HIS 108  55.652  10.082   2.961
  694    HE1  HIS 108           HE1      HIS 108  54.242  12.380  -0.314
  695    HE2  HIS 108           HE2      HIS 108  56.159  10.968   0.569
  696    H    HIS 109           H        HIS 109  51.871   7.454   4.609
  697    HA   HIS 109           HA       HIS 109  51.060   8.177   7.348
  698    HB2  HIS 109           HB1      HIS 109  50.171   6.089   5.473
  699    HB3  HIS 109           HB2      HIS 109  50.476   5.508   7.114
  700    HD1  HIS 109           HD1      HIS 109  49.421   7.792   8.805
  701    HD2  HIS 109           HD2      HIS 109  47.462   6.362   5.431
  702    HE1  HIS 109           HE1      HIS 109  47.011   8.448   9.098
  703    HE2  HIS 109           HE2      HIS 109  45.813   7.575   7.035
  704    H    HIS 110           H        HIS 110  52.305   7.572   9.016
  705    HA   HIS 110           HA       HIS 110  53.989   6.621  10.221
  706    HB2  HIS 110           HB1      HIS 110  53.246   4.601   8.313
  707    HB3  HIS 110           HB2      HIS 110  54.996   4.567   8.554
  708    HD1  HIS 110           HD1      HIS 110  52.092   3.075   9.880
  709    HD2  HIS 110           HD2      HIS 110  55.552   4.640  11.567
  710    HE1  HIS 110           HE1      HIS 110  52.245   2.053  12.173
  711    HE2  HIS 110           HE2      HIS 110  54.359   3.009  13.204
  712    H    HIS 111           H        HIS 111  55.178   5.881   6.956
  713    HA   HIS 111           HA       HIS 111  57.058   6.511   5.841
  714    HB2  HIS 111           HB1      HIS 111  55.841   8.755   6.162
  715    HB3  HIS 111           HB2      HIS 111  57.021   9.065   7.438
  716    HD1  HIS 111           HD1      HIS 111  57.027   8.215   3.732
  717    HD2  HIS 111           HD2      HIS 111  59.330  10.190   6.571
  718    HE1  HIS 111           HE1      HIS 111  58.915   9.270   2.450
  719    HE2  HIS 111           HE2      HIS 111  60.324  10.478   4.185
  720    H    HIS 112           H        HIS 112  57.679   4.798   7.738
  721    HA   HIS 112           HA       HIS 112  59.364   5.550   9.811
  722    HB2  HIS 112           HB1      HIS 112  58.413   3.188   8.920
  723    HB3  HIS 112           HB2      HIS 112  60.079   3.072   8.345
  724    HD1  HIS 112           HD1      HIS 112  61.157   4.731  10.940
  725    HD2  HIS 112           HD2      HIS 112  58.935   1.221  10.880
  726    HE1  HIS 112           HE1      HIS 112  61.614   3.608  13.144
  727    HE2  HIS 112           HE2      HIS 112  60.255   1.462  13.108
  Start of MODEL   49
    1    H1   MET  18           H        MET  18  24.401  -6.113  36.544
    2    HA   MET  18           HA       MET  18  22.922  -7.626  38.571
    3    HB2  MET  18           HB1      MET  18  25.269  -5.745  38.676
    4    HB3  MET  18           HB2      MET  18  24.343  -6.128  40.136
    5    HG2  MET  18           HG1      MET  18  25.045  -8.315  40.197
    6    HG3  MET  18           HG2      MET  18  25.355  -8.365  38.459
    7    HE1  MET  18           HE1      MET  18  26.932  -5.654  41.208
    8    HE2  MET  18           HE2      MET  18  26.344  -7.186  41.855
    9    HE3  MET  18           HE3      MET  18  28.079  -6.866  41.783
   10    H    LEU  19           H        LEU  19  21.472  -5.906  36.835
   11    HA   LEU  19           HA       LEU  19  20.829  -3.582  38.494
   12    HB2  LEU  19           HB1      LEU  19  19.451  -2.865  36.569
   13    HB3  LEU  19           HB2      LEU  19  21.163  -3.089  36.176
   14    HG   LEU  19           HG       LEU  19  20.047  -5.530  35.529
   15   HD11  LEU  19          HD11      LEU  19  17.811  -5.015  35.579
   16   HD12  LEU  19          HD12      LEU  19  18.208  -4.617  33.908
   17   HD13  LEU  19          HD13      LEU  19  18.073  -3.335  35.111
   18   HD21  LEU  19          HD21      LEU  19  21.744  -4.372  34.253
   19   HD22  LEU  19          HD22      LEU  19  20.586  -3.126  33.788
   20   HD23  LEU  19          HD23      LEU  19  20.386  -4.780  33.205
   21    H    VAL  20           H        VAL  20  18.380  -3.040  38.468
   22    HA   VAL  20           HA       VAL  20  17.016  -5.352  39.597
   23    HB   VAL  20           HB       VAL  20  15.373  -3.779  40.441
   24   HG11  VAL  20          HG11      VAL  20  17.846  -2.279  41.035
   25   HG12  VAL  20          HG12      VAL  20  16.676  -3.023  42.128
   26   HG13  VAL  20          HG13      VAL  20  17.896  -4.017  41.332
   27   HG21  VAL  20          HG21      VAL  20  16.753  -1.905  38.579
   28   HG22  VAL  20          HG22      VAL  20  15.030  -2.135  38.872
   29   HG23  VAL  20          HG23      VAL  20  16.015  -1.266  40.048
   30    H    LEU  21           H        LEU  21  15.282  -6.341  38.726
   31    HA   LEU  21           HA       LEU  21  14.556  -5.625  36.005
   32    HB2  LEU  21           HB1      LEU  21  14.591  -8.027  37.608
   33    HB3  LEU  21           HB2      LEU  21  13.007  -7.800  36.848
   34    HG   LEU  21           HG       LEU  21  14.401  -7.464  34.668
   35   HD11  LEU  21          HD11      LEU  21  16.314  -9.401  35.732
   36   HD12  LEU  21          HD12      LEU  21  16.495  -7.775  36.391
   37   HD13  LEU  21          HD13      LEU  21  16.563  -8.033  34.647
   38   HD21  LEU  21          HD21      LEU  21  14.001 -10.139  36.003
   39   HD22  LEU  21          HD22      LEU  21  14.346  -9.912  34.289
   40   HD23  LEU  21          HD23      LEU  21  12.850  -9.280  34.979
   41    H    ASP  22           H        ASP  22  12.454  -5.184  35.310
   42    HA   ASP  22           HA       ASP  22  10.393  -4.226  35.408
   43    HB2  ASP  22           HB1      ASP  22  10.429  -6.081  37.738
   44    HB3  ASP  22           HB2      ASP  22   9.130  -4.881  37.679
   45    HD2  ASP  22           HD       ASP  22   9.050  -7.077  34.414
   46    H    PHE  23           H        PHE  23  10.902  -2.081  35.508
   47    HA   PHE  23           HA       PHE  23  10.308  -0.714  37.947
   48    HB2  PHE  23           HB1      PHE  23  12.724  -1.409  38.237
   49    HB3  PHE  23           HB2      PHE  23  13.110  -0.354  36.877
   50    HD1  PHE  23           HD1      PHE  23  14.040   1.644  37.477
   51    HD2  PHE  23           HD2      PHE  23  11.033  -0.051  39.967
   52    HE1  PHE  23           HE1      PHE  23  14.208   3.577  38.990
   53    HE2  PHE  23           HE2      PHE  23  11.197   1.880  41.484
   54    HZ   PHE  23           HZ       PHE  23  12.784   3.697  40.995
   55    H    ASN  24           H        ASN  24   8.923  -0.486  35.731
   56    HA   ASN  24           HA       ASN  24   9.605   2.191  34.759
   57    HB2  ASN  24           HB1      ASN  24   9.663  -0.225  33.183
   58    HB3  ASN  24           HB2      ASN  24   8.403   0.860  32.579
   59   HD21  ASN  24          HD21      ASN  24   9.181   3.246  32.537
   60   HD22  ASN  24          HD22      ASN  24  10.717   3.493  31.784
   61    H    ASN  25           H        ASN  25   7.143  -0.380  34.740
   62    HA   ASN  25           HA       ASN  25   4.889  -0.329  35.036
   63    HB2  ASN  25           HB1      ASN  25   5.668   1.049  37.059
   64    HB3  ASN  25           HB2      ASN  25   5.178   2.468  36.124
   65   HD21  ASN  25          HD21      ASN  25   4.176   0.316  38.382
   66   HD22  ASN  25          HD22      ASN  25   2.466   0.473  38.197
   67    H    ILE  26           H        ILE  26   5.140  -0.135  32.582
   68    HA   ILE  26           HA       ILE  26   3.178   1.690  31.641
   69    HB   ILE  26           HB       ILE  26   5.020   3.286  31.736
   70   HG12  ILE  26          HG11      ILE  26   4.824   2.698  28.817
   71   HG13  ILE  26          HG12      ILE  26   3.319   2.993  29.705
   72   HG21  ILE  26          HG21      ILE  26   6.485   1.554  29.760
   73   HG22  ILE  26          HG22      ILE  26   7.065   3.010  30.567
   74   HG23  ILE  26          HG23      ILE  26   6.808   1.532  31.493
   75   HD11  ILE  26          HD11      ILE  26   3.713   5.135  29.192
   76   HD12  ILE  26          HD12      ILE  26   4.816   5.071  30.566
   77   HD13  ILE  26          HD13      ILE  26   5.435   4.864  28.928
   78    H    ARG  27           H        ARG  27   2.249   0.915  29.831
   79    HA   ARG  27           HA       ARG  27   3.742  -0.866  28.073
   80    HB2  ARG  27           HB1      ARG  27   1.667  -1.729  29.961
   81    HB3  ARG  27           HB2      ARG  27   1.374  -2.241  28.293
   82    HG2  ARG  27           HG1      ARG  27   3.273  -3.557  28.203
   83    HG3  ARG  27           HG2      ARG  27   4.057  -2.676  29.525
   84    HD2  ARG  27           HD1      ARG  27   1.529  -4.204  30.047
   85    HD3  ARG  27           HD2      ARG  27   3.077  -5.055  29.946
   86    HE   ARG  27           HE       ARG  27   3.404  -2.901  31.689
   87   HH11  ARG  27          HH11      ARG  27   1.633  -5.893  31.504
   88   HH12  ARG  27          HH12      ARG  27   1.593  -6.127  33.220
   89   HH21  ARG  27          HH21      ARG  27   3.357  -3.198  33.950
   90   HH22  ARG  27          HH22      ARG  27   2.573  -4.592  34.611
   91    H    SER  28           H        SER  28   0.346   0.068  28.657
   92    HA   SER  28           HA       SER  28   0.277   1.198  25.942
   93    HB2  SER  28           HB1      SER  28  -1.839   0.197  25.465
   94    HB3  SER  28           HB2      SER  28  -0.794  -1.098  26.076
   95    HG   SER  28           HG       SER  28  -2.631  -1.334  27.216
   96    H    SER  29           H        SER  29  -2.105   2.285  25.764
   97    HA   SER  29           HA       SER  29  -3.392   4.063  26.365
   98    HB2  SER  29           HB1      SER  29  -3.549   2.349  28.478
   99    HB3  SER  29           HB2      SER  29  -2.918   3.805  29.268
  100    HG   SER  29           HG       SER  29  -5.413   3.310  28.383
  101    H    ALA  30           H        ALA  30  -2.241   5.779  25.635
  102    HA   ALA  30           HA       ALA  30  -0.768   7.307  27.628
  103    HB1  ALA  30           HB1      ALA  30   0.968   5.968  26.565
  104    HB2  ALA  30           HB2      ALA  30   0.461   6.550  24.979
  105    HB3  ALA  30           HB3      ALA  30   1.149   7.673  26.151
  106    H    ASP  31           H        ASP  31  -3.310   7.706  26.433
  107    HA   ASP  31           HA       ASP  31  -4.567   9.371  25.526
  108    HB2  ASP  31           HB1      ASP  31  -2.426  10.639  26.737
  109    HB3  ASP  31           HB2      ASP  31  -2.420  11.310  25.100
  110    HD2  ASP  31           HD       ASP  31  -5.898  12.312  25.823
  111    H    LEU  32           H        LEU  32  -5.140   8.608  23.561
  112    HA   LEU  32           HA       LEU  32  -3.427   9.375  21.293
  113    HB2  LEU  32           HB1      LEU  32  -4.027   7.350  20.122
  114    HB3  LEU  32           HB2      LEU  32  -3.297   6.958  21.689
  115    HG   LEU  32           HG       LEU  32  -6.155   7.070  21.950
  116   HD11  LEU  32          HD11      LEU  32  -6.551   4.993  20.543
  117   HD12  LEU  32          HD12      LEU  32  -5.064   5.412  19.695
  118   HD13  LEU  32          HD13      LEU  32  -6.430   6.527  19.681
  119   HD21  LEU  32          HD21      LEU  32  -3.918   5.187  22.458
  120   HD22  LEU  32          HD22      LEU  32  -5.554   4.527  22.413
  121   HD23  LEU  32          HD23      LEU  32  -5.149   5.808  23.557
  122    H    HIS  33           H        HIS  33  -4.448  10.198  19.505
  123    HA   HIS  33           HA       HIS  33  -7.380  10.378  19.582
  124    HB2  HIS  33           HB1      HIS  33  -5.653  12.507  20.124
  125    HB3  HIS  33           HB2      HIS  33  -6.164  12.762  18.453
  126    HD1  HIS  33           HD1      HIS  33  -7.762  12.166  21.847
  127    HD2  HIS  33           HD2      HIS  33  -8.592  13.944  18.186
  128    HE1  HIS  33           HE1      HIS  33  -9.977  13.320  22.147
  129    HE2  HIS  33           HE2      HIS  33 -10.484  14.407  19.909
  130    H    GLY  34           H        GLY  34  -8.368  10.844  17.501
  131    HA2  GLY  34           HA2      GLY  34  -6.809   9.636  15.329
  132    HA3  GLY  34           HA3      GLY  34  -8.560   9.782  15.386
  133    HA1  GLY  34           HA1      GLY  34  -6.549  10.400  15.683
  134    H    ALA  35           H        ALA  35  -7.618  10.466  13.074
  135    HA   ALA  35           HA       ALA  35  -7.620  13.410  13.097
  136    HB1  ALA  35           HB1      ALA  35  -6.074  13.431  11.214
  137    HB2  ALA  35           HB2      ALA  35  -5.359  12.616  12.606
  138    HB3  ALA  35           HB3      ALA  35  -5.985  11.670  11.255
  139    H    ARG  36           H        ARG  36  -8.791  14.419  11.485
  140    HA   ARG  36           HA       ARG  36 -10.129  12.759   9.487
  141    HB2  ARG  36           HB1      ARG  36 -12.324  13.763  10.009
  142    HB3  ARG  36           HB2      ARG  36 -11.692  12.785  11.343
  143    HG2  ARG  36           HG1      ARG  36 -10.760  15.095  12.188
  144    HG3  ARG  36           HG2      ARG  36 -12.059  15.730  11.165
  145    HD2  ARG  36           HD1      ARG  36 -12.849  13.488  12.906
  146    HD3  ARG  36           HD2      ARG  36 -12.365  14.962  13.755
  147    HE   ARG  36           HE       ARG  36 -14.085  15.842  11.836
  148   HH11  ARG  36          HH11      ARG  36 -14.258  13.461  14.370
  149   HH12  ARG  36          HH12      ARG  36 -15.963  13.652  14.612
  150   HH21  ARG  36          HH21      ARG  36 -16.331  16.102  12.145
  151   HH22  ARG  36          HH22      ARG  36 -17.141  15.153  13.344
  152    H    LYS  37           H        LYS  37 -11.211  14.054   7.812
  153    HA   LYS  37           HA       LYS  37 -10.905  16.839   7.590
  154    HB2  LYS  37           HB1      LYS  37  -8.514  15.420   7.136
  155    HB3  LYS  37           HB2      LYS  37  -9.108  15.904   5.540
  156    HG2  LYS  37           HG1      LYS  37  -9.003  18.181   6.040
  157    HG3  LYS  37           HG2      LYS  37  -8.926  17.878   7.786
  158    HD2  LYS  37           HD1      LYS  37  -6.698  17.694   7.763
  159    HD3  LYS  37           HD2      LYS  37  -6.736  16.606   6.366
  160    HE2  LYS  37           HE1      LYS  37  -5.684  18.340   5.348
  161    HE3  LYS  37           HE2      LYS  37  -7.346  18.907   5.136
  162    HZ1  LYS  37           HZ1      LYS  37  -5.315  20.243   6.401
  163    HZ2  LYS  37           HZ2      LYS  37  -6.298  19.696   7.663
  164    HZ3  LYS  37           HZ3      LYS  37  -6.957  20.649   6.431
  165    H    GLY  38           H        GLY  38 -11.540  17.655   5.471
  166    HA2  GLY  38           HA2      GLY  38 -13.507  15.923   4.259
  167    HA3  GLY  38           HA3      GLY  38 -13.216  17.610   3.866
  168    HA1  GLY  38           HA1      GLY  38 -12.690  15.599   4.308
  169    H    SER  39           H        SER  39 -12.250  14.305   3.247
  170    HA   SER  39           HA       SER  39 -11.183  15.157   0.660
  171    HB2  SER  39           HB1      SER  39  -9.498  13.049   1.509
  172    HB3  SER  39           HB2      SER  39  -9.059  14.745   1.238
  173    HG   SER  39           HG       SER  39  -9.750  15.130   3.439
  174    H    GLN  40           H        GLN  40 -10.501  12.974  -0.554
  175    HA   GLN  40           HA       GLN  40 -12.944  11.422  -0.656
  176    HB2  GLN  40           HB1      GLN  40 -10.624  11.902  -2.424
  177    HB3  GLN  40           HB2      GLN  40 -11.346  10.289  -2.531
  178    HG2  GLN  40           HG1      GLN  40 -12.595  11.333  -4.107
  179    HG3  GLN  40           HG2      GLN  40 -13.581  11.686  -2.682
  180   HE21  GLN  40          HE21      GLN  40 -12.726  13.051  -5.369
  181   HE22  GLN  40          HE22      GLN  40 -12.482  14.690  -4.884
  182    H    CYS  41           H        CYS  41  -9.687  11.075   0.480
  183    HA   CYS  41           HA       CYS  41 -10.344   8.373   1.422
  184    HB2  CYS  41           HB1      CYS  41  -8.126   7.555   0.870
  185    HB3  CYS  41           HB2      CYS  41  -8.922   8.155  -0.586
  186    H    LEU  42           H        LEU  42  -9.552   7.846   3.428
  187    HA   LEU  42           HA       LEU  42  -8.654  10.072   5.047
  188    HB2  LEU  42           HB1      LEU  42 -10.351   8.057   5.558
  189    HB3  LEU  42           HB2      LEU  42  -8.855   7.350   6.192
  190    HG   LEU  42           HG       LEU  42  -8.773   9.755   7.403
  191   HD11  LEU  42          HD11      LEU  42 -11.350   9.683   6.303
  192   HD12  LEU  42          HD12      LEU  42 -10.711  10.826   7.483
  193   HD13  LEU  42          HD13      LEU  42 -11.544   9.370   8.028
  194   HD21  LEU  42          HD21      LEU  42 -10.054   8.489   9.297
  195   HD22  LEU  42          HD22      LEU  42  -8.478   7.915   8.751
  196   HD23  LEU  42          HD23      LEU  42  -9.950   7.126   8.182
  197    H    SER  43           H        SER  43  -7.353   7.153   3.662
  198    HA   SER  43           HA       SER  43  -4.673   7.994   4.137
  199    HB2  SER  43           HB1      SER  43  -5.774   6.671   6.288
  200    HB3  SER  43           HB2      SER  43  -4.977   5.361   5.399
  201    HG   SER  43           HG       SER  43  -3.639   6.519   6.967
  202    H    ASP  44           H        ASP  44  -3.223   5.796   3.754
  203    HA   ASP  44           HA       ASP  44  -3.638   5.177   1.036
  204    HB2  ASP  44           HB1      ASP  44  -1.834   3.430   1.450
  205    HB3  ASP  44           HB2      ASP  44  -1.405   5.103   1.828
  206    HD2  ASP  44           HD       ASP  44  -0.651   4.244   5.039
  207    H    THR  45           H        THR  45  -4.656   3.635   3.979
  208    HA   THR  45           HA       THR  45  -5.169   1.049   3.070
  209    HB   THR  45           HB       THR  45  -7.246   1.870   4.882
  210    HG1  THR  45           HG1      THR  45  -6.190   3.424   5.869
  211   HG21  THR  45          HG21      THR  45  -4.970  -0.018   4.783
  212   HG22  THR  45          HG22      THR  45  -6.657  -0.298   5.215
  213   HG23  THR  45          HG23      THR  45  -5.554   0.424   6.386
  214    H    ASP  46           H        ASP  46  -6.838   4.017   2.464
  215    HA   ASP  46           HA       ASP  46  -9.352   2.933   1.723
  216    HB2  ASP  46           HB1      ASP  46  -8.824   5.358   2.298
  217    HB3  ASP  46           HB2      ASP  46  -8.159   5.496   0.666
  218    HD2  ASP  46           HD       ASP  46 -11.370   6.406  -0.194
  219    H    CYS  47           H        CYS  47  -6.320   3.344   0.060
  220    HA   CYS  47           HA       CYS  47  -7.495   2.741  -2.532
  221    HB2  CYS  47           HB1      CYS  47  -4.799   3.594  -1.555
  222    HB3  CYS  47           HB2      CYS  47  -4.909   2.770  -3.110
  223    H    ASN  48           H        ASN  48  -7.178   0.866  -3.681
  224    HA   ASN  48           HA       ASN  48  -6.458  -1.461  -2.096
  225    HB2  ASN  48           HB1      ASN  48  -7.621  -1.185  -4.882
  226    HB3  ASN  48           HB2      ASN  48  -7.298  -2.730  -4.086
  227   HD21  ASN  48          HD21      ASN  48  -8.509  -3.316  -2.251
  228   HD22  ASN  48          HD22      ASN  48 -10.053  -2.608  -1.936
  229    H    THR  49           H        THR  49  -5.210  -3.230  -3.271
  230    HA   THR  49           HA       THR  49  -3.225  -3.976  -4.101
  231    HB   THR  49           HB       THR  49  -2.743  -1.787  -5.982
  232    HG1  THR  49           HG1      THR  49  -4.634  -1.901  -7.068
  233   HG21  THR  49          HG21      THR  49  -2.158  -3.486  -7.373
  234   HG22  THR  49          HG22      THR  49  -3.498  -4.512  -6.861
  235   HG23  THR  49          HG23      THR  49  -2.057  -4.376  -5.855
  236    H    ARG  50           H        ARG  50  -0.907  -2.992  -4.862
  237    HA   ARG  50           HA       ARG  50   0.072  -1.674  -2.503
  238    HB2  ARG  50           HB1      ARG  50   1.545  -2.411  -5.043
  239    HB3  ARG  50           HB2      ARG  50   2.278  -1.978  -3.492
  240    HG2  ARG  50           HG1      ARG  50   2.428  -4.223  -3.281
  241    HG3  ARG  50           HG2      ARG  50   0.776  -4.022  -2.672
  242    HD2  ARG  50           HD1      ARG  50  -0.057  -5.248  -4.339
  243    HD3  ARG  50           HD2      ARG  50   0.736  -4.212  -5.533
  244    HE   ARG  50           HE       ARG  50   2.751  -5.795  -4.655
  245   HH11  ARG  50          HH11      ARG  50  -0.439  -6.427  -5.899
  246   HH12  ARG  50          HH12      ARG  50  -0.006  -7.952  -6.598
  247   HH21  ARG  50          HH21      ARG  50   3.334  -7.801  -5.572
  248   HH22  ARG  50          HH22      ARG  50   2.140  -8.733  -6.411
  249    H    LYS  51           H        LYS  51  -1.349   0.257  -2.999
  250    HA   LYS  51           HA       LYS  51   0.258   2.227  -4.464
  251    HB2  LYS  51           HB1      LYS  51  -2.742   1.885  -4.678
  252    HB3  LYS  51           HB2      LYS  51  -1.835   3.259  -5.329
  253    HG2  LYS  51           HG1      LYS  51  -1.073   2.106  -7.108
  254    HG3  LYS  51           HG2      LYS  51  -0.889   0.607  -6.180
  255    HD2  LYS  51           HD1      LYS  51  -2.622   0.060  -7.613
  256    HD3  LYS  51           HD2      LYS  51  -3.493   0.605  -6.169
  257    HE2  LYS  51           HE1      LYS  51  -3.369   2.956  -7.352
  258    HE3  LYS  51           HE2      LYS  51  -3.148   1.965  -8.802
  259    HZ1  LYS  51           HZ1      LYS  51  -5.308   1.081  -7.118
  260    HZ2  LYS  51           HZ2      LYS  51  -5.276   1.340  -8.789
  261    HZ3  LYS  51           HZ3      LYS  51  -5.532   2.639  -7.736
  262    H    PHE  52           H        PHE  52  -0.420   4.499  -3.909
  263    HA   PHE  52           HA       PHE  52  -1.330   4.646  -1.111
  264    HB2  PHE  52           HB1      PHE  52   0.219   6.546  -0.795
  265    HB3  PHE  52           HB2      PHE  52   1.064   5.049  -1.193
  266    HD1  PHE  52           HD1      PHE  52   2.245   4.776  -3.265
  267    HD2  PHE  52           HD2      PHE  52   0.102   8.358  -2.434
  268    HE1  PHE  52           HE1      PHE  52   3.383   5.888  -5.141
  269    HE2  PHE  52           HE2      PHE  52   1.236   9.475  -4.310
  270    HZ   PHE  52           HZ       PHE  52   2.878   8.240  -5.666
  271    H    CYS  53           H        CYS  53  -1.938   7.006  -0.546
  272    HA   CYS  53           HA       CYS  53  -3.644   8.019  -2.722
  273    HB2  CYS  53           HB1      CYS  53  -4.471   7.138  -0.314
  274    HB3  CYS  53           HB2      CYS  53  -4.176   8.832   0.082
  275    H    LEU  54           H        LEU  54  -2.741   9.727  -3.668
  276    HA   LEU  54           HA       LEU  54  -1.051  11.539  -2.138
  277    HB2  LEU  54           HB1      LEU  54  -0.205  10.850  -4.277
  278    HB3  LEU  54           HB2      LEU  54  -1.707  11.347  -5.071
  279    HG   LEU  54           HG       LEU  54  -0.707  13.652  -3.815
  280   HD11  LEU  54          HD11      LEU  54   1.517  13.737  -4.054
  281   HD12  LEU  54          HD12      LEU  54   1.490  12.845  -5.574
  282   HD13  LEU  54          HD13      LEU  54   1.426  11.976  -4.041
  283   HD21  LEU  54          HD21      LEU  54  -0.499  12.851  -6.714
  284   HD22  LEU  54          HD22      LEU  54  -0.554  14.487  -6.060
  285   HD23  LEU  54          HD23      LEU  54  -1.972  13.444  -5.945
  286    H    GLN  55           H        GLN  55  -1.589  13.565  -1.553
  287    HA   GLN  55           HA       GLN  55  -4.160  14.636  -2.507
  288    HB2  GLN  55           HB1      GLN  55  -4.388  15.669  -0.202
  289    HB3  GLN  55           HB2      GLN  55  -4.617  13.915  -0.300
  290    HG2  GLN  55           HG1      GLN  55  -2.977  13.532   1.139
  291    HG3  GLN  55           HG2      GLN  55  -1.858  14.539   0.208
  292   HE21  GLN  55          HE21      GLN  55  -1.563  16.680   0.766
  293   HE22  GLN  55          HE22      GLN  55  -2.120  17.337   2.264
  294    HA   PRO  56           HA       PRO  56  -0.933  17.747  -3.451
  295    HB2  PRO  56           HB1      PRO  56  -2.185  18.673  -5.704
  296    HB3  PRO  56           HB2      PRO  56  -1.141  17.253  -5.685
  297    HG2  PRO  56           HG1      PRO  56  -4.132  17.416  -5.537
  298    HG3  PRO  56           HG2      PRO  56  -3.097  16.323  -6.530
  299    HD2  PRO  56           HD1      PRO  56  -4.301  15.516  -4.235
  300    HD3  PRO  56           HD2      PRO  56  -2.721  14.905  -4.754
  301    H    ARG  57           H        ARG  57  -1.035  20.060  -3.468
  302    HA   ARG  57           HA       ARG  57  -3.217  21.087  -1.875
  303    HB2  ARG  57           HB1      ARG  57  -0.549  22.111  -2.768
  304    HB3  ARG  57           HB2      ARG  57  -1.767  23.259  -2.194
  305    HG2  ARG  57           HG1      ARG  57  -1.661  21.118  -0.331
  306    HG3  ARG  57           HG2      ARG  57  -0.004  21.645  -0.671
  307    HD2  ARG  57           HD1      ARG  57  -0.466  23.883  -0.026
  308    HD3  ARG  57           HD2      ARG  57  -2.210  23.583  -0.020
  309    HE   ARG  57           HE       ARG  57  -0.350  23.007   2.090
  310   HH11  ARG  57          HH11      ARG  57  -3.417  22.159   0.678
  311   HH12  ARG  57          HH12      ARG  57  -4.064  21.514   2.149
  312   HH21  ARG  57          HH21      ARG  57  -1.192  22.161   4.035
  313   HH22  ARG  57          HH22      ARG  57  -2.798  21.517   4.059
  314    H    ASP  58           H        ASP  58  -1.812  21.733  -5.071
  315    HA   ASP  58           HA       ASP  58  -3.786  23.698  -5.744
  316    HB2  ASP  58           HB1      ASP  58  -1.596  22.293  -7.255
  317    HB3  ASP  58           HB2      ASP  58  -2.783  23.291  -8.107
  318    HD2  ASP  58           HD       ASP  58  -1.386  26.228  -6.946
  319    H    GLU  59           H        GLU  59  -3.554  20.266  -5.951
  320    HA   GLU  59           HA       GLU  59  -5.976  20.193  -7.628
  321    HB2  GLU  59           HB1      GLU  59  -3.503  18.693  -7.728
  322    HB3  GLU  59           HB2      GLU  59  -4.889  17.610  -7.529
  323    HG2  GLU  59           HG1      GLU  59  -4.886  19.757  -9.626
  324    HG3  GLU  59           HG2      GLU  59  -4.120  18.187  -9.904
  325    HE2  GLU  59           HE       GLU  59  -7.170  16.963 -10.841
  326    H    LYS  60           H        LYS  60  -7.051  17.847  -7.193
  327    HA   LYS  60           HA       LYS  60  -7.735  17.904  -4.344
  328    HB2  LYS  60           HB1      LYS  60  -9.702  16.498  -5.088
  329    HB3  LYS  60           HB2      LYS  60  -9.657  18.152  -5.718
  330    HG2  LYS  60           HG1      LYS  60  -9.676  17.437  -7.817
  331    HG3  LYS  60           HG2      LYS  60  -8.298  16.364  -7.511
  332    HD2  LYS  60           HD1      LYS  60  -9.754  14.621  -6.691
  333    HD3  LYS  60           HD2      LYS  60 -11.154  15.700  -6.804
  334    HE2  LYS  60           HE1      LYS  60  -9.599  15.358  -9.298
  335    HE3  LYS  60           HE2      LYS  60 -10.458  13.924  -8.717
  336    HZ1  LYS  60           HZ1      LYS  60 -11.531  15.993 -10.157
  337    HZ2  LYS  60           HZ2      LYS  60 -12.103  16.246  -8.586
  338    HZ3  LYS  60           HZ3      LYS  60 -12.390  14.772  -9.362
  339    HA   PRO  61           HA       PRO  61  -5.883  14.027  -3.450
  340    HB2  PRO  61           HB1      PRO  61  -7.636  12.993  -1.617
  341    HB3  PRO  61           HB2      PRO  61  -6.549  14.338  -1.273
  342    HG2  PRO  61           HG1      PRO  61  -9.441  14.384  -2.068
  343    HG3  PRO  61           HG2      PRO  61  -8.600  15.317  -0.775
  344    HD2  PRO  61           HD1      PRO  61  -9.236  16.398  -3.183
  345    HD3  PRO  61           HD2      PRO  61  -7.780  16.857  -2.282
  346    H    PHE  62           H        PHE  62  -5.842  12.001  -4.263
  347    HA   PHE  62           HA       PHE  62  -8.236  10.541  -4.882
  348    HB2  PHE  62           HB1      PHE  62  -7.998  10.405  -7.256
  349    HB3  PHE  62           HB2      PHE  62  -7.992  12.116  -6.827
  350    HD1  PHE  62           HD1      PHE  62  -5.839  13.375  -6.764
  351    HD2  PHE  62           HD2      PHE  62  -6.133   9.434  -8.343
  352    HE1  PHE  62           HE1      PHE  62  -3.700  13.691  -7.939
  353    HE2  PHE  62           HE2      PHE  62  -3.994   9.742  -9.518
  354    HZ   PHE  62           HZ       PHE  62  -2.774  11.872  -9.317
  355    H    CYS  63           H        CYS  63  -7.497   8.524  -6.326
  356    HA   CYS  63           HA       CYS  63  -5.394   7.269  -4.777
  357    HB2  CYS  63           HB1      CYS  63  -7.710   6.283  -5.573
  358    HB3  CYS  63           HB2      CYS  63  -6.797   5.893  -7.032
  359    H    ALA  64           H        ALA  64  -3.343   7.289  -5.383
  360    HA   ALA  64           HA       ALA  64  -2.699   7.724  -8.216
  361    HB1  ALA  64           HB1      ALA  64  -0.512   8.461  -7.459
  362    HB2  ALA  64           HB2      ALA  64  -1.784   9.354  -6.624
  363    HB3  ALA  64           HB3      ALA  64  -0.931   8.053  -5.795
  364    H    THR  65           H        THR  65  -0.452   6.707  -8.781
  365    HA   THR  65           HA       THR  65  -0.687   3.848  -8.178
  366    HB   THR  65           HB       THR  65   1.125   3.846 -10.136
  367    HG1  THR  65           HG1      THR  65  -0.444   6.146 -10.738
  368   HG21  THR  65          HG21      THR  65  -0.544   3.058 -11.478
  369   HG22  THR  65          HG22      THR  65  -1.639   4.383 -11.080
  370   HG23  THR  65          HG23      THR  65  -1.412   3.054  -9.944
  371    H    CYS  66           H        CYS  66   1.492   2.652  -8.249
  372    HA   CYS  66           HA       CYS  66   3.057   3.557  -6.073
  373    HB2  CYS  66           HB1      CYS  66   2.641   1.144  -7.240
  374    HB3  CYS  66           HB2      CYS  66   4.239   1.534  -7.880
  375    H    ARG  67           H        ARG  67   5.289   4.122  -6.039
  376    HA   ARG  67           HA       ARG  67   6.136   5.536  -8.473
  377    HB2  ARG  67           HB1      ARG  67   6.885   5.956  -5.571
  378    HB3  ARG  67           HB2      ARG  67   7.607   6.838  -6.925
  379    HG2  ARG  67           HG1      ARG  67   4.707   6.952  -6.998
  380    HG3  ARG  67           HG2      ARG  67   5.369   7.579  -5.479
  381    HD2  ARG  67           HD1      ARG  67   6.892   9.046  -6.764
  382    HD3  ARG  67           HD2      ARG  67   6.160   8.447  -8.258
  383    HE   ARG  67           HE       ARG  67   5.069  10.400  -6.470
  384   HH11  ARG  67          HH11      ARG  67   4.289   7.959  -8.825
  385   HH12  ARG  67          HH12      ARG  67   2.768   8.671  -9.252
  386   HH21  ARG  67          HH21      ARG  67   3.070  11.348  -7.023
  387   HH22  ARG  67          HH22      ARG  67   2.076  10.601  -8.227
  388    H    GLY  68           H        GLY  68   7.639   4.538  -9.633
  389    HA2  GLY  68           HA2      GLY  68   9.093   2.293  -8.801
  390    HA3  GLY  68           HA3      GLY  68   9.474   3.283 -10.203
  391    HA1  GLY  68           HA1      GLY  68   9.023   2.897  -8.162
  392    H    LEU  69           H        LEU  69  11.621   2.327  -9.156
  393    HA   LEU  69           HA       LEU  69  12.723   3.591  -6.905
  394    HB2  LEU  69           HB1      LEU  69  13.824   2.120  -9.260
  395    HB3  LEU  69           HB2      LEU  69  14.935   3.009  -8.204
  396    HG   LEU  69           HG       LEU  69  13.088   0.785  -7.335
  397   HD11  LEU  69          HD11      LEU  69  15.676   0.008  -6.862
  398   HD12  LEU  69          HD12      LEU  69  15.790   0.821  -8.423
  399   HD13  LEU  69          HD13      LEU  69  14.668  -0.523  -8.209
  400   HD21  LEU  69          HD21      LEU  69  15.090   2.471  -5.851
  401   HD22  LEU  69          HD22      LEU  69  14.502   0.921  -5.249
  402   HD23  LEU  69          HD23      LEU  69  13.375   2.255  -5.500
  403    H    ARG  70           H        ARG  70  13.400   4.235 -10.352
  404    HA   ARG  70           HA       ARG  70  14.928   6.528  -9.979
  405    HB2  ARG  70           HB1      ARG  70  13.229   5.535 -12.254
  406    HB3  ARG  70           HB2      ARG  70  14.045   7.103 -12.352
  407    HG2  ARG  70           HG1      ARG  70  15.890   6.091 -13.034
  408    HG3  ARG  70           HG2      ARG  70  15.973   5.245 -11.481
  409    HD2  ARG  70           HD1      ARG  70  15.886   3.425 -12.855
  410    HD3  ARG  70           HD2      ARG  70  14.152   3.705 -12.641
  411    HE   ARG  70           HE       ARG  70  14.003   4.310 -14.849
  412   HH11  ARG  70          HH11      ARG  70  17.349   4.250 -13.887
  413   HH12  ARG  70          HH12      ARG  70  17.951   4.449 -15.500
  414   HH21  ARG  70          HH21      ARG  70  14.784   4.573 -16.976
  415   HH22  ARG  70          HH22      ARG  70  16.491   4.633 -17.255
  416    H    ARG  71           H        ARG  71  11.503   6.072  -9.793
  417    HA   ARG  71           HA       ARG  71  10.598   8.672 -10.275
  418    HB2  ARG  71           HB1      ARG  71   9.515   6.222  -9.326
  419    HB3  ARG  71           HB2      ARG  71   9.045   7.491  -8.185
  420    HG2  ARG  71           HG1      ARG  71   8.555   7.510 -11.167
  421    HG3  ARG  71           HG2      ARG  71   7.354   7.211  -9.898
  422    HD2  ARG  71           HD1      ARG  71   7.726   9.472  -9.003
  423    HD3  ARG  71           HD2      ARG  71   8.916   9.765 -10.280
  424    HE   ARG  71           HE       ARG  71   6.072   9.894 -10.525
  425   HH11  ARG  71          HH11      ARG  71   9.020   9.211 -12.248
  426   HH12  ARG  71          HH12      ARG  71   8.361   9.612 -13.798
  427   HH21  ARG  71          HH21      ARG  71   5.192  10.426 -12.562
  428   HH22  ARG  71          HH22      ARG  71   6.184  10.304 -13.977
  429    H    ARG  72           H        ARG  72  10.238  10.443  -8.962
  430    HA   ARG  72           HA       ARG  72  11.984  10.637  -6.654
  431    HB2  ARG  72           HB1      ARG  72  10.193  12.789  -7.788
  432    HB3  ARG  72           HB2      ARG  72  11.623  12.995  -6.764
  433    HG2  ARG  72           HG1      ARG  72  12.493  11.583  -9.037
  434    HG3  ARG  72           HG2      ARG  72  11.444  12.887  -9.617
  435    HD2  ARG  72           HD1      ARG  72  13.708  13.298  -7.656
  436    HD3  ARG  72           HD2      ARG  72  13.860  13.505  -9.407
  437    HE   ARG  72           HE       ARG  72  12.563  15.291  -7.554
  438   HH11  ARG  72          HH11      ARG  72  12.836  14.280 -10.874
  439   HH12  ARG  72          HH12      ARG  72  12.257  15.782 -11.516
  440   HH21  ARG  72          HH21      ARG  72  11.799  17.272  -8.386
  441   HH22  ARG  72          HH22      ARG  72  11.669  17.484 -10.099
  442    H    CYS  73           H        CYS  73  11.245  11.567  -4.624
  443    HA   CYS  73           HA       CYS  73   8.405  11.428  -4.045
  444    HB2  CYS  73           HB1      CYS  73   8.821   9.893  -2.082
  445    HB3  CYS  73           HB2      CYS  73   8.918   9.135  -3.672
  446    H    GLN  74           H        GLN  74   7.944  12.104  -1.777
  447    HA   GLN  74           HA       GLN  74   9.993  14.001  -0.837
  448    HB2  GLN  74           HB1      GLN  74   7.953  15.047  -1.821
  449    HB3  GLN  74           HB2      GLN  74   6.996  14.265  -0.552
  450    HG2  GLN  74           HG1      GLN  74   7.704  15.681   1.075
  451    HG3  GLN  74           HG2      GLN  74   9.287  15.918   0.322
  452   HE21  GLN  74          HE21      GLN  74   5.978  16.386  -0.865
  453   HE22  GLN  74          HE22      GLN  74   6.186  18.044  -1.301
  454    H    ARG  75           H        ARG  75   7.784  11.469   0.008
  455    HA   ARG  75           HA       ARG  75   8.801  11.557   2.768
  456    HB2  ARG  75           HB1      ARG  75   5.983  11.108   1.798
  457    HB3  ARG  75           HB2      ARG  75   6.524  10.520   3.377
  458    HG2  ARG  75           HG1      ARG  75   6.134  12.507   4.270
  459    HG3  ARG  75           HG2      ARG  75   7.306  13.233   3.159
  460    HD2  ARG  75           HD1      ARG  75   5.172  12.918   1.502
  461    HD3  ARG  75           HD2      ARG  75   4.366  13.205   3.052
  462    HE   ARG  75           HE       ARG  75   6.414  15.114   2.648
  463   HH11  ARG  75          HH11      ARG  75   3.217  14.256   1.571
  464   HH12  ARG  75          HH12      ARG  75   2.782  15.878   1.148
  465   HH21  ARG  75          HH21      ARG  75   5.854  17.255   2.096
  466   HH22  ARG  75          HH22      ARG  75   4.284  17.584   1.447
  467    H    ASP  76           H        ASP  76   8.241   9.343   3.872
  468    HA   ASP  76           HA       ASP  76   9.582   7.332   2.321
  469    HB2  ASP  76           HB1      ASP  76  10.188   7.325   4.586
  470    HB3  ASP  76           HB2      ASP  76   8.508   7.461   5.126
  471    HD2  ASP  76           HD       ASP  76   8.440   4.076   5.546
  472    H    ALA  77           H        ALA  77   6.296   7.994   3.319
  473    HA   ALA  77           HA       ALA  77   5.257   5.431   2.578
  474    HB1  ALA  77           HB1      ALA  77   4.260   7.835   3.799
  475    HB2  ALA  77           HB2      ALA  77   3.154   7.275   2.544
  476    HB3  ALA  77           HB3      ALA  77   3.613   6.195   3.861
  477    H    MET  78           H        MET  78   5.722   8.504   0.969
  478    HA   MET  78           HA       MET  78   4.032   8.143  -1.228
  479    HB2  MET  78           HB1      MET  78   6.466   9.771  -0.667
  480    HB3  MET  78           HB2      MET  78   5.953   9.606  -2.353
  481    HG2  MET  78           HG1      MET  78   4.063  10.495  -0.186
  482    HG3  MET  78           HG2      MET  78   5.097  11.620  -1.071
  483    HE1  MET  78           HE1      MET  78   4.190  12.681  -3.568
  484    HE2  MET  78           HE2      MET  78   5.352  11.358  -3.638
  485    HE3  MET  78           HE3      MET  78   3.939  11.347  -4.693
  486    H    CYS  79           H        CYS  79   7.099   6.732  -0.456
  487    HA   CYS  79           HA       CYS  79   7.642   5.840  -3.148
  488    HB2  CYS  79           HB1      CYS  79   9.355   6.398  -1.291
  489    HB3  CYS  79           HB2      CYS  79   8.987   4.787  -0.672
  490    H    CYS  80           H        CYS  80   7.883   3.557  -3.695
  491    HA   CYS  80           HA       CYS  80   5.568   2.078  -3.187
  492    HB2  CYS  80           HB1      CYS  80   8.219   1.483  -4.438
  493    HB3  CYS  80           HB2      CYS  80   7.134   0.137  -4.083
  494    HA   PRO  81           HA       PRO  81   6.259  -0.126   0.542
  495    HB2  PRO  81           HB1      PRO  81   5.221  -2.596  -0.031
  496    HB3  PRO  81           HB2      PRO  81   4.233  -1.153   0.199
  497    HG2  PRO  81           HG1      PRO  81   5.197  -2.412  -2.347
  498    HG3  PRO  81           HG2      PRO  81   3.557  -1.791  -1.932
  499    HD2  PRO  81           HD1      PRO  81   5.312  -0.390  -3.456
  500    HD3  PRO  81           HD2      PRO  81   4.172   0.392  -2.347
  501    H    GLY  82           H        GLY  82   8.207  -0.716   1.260
  502    HA2  GLY  82           HA2      GLY  82   9.710  -2.617   1.578
  503    HA3  GLY  82           HA3      GLY  82   9.598  -2.906  -0.151
  504    HA1  GLY  82           HA1      GLY  82   9.658  -1.738   1.624
  505    H    THR  83           H        THR  83   9.725   0.198  -0.342
  506    HA   THR  83           HA       THR  83  12.664   0.345  -0.160
  507    HB   THR  83           HB       THR  83  12.316   2.190  -1.972
  508    HG1  THR  83           HG1      THR  83  10.137   0.603  -2.758
  509   HG21  THR  83          HG21      THR  83  12.811  -0.611  -2.074
  510   HG22  THR  83          HG22      THR  83  13.373   0.646  -3.178
  511   HG23  THR  83          HG23      THR  83  11.839  -0.171  -3.479
  512    H    LEU  84           H        LEU  84  13.403   2.746  -0.187
  513    HA   LEU  84           HA       LEU  84  11.677   4.312   1.612
  514    HB2  LEU  84           HB1      LEU  84  13.948   3.072   2.426
  515    HB3  LEU  84           HB2      LEU  84  14.585   4.645   1.915
  516    HG   LEU  84           HG       LEU  84  12.835   5.681   3.449
  517   HD11  LEU  84          HD11      LEU  84  12.841   3.062   4.877
  518   HD12  LEU  84          HD12      LEU  84  11.664   3.357   3.597
  519   HD13  LEU  84          HD13      LEU  84  11.716   4.414   5.008
  520   HD21  LEU  84          HD21      LEU  84  14.531   4.250   5.305
  521   HD22  LEU  84          HD22      LEU  84  14.528   5.958   4.866
  522   HD23  LEU  84          HD23      LEU  84  15.429   4.799   3.888
  523    H    CYS  85           H        CYS  85  12.227   6.641   1.658
  524    HA   CYS  85           HA       CYS  85  12.807   7.558  -1.053
  525    HB2  CYS  85           HB1      CYS  85  10.751   8.285   0.256
  526    HB3  CYS  85           HB2      CYS  85  11.845   9.226   1.272
  527    H    VAL  86           H        VAL  86  14.984   7.632  -1.312
  528    HA   VAL  86           HA       VAL  86  16.556   9.117   0.684
  529    HB   VAL  86           HB       VAL  86  17.538   7.241  -1.472
  530   HG11  VAL  86          HG11      VAL  86  19.539   7.498   0.373
  531   HG12  VAL  86          HG12      VAL  86  19.454   8.360  -1.164
  532   HG13  VAL  86          HG13      VAL  86  18.877   9.131   0.313
  533   HG21  VAL  86          HG21      VAL  86  17.164   6.858   1.493
  534   HG22  VAL  86          HG22      VAL  86  16.380   5.969   0.188
  535   HG23  VAL  86          HG23      VAL  86  18.109   5.774   0.473
  536    H    ASN  87           H        ASN  87  17.377  11.045   0.180
  537    HA   ASN  87           HA       ASN  87  17.823  12.952  -0.980
  538    HB2  ASN  87           HB1      ASN  87  18.629  10.868  -3.022
  539    HB3  ASN  87           HB2      ASN  87  18.924  12.598  -3.234
  540   HD21  ASN  87          HD21      ASN  87  21.068  11.069  -3.304
  541   HD22  ASN  87          HD22      ASN  87  21.998  11.200  -1.854
  542    H    ASP  88           H        ASP  88  15.132  12.148  -1.006
  543    HA   ASP  88           HA       ASP  88  13.153  12.687  -1.990
  544    HB2  ASP  88           HB1      ASP  88  14.771  14.775  -2.554
  545    HB3  ASP  88           HB2      ASP  88  14.398  14.229  -4.194
  546    HD2  ASP  88           HD       ASP  88  11.593  16.041  -2.130
  547    H    VAL  89           H        VAL  89  14.808  10.399  -2.916
  548    HA   VAL  89           HA       VAL  89  13.296   9.863  -5.360
  549    HB   VAL  89           HB       VAL  89  16.277   9.411  -5.148
  550   HG11  VAL  89          HG11      VAL  89  14.363   8.785  -7.393
  551   HG12  VAL  89          HG12      VAL  89  16.115   8.592  -7.447
  552   HG13  VAL  89          HG13      VAL  89  15.152   7.607  -6.345
  553   HG21  VAL  89          HG21      VAL  89  15.598  11.762  -5.559
  554   HG22  VAL  89          HG22      VAL  89  16.500  11.050  -6.896
  555   HG23  VAL  89          HG23      VAL  89  14.749  11.226  -7.010
  556    H    CYS  90           H        CYS  90  12.657   7.766  -5.583
  557    HA   CYS  90           HA       CYS  90  12.608   6.117  -3.307
  558    HB2  CYS  90           HB1      CYS  90  11.790   5.852  -6.159
  559    HB3  CYS  90           HB2      CYS  90  11.954   4.365  -5.225
  560    H    THR  91           H        THR  91  14.192   4.947  -2.474
  561    HA   THR  91           HA       THR  91  16.128   3.682  -4.297
  562    HB   THR  91           HB       THR  91  16.766   4.928  -1.616
  563    HG1  THR  91           HG1      THR  91  17.594   5.657  -4.248
  564   HG21  THR  91          HG21      THR  91  18.110   2.949  -1.962
  565   HG22  THR  91          HG22      THR  91  19.113   4.378  -2.216
  566   HG23  THR  91          HG23      THR  91  18.512   3.466  -3.599
  567    H    THR  92           H        THR  92  16.846   1.635  -3.744
  568    HA   THR  92           HA       THR  92  15.067  -0.012  -2.329
  569    HB   THR  92           HB       THR  92  17.377  -1.485  -2.360
  570    HG1  THR  92           HG1      THR  92  18.289  -0.916  -4.472
  571   HG21  THR  92          HG21      THR  92  16.521  -2.216  -4.678
  572   HG22  THR  92          HG22      THR  92  15.232  -1.042  -4.413
  573   HG23  THR  92          HG23      THR  92  15.437  -2.393  -3.299
  574    H    MET  93           H        MET  93  15.083  -0.873  -0.296
  575    HA   MET  93           HA       MET  93  16.267   0.588   1.784
  576    HB2  MET  93           HB1      MET  93  14.294  -1.301   1.601
  577    HB3  MET  93           HB2      MET  93  15.581  -2.197   2.426
  578    HG2  MET  93           HG1      MET  93  15.492   0.274   3.723
  579    HG3  MET  93           HG2      MET  93  13.806  -0.172   3.448
  580    HE1  MET  93           HE1      MET  93  14.199  -1.232   7.154
  581    HE2  MET  93           HE2      MET  93  14.612   0.239   6.275
  582    HE3  MET  93           HE3      MET  93  13.072  -0.567   5.972
  583    H    GLU  94           H        GLU  94  17.400  -2.118  -0.070
  584    HA   GLU  94           HA       GLU  94  19.462  -2.885   1.775
  585    HB2  GLU  94           HB1      GLU  94  18.575  -3.701  -0.937
  586    HB3  GLU  94           HB2      GLU  94  20.276  -3.990  -0.541
  587    HG2  GLU  94           HG1      GLU  94  18.829  -4.885   1.686
  588    HG3  GLU  94           HG2      GLU  94  17.942  -5.453   0.266
  589    HE2  GLU  94           HE       GLU  94  20.180  -8.062   0.247
  590    H    ASP  95           H        ASP  95  19.165  -0.686  -0.907
  591    HA   ASP  95           HA       ASP  95  21.973  -0.314  -1.310
  592    HB2  ASP  95           HB1      ASP  95  19.481   0.716  -2.439
  593    HB3  ASP  95           HB2      ASP  95  20.732   1.958  -2.297
  594    HD2  ASP  95           HD       ASP  95  21.688  -1.139  -4.600
  595    H    ALA  96           H        ALA  96  19.436   1.497   0.380
  596    HA   ALA  96           HA       ALA  96  20.986   3.681   1.184
  597    HB1  ALA  96           HB1      ALA  96  19.052   3.007   3.198
  598    HB2  ALA  96           HB2      ALA  96  19.052   4.345   2.049
  599    HB3  ALA  96           HB3      ALA  96  18.363   2.788   1.590
  600    H    THR  97           H        THR  97  22.408   4.023   2.796
  601    HA   THR  97           HA       THR  97  23.734   3.665   4.622
  602    HB   THR  97           HB       THR  97  22.182   1.188   5.324
  603    HG1  THR  97           HG1      THR  97  20.469   2.357   5.720
  604   HG21  THR  97          HG21      THR  97  23.111   1.406   7.369
  605   HG22  THR  97          HG22      THR  97  22.969   3.164   7.358
  606   HG23  THR  97          HG23      THR  97  24.308   2.382   6.518
  607    H    GLU  98           H        GLU  98  22.782   0.356   3.684
  608    HA   GLU  98           HA       GLU  98  23.992  -1.424   2.948
  609    HB2  GLU  98           HB1      GLU  98  24.811   0.673   1.406
  610    HB3  GLU  98           HB2      GLU  98  26.347   0.126   2.098
  611    HG2  GLU  98           HG1      GLU  98  25.107  -2.223   1.307
  612    HG3  GLU  98           HG2      GLU  98  24.720  -1.069   0.025
  613    HE2  GLU  98           HE       GLU  98  27.809  -1.788  -1.277
  614    H    ASN  99           H        ASN  99  24.344  -0.371   5.654
  615    HA   ASN  99           HA       ASN  99  27.047  -0.499   6.450
  616    HB2  ASN  99           HB1      ASN  99  24.680   0.148   7.678
  617    HB3  ASN  99           HB2      ASN  99  25.081  -1.393   8.443
  618   HD21  ASN  99          HD21      ASN  99  25.537  -0.522  10.428
  619   HD22  ASN  99          HD22      ASN  99  26.929   0.456  10.729
  620    H    LEU 100           H        LEU 100  28.209  -2.163   7.468
  621    HA   LEU 100           HA       LEU 100  27.635  -4.791   6.442
  622    HB2  LEU 100           HB1      LEU 100  29.832  -3.977   8.347
  623    HB3  LEU 100           HB2      LEU 100  29.769  -5.421   7.323
  624    HG   LEU 100           HG       LEU 100  29.830  -2.671   6.123
  625   HD11  LEU 100          HD11      LEU 100  32.136  -4.316   7.128
  626   HD12  LEU 100          HD12      LEU 100  31.752  -2.633   7.488
  627   HD13  LEU 100          HD13      LEU 100  32.313  -3.084   5.878
  628   HD21  LEU 100          HD21      LEU 100  29.522  -5.213   5.069
  629   HD22  LEU 100          HD22      LEU 100  31.221  -4.835   4.786
  630   HD23  LEU 100          HD23      LEU 100  29.964  -3.754   4.181
  631    H    TYR 101           H        TYR 101  27.272  -6.669   7.645
  632    HA   TYR 101           HA       TYR 101  25.569  -6.392   9.870
  633    HB2  TYR 101           HB1      TYR 101  27.054  -8.878   8.979
  634    HB3  TYR 101           HB2      TYR 101  25.603  -8.823   9.984
  635    HD1  TYR 101           HD1      TYR 101  26.813  -9.109   6.664
  636    HD2  TYR 101           HD2      TYR 101  23.492  -7.729   8.938
  637    HE1  TYR 101           HE1      TYR 101  25.396  -9.232   4.658
  638    HE2  TYR 101           HE2      TYR 101  22.066  -7.850   6.938
  639    HH   TYR 101           HH       TYR 101  22.097  -9.186   4.732
  640    H    PHE 102           H        PHE 102  25.947  -7.610  11.964
  641    HA   PHE 102           HA       PHE 102  28.710  -7.582  12.883
  642    HB2  PHE 102           HB1      PHE 102  28.350  -6.092  14.710
  643    HB3  PHE 102           HB2      PHE 102  27.763  -5.278  13.259
  644    HD1  PHE 102           HD1      PHE 102  25.308  -5.188  12.793
  645    HD2  PHE 102           HD2      PHE 102  26.886  -6.527  16.513
  646    HE1  PHE 102           HE1      PHE 102  23.114  -4.830  13.849
  647    HE2  PHE 102           HE2      PHE 102  24.695  -6.171  17.574
  648    HZ   PHE 102           HZ       PHE 102  22.805  -5.324  16.241
  649    H    GLN 103           H        GLN 103  29.053  -8.757  14.818
  650    HA   GLN 103           HA       GLN 103  26.760 -10.387  15.687
  651    HB2  GLN 103           HB1      GLN 103  28.201 -12.326  15.878
  652    HB3  GLN 103           HB2      GLN 103  28.280 -11.683  14.229
  653    HG2  GLN 103           HG1      GLN 103  30.321 -10.982  16.324
  654    HG3  GLN 103           HG2      GLN 103  30.463 -12.410  15.288
  655   HE21  GLN 103          HE21      GLN 103  32.338 -10.354  15.321
  656   HE22  GLN 103          HE22      GLN 103  32.317  -9.559  13.787
  657    H    SER 104           H        SER 104  27.171 -11.461  17.835
  658    HA   SER 104           HA       SER 104  29.103 -10.307  19.599
  659    HB2  SER 104           HB1      SER 104  26.928  -8.695  19.218
  660    HB3  SER 104           HB2      SER 104  26.409  -9.661  20.611
  661    HG   SER 104           HG       SER 104  28.593  -7.907  20.385
  662    H    LEU 105           H        LEU 105  28.938 -11.165  21.788
  663    HA   LEU 105           HA       LEU 105  27.267 -13.582  21.962
  664    HB2  LEU 105           HB1      LEU 105  30.146 -13.305  22.840
  665    HB3  LEU 105           HB2      LEU 105  29.119 -14.727  23.088
  666    HG   LEU 105           HG       LEU 105  29.811 -13.686  20.350
  667   HD11  LEU 105          HD11      LEU 105  31.884 -14.217  21.526
  668   HD12  LEU 105          HD12      LEU 105  31.546 -15.394  20.257
  669   HD13  LEU 105          HD13      LEU 105  31.243 -15.807  21.945
  670   HD21  LEU 105          HD21      LEU 105  29.013 -16.457  21.202
  671   HD22  LEU 105          HD22      LEU 105  29.052 -15.779  19.573
  672   HD23  LEU 105          HD23      LEU 105  27.838 -15.230  20.730
  673    H    GLU 106           H        GLU 106  27.159 -14.416  24.268
  674    HA   GLU 106           HA       GLU 106  27.515 -12.425  26.338
  675    HB2  GLU 106           HB1      GLU 106  25.161 -12.434  27.039
  676    HB3  GLU 106           HB2      GLU 106  25.362 -11.760  25.414
  677    HG2  GLU 106           HG1      GLU 106  24.902 -14.569  25.189
  678    HG3  GLU 106           HG2      GLU 106  23.668 -13.856  26.239
  679    HE2  GLU 106           HE       GLU 106  23.247 -13.366  22.451
  680    H    HIS 107           H        HIS 107  27.126 -13.271  28.482
  681    HA   HIS 107           HA       HIS 107  26.366 -15.915  29.022
  682    HB2  HIS 107           HB1      HIS 107  28.961 -15.714  27.918
  683    HB3  HIS 107           HB2      HIS 107  29.172 -16.046  29.640
  684    HD1  HIS 107           HD1      HIS 107  29.126 -17.874  26.715
  685    HD2  HIS 107           HD2      HIS 107  27.055 -18.283  30.293
  686    HE1  HIS 107           HE1      HIS 107  28.392 -20.277  26.795
  687    HE2  HIS 107           HE2      HIS 107  27.126 -20.528  28.983
  688    H    HIS 108           H        HIS 108  25.954 -16.095  31.145
  689    HA   HIS 108           HA       HIS 108  26.921 -13.946  32.891
  690    HB2  HIS 108           HB1      HIS 108  24.395 -15.219  32.545
  691    HB3  HIS 108           HB2      HIS 108  24.962 -15.582  34.178
  692    HD1  HIS 108           HD1      HIS 108  24.130 -12.630  31.979
  693    HD2  HIS 108           HD2      HIS 108  24.825 -13.509  35.980
  694    HE1  HIS 108           HE1      HIS 108  23.518 -10.544  33.242
  695    HE2  HIS 108           HE2      HIS 108  23.941 -11.078  35.687
  696    H    HIS 109           H        HIS 109  27.045 -14.717  35.297
  697    HA   HIS 109           HA       HIS 109  27.863 -17.358  35.861
  698    HB2  HIS 109           HB1      HIS 109  29.781 -16.409  34.409
  699    HB3  HIS 109           HB2      HIS 109  30.190 -15.451  35.838
  700    HD1  HIS 109           HD1      HIS 109  32.083 -16.509  37.006
  701    HD2  HIS 109           HD2      HIS 109  29.423 -19.335  35.524
  702    HE1  HIS 109           HE1      HIS 109  32.990 -18.736  37.742
  703    HE2  HIS 109           HE2      HIS 109  31.364 -20.464  36.838
  704    H    HIS 110           H        HIS 110  26.461 -16.935  37.601
  705    HA   HIS 110           HA       HIS 110  27.568 -15.140  39.661
  706    HB2  HIS 110           HB1      HIS 110  25.082 -14.984  38.517
  707    HB3  HIS 110           HB2      HIS 110  24.754 -15.956  39.955
  708    HD1  HIS 110           HD1      HIS 110  24.370 -12.677  39.104
  709    HD2  HIS 110           HD2      HIS 110  26.443 -14.476  42.223
  710    HE1  HIS 110           HE1      HIS 110  24.596 -10.903  40.872
  711    HE2  HIS 110           HE2      HIS 110  25.863 -12.002  42.779
  712    H    HIS 111           H        HIS 111  28.512 -16.215  41.253
  713    HA   HIS 111           HA       HIS 111  27.219 -18.621  42.311
  714    HB2  HIS 111           HB1      HIS 111  29.419 -18.818  40.680
  715    HB3  HIS 111           HB2      HIS 111  30.153 -18.781  42.286
  716    HD1  HIS 111           HD1      HIS 111  29.124 -20.625  44.025
  717    HD2  HIS 111           HD2      HIS 111  28.510 -21.288  39.969
  718    HE1  HIS 111           HE1      HIS 111  28.531 -23.061  43.824
  719    HE2  HIS 111           HE2      HIS 111  28.155 -23.467  41.346
  720    H    HIS 112           H        HIS 112  27.798 -19.122  44.496
  721    HA   HIS 112           HA       HIS 112  28.251 -16.766  46.076
  722    HB2  HIS 112           HB1      HIS 112  27.714 -19.660  46.735
  723    HB3  HIS 112           HB2      HIS 112  28.088 -18.476  47.991
  724    HD1  HIS 112           HD1      HIS 112  25.753 -18.173  45.000
  725    HD2  HIS 112           HD2      HIS 112  25.713 -17.899  49.144
  726    HE1  HIS 112           HE1      HIS 112  23.420 -17.455  45.603
  727    HE2  HIS 112           HE2      HIS 112  23.394 -17.287  48.136
  Start of MODEL   50
    1    H1   MET  18           H        MET  18 -44.622 -15.138 -31.795
    2    HA   MET  18           HA       MET  18 -44.707 -17.402 -32.319
    3    HB2  MET  18           HB1      MET  18 -45.058 -16.584 -34.754
    4    HB3  MET  18           HB2      MET  18 -43.322 -16.881 -34.933
    5    HG2  MET  18           HG1      MET  18 -43.674 -19.044 -35.253
    6    HG3  MET  18           HG2      MET  18 -44.505 -19.155 -33.699
    7    HE1  MET  18           HE1      MET  18 -47.515 -19.912 -33.913
    8    HE2  MET  18           HE2      MET  18 -47.097 -21.029 -35.213
    9    HE3  MET  18           HE3      MET  18 -45.936 -20.698 -33.927
   10    H    LEU  19           H        LEU  19 -41.863 -15.550 -33.343
   11    HA   LEU  19           HA       LEU  19 -39.925 -17.515 -32.966
   12    HB2  LEU  19           HB1      LEU  19 -39.753 -14.519 -32.610
   13    HB3  LEU  19           HB2      LEU  19 -38.354 -15.606 -32.631
   14    HG   LEU  19           HG       LEU  19 -40.085 -15.850 -34.983
   15   HD11  LEU  19          HD11      LEU  19 -39.974 -13.318 -34.205
   16   HD12  LEU  19          HD12      LEU  19 -39.864 -13.783 -35.902
   17   HD13  LEU  19          HD13      LEU  19 -38.399 -13.410 -34.993
   18   HD21  LEU  19          HD21      LEU  19 -38.171 -16.544 -35.892
   19   HD22  LEU  19          HD22      LEU  19 -37.499 -16.487 -34.262
   20   HD23  LEU  19          HD23      LEU  19 -37.299 -15.110 -35.346
   21    H    VAL  20           H        VAL  20 -38.140 -17.243 -31.219
   22    HA   VAL  20           HA       VAL  20 -39.448 -17.624 -28.656
   23    HB   VAL  20           HB       VAL  20 -36.528 -17.911 -29.378
   24   HG11  VAL  20          HG11      VAL  20 -38.110 -18.501 -26.905
   25   HG12  VAL  20          HG12      VAL  20 -36.652 -19.421 -27.282
   26   HG13  VAL  20          HG13      VAL  20 -36.562 -17.672 -27.068
   27   HG21  VAL  20          HG21      VAL  20 -37.349 -20.425 -29.025
   28   HG22  VAL  20          HG22      VAL  20 -38.857 -19.727 -29.617
   29   HG23  VAL  20          HG23      VAL  20 -37.393 -19.623 -30.596
   30    H    LEU  21           H        LEU  21 -39.346 -16.286 -26.943
   31    HA   LEU  21           HA       LEU  21 -38.606 -13.591 -27.287
   32    HB2  LEU  21           HB1      LEU  21 -39.094 -15.142 -24.737
   33    HB3  LEU  21           HB2      LEU  21 -39.021 -13.376 -24.873
   34    HG   LEU  21           HG       LEU  21 -40.982 -14.334 -26.706
   35   HD11  LEU  21          HD11      LEU  21 -42.562 -15.338 -25.114
   36   HD12  LEU  21          HD12      LEU  21 -41.290 -15.371 -23.893
   37   HD13  LEU  21          HD13      LEU  21 -41.130 -16.338 -25.359
   38   HD21  LEU  21          HD21      LEU  21 -40.875 -12.596 -24.281
   39   HD22  LEU  21          HD22      LEU  21 -42.438 -13.043 -24.964
   40   HD23  LEU  21          HD23      LEU  21 -41.259 -12.176 -25.950
   41    H    ASP  22           H        ASP  22 -36.754 -12.528 -26.957
   42    HA   ASP  22           HA       ASP  22 -34.431 -14.066 -26.077
   43    HB2  ASP  22           HB1      ASP  22 -34.692 -11.381 -27.451
   44    HB3  ASP  22           HB2      ASP  22 -33.150 -12.073 -26.931
   45    HD2  ASP  22           HD       ASP  22 -33.364 -14.583 -29.420
   46    H    PHE  23           H        PHE  23 -33.938 -14.003 -23.994
   47    HA   PHE  23           HA       PHE  23 -33.540 -13.251 -21.885
   48    HB2  PHE  23           HB1      PHE  23 -32.723 -11.178 -23.611
   49    HB3  PHE  23           HB2      PHE  23 -33.634 -10.396 -22.317
   50    HD1  PHE  23           HD1      PHE  23 -31.028 -13.042 -22.689
   51    HD2  PHE  23           HD2      PHE  23 -32.482  -9.724 -20.456
   52    HE1  PHE  23           HE1      PHE  23 -29.077 -13.196 -21.197
   53    HE2  PHE  23           HE2      PHE  23 -30.534  -9.872 -18.961
   54    HZ   PHE  23           HZ       PHE  23 -28.827 -11.608 -19.331
   55    H    ASN  24           H        ASN  24 -34.415 -11.540 -20.198
   56    HA   ASN  24           HA       ASN  24 -37.237 -10.948 -20.674
   57    HB2  ASN  24           HB1      ASN  24 -36.612 -13.279 -19.439
   58    HB3  ASN  24           HB2      ASN  24 -36.673 -12.189 -18.047
   59   HD21  ASN  24          HD21      ASN  24 -38.525 -12.823 -17.111
   60   HD22  ASN  24          HD22      ASN  24 -40.079 -12.745 -17.862
   61    H    ASN  25           H        ASN  25 -37.699  -8.973 -19.974
   62    HA   ASN  25           HA       ASN  25 -35.835  -7.319 -18.697
   63    HB2  ASN  25           HB1      ASN  25 -38.837  -7.034 -18.983
   64    HB3  ASN  25           HB2      ASN  25 -37.770  -5.752 -18.401
   65   HD21  ASN  25          HD21      ASN  25 -39.411  -5.527 -20.657
   66   HD22  ASN  25          HD22      ASN  25 -38.402  -5.349 -22.047
   67    H    ILE  26           H        ILE  26 -35.291  -7.058 -16.633
   68    HA   ILE  26           HA       ILE  26 -37.086  -8.158 -14.569
   69    HB   ILE  26           HB       ILE  26 -35.065  -9.506 -14.747
   70   HG12  ILE  26          HG11      ILE  26 -34.834  -7.781 -12.278
   71   HG13  ILE  26          HG12      ILE  26 -36.141  -8.955 -12.507
   72   HG21  ILE  26          HG21      ILE  26 -33.526  -7.001 -14.092
   73   HG22  ILE  26          HG22      ILE  26 -32.865  -8.609 -14.377
   74   HG23  ILE  26          HG23      ILE  26 -33.629  -7.723 -15.697
   75   HD11  ILE  26          HD11      ILE  26 -33.765  -9.487 -11.297
   76   HD12  ILE  26          HD12      ILE  26 -34.838 -10.694 -12.005
   77   HD13  ILE  26          HD13      ILE  26 -33.477 -10.070 -12.936
   78    H    ARG  27           H        ARG  27 -34.933  -5.561 -15.505
   79    HA   ARG  27           HA       ARG  27 -35.738  -4.056 -13.105
   80    HB2  ARG  27           HB1      ARG  27 -33.767  -2.566 -13.736
   81    HB3  ARG  27           HB2      ARG  27 -33.384  -4.183 -13.125
   82    HG2  ARG  27           HG1      ARG  27 -33.010  -4.985 -15.398
   83    HG3  ARG  27           HG2      ARG  27 -33.421  -3.380 -16.027
   84    HD2  ARG  27           HD1      ARG  27 -31.059  -4.133 -14.298
   85    HD3  ARG  27           HD2      ARG  27 -31.041  -3.546 -15.967
   86    HE   ARG  27           HE       ARG  27 -32.270  -1.564 -14.518
   87   HH11  ARG  27          HH11      ARG  27 -29.193  -3.189 -14.442
   88   HH12  ARG  27          HH12      ARG  27 -28.339  -1.821 -13.808
   89   HH21  ARG  27          HH21      ARG  27 -31.158   0.244 -13.682
   90   HH22  ARG  27          HH22      ARG  27 -29.458   0.130 -13.374
   91    H    SER  28           H        SER  28 -37.787  -3.672 -14.276
   92    HA   SER  28           HA       SER  28 -37.572  -1.711 -16.443
   93    HB2  SER  28           HB1      SER  28 -40.279  -2.520 -15.643
   94    HB3  SER  28           HB2      SER  28 -39.515  -2.534 -17.243
   95    HG   SER  28           HG       SER  28 -40.037  -4.610 -15.766
   96    H    SER  29           H        SER  29 -38.886  -2.139 -13.201
   97    HA   SER  29           HA       SER  29 -39.406   0.761 -13.102
   98    HB2  SER  29           HB1      SER  29 -40.920  -0.159 -11.057
   99    HB3  SER  29           HB2      SER  29 -41.530   0.035 -12.709
  100    HG   SER  29           HG       SER  29 -41.548  -2.077 -12.980
  101    H    ALA  30           H        ALA  30 -37.103   0.881 -12.507
  102    HA   ALA  30           HA       ALA  30 -36.792   1.156  -9.706
  103    HB1  ALA  30           HB1      ALA  30 -36.467  -1.130  -9.470
  104    HB2  ALA  30           HB2      ALA  30 -35.591  -1.264 -10.995
  105    HB3  ALA  30           HB3      ALA  30 -34.822  -0.508  -9.599
  106    H    ASP  31           H        ASP  31 -36.414   3.173 -11.108
  107    HA   ASP  31           HA       ASP  31 -33.525   3.380 -11.644
  108    HB2  ASP  31           HB1      ASP  31 -35.606   5.002 -13.111
  109    HB3  ASP  31           HB2      ASP  31 -33.900   4.776 -13.522
  110    HD2  ASP  31           HD       ASP  31 -36.461   1.935 -14.553
  111    H    LEU  32           H        LEU  32 -32.779   4.445  -9.911
  112    HA   LEU  32           HA       LEU  32 -33.554   7.173  -9.510
  113    HB2  LEU  32           HB1      LEU  32 -34.081   6.861  -7.073
  114    HB3  LEU  32           HB2      LEU  32 -35.309   6.277  -8.209
  115    HG   LEU  32           HG       LEU  32 -33.465   4.171  -7.459
  116   HD11  LEU  32          HD11      LEU  32 -33.649   5.821  -5.399
  117   HD12  LEU  32          HD12      LEU  32 -33.677   4.070  -5.195
  118   HD13  LEU  32          HD13      LEU  32 -35.185   4.983  -5.180
  119   HD21  LEU  32          HD21      LEU  32 -36.330   4.141  -6.716
  120   HD22  LEU  32          HD22      LEU  32 -35.349   2.910  -7.513
  121   HD23  LEU  32          HD23      LEU  32 -35.947   4.293  -8.432
  122    H    HIS  33           H        HIS  33 -31.156   6.010 -10.255
  123    HA   HIS  33           HA       HIS  33 -29.482   6.425  -7.865
  124    HB2  HIS  33           HB1      HIS  33 -29.566   4.223  -9.623
  125    HB3  HIS  33           HB2      HIS  33 -28.071   5.088  -9.995
  126    HD1  HIS  33           HD1      HIS  33 -26.453   3.450  -8.947
  127    HD2  HIS  33           HD2      HIS  33 -29.397   4.736  -6.313
  128    HE1  HIS  33           HE1      HIS  33 -25.742   2.614  -6.685
  129    HE2  HIS  33           HE2      HIS  33 -27.542   3.401  -5.074
  130    H    GLY  34           H        GLY  34 -28.858   8.506  -7.985
  131    HA2  GLY  34           HA2      GLY  34 -27.488   9.340 -10.461
  132    HA3  GLY  34           HA3      GLY  34 -28.632  10.412  -9.666
  133    HA1  GLY  34           HA1      GLY  34 -27.180   8.864  -9.786
  134    H    ALA  35           H        ALA  35 -25.936   8.358  -8.553
  135    HA   ALA  35           HA       ALA  35 -25.026  10.578  -6.876
  136    HB1  ALA  35           HB1      ALA  35 -24.738   8.950  -5.394
  137    HB2  ALA  35           HB2      ALA  35 -25.034   7.711  -6.614
  138    HB3  ALA  35           HB3      ALA  35 -23.408   8.355  -6.387
  139    H    ARG  36           H        ARG  36 -23.696  11.925  -7.920
  140    HA   ARG  36           HA       ARG  36 -21.578  10.759  -9.604
  141    HB2  ARG  36           HB1      ARG  36 -21.497  12.885 -10.802
  142    HB3  ARG  36           HB2      ARG  36 -23.125  12.195 -10.850
  143    HG2  ARG  36           HG1      ARG  36 -24.040  13.875  -9.646
  144    HG3  ARG  36           HG2      ARG  36 -22.588  14.083  -8.650
  145    HD2  ARG  36           HD1      ARG  36 -21.471  15.305 -10.385
  146    HD3  ARG  36           HD2      ARG  36 -22.756  14.920 -11.539
  147    HE   ARG  36           HE       ARG  36 -23.990  16.649 -10.693
  148   HH11  ARG  36          HH11      ARG  36 -21.447  15.864  -8.450
  149   HH12  ARG  36          HH12      ARG  36 -21.753  17.225  -7.423
  150   HH21  ARG  36          HH21      ARG  36 -24.402  18.447  -9.350
  151   HH22  ARG  36          HH22      ARG  36 -23.435  18.694  -7.936
  152    H    LYS  37           H        LYS  37 -19.518  11.946  -9.619
  153    HA   LYS  37           HA       LYS  37 -17.685  12.780  -8.562
  154    HB2  LYS  37           HB1      LYS  37 -19.666  14.666  -8.246
  155    HB3  LYS  37           HB2      LYS  37 -19.116  14.400  -6.584
  156    HG2  LYS  37           HG1      LYS  37 -16.813  14.891  -7.248
  157    HG3  LYS  37           HG2      LYS  37 -17.361  15.158  -8.912
  158    HD2  LYS  37           HD1      LYS  37 -18.643  16.699  -6.687
  159    HD3  LYS  37           HD2      LYS  37 -17.043  17.182  -7.279
  160    HE2  LYS  37           HE1      LYS  37 -17.958  17.299  -9.584
  161    HE3  LYS  37           HE2      LYS  37 -19.556  16.912  -8.927
  162    HZ1  LYS  37           HZ1      LYS  37 -18.684  19.393  -9.285
  163    HZ2  LYS  37           HZ2      LYS  37 -18.192  19.155  -7.684
  164    HZ3  LYS  37           HZ3      LYS  37 -19.820  18.974  -8.103
  165    H    GLY  38           H        GLY  38 -16.748  13.177  -6.222
  166    HA2  GLY  38           HA2      GLY  38 -17.465  12.299  -3.862
  167    HA3  GLY  38           HA3      GLY  38 -17.435  10.760  -4.712
  168    HA1  GLY  38           HA1      GLY  38 -16.889  12.779  -4.329
  169    H    SER  39           H        SER  39 -15.851  10.969  -2.569
  170    HA   SER  39           HA       SER  39 -13.198  11.834  -3.353
  171    HB2  SER  39           HB1      SER  39 -14.545  11.471  -0.901
  172    HB3  SER  39           HB2      SER  39 -13.242  10.268  -0.926
  173    HG   SER  39           HG       SER  39 -12.867  12.623  -0.198
  174    H    GLN  40           H        GLN  40 -11.381  10.470  -3.516
  175    HA   GLN  40           HA       GLN  40 -12.041   7.782  -4.455
  176    HB2  GLN  40           HB1      GLN  40 -10.108   9.804  -5.186
  177    HB3  GLN  40           HB2      GLN  40  -9.307   8.260  -4.858
  178    HG2  GLN  40           HG1      GLN  40 -11.512   8.780  -6.849
  179    HG3  GLN  40           HG2      GLN  40  -9.822   8.383  -7.189
  180   HE21  GLN  40          HE21      GLN  40 -12.538   7.079  -7.705
  181   HE22  GLN  40          HE22      GLN  40 -12.290   5.433  -7.244
  182    H    CYS  41           H        CYS  41  -9.434   9.287  -2.537
  183    HA   CYS  41           HA       CYS  41  -9.627   7.170  -0.567
  184    HB2  CYS  41           HB1      CYS  41  -7.204   6.619  -0.723
  185    HB3  CYS  41           HB2      CYS  41  -8.135   6.114  -2.135
  186    H    LEU  42           H        LEU  42  -8.879   7.771   1.428
  187    HA   LEU  42           HA       LEU  42  -8.066  10.573   1.681
  188    HB2  LEU  42           HB1      LEU  42  -9.530   8.636   3.378
  189    HB3  LEU  42           HB2      LEU  42  -8.492   9.801   4.217
  190    HG   LEU  42           HG       LEU  42 -10.102  11.194   2.305
  191   HD11  LEU  42          HD11      LEU  42 -11.564   9.168   2.612
  192   HD12  LEU  42          HD12      LEU  42 -12.302  10.713   3.034
  193   HD13  LEU  42          HD13      LEU  42 -11.721   9.637   4.305
  194   HD21  LEU  42          HD21      LEU  42 -10.808  12.420   4.291
  195   HD22  LEU  42          HD22      LEU  42  -9.062  12.162   4.295
  196   HD23  LEU  42          HD23      LEU  42 -10.104  11.174   5.323
  197    H    SER  43           H        SER  43  -6.951   7.331   2.196
  198    HA   SER  43           HA       SER  43  -4.345   8.390   3.006
  199    HB2  SER  43           HB1      SER  43  -5.645   7.661   5.049
  200    HB3  SER  43           HB2      SER  43  -5.600   6.015   4.394
  201    HG   SER  43           HG       SER  43  -3.569   5.842   4.939
  202    H    ASP  44           H        ASP  44  -2.630   6.666   2.877
  203    HA   ASP  44           HA       ASP  44  -2.573   5.543   0.321
  204    HB2  ASP  44           HB1      ASP  44  -0.929   4.632   2.696
  205    HB3  ASP  44           HB2      ASP  44  -0.511   4.482   0.984
  206    HD2  ASP  44           HD       ASP  44   1.074   7.454   2.460
  207    H    THR  45           H        THR  45  -3.753   4.284   3.334
  208    HA   THR  45           HA       THR  45  -3.898   1.555   2.375
  209    HB   THR  45           HB       THR  45  -5.179   1.200   4.552
  210    HG1  THR  45           HG1      THR  45  -5.782   3.395   4.877
  211   HG21  THR  45          HG21      THR  45  -3.080   1.550   5.948
  212   HG22  THR  45          HG22      THR  45  -2.348   2.224   4.492
  213   HG23  THR  45          HG23      THR  45  -2.906   0.551   4.506
  214    H    ASP  46           H        ASP  46  -5.942   4.350   2.556
  215    HA   ASP  46           HA       ASP  46  -8.443   3.031   2.325
  216    HB2  ASP  46           HB1      ASP  46  -7.856   5.510   2.969
  217    HB3  ASP  46           HB2      ASP  46  -7.989   5.781   1.225
  218    HD2  ASP  46           HD       ASP  46 -11.257   5.906   3.113
  219    H    CYS  47           H        CYS  47  -5.974   3.902   0.052
  220    HA   CYS  47           HA       CYS  47  -7.527   3.863  -2.307
  221    HB2  CYS  47           HB1      CYS  47  -5.233   4.824  -2.113
  222    HB3  CYS  47           HB2      CYS  47  -4.596   3.182  -2.007
  223    H    ASN  48           H        ASN  48  -5.148   1.411  -1.284
  224    HA   ASN  48           HA       ASN  48  -7.019  -0.726  -1.829
  225    HB2  ASN  48           HB1      ASN  48  -5.512   0.142  -3.953
  226    HB3  ASN  48           HB2      ASN  48  -4.511  -1.160  -3.299
  227   HD21  ASN  48          HD21      ASN  48  -4.809  -2.856  -4.558
  228   HD22  ASN  48          HD22      ASN  48  -6.337  -3.502  -5.040
  229    H    THR  49           H        THR  49  -5.694  -2.916  -1.669
  230    HA   THR  49           HA       THR  49  -4.658  -3.014   0.955
  231    HB   THR  49           HB       THR  49  -5.744  -4.961   0.024
  232    HG1  THR  49           HG1      THR  49  -4.072  -5.344   1.558
  233   HG21  THR  49          HG21      THR  49  -5.158  -4.696  -2.316
  234   HG22  THR  49          HG22      THR  49  -4.662  -6.294  -1.757
  235   HG23  THR  49          HG23      THR  49  -3.462  -5.017  -1.953
  236    H    ARG  50           H        ARG  50  -3.160  -2.658  -2.171
  237    HA   ARG  50           HA       ARG  50  -0.585  -2.244  -0.855
  238    HB2  ARG  50           HB1      ARG  50  -1.045  -4.142  -3.166
  239    HB3  ARG  50           HB2      ARG  50   0.551  -3.565  -2.663
  240    HG2  ARG  50           HG1      ARG  50  -0.254  -4.489  -0.309
  241    HG3  ARG  50           HG2      ARG  50  -1.258  -5.510  -1.351
  242    HD2  ARG  50           HD1      ARG  50   1.292  -5.534  -2.524
  243    HD3  ARG  50           HD2      ARG  50   1.561  -5.689  -0.783
  244    HE   ARG  50           HE       ARG  50  -0.466  -7.461  -1.416
  245   HH11  ARG  50          HH11      ARG  50   2.874  -6.973  -2.266
  246   HH12  ARG  50          HH12      ARG  50   3.183  -8.654  -2.551
  247   HH21  ARG  50          HH21      ARG  50  -0.073  -9.678  -1.787
  248   HH22  ARG  50          HH22      ARG  50   1.506 -10.191  -2.280
  249    H    LYS  51           H        LYS  51  -1.799  -0.105  -1.512
  250    HA   LYS  51           HA       LYS  51  -0.473   0.824  -3.939
  251    HB2  LYS  51           HB1      LYS  51  -3.189   0.218  -3.951
  252    HB3  LYS  51           HB2      LYS  51  -3.137   1.974  -3.726
  253    HG2  LYS  51           HG1      LYS  51  -1.853   2.266  -5.736
  254    HG3  LYS  51           HG2      LYS  51  -1.696   0.511  -5.926
  255    HD2  LYS  51           HD1      LYS  51  -3.749   0.288  -6.823
  256    HD3  LYS  51           HD2      LYS  51  -4.464   1.449  -5.692
  257    HE2  LYS  51           HE1      LYS  51  -4.438   3.054  -7.240
  258    HE3  LYS  51           HE2      LYS  51  -2.696   2.832  -7.466
  259    HZ1  LYS  51           HZ1      LYS  51  -3.081   1.171  -9.099
  260    HZ2  LYS  51           HZ2      LYS  51  -4.060   2.491  -9.500
  261    HZ3  LYS  51           HZ3      LYS  51  -4.740   1.124  -8.772
  262    H    PHE  52           H        PHE  52  -0.570   3.244  -4.108
  263    HA   PHE  52           HA       PHE  52  -0.505   4.428  -1.411
  264    HB2  PHE  52           HB1      PHE  52   1.704   4.508  -2.169
  265    HB3  PHE  52           HB2      PHE  52   1.220   4.858  -3.830
  266    HD1  PHE  52           HD1      PHE  52   1.524   6.320  -0.456
  267    HD2  PHE  52           HD2      PHE  52   0.932   7.068  -4.604
  268    HE1  PHE  52           HE1      PHE  52   1.857   8.726  -0.065
  269    HE2  PHE  52           HE2      PHE  52   1.264   9.476  -4.220
  270    HZ   PHE  52           HZ       PHE  52   1.728  10.307  -1.949
  271    H    CYS  53           H        CYS  53  -1.423   6.435  -1.071
  272    HA   CYS  53           HA       CYS  53  -3.175   7.390  -3.236
  273    HB2  CYS  53           HB1      CYS  53  -4.342   6.537  -1.230
  274    HB3  CYS  53           HB2      CYS  53  -3.498   7.735  -0.247
  275    H    LEU  54           H        LEU  54  -2.982   9.426  -3.957
  276    HA   LEU  54           HA       LEU  54  -1.063  11.178  -2.574
  277    HB2  LEU  54           HB1      LEU  54  -0.560  10.317  -4.932
  278    HB3  LEU  54           HB2      LEU  54  -1.859  11.400  -5.462
  279    HG   LEU  54           HG       LEU  54   0.467  12.296  -5.731
  280   HD11  LEU  54          HD11      LEU  54  -1.596  13.698  -5.599
  281   HD12  LEU  54          HD12      LEU  54  -0.120  14.515  -5.088
  282   HD13  LEU  54          HD13      LEU  54  -1.263  13.925  -3.882
  283   HD21  LEU  54          HD21      LEU  54   1.334  11.368  -3.596
  284   HD22  LEU  54          HD22      LEU  54   0.363  12.558  -2.728
  285   HD23  LEU  54          HD23      LEU  54   1.658  13.089  -3.803
  286    H    GLN  55           H        GLN  55  -1.966  12.818  -1.536
  287    HA   GLN  55           HA       GLN  55  -4.529  13.876  -2.518
  288    HB2  GLN  55           HB1      GLN  55  -4.694  14.860  -0.181
  289    HB3  GLN  55           HB2      GLN  55  -4.821  13.097  -0.306
  290    HG2  GLN  55           HG1      GLN  55  -2.089  14.080   0.112
  291    HG3  GLN  55           HG2      GLN  55  -3.213  14.428   1.434
  292   HE21  GLN  55          HE21      GLN  55  -2.794  13.001   2.969
  293   HE22  GLN  55          HE22      GLN  55  -2.684  11.291   2.755
  294    HA   PRO  56           HA       PRO  56  -1.618  17.235  -3.591
  295    HB2  PRO  56           HB1      PRO  56  -3.113  18.142  -5.699
  296    HB3  PRO  56           HB2      PRO  56  -1.982  16.795  -5.816
  297    HG2  PRO  56           HG1      PRO  56  -4.955  16.753  -5.418
  298    HG3  PRO  56           HG2      PRO  56  -3.940  15.762  -6.530
  299    HD2  PRO  56           HD1      PRO  56  -4.891  14.808  -4.173
  300    HD3  PRO  56           HD2      PRO  56  -3.324  14.321  -4.841
  301    H    ARG  57           H        ARG  57  -1.741  19.408  -3.137
  302    HA   ARG  57           HA       ARG  57  -4.043  20.263  -1.610
  303    HB2  ARG  57           HB1      ARG  57  -1.441  20.707  -1.240
  304    HB3  ARG  57           HB2      ARG  57  -1.807  22.128  -2.229
  305    HG2  ARG  57           HG1      ARG  57  -3.649  22.681  -0.615
  306    HG3  ARG  57           HG2      ARG  57  -3.025  21.383   0.417
  307    HD2  ARG  57           HD1      ARG  57  -0.888  23.144  -0.444
  308    HD3  ARG  57           HD2      ARG  57  -2.182  24.041   0.362
  309    HE   ARG  57           HE       ARG  57  -0.313  22.291   1.592
  310   HH11  ARG  57          HH11      ARG  57  -3.613  23.386   1.761
  311   HH12  ARG  57          HH12      ARG  57  -3.768  23.071   3.458
  312   HH21  ARG  57          HH21      ARG  57  -0.503  21.873   3.825
  313   HH22  ARG  57          HH22      ARG  57  -1.998  22.212   4.631
  314    H    ASP  58           H        ASP  58  -2.779  20.691  -4.789
  315    HA   ASP  58           HA       ASP  58  -4.447  23.029  -5.305
  316    HB2  ASP  58           HB1      ASP  58  -2.057  21.874  -6.478
  317    HB3  ASP  58           HB2      ASP  58  -3.281  22.202  -7.712
  318    HD2  ASP  58           HD       ASP  58  -1.266  25.198  -6.361
  319    H    GLU  59           H        GLU  59  -4.440  19.611  -5.754
  320    HA   GLU  59           HA       GLU  59  -6.913  19.838  -7.340
  321    HB2  GLU  59           HB1      GLU  59  -4.464  18.403  -7.925
  322    HB3  GLU  59           HB2      GLU  59  -5.848  17.302  -7.852
  323    HG2  GLU  59           HG1      GLU  59  -6.320  17.864  -9.938
  324    HG3  GLU  59           HG2      GLU  59  -6.757  19.469  -9.333
  325    HE2  GLU  59           HE       GLU  59  -3.708  20.831 -10.420
  326    H    LYS  60           H        LYS  60  -7.955  17.436  -7.286
  327    HA   LYS  60           HA       LYS  60  -8.640  17.053  -4.501
  328    HB2  LYS  60           HB1      LYS  60  -9.792  16.356  -7.119
  329    HB3  LYS  60           HB2      LYS  60 -10.023  15.126  -5.866
  330    HG2  LYS  60           HG1      LYS  60 -11.129  16.699  -4.423
  331    HG3  LYS  60           HG2      LYS  60 -10.765  18.025  -5.542
  332    HD2  LYS  60           HD1      LYS  60 -12.118  16.850  -7.287
  333    HD3  LYS  60           HD2      LYS  60 -12.581  15.670  -6.049
  334    HE2  LYS  60           HE1      LYS  60 -13.012  18.311  -5.019
  335    HE3  LYS  60           HE2      LYS  60 -13.774  18.170  -6.610
  336    HZ1  LYS  60           HZ1      LYS  60 -14.271  15.855  -5.040
  337    HZ2  LYS  60           HZ2      LYS  60 -15.373  16.912  -5.766
  338    HZ3  LYS  60           HZ3      LYS  60 -14.772  17.247  -4.221
  339    HA   PRO  61           HA       PRO  61  -6.251  13.475  -3.640
  340    HB2  PRO  61           HB1      PRO  61  -7.982  11.953  -2.159
  341    HB3  PRO  61           HB2      PRO  61  -7.234  13.435  -1.564
  342    HG2  PRO  61           HG1      PRO  61  -9.954  13.025  -2.758
  343    HG3  PRO  61           HG2      PRO  61  -9.482  13.961  -1.290
  344    HD2  PRO  61           HD1      PRO  61 -10.013  15.143  -3.675
  345    HD3  PRO  61           HD2      PRO  61  -8.801  15.770  -2.544
  346    H    PHE  62           H        PHE  62  -5.664  11.798  -4.858
  347    HA   PHE  62           HA       PHE  62  -7.702  10.004  -5.939
  348    HB2  PHE  62           HB1      PHE  62  -6.357  10.027  -8.146
  349    HB3  PHE  62           HB2      PHE  62  -7.469  11.361  -7.829
  350    HD1  PHE  62           HD1      PHE  62  -3.917  10.552  -6.996
  351    HD2  PHE  62           HD2      PHE  62  -6.708  13.431  -8.424
  352    HE1  PHE  62           HE1      PHE  62  -2.090  12.173  -7.290
  353    HE2  PHE  62           HE2      PHE  62  -4.884  15.055  -8.722
  354    HZ   PHE  62           HZ       PHE  62  -2.571  14.427  -8.156
  355    H    CYS  63           H        CYS  63  -6.725   8.008  -6.869
  356    HA   CYS  63           HA       CYS  63  -4.734   6.993  -5.067
  357    HB2  CYS  63           HB1      CYS  63  -6.465   5.869  -7.223
  358    HB3  CYS  63           HB2      CYS  63  -5.022   4.961  -6.769
  359    H    ALA  64           H        ALA  64  -2.611   6.810  -5.380
  360    HA   ALA  64           HA       ALA  64  -1.563   7.292  -8.094
  361    HB1  ALA  64           HB1      ALA  64   0.495   8.157  -6.851
  362    HB2  ALA  64           HB2      ALA  64  -0.943   9.180  -6.855
  363    HB3  ALA  64           HB3      ALA  64  -0.545   8.223  -5.427
  364    H    THR  65           H        THR  65  -0.903   5.403  -8.891
  365    HA   THR  65           HA       THR  65  -0.206   3.136  -7.406
  366    HB   THR  65           HB       THR  65   1.124   3.292 -10.010
  367    HG1  THR  65           HG1      THR  65  -0.457   4.463 -10.852
  368   HG21  THR  65          HG21      THR  65  -0.482   1.304 -10.350
  369   HG22  THR  65          HG22      THR  65  -0.854   1.502  -8.637
  370   HG23  THR  65          HG23      THR  65   0.796   1.147  -9.146
  371    H    CYS  66           H        CYS  66   1.882   2.063  -7.267
  372    HA   CYS  66           HA       CYS  66   3.842   3.562  -6.034
  373    HB2  CYS  66           HB1      CYS  66   3.763   1.176  -5.753
  374    HB3  CYS  66           HB2      CYS  66   4.063   0.915  -7.472
  375    H    ARG  67           H        ARG  67   5.614   4.679  -6.661
  376    HA   ARG  67           HA       ARG  67   5.849   5.309  -9.484
  377    HB2  ARG  67           HB1      ARG  67   7.267   6.402  -7.044
  378    HB3  ARG  67           HB2      ARG  67   7.508   6.995  -8.694
  379    HG2  ARG  67           HG1      ARG  67   4.825   6.988  -7.318
  380    HG3  ARG  67           HG2      ARG  67   5.952   8.355  -7.276
  381    HD2  ARG  67           HD1      ARG  67   5.925   8.408  -9.764
  382    HD3  ARG  67           HD2      ARG  67   4.703   7.129  -9.732
  383    HE   ARG  67           HE       ARG  67   3.710   9.152  -8.145
  384   HH11  ARG  67          HH11      ARG  67   4.703   8.782 -11.461
  385   HH12  ARG  67          HH12      ARG  67   3.599   9.976 -12.061
  386   HH21  ARG  67          HH21      ARG  67   2.253  10.725  -8.922
  387   HH22  ARG  67          HH22      ARG  67   2.207  11.081 -10.616
  388    H    GLY  68           H        GLY  68   8.410   5.823  -9.965
  389    HA2  GLY  68           HA2      GLY  68   9.610   3.154  -9.912
  390    HA3  GLY  68           HA3      GLY  68  10.073   4.478 -10.971
  391    HA1  GLY  68           HA1      GLY  68   9.460   3.570  -9.149
  392    H    LEU  69           H        LEU  69  12.059   3.106  -9.803
  393    HA   LEU  69           HA       LEU  69  12.860   4.141  -7.276
  394    HB2  LEU  69           HB1      LEU  69  14.397   2.733  -9.463
  395    HB3  LEU  69           HB2      LEU  69  15.080   3.160  -7.883
  396    HG   LEU  69           HG       LEU  69  12.841   1.209  -8.415
  397   HD11  LEU  69          HD11      LEU  69  14.685  -0.033  -8.866
  398   HD12  LEU  69          HD12      LEU  69  14.685  -0.194  -7.110
  399   HD13  LEU  69          HD13      LEU  69  15.747   0.980  -7.888
  400   HD21  LEU  69          HD21      LEU  69  12.382   2.388  -6.361
  401   HD22  LEU  69          HD22      LEU  69  14.040   2.145  -5.811
  402   HD23  LEU  69          HD23      LEU  69  12.959   0.763  -5.987
  403    H    ARG  70           H        ARG  70  13.142   5.248 -10.534
  404    HA   ARG  70           HA       ARG  70  15.236   7.162  -9.878
  405    HB2  ARG  70           HB1      ARG  70  13.913   6.213 -12.378
  406    HB3  ARG  70           HB2      ARG  70  14.620   7.837 -12.376
  407    HG2  ARG  70           HG1      ARG  70  16.674   6.464 -11.315
  408    HG3  ARG  70           HG2      ARG  70  15.938   5.203 -12.317
  409    HD2  ARG  70           HD1      ARG  70  16.417   7.931 -13.469
  410    HD3  ARG  70           HD2      ARG  70  17.751   6.776 -13.332
  411    HE   ARG  70           HE       ARG  70  15.528   6.649 -15.160
  412   HH11  ARG  70          HH11      ARG  70  18.039   4.855 -13.547
  413   HH12  ARG  70          HH12      ARG  70  18.070   3.587 -14.727
  414   HH21  ARG  70          HH21      ARG  70  15.560   4.985 -16.720
  415   HH22  ARG  70          HH22      ARG  70  16.660   3.662 -16.532
  416    H    ARG  71           H        ARG  71  12.229   7.116  -9.011
  417    HA   ARG  71           HA       ARG  71  11.483   9.799  -9.916
  418    HB2  ARG  71           HB1      ARG  71   9.955   7.613  -8.497
  419    HB3  ARG  71           HB2      ARG  71   9.310   9.246  -8.720
  420    HG2  ARG  71           HG1      ARG  71  10.122   7.354 -10.930
  421    HG3  ARG  71           HG2      ARG  71   8.466   7.719 -10.417
  422    HD2  ARG  71           HD1      ARG  71   8.485   9.326 -11.977
  423    HD3  ARG  71           HD2      ARG  71   9.531  10.215 -10.859
  424    HE   ARG  71           HE       ARG  71  11.014   8.427 -12.519
  425   HH11  ARG  71          HH11      ARG  71   9.473  11.547 -12.424
  426   HH12  ARG  71          HH12      ARG  71  10.489  12.232 -13.648
  427   HH21  ARG  71          HH21      ARG  71  12.359   9.318 -14.132
  428   HH22  ARG  71          HH22      ARG  71  12.130  10.962 -14.620
  429    H    ARG  72           H        ARG  72  11.607  11.533  -8.634
  430    HA   ARG  72           HA       ARG  72  12.941  11.397  -6.140
  431    HB2  ARG  72           HB1      ARG  72  11.386  13.655  -7.426
  432    HB3  ARG  72           HB2      ARG  72  12.406  13.824  -5.989
  433    HG2  ARG  72           HG1      ARG  72  13.839  12.568  -8.178
  434    HG3  ARG  72           HG2      ARG  72  13.195  14.159  -8.616
  435    HD2  ARG  72           HD1      ARG  72  14.178  14.787  -6.211
  436    HD3  ARG  72           HD2      ARG  72  15.244  13.428  -6.600
  437    HE   ARG  72           HE       ARG  72  16.326  14.781  -8.078
  438   HH11  ARG  72          HH11      ARG  72  13.141  16.074  -7.525
  439   HH12  ARG  72          HH12      ARG  72  13.411  17.495  -8.479
  440   HH21  ARG  72          HH21      ARG  72  16.694  16.647  -9.336
  441   HH22  ARG  72          HH22      ARG  72  15.432  17.820  -9.509
  442    H    CYS  73           H        CYS  73  12.157  11.984  -4.055
  443    HA   CYS  73           HA       CYS  73   9.265  11.938  -3.661
  444    HB2  CYS  73           HB1      CYS  73   9.337  10.181  -2.014
  445    HB3  CYS  73           HB2      CYS  73  10.042   9.580  -3.515
  446    H    GLN  74           H        GLN  74   8.582  13.097  -1.918
  447    HA   GLN  74           HA       GLN  74  10.600  14.710  -0.580
  448    HB2  GLN  74           HB1      GLN  74   7.608  14.858  -0.839
  449    HB3  GLN  74           HB2      GLN  74   8.459  15.816   0.384
  450    HG2  GLN  74           HG1      GLN  74   9.936  16.466  -1.750
  451    HG3  GLN  74           HG2      GLN  74   8.399  16.115  -2.552
  452   HE21  GLN  74          HE21      GLN  74   9.584  18.645  -2.491
  453   HE22  GLN  74          HE22      GLN  74   8.561  19.707  -1.592
  454    H    ARG  75           H        ARG  75   7.861  12.626   0.327
  455    HA   ARG  75           HA       ARG  75   9.104  12.310   2.981
  456    HB2  ARG  75           HB1      ARG  75   6.180  12.115   2.213
  457    HB3  ARG  75           HB2      ARG  75   6.834  11.808   3.828
  458    HG2  ARG  75           HG1      ARG  75   7.034  13.993   4.324
  459    HG3  ARG  75           HG2      ARG  75   7.541  14.416   2.680
  460    HD2  ARG  75           HD1      ARG  75   5.247  14.297   1.889
  461    HD3  ARG  75           HD2      ARG  75   4.712  13.747   3.483
  462    HE   ARG  75           HE       ARG  75   5.323  16.448   2.695
  463   HH11  ARG  75          HH11      ARG  75   5.007  14.229   5.359
  464   HH12  ARG  75          HH12      ARG  75   4.706  15.471   6.529
  465   HH21  ARG  75          HH21      ARG  75   4.928  18.093   4.226
  466   HH22  ARG  75          HH22      ARG  75   4.660  17.669   5.883
  467    H    ASP  76           H        ASP  76   8.676  10.202   4.031
  468    HA   ASP  76           HA       ASP  76   9.433   8.069   2.334
  469    HB2  ASP  76           HB1      ASP  76   8.257   7.662   5.076
  470    HB3  ASP  76           HB2      ASP  76   9.537   6.746   4.269
  471    HD2  ASP  76           HD       ASP  76  10.829   9.256   6.713
  472    H    ALA  77           H        ALA  77   6.366   9.253   3.439
  473    HA   ALA  77           HA       ALA  77   4.895   6.865   2.817
  474    HB1  ALA  77           HB1      ALA  77   3.035   8.871   2.893
  475    HB2  ALA  77           HB2      ALA  77   3.583   7.931   4.280
  476    HB3  ALA  77           HB3      ALA  77   4.313   9.499   3.933
  477    H    MET  78           H        MET  78   5.794   9.797   1.143
  478    HA   MET  78           HA       MET  78   3.966   9.847  -0.930
  479    HB2  MET  78           HB1      MET  78   6.682  10.855  -0.466
  480    HB3  MET  78           HB2      MET  78   6.313  10.567  -2.173
  481    HG2  MET  78           HG1      MET  78   4.058  11.877  -1.258
  482    HG3  MET  78           HG2      MET  78   5.381  12.663  -0.393
  483    HE1  MET  78           HE1      MET  78   5.640  11.151  -4.188
  484    HE2  MET  78           HE2      MET  78   3.979  11.526  -3.725
  485    HE3  MET  78           HE3      MET  78   4.800  12.507  -4.942
  486    H    CYS  79           H        CYS  79   6.903   7.909  -0.601
  487    HA   CYS  79           HA       CYS  79   6.514   6.676  -3.196
  488    HB2  CYS  79           HB1      CYS  79   8.767   7.243  -2.021
  489    HB3  CYS  79           HB2      CYS  79   8.494   5.737  -1.142
  490    H    CYS  80           H        CYS  80   5.934   4.554  -3.570
  491    HA   CYS  80           HA       CYS  80   3.992   3.397  -1.991
  492    HB2  CYS  80           HB1      CYS  80   4.501   1.271  -3.264
  493    HB3  CYS  80           HB2      CYS  80   4.175   2.694  -4.255
  494    HA   PRO  81           HA       PRO  81   5.966   1.341   1.345
  495    HB2  PRO  81           HB1      PRO  81   4.390  -0.882   1.629
  496    HB3  PRO  81           HB2      PRO  81   3.868   0.744   2.069
  497    HG2  PRO  81           HG1      PRO  81   3.341  -0.807  -0.445
  498    HG3  PRO  81           HG2      PRO  81   2.198   0.163   0.559
  499    HD2  PRO  81           HD1      PRO  81   3.270   1.093  -1.754
  500    HD3  PRO  81           HD2      PRO  81   2.907   2.146  -0.377
  501    H    GLY  82           H        GLY  82   7.816   0.234   1.405
  502    HA2  GLY  82           HA2      GLY  82   8.671  -2.134   1.145
  503    HA3  GLY  82           HA3      GLY  82   8.188  -1.960  -0.536
  504    HA1  GLY  82           HA1      GLY  82   8.867  -1.304   1.368
  505    H    THR  83           H        THR  83   9.098   0.963  -0.274
  506    HA   THR  83           HA       THR  83  11.971   0.410  -0.639
  507    HB   THR  83           HB       THR  83  11.794   2.625  -2.046
  508    HG1  THR  83           HG1      THR  83   9.141   1.582  -2.140
  509   HG21  THR  83          HG21      THR  83  10.625   0.660  -3.761
  510   HG22  THR  83          HG22      THR  83  11.743  -0.136  -2.653
  511   HG23  THR  83          HG23      THR  83  12.305   1.190  -3.670
  512    H    LEU  84           H        LEU  84  13.297   2.519  -0.436
  513    HA   LEU  84           HA       LEU  84  12.330   4.035   1.899
  514    HB2  LEU  84           HB1      LEU  84  14.707   2.423   1.559
  515    HB3  LEU  84           HB2      LEU  84  15.122   4.103   1.942
  516    HG   LEU  84           HG       LEU  84  15.030   2.720   3.951
  517   HD11  LEU  84          HD11      LEU  84  14.291   4.469   5.108
  518   HD12  LEU  84          HD12      LEU  84  12.649   4.272   4.496
  519   HD13  LEU  84          HD13      LEU  84  13.833   5.189   3.565
  520   HD21  LEU  84          HD21      LEU  84  13.219   1.476   4.614
  521   HD22  LEU  84          HD22      LEU  84  13.135   1.275   2.864
  522   HD23  LEU  84          HD23      LEU  84  12.075   2.432   3.672
  523    H    CYS  85           H        CYS  85  12.623   6.215   1.896
  524    HA   CYS  85           HA       CYS  85  13.231   7.449  -0.632
  525    HB2  CYS  85           HB1      CYS  85  12.049   8.267   1.947
  526    HB3  CYS  85           HB2      CYS  85  12.948   9.531   1.106
  527    H    VAL  86           H        VAL  86  15.372   7.312  -1.113
  528    HA   VAL  86           HA       VAL  86  17.266   8.444   0.841
  529    HB   VAL  86           HB       VAL  86  17.875   6.583  -1.459
  530   HG11  VAL  86          HG11      VAL  86  19.621   7.616   0.774
  531   HG12  VAL  86          HG12      VAL  86  20.097   6.418  -0.431
  532   HG13  VAL  86          HG13      VAL  86  19.727   8.071  -0.926
  533   HG21  VAL  86          HG21      VAL  86  16.635   5.394   0.226
  534   HG22  VAL  86          HG22      VAL  86  18.330   4.919   0.328
  535   HG23  VAL  86          HG23      VAL  86  17.660   6.052   1.502
  536    H    ASN  87           H        ASN  87  18.403  10.216   0.318
  537    HA   ASN  87           HA       ASN  87  18.981  12.117  -0.795
  538    HB2  ASN  87           HB1      ASN  87  20.280  10.192  -1.984
  539    HB3  ASN  87           HB2      ASN  87  19.160  10.494  -3.317
  540   HD21  ASN  87          HD21      ASN  87  22.140  10.999  -2.716
  541   HD22  ASN  87          HD22      ASN  87  22.379  12.617  -3.275
  542    H    ASP  88           H        ASP  88  16.185  11.602  -0.623
  543    HA   ASP  88           HA       ASP  88  14.216  12.446  -1.388
  544    HB2  ASP  88           HB1      ASP  88  15.855  14.033  -3.376
  545    HB3  ASP  88           HB2      ASP  88  14.249  14.421  -2.741
  546    HD2  ASP  88           HD       ASP  88  17.398  15.495  -0.669
  547    H    VAL  89           H        VAL  89  15.319  10.036  -2.542
  548    HA   VAL  89           HA       VAL  89  13.676   9.954  -4.948
  549    HB   VAL  89           HB       VAL  89  16.546   9.008  -4.957
  550   HG11  VAL  89          HG11      VAL  89  16.115   8.522  -7.340
  551   HG12  VAL  89          HG12      VAL  89  15.135   7.536  -6.254
  552   HG13  VAL  89          HG13      VAL  89  14.415   8.913  -7.089
  553   HG21  VAL  89          HG21      VAL  89  16.705  11.308  -5.215
  554   HG22  VAL  89          HG22      VAL  89  16.624  10.737  -6.881
  555   HG23  VAL  89          HG23      VAL  89  15.190  11.415  -6.110
  556    H    CYS  90           H        CYS  90  12.793   7.952  -5.375
  557    HA   CYS  90           HA       CYS  90  12.523   6.171  -3.208
  558    HB2  CYS  90           HB1      CYS  90  11.785   5.971  -6.129
  559    HB3  CYS  90           HB2      CYS  90  11.434   4.677  -4.981
  560    H    THR  91           H        THR  91  14.202   5.028  -2.473
  561    HA   THR  91           HA       THR  91  15.784   3.491  -4.431
  562    HB   THR  91           HB       THR  91  16.778   4.475  -1.751
  563    HG1  THR  91           HG1      THR  91  16.594   6.271  -3.046
  564   HG21  THR  91          HG21      THR  91  18.250   3.286  -4.107
  565   HG22  THR  91          HG22      THR  91  17.864   2.435  -2.610
  566   HG23  THR  91          HG23      THR  91  18.967   3.812  -2.584
  567    H    THR  92           H        THR  92  15.881   1.344  -4.158
  568    HA   THR  92           HA       THR  92  14.143  -0.031  -2.490
  569    HB   THR  92           HB       THR  92  15.970  -1.952  -2.898
  570    HG1  THR  92           HG1      THR  92  16.427  -0.393  -5.187
  571   HG21  THR  92          HG21      THR  92  14.873  -1.790  -5.408
  572   HG22  THR  92          HG22      THR  92  13.741  -0.850  -4.437
  573   HG23  THR  92          HG23      THR  92  14.101  -2.521  -4.002
  574    H    MET  93           H        MET  93  14.503  -1.370  -0.649
  575    HA   MET  93           HA       MET  93  15.994  -0.135   1.399
  576    HB2  MET  93           HB1      MET  93  14.004  -2.080   1.234
  577    HB3  MET  93           HB2      MET  93  15.393  -2.926   1.936
  578    HG2  MET  93           HG1      MET  93  15.219  -0.446   3.269
  579    HG3  MET  93           HG2      MET  93  13.580  -1.094   3.171
  580    HE1  MET  93           HE1      MET  93  14.720  -0.387   5.601
  581    HE2  MET  93           HE2      MET  93  13.695  -1.634   6.310
  582    HE3  MET  93           HE3      MET  93  15.421  -1.603   6.670
  583    H    GLU  94           H        GLU  94  16.535  -3.166  -0.386
  584    HA   GLU  94           HA       GLU  94  18.860  -3.989   0.879
  585    HB2  GLU  94           HB1      GLU  94  18.147  -4.294  -2.049
  586    HB3  GLU  94           HB2      GLU  94  19.351  -5.250  -1.172
  587    HG2  GLU  94           HG1      GLU  94  16.976  -5.464   0.312
  588    HG3  GLU  94           HG2      GLU  94  16.525  -5.651  -1.389
  589    HE2  GLU  94           HE       GLU  94  18.089  -8.720  -1.627
  590    H    ASP  95           H        ASP  95  18.404  -1.597  -1.649
  591    HA   ASP  95           HA       ASP  95  21.231  -1.243  -2.095
  592    HB2  ASP  95           HB1      ASP  95  18.725  -0.256  -3.269
  593    HB3  ASP  95           HB2      ASP  95  20.007   0.962  -3.199
  594    HD2  ASP  95           HD       ASP  95  21.329  -0.395  -6.038
  595    H    ALA  96           H        ALA  96  18.678   0.361  -0.287
  596    HA   ALA  96           HA       ALA  96  19.892   2.756   0.358
  597    HB1  ALA  96           HB1      ALA  96  18.172   3.036   1.772
  598    HB2  ALA  96           HB2      ALA  96  17.574   1.533   1.069
  599    HB3  ALA  96           HB3      ALA  96  18.464   1.502   2.591
  600    H    THR  97           H        THR  97  21.963   2.922   0.969
  601    HA   THR  97           HA       THR  97  22.790   1.463   3.383
  602    HB   THR  97           HB       THR  97  25.164   1.571   2.190
  603    HG1  THR  97           HG1      THR  97  24.565   0.846  -0.105
  604   HG21  THR  97          HG21      THR  97  23.131  -0.424   2.533
  605   HG22  THR  97          HG22      THR  97  24.885  -0.608   2.561
  606   HG23  THR  97          HG23      THR  97  24.009  -0.723   1.034
  607    H    GLU  98           H        GLU  98  22.169   3.563   4.326
  608    HA   GLU  98           HA       GLU  98  24.177   5.663   3.869
  609    HB2  GLU  98           HB1      GLU  98  22.606   7.204   4.942
  610    HB3  GLU  98           HB2      GLU  98  21.859   6.382   3.564
  611    HG2  GLU  98           HG1      GLU  98  20.754   4.814   5.105
  612    HG3  GLU  98           HG2      GLU  98  21.457   5.700   6.466
  613    HE2  GLU  98           HE       GLU  98  18.709   7.699   4.399
  614    H    ASN  99           H        ASN  99  24.437   7.040   6.009
  615    HA   ASN  99           HA       ASN  99  25.427   7.149   8.054
  616    HB2  ASN  99           HB1      ASN  99  23.027   5.846   8.407
  617    HB3  ASN  99           HB2      ASN  99  24.178   4.734   9.160
  618   HD21  ASN  99          HD21      ASN  99  24.516   5.056  11.225
  619   HD22  ASN  99          HD22      ASN  99  24.388   6.563  12.060
  620    H    LEU 100           H        LEU 100  26.498   5.554   9.828
  621    HA   LEU 100           HA       LEU 100  27.884   3.351   8.520
  622    HB2  LEU 100           HB1      LEU 100  29.036   5.880   8.631
  623    HB3  LEU 100           HB2      LEU 100  29.767   4.997   9.983
  624    HG   LEU 100           HG       LEU 100  29.968   3.214   7.886
  625   HD11  LEU 100          HD11      LEU 100  29.359   4.743   6.195
  626   HD12  LEU 100          HD12      LEU 100  31.118   4.631   6.138
  627   HD13  LEU 100          HD13      LEU 100  30.348   6.027   6.892
  628   HD21  LEU 100          HD21      LEU 100  31.641   3.713   9.618
  629   HD22  LEU 100          HD22      LEU 100  32.011   5.235   8.807
  630   HD23  LEU 100          HD23      LEU 100  32.340   3.703   7.999
  631    H    TYR 101           H        TYR 101  29.695   2.619  10.298
  632    HA   TYR 101           HA       TYR 101  28.332   2.536  12.904
  633    HB2  TYR 101           HB1      TYR 101  29.084   0.131  13.079
  634    HB3  TYR 101           HB2      TYR 101  27.798   0.440  11.910
  635    HD1  TYR 101           HD1      TYR 101  31.315  -0.500  12.306
  636    HD2  TYR 101           HD2      TYR 101  28.192   0.259   9.518
  637    HE1  TYR 101           HE1      TYR 101  32.646  -1.566  10.534
  638    HE2  TYR 101           HE2      TYR 101  29.515  -0.804   7.738
  639    HH   TYR 101           HH       TYR 101  31.473  -2.655   7.755
  640    H    PHE 102           H        PHE 102  29.976   1.237  14.465
  641    HA   PHE 102           HA       PHE 102  32.732   2.012  14.021
  642    HB2  PHE 102           HB1      PHE 102  32.932   3.371  16.021
  643    HB3  PHE 102           HB2      PHE 102  31.701   4.058  14.959
  644    HD1  PHE 102           HD1      PHE 102  32.300   2.364  18.136
  645    HD2  PHE 102           HD2      PHE 102  29.356   4.024  15.549
  646    HE1  PHE 102           HE1      PHE 102  30.665   2.321  19.975
  647    HE2  PHE 102           HE2      PHE 102  27.717   3.984  17.383
  648    HZ   PHE 102           HZ       PHE 102  28.370   3.133  19.600
  649    H    GLN 103           H        GLN 103  34.192   0.898  15.311
  650    HA   GLN 103           HA       GLN 103  33.010  -1.207  17.000
  651    HB2  GLN 103           HB1      GLN 103  34.857  -1.342  14.788
  652    HB3  GLN 103           HB2      GLN 103  35.608  -1.991  16.256
  653    HG2  GLN 103           HG1      GLN 103  34.529  -3.897  15.969
  654    HG3  GLN 103           HG2      GLN 103  32.995  -3.037  16.144
  655   HE21  GLN 103          HE21      GLN 103  31.859  -2.399  14.309
  656   HE22  GLN 103          HE22      GLN 103  32.192  -3.062  12.749
  657    H    SER 104           H        SER 104  34.883  -2.162  18.470
  658    HA   SER 104           HA       SER 104  36.130  -1.842  20.347
  659    HB2  SER 104           HB1      SER 104  37.608  -0.834  18.386
  660    HB3  SER 104           HB2      SER 104  37.294   0.682  19.248
  661    HG   SER 104           HG       SER 104  39.181  -0.876  19.836
  662    H    LEU 105           H        LEU 105  36.952   0.284  21.793
  663    HA   LEU 105           HA       LEU 105  35.117   2.403  22.045
  664    HB2  LEU 105           HB1      LEU 105  33.931   0.124  22.841
  665    HB3  LEU 105           HB2      LEU 105  34.731   0.593  24.352
  666    HG   LEU 105           HG       LEU 105  33.510   2.924  23.655
  667   HD11  LEU 105          HD11      LEU 105  31.650   2.665  22.443
  668   HD12  LEU 105          HD12      LEU 105  31.241   1.136  23.221
  669   HD13  LEU 105          HD13      LEU 105  32.394   1.166  21.887
  670   HD21  LEU 105          HD21      LEU 105  31.795   2.267  25.336
  671   HD22  LEU 105          HD22      LEU 105  33.455   1.986  25.858
  672   HD23  LEU 105          HD23      LEU 105  32.462   0.635  25.312
  673    H    GLU 106           H        GLU 106  35.227   3.158  24.575
  674    HA   GLU 106           HA       GLU 106  37.971   2.801  25.530
  675    HB2  GLU 106           HB1      GLU 106  38.257   5.226  25.824
  676    HB3  GLU 106           HB2      GLU 106  38.048   4.786  24.123
  677    HG2  GLU 106           HG1      GLU 106  35.709   5.480  24.209
  678    HG3  GLU 106           HG2      GLU 106  35.905   5.910  25.912
  679    HE2  GLU 106           HE       GLU 106  37.004   9.021  25.040
  680    H    HIS 107           H        HIS 107  38.290   3.609  27.735
  681    HA   HIS 107           HA       HIS 107  36.211   4.496  29.388
  682    HB2  HIS 107           HB1      HIS 107  35.892   1.814  28.711
  683    HB3  HIS 107           HB2      HIS 107  36.632   1.767  30.314
  684    HD1  HIS 107           HD1      HIS 107  33.529   2.960  28.564
  685    HD2  HIS 107           HD2      HIS 107  35.014   2.555  32.423
  686    HE1  HIS 107           HE1      HIS 107  31.568   3.367  30.085
  687    HE2  HIS 107           HE2      HIS 107  32.475   3.122  32.444
  688    H    HIS 108           H        HIS 108  36.767   3.940  31.805
  689    HA   HIS 108           HA       HIS 108  38.241   4.310  33.501
  690    HB2  HIS 108           HB1      HIS 108  38.875   1.954  32.501
  691    HB3  HIS 108           HB2      HIS 108  40.350   2.795  32.013
  692    HD1  HIS 108           HD1      HIS 108  40.462   4.603  34.655
  693    HD2  HIS 108           HD2      HIS 108  40.159   0.463  34.481
  694    HE1  HIS 108           HE1      HIS 108  41.359   3.770  36.852
  695    HE2  HIS 108           HE2      HIS 108  41.173   1.240  36.748
  696    H    HIS 109           H        HIS 109  38.134   6.508  32.120
  697    HA   HIS 109           HA       HIS 109  40.853   7.516  32.191
  698    HB2  HIS 109           HB1      HIS 109  39.149   7.546  29.697
  699    HB3  HIS 109           HB2      HIS 109  40.479   8.682  29.946
  700    HD1  HIS 109           HD1      HIS 109  39.918   5.733  28.199
  701    HD2  HIS 109           HD2      HIS 109  42.942   6.952  30.774
  702    HE1  HIS 109           HE1      HIS 109  41.885   4.256  27.672
  703    HE2  HIS 109           HE2      HIS 109  43.733   5.000  29.248
  704    H    HIS 110           H        HIS 110  39.969   8.597  34.036
  705    HA   HIS 110           HA       HIS 110  38.717  11.120  33.323
  706    HB2  HIS 110           HB1      HIS 110  37.090   9.096  34.204
  707    HB3  HIS 110           HB2      HIS 110  37.477   9.932  35.711
  708    HD1  HIS 110           HD1      HIS 110  35.227  10.101  32.885
  709    HD2  HIS 110           HD2      HIS 110  36.850  12.817  35.579
  710    HE1  HIS 110           HE1      HIS 110  33.773  12.148  32.736
  711    HE2  HIS 110           HE2      HIS 110  34.762  13.807  34.382
  712    H    HIS 111           H        HIS 111  39.870   9.085  36.002
  713    HA   HIS 111           HA       HIS 111  40.617  11.361  37.593
  714    HB2  HIS 111           HB1      HIS 111  40.049   8.727  38.145
  715    HB3  HIS 111           HB2      HIS 111  41.806   8.778  38.318
  716    HD1  HIS 111           HD1      HIS 111  39.001  11.094  39.468
  717    HD2  HIS 111           HD2      HIS 111  42.444   9.255  40.888
  718    HE1  HIS 111           HE1      HIS 111  39.214  11.825  41.865
  719    HE2  HIS 111           HE2      HIS 111  41.317  10.702  42.734
  720    H    HIS 112           H        HIS 112  42.917  11.388  38.528
  721    HA   HIS 112           HA       HIS 112  44.782  11.291  36.264
  722    HB2  HIS 112           HB1      HIS 112  44.399  13.476  37.409
  723    HB3  HIS 112           HB2      HIS 112  45.074  12.775  38.883
  724    HD1  HIS 112           HD1      HIS 112  46.531  12.275  35.434
  725    HD2  HIS 112           HD2      HIS 112  47.405  14.221  38.999
  726    HE1  HIS 112           HE1      HIS 112  48.882  13.128  35.176
  727    HE2  HIS 112           HE2      HIS 112  49.418  14.317  37.355
  Start of MODEL   51
    1    H1   MET  18           H        MET  18 -47.469 -24.608  41.176
    2    HA   MET  18           HA       MET  18 -48.913 -22.360  40.735
    3    HB2  MET  18           HB1      MET  18 -47.970 -22.383  43.613
    4    HB3  MET  18           HB2      MET  18 -48.636 -20.980  42.766
    5    HG2  MET  18           HG1      MET  18 -50.786 -21.787  42.791
    6    HG3  MET  18           HG2      MET  18 -50.256 -23.469  42.880
    7    HE1  MET  18           HE1      MET  18 -52.546 -22.160  44.288
    8    HE2  MET  18           HE2      MET  18 -52.340 -23.683  45.152
    9    HE3  MET  18           HE3      MET  18 -52.439 -22.166  46.049
   10    H    LEU  19           H        LEU  19 -47.473 -20.240  41.291
   11    HA   LEU  19           HA       LEU  19 -45.586 -19.108  40.717
   12    HB2  LEU  19           HB1      LEU  19 -44.258 -21.566  41.872
   13    HB3  LEU  19           HB2      LEU  19 -43.450 -20.028  41.522
   14    HG   LEU  19           HG       LEU  19 -45.599 -19.389  43.209
   15   HD11  LEU  19          HD11      LEU  19 -45.461 -21.957  43.620
   16   HD12  LEU  19          HD12      LEU  19 -45.593 -20.851  44.986
   17   HD13  LEU  19          HD13      LEU  19 -44.027 -21.538  44.556
   18   HD21  LEU  19          HD21      LEU  19 -43.856 -18.715  44.731
   19   HD22  LEU  19          HD22      LEU  19 -43.366 -18.331  43.080
   20   HD23  LEU  19          HD23      LEU  19 -42.684 -19.737  43.899
   21    H    VAL  20           H        VAL  20 -45.891 -19.146  38.488
   22    HA   VAL  20           HA       VAL  20 -44.446 -21.247  37.016
   23    HB   VAL  20           HB       VAL  20 -46.499 -19.330  35.908
   24   HG11  VAL  20          HG11      VAL  20 -45.698 -20.048  33.958
   25   HG12  VAL  20          HG12      VAL  20 -44.702 -21.278  34.739
   26   HG13  VAL  20          HG13      VAL  20 -46.389 -21.622  34.352
   27   HG21  VAL  20          HG21      VAL  20 -46.783 -22.059  37.106
   28   HG22  VAL  20          HG22      VAL  20 -47.767 -20.619  37.366
   29   HG23  VAL  20          HG23      VAL  20 -47.892 -21.510  35.849
   30    H    LEU  21           H        LEU  21 -42.704 -20.743  35.833
   31    HA   LEU  21           HA       LEU  21 -41.745 -18.002  35.899
   32    HB2  LEU  21           HB1      LEU  21 -40.348 -20.347  34.626
   33    HB3  LEU  21           HB2      LEU  21 -39.645 -18.853  35.271
   34    HG   LEU  21           HG       LEU  21 -40.929 -20.142  37.430
   35   HD11  LEU  21          HD11      LEU  21 -40.485 -22.088  35.612
   36   HD12  LEU  21          HD12      LEU  21 -40.443 -22.336  37.358
   37   HD13  LEU  21          HD13      LEU  21 -38.942 -22.083  36.466
   38   HD21  LEU  21          HD21      LEU  21 -38.424 -20.491  38.049
   39   HD22  LEU  21          HD22      LEU  21 -39.079 -18.857  37.926
   40   HD23  LEU  21          HD23      LEU  21 -38.126 -19.528  36.601
   41    H    ASP  22           H        ASP  22 -41.005 -16.883  34.017
   42    HA   ASP  22           HA       ASP  22 -42.016 -17.857  31.448
   43    HB2  ASP  22           HB1      ASP  22 -43.810 -16.460  32.344
   44    HB3  ASP  22           HB2      ASP  22 -42.665 -15.137  32.606
   45    HD2  ASP  22           HD       ASP  22 -43.652 -15.912  28.833
   46    H    PHE  23           H        PHE  23 -40.298 -15.199  33.078
   47    HA   PHE  23           HA       PHE  23 -38.408 -14.053  32.543
   48    HB2  PHE  23           HB1      PHE  23 -37.883 -16.750  31.995
   49    HB3  PHE  23           HB2      PHE  23 -37.298 -15.877  30.579
   50    HD1  PHE  23           HD1      PHE  23 -37.003 -16.070  34.259
   51    HD2  PHE  23           HD2      PHE  23 -35.303 -14.642  30.627
   52    HE1  PHE  23           HE1      PHE  23 -34.954 -15.441  35.469
   53    HE2  PHE  23           HE2      PHE  23 -33.252 -14.012  31.831
   54    HZ   PHE  23           HZ       PHE  23 -33.075 -14.412  34.255
   55    H    ASN  24           H        ASN  24 -37.033 -13.320  30.516
   56    HA   ASN  24           HA       ASN  24 -38.359 -13.233  28.003
   57    HB2  ASN  24           HB1      ASN  24 -39.301 -11.393  29.934
   58    HB3  ASN  24           HB2      ASN  24 -38.312 -10.466  28.799
   59   HD21  ASN  24          HD21      ASN  24 -41.327 -11.772  29.366
   60   HD22  ASN  24          HD22      ASN  24 -41.985 -11.621  27.776
   61    H    ASN  25           H        ASN  25 -37.120 -12.221  26.394
   62    HA   ASN  25           HA       ASN  25 -34.463 -11.293  27.270
   63    HB2  ASN  25           HB1      ASN  25 -35.196 -13.121  24.976
   64    HB3  ASN  25           HB2      ASN  25 -33.632 -12.304  25.081
   65   HD21  ASN  25          HD21      ASN  25 -35.439 -14.985  26.026
   66   HD22  ASN  25          HD22      ASN  25 -34.316 -15.658  27.152
   67    H    ILE  26           H        ILE  26 -33.316 -10.095  25.422
   68    HA   ILE  26           HA       ILE  26 -35.237  -8.463  23.904
   69    HB   ILE  26           HB       ILE  26 -33.751  -6.483  24.335
   70   HG12  ILE  26          HG11      ILE  26 -32.757  -7.772  26.816
   71   HG13  ILE  26          HG12      ILE  26 -31.967  -8.260  25.306
   72   HG21  ILE  26          HG21      ILE  26 -34.573  -6.271  26.788
   73   HG22  ILE  26          HG22      ILE  26 -35.753  -6.399  25.486
   74   HG23  ILE  26          HG23      ILE  26 -35.369  -7.812  26.468
   75   HD11  ILE  26          HD11      ILE  26 -31.130  -6.196  26.755
   76   HD12  ILE  26          HD12      ILE  26 -30.981  -6.253  24.998
   77   HD13  ILE  26          HD13      ILE  26 -32.307  -5.359  25.742
   78    H    ARG  27           H        ARG  27 -34.338  -7.395  22.033
   79    HA   ARG  27           HA       ARG  27 -31.714  -8.235  21.124
   80    HB2  ARG  27           HB1      ARG  27 -34.276  -9.285  20.009
   81    HB3  ARG  27           HB2      ARG  27 -32.961  -8.924  18.883
   82    HG2  ARG  27           HG1      ARG  27 -31.471 -10.430  20.094
   83    HG3  ARG  27           HG2      ARG  27 -32.772 -10.782  21.244
   84    HD2  ARG  27           HD1      ARG  27 -34.053 -11.335  18.934
   85    HD3  ARG  27           HD2      ARG  27 -32.389 -11.719  18.469
   86    HE   ARG  27           HE       ARG  27 -32.943 -12.926  20.943
   87   HH11  ARG  27          HH11      ARG  27 -33.818 -13.173  17.583
   88   HH12  ARG  27          HH12      ARG  27 -34.158 -14.870  17.662
   89   HH21  ARG  27          HH21      ARG  27 -33.388 -15.160  21.061
   90   HH22  ARG  27          HH22      ARG  27 -33.915 -15.999  19.642
   91    H    SER  28           H        SER  28 -30.860  -6.919  19.534
   92    HA   SER  28           HA       SER  28 -32.503  -4.946  18.210
   93    HB2  SER  28           HB1      SER  28 -30.441  -4.139  20.279
   94    HB3  SER  28           HB2      SER  28 -31.137  -3.027  19.089
   95    HG   SER  28           HG       SER  28 -32.132  -3.362  21.356
   96    H    SER  29           H        SER  29 -31.186  -3.563  16.738
   97    HA   SER  29           HA       SER  29 -28.532  -4.525  16.092
   98    HB2  SER  29           HB1      SER  29 -28.987  -5.315  13.903
   99    HB3  SER  29           HB2      SER  29 -30.218  -6.063  14.936
  100    HG   SER  29           HG       SER  29 -31.737  -4.897  14.014
  101    H    ALA  30           H        ALA  30 -27.722  -3.340  14.049
  102    HA   ALA  30           HA       ALA  30 -28.916  -0.934  13.215
  103    HB1  ALA  30           HB1      ALA  30 -28.595   0.184  15.174
  104    HB2  ALA  30           HB2      ALA  30 -27.188  -0.778  15.625
  105    HB3  ALA  30           HB3      ALA  30 -27.034   0.495  14.413
  106    H    ASP  31           H        ASP  31 -27.860  -0.103  11.474
  107    HA   ASP  31           HA       ASP  31 -25.088  -0.354  10.992
  108    HB2  ASP  31           HB1      ASP  31 -25.997  -2.758  10.683
  109    HB3  ASP  31           HB2      ASP  31 -26.704  -2.136   9.187
  110    HD2  ASP  31           HD       ASP  31 -22.739  -1.983   9.257
  111    H    LEU  32           H        LEU  32 -25.243   1.785  10.396
  112    HA   LEU  32           HA       LEU  32 -26.887   2.398   8.038
  113    HB2  LEU  32           HB1      LEU  32 -25.656   4.220  10.112
  114    HB3  LEU  32           HB2      LEU  32 -26.555   4.768   8.686
  115    HG   LEU  32           HG       LEU  32 -27.842   2.955  10.697
  116   HD11  LEU  32          HD11      LEU  32 -27.946   5.954  10.850
  117   HD12  LEU  32          HD12      LEU  32 -26.824   4.990  11.811
  118   HD13  LEU  32          HD13      LEU  32 -28.563   4.773  12.007
  119   HD21  LEU  32          HD21      LEU  32 -29.362   5.082   9.394
  120   HD22  LEU  32          HD22      LEU  32 -29.723   3.364   9.556
  121   HD23  LEU  32          HD23      LEU  32 -28.654   3.923   8.270
  122    H    HIS  33           H        HIS  33 -25.950   2.862   6.151
  123    HA   HIS  33           HA       HIS  33 -23.509   4.189   5.806
  124    HB2  HIS  33           HB1      HIS  33 -23.178   1.475   6.508
  125    HB3  HIS  33           HB2      HIS  33 -22.834   1.584   4.779
  126    HD1  HIS  33           HD1      HIS  33 -21.091   1.705   7.811
  127    HD2  HIS  33           HD2      HIS  33 -20.989   4.031   4.370
  128    HE1  HIS  33           HE1      HIS  33 -18.860   2.864   7.849
  129    HE2  HIS  33           HE2      HIS  33 -18.796   4.286   5.747
  130    H    GLY  34           H        GLY  34 -23.317   4.874   3.733
  131    HA2  GLY  34           HA2      GLY  34 -24.015   3.547   1.411
  132    HA3  GLY  34           HA3      GLY  34 -25.474   4.373   1.940
  133    HA1  GLY  34           HA1      GLY  34 -23.382   4.026   1.797
  134    H    ALA  35           H        ALA  35 -22.198   4.780   0.784
  135    HA   ALA  35           HA       ALA  35 -22.852   7.213  -0.534
  136    HB1  ALA  35           HB1      ALA  35 -21.784   7.397   2.155
  137    HB2  ALA  35           HB2      ALA  35 -20.762   8.219   0.975
  138    HB3  ALA  35           HB3      ALA  35 -22.465   8.653   1.121
  139    H    ARG  36           H        ARG  36 -21.705   7.156  -2.343
  140    HA   ARG  36           HA       ARG  36 -18.883   6.627  -2.340
  141    HB2  ARG  36           HB1      ARG  36 -19.875   4.335  -2.299
  142    HB3  ARG  36           HB2      ARG  36 -20.673   4.705  -3.834
  143    HG2  ARG  36           HG1      ARG  36 -18.341   5.195  -4.750
  144    HG3  ARG  36           HG2      ARG  36 -17.742   4.388  -3.292
  145    HD2  ARG  36           HD1      ARG  36 -19.810   2.782  -4.462
  146    HD3  ARG  36           HD2      ARG  36 -18.622   3.207  -5.701
  147    HE   ARG  36           HE       ARG  36 -17.316   2.336  -3.345
  148   HH11  ARG  36          HH11      ARG  36 -19.142   1.162  -6.067
  149   HH12  ARG  36          HH12      ARG  36 -18.412  -0.410  -6.045
  150   HH21  ARG  36          HH21      ARG  36 -16.348   0.271  -3.306
  151   HH22  ARG  36          HH22      ARG  36 -16.824  -0.916  -4.473
  152    H    LYS  37           H        LYS  37 -19.140   8.826  -3.156
  153    HA   LYS  37           HA       LYS  37 -19.050   8.883  -6.012
  154    HB2  LYS  37           HB1      LYS  37 -21.505   8.932  -5.607
  155    HB3  LYS  37           HB2      LYS  37 -21.284  10.421  -4.676
  156    HG2  LYS  37           HG1      LYS  37 -20.927  11.707  -6.519
  157    HG3  LYS  37           HG2      LYS  37 -20.213  10.370  -7.439
  158    HD2  LYS  37           HD1      LYS  37 -22.156  10.036  -8.469
  159    HD3  LYS  37           HD2      LYS  37 -22.909   9.682  -6.904
  160    HE2  LYS  37           HE1      LYS  37 -23.220  12.152  -6.574
  161    HE3  LYS  37           HE2      LYS  37 -22.653  12.374  -8.235
  162    HZ1  LYS  37           HZ1      LYS  37 -25.187  11.300  -7.272
  163    HZ2  LYS  37           HZ2      LYS  37 -24.544  10.592  -8.667
  164    HZ3  LYS  37           HZ3      LYS  37 -24.863  12.254  -8.632
  165    H    GLY  38           H        GLY  38 -17.903  10.618  -6.757
  166    HA2  GLY  38           HA2      GLY  38 -17.441  13.068  -6.312
  167    HA3  GLY  38           HA3      GLY  38 -17.010  12.535  -4.695
  168    HA1  GLY  38           HA1      GLY  38 -17.242  12.361  -6.801
  169    H    SER  39           H        SER  39 -14.880  12.857  -4.540
  170    HA   SER  39           HA       SER  39 -13.052  12.712  -6.673
  171    HB2  SER  39           HB1      SER  39 -12.859  12.887  -3.700
  172    HB3  SER  39           HB2      SER  39 -11.410  12.380  -4.588
  173    HG   SER  39           HG       SER  39 -12.201  14.820  -4.233
  174    H    GLN  40           H        GLN  40 -10.981  11.215  -6.261
  175    HA   GLN  40           HA       GLN  40 -11.848   8.578  -6.889
  176    HB2  GLN  40           HB1      GLN  40  -9.446  10.099  -7.086
  177    HB3  GLN  40           HB2      GLN  40  -9.073   8.592  -6.235
  178    HG2  GLN  40           HG1      GLN  40 -10.610   7.677  -8.291
  179    HG3  GLN  40           HG2      GLN  40  -9.772   9.044  -9.038
  180   HE21  GLN  40          HE21      GLN  40  -9.598   5.903  -8.900
  181   HE22  GLN  40          HE22      GLN  40  -7.891   5.641  -8.870
  182    H    CYS  41           H        CYS  41  -9.679   9.677  -4.275
  183    HA   CYS  41           HA       CYS  41 -10.940   7.708  -2.498
  184    HB2  CYS  41           HB1      CYS  41  -8.806   6.973  -1.650
  185    HB3  CYS  41           HB2      CYS  41  -8.823   6.768  -3.402
  186    H    LEU  42           H        LEU  42 -11.168   8.333  -0.395
  187    HA   LEU  42           HA       LEU  42 -10.587  11.137   0.173
  188    HB2  LEU  42           HB1      LEU  42 -12.389   9.074   1.414
  189    HB3  LEU  42           HB2      LEU  42 -12.003  10.586   2.251
  190    HG   LEU  42           HG       LEU  42 -12.841  11.397  -0.273
  191   HD11  LEU  42          HD11      LEU  42 -15.185  10.254  -0.169
  192   HD12  LEU  42          HD12      LEU  42 -14.300   8.958   0.634
  193   HD13  LEU  42          HD13      LEU  42 -13.844   9.459  -0.994
  194   HD21  LEU  42          HD21      LEU  42 -14.082  11.318   2.452
  195   HD22  LEU  42          HD22      LEU  42 -14.961  11.988   1.078
  196   HD23  LEU  42          HD23      LEU  42 -13.419  12.692   1.566
  197    H    SER  43           H        SER  43  -9.589   7.951   1.069
  198    HA   SER  43           HA       SER  43  -7.386   8.990   2.584
  199    HB2  SER  43           HB1      SER  43  -9.668   8.626   4.062
  200    HB3  SER  43           HB2      SER  43  -8.857   7.062   4.254
  201    HG   SER  43           HG       SER  43  -8.198   8.580   5.845
  202    H    ASP  44           H        ASP  44  -6.532   6.782   3.906
  203    HA   ASP  44           HA       ASP  44  -5.469   5.183   1.856
  204    HB2  ASP  44           HB1      ASP  44  -4.656   3.719   3.707
  205    HB3  ASP  44           HB2      ASP  44  -4.277   5.432   3.938
  206    HD2  ASP  44           HD       ASP  44  -5.927   5.486   6.924
  207    H    THR  45           H        THR  45  -8.447   5.017   3.534
  208    HA   THR  45           HA       THR  45  -9.068   2.331   3.568
  209    HB   THR  45           HB       THR  45 -11.107   4.360   2.693
  210    HG1  THR  45           HG1      THR  45 -11.101   5.256   4.657
  211   HG21  THR  45          HG21      THR  45 -11.291   1.698   3.338
  212   HG22  THR  45          HG22      THR  45 -12.620   2.856   3.392
  213   HG23  THR  45          HG23      THR  45 -11.710   2.489   4.857
  214    H    ASP  46           H        ASP  46  -9.099   4.566   0.849
  215    HA   ASP  46           HA       ASP  46 -10.236   2.604  -0.947
  216    HB2  ASP  46           HB1      ASP  46 -10.141   5.370  -0.919
  217    HB3  ASP  46           HB2      ASP  46  -8.988   4.937  -2.189
  218    HD2  ASP  46           HD       ASP  46 -12.797   3.973  -2.779
  219    H    CYS  47           H        CYS  47  -7.091   3.805  -0.058
  220    HA   CYS  47           HA       CYS  47  -5.870   1.759  -1.759
  221    HB2  CYS  47           HB1      CYS  47  -5.275   4.705  -1.805
  222    HB3  CYS  47           HB2      CYS  47  -4.016   3.536  -2.207
  223    H    ASN  48           H        ASN  48  -5.292   0.508  -0.029
  224    HA   ASN  48           HA       ASN  48  -3.308   1.688   1.798
  225    HB2  ASN  48           HB1      ASN  48  -5.819   0.803   2.556
  226    HB3  ASN  48           HB2      ASN  48  -4.780  -0.581   2.913
  227   HD21  ASN  48          HD21      ASN  48  -6.090   0.865   4.884
  228   HD22  ASN  48          HD22      ASN  48  -4.914   1.674   5.858
  229    H    THR  49           H        THR  49  -3.118   0.111  -0.736
  230    HA   THR  49           HA       THR  49  -1.118  -1.757   0.197
  231    HB   THR  49           HB       THR  49  -2.875  -3.317   0.286
  232    HG1  THR  49           HG1      THR  49  -2.126  -3.757  -2.389
  233   HG21  THR  49          HG21      THR  49  -3.843  -2.258  -2.375
  234   HG22  THR  49          HG22      THR  49  -4.590  -1.945  -0.808
  235   HG23  THR  49          HG23      THR  49  -4.566  -3.582  -1.461
  236    H    ARG  50           H        ARG  50   0.574  -1.244  -1.018
  237    HA   ARG  50           HA       ARG  50   1.866  -0.628  -2.789
  238    HB2  ARG  50           HB1      ARG  50  -0.238  -2.017  -4.459
  239    HB3  ARG  50           HB2      ARG  50   1.464  -1.759  -4.871
  240    HG2  ARG  50           HG1      ARG  50   2.197  -3.313  -3.219
  241    HG3  ARG  50           HG2      ARG  50   0.565  -3.434  -2.543
  242    HD2  ARG  50           HD1      ARG  50  -0.196  -4.794  -4.216
  243    HD3  ARG  50           HD2      ARG  50   0.893  -4.083  -5.417
  244    HE   ARG  50           HE       ARG  50   1.428  -6.340  -3.721
  245   HH11  ARG  50          HH11      ARG  50   2.843  -3.757  -5.578
  246   HH12  ARG  50          HH12      ARG  50   4.355  -4.571  -5.802
  247   HH21  ARG  50          HH21      ARG  50   3.415  -7.422  -4.010
  248   HH22  ARG  50          HH22      ARG  50   4.680  -6.656  -4.911
  249    H    LYS  51           H        LYS  51  -0.423   1.101  -1.961
  250    HA   LYS  51           HA       LYS  51  -0.257   2.942  -4.187
  251    HB2  LYS  51           HB1      LYS  51  -2.748   1.485  -3.464
  252    HB3  LYS  51           HB2      LYS  51  -2.900   3.210  -3.833
  253    HG2  LYS  51           HG1      LYS  51  -1.845   2.852  -6.013
  254    HG3  LYS  51           HG2      LYS  51  -1.699   1.124  -5.645
  255    HD2  LYS  51           HD1      LYS  51  -4.348   1.518  -5.174
  256    HD3  LYS  51           HD2      LYS  51  -4.050   2.690  -6.469
  257    HE2  LYS  51           HE1      LYS  51  -3.291   1.018  -7.965
  258    HE3  LYS  51           HE2      LYS  51  -3.135  -0.167  -6.660
  259    HZ1  LYS  51           HZ1      LYS  51  -5.407  -0.484  -6.553
  260    HZ2  LYS  51           HZ2      LYS  51  -5.156  -0.296  -8.216
  261    HZ3  LYS  51           HZ3      LYS  51  -5.769   0.989  -7.302
  262    H    PHE  52           H        PHE  52  -1.157   5.081  -3.637
  263    HA   PHE  52           HA       PHE  52  -1.511   5.544  -0.769
  264    HB2  PHE  52           HB1      PHE  52   0.065   7.443  -0.822
  265    HB3  PHE  52           HB2      PHE  52   0.863   5.906  -1.157
  266    HD1  PHE  52           HD1      PHE  52  -0.278   9.061  -2.641
  267    HD2  PHE  52           HD2      PHE  52   1.851   5.432  -3.280
  268    HE1  PHE  52           HE1      PHE  52   0.640   9.973  -4.734
  269    HE2  PHE  52           HE2      PHE  52   2.773   6.337  -5.374
  270    HZ   PHE  52           HZ       PHE  52   2.169   8.611  -6.103
  271    H    CYS  53           H        CYS  53  -2.957   7.111  -0.291
  272    HA   CYS  53           HA       CYS  53  -4.501   8.213  -2.460
  273    HB2  CYS  53           HB1      CYS  53  -5.383   7.323  -0.210
  274    HB3  CYS  53           HB2      CYS  53  -4.858   8.870   0.457
  275    H    LEU  54           H        LEU  54  -3.216   9.709  -3.507
  276    HA   LEU  54           HA       LEU  54  -1.825  11.778  -2.094
  277    HB2  LEU  54           HB1      LEU  54  -1.085  10.859  -4.276
  278    HB3  LEU  54           HB2      LEU  54  -2.511  11.599  -5.023
  279    HG   LEU  54           HG       LEU  54  -1.468  13.798  -3.962
  280   HD11  LEU  54          HD11      LEU  54   1.036  12.308  -4.648
  281   HD12  LEU  54          HD12      LEU  54   0.403  12.306  -3.002
  282   HD13  LEU  54          HD13      LEU  54   0.844  13.829  -3.775
  283   HD21  LEU  54          HD21      LEU  54  -1.793  13.958  -6.204
  284   HD22  LEU  54          HD22      LEU  54  -1.039  12.399  -6.540
  285   HD23  LEU  54          HD23      LEU  54  -0.036  13.812  -6.206
  286    H    GLN  55           H        GLN  55  -2.387  13.893  -1.800
  287    HA   GLN  55           HA       GLN  55  -5.005  14.771  -2.795
  288    HB2  GLN  55           HB1      GLN  55  -5.374  15.874  -0.541
  289    HB3  GLN  55           HB2      GLN  55  -5.523  14.110  -0.581
  290    HG2  GLN  55           HG1      GLN  55  -3.816  13.797   0.826
  291    HG3  GLN  55           HG2      GLN  55  -2.829  15.039   0.043
  292   HE21  GLN  55          HE21      GLN  55  -3.974  17.327   0.367
  293   HE22  GLN  55          HE22      GLN  55  -4.299  17.697   2.023
  294    HA   PRO  56           HA       PRO  56  -1.864  17.973  -3.722
  295    HB2  PRO  56           HB1      PRO  56  -3.055  18.768  -6.058
  296    HB3  PRO  56           HB2      PRO  56  -1.959  17.390  -5.943
  297    HG2  PRO  56           HG1      PRO  56  -4.959  17.441  -5.923
  298    HG3  PRO  56           HG2      PRO  56  -3.842  16.354  -6.832
  299    HD2  PRO  56           HD1      PRO  56  -5.108  15.582  -4.559
  300    HD3  PRO  56           HD2      PRO  56  -3.485  15.017  -4.989
  301    H    ARG  57           H        ARG  57  -1.988  20.198  -3.508
  302    HA   ARG  57           HA       ARG  57  -4.405  21.196  -2.278
  303    HB2  ARG  57           HB1      ARG  57  -1.782  21.675  -1.812
  304    HB3  ARG  57           HB2      ARG  57  -2.180  23.061  -2.839
  305    HG2  ARG  57           HG1      ARG  57  -4.149  23.469  -1.266
  306    HG3  ARG  57           HG2      ARG  57  -3.345  22.326  -0.176
  307    HD2  ARG  57           HD1      ARG  57  -1.923  23.894   0.524
  308    HD3  ARG  57           HD2      ARG  57  -1.437  24.234  -1.142
  309    HE   ARG  57           HE       ARG  57  -3.946  25.431  -0.484
  310   HH11  ARG  57          HH11      ARG  57  -0.494  25.787  -0.205
  311   HH12  ARG  57          HH12      ARG  57  -0.552  27.513  -0.062
  312   HH21  ARG  57          HH21      ARG  57  -4.036  27.703  -0.297
  313   HH22  ARG  57          HH22      ARG  57  -2.567  28.602  -0.114
  314    H    ASP  58           H        ASP  58  -2.785  21.422  -5.337
  315    HA   ASP  58           HA       ASP  58  -4.403  23.677  -6.209
  316    HB2  ASP  58           HB1      ASP  58  -2.094  22.144  -7.344
  317    HB3  ASP  58           HB2      ASP  58  -3.135  23.060  -8.442
  318    HD2  ASP  58           HD       ASP  58  -0.536  25.011  -6.291
  319    H    GLU  59           H        GLU  59  -4.395  20.234  -6.366
  320    HA   GLU  59           HA       GLU  59  -6.688  20.331  -8.215
  321    HB2  GLU  59           HB1      GLU  59  -4.229  18.808  -8.370
  322    HB3  GLU  59           HB2      GLU  59  -5.637  17.738  -8.328
  323    HG2  GLU  59           HG1      GLU  59  -6.515  18.578 -10.306
  324    HG3  GLU  59           HG2      GLU  59  -5.570  20.069 -10.195
  325    HE2  GLU  59           HE       GLU  59  -3.671  16.837 -11.530
  326    H    LYS  60           H        LYS  60  -7.799  17.971  -8.025
  327    HA   LYS  60           HA       LYS  60  -8.772  17.889  -5.298
  328    HB2  LYS  60           HB1      LYS  60  -9.702  16.987  -7.942
  329    HB3  LYS  60           HB2      LYS  60 -10.105  15.893  -6.609
  330    HG2  LYS  60           HG1      LYS  60 -11.455  17.440  -5.550
  331    HG3  LYS  60           HG2      LYS  60 -10.670  18.813  -6.352
  332    HD2  LYS  60           HD1      LYS  60 -11.905  18.600  -8.262
  333    HD3  LYS  60           HD2      LYS  60 -12.076  16.846  -8.075
  334    HE2  LYS  60           HE1      LYS  60 -14.008  17.034  -6.946
  335    HE3  LYS  60           HE2      LYS  60 -13.378  18.351  -5.945
  336    HZ1  LYS  60           HZ1      LYS  60 -14.445  19.834  -7.177
  337    HZ2  LYS  60           HZ2      LYS  60 -15.218  18.561  -7.977
  338    HZ3  LYS  60           HZ3      LYS  60 -13.799  19.223  -8.616
  339    HA   PRO  61           HA       PRO  61  -6.640  14.323  -3.890
  340    HB2  PRO  61           HB1      PRO  61  -8.572  12.995  -2.474
  341    HB3  PRO  61           HB2      PRO  61  -7.829  14.498  -1.931
  342    HG2  PRO  61           HG1      PRO  61 -10.429  14.070  -3.364
  343    HG3  PRO  61           HG2      PRO  61 -10.070  15.118  -1.940
  344    HD2  PRO  61           HD1      PRO  61 -10.308  16.101  -4.459
  345    HD3  PRO  61           HD2      PRO  61  -9.192  16.787  -3.266
  346    H    PHE  62           H        PHE  62  -6.031  12.440  -4.765
  347    HA   PHE  62           HA       PHE  62  -7.941  10.540  -5.781
  348    HB2  PHE  62           HB1      PHE  62  -7.255  10.524  -8.067
  349    HB3  PHE  62           HB2      PHE  62  -7.649  12.194  -7.658
  350    HD1  PHE  62           HD1      PHE  62  -5.659  13.687  -6.877
  351    HD2  PHE  62           HD2      PHE  62  -5.234  10.090  -9.112
  352    HE1  PHE  62           HE1      PHE  62  -3.438  14.425  -7.636
  353    HE2  PHE  62           HE2      PHE  62  -3.012  10.822  -9.875
  354    HZ   PHE  62           HZ       PHE  62  -2.111  12.992  -9.136
  355    H    CYS  63           H        CYS  63  -7.073   8.482  -6.071
  356    HA   CYS  63           HA       CYS  63  -4.685   7.957  -4.592
  357    HB2  CYS  63           HB1      CYS  63  -6.592   6.425  -4.527
  358    HB3  CYS  63           HB2      CYS  63  -6.412   6.111  -6.255
  359    H    ALA  64           H        ALA  64  -2.681   8.033  -5.338
  360    HA   ALA  64           HA       ALA  64  -2.233   7.838  -8.236
  361    HB1  ALA  64           HB1      ALA  64  -1.031   9.413  -6.091
  362    HB2  ALA  64           HB2      ALA  64   0.148   8.666  -7.170
  363    HB3  ALA  64           HB3      ALA  64  -1.102   9.724  -7.826
  364    H    THR  65           H        THR  65  -1.366   6.052  -9.039
  365    HA   THR  65           HA       THR  65  -0.744   3.779  -7.607
  366    HB   THR  65           HB       THR  65   0.792   4.233 -10.115
  367    HG1  THR  65           HG1      THR  65  -2.049   4.200  -9.940
  368   HG21  THR  65          HG21      THR  65   0.913   2.019  -9.684
  369   HG22  THR  65          HG22      THR  65  -0.681   1.981 -10.438
  370   HG23  THR  65          HG23      THR  65  -0.536   2.031  -8.681
  371    H    CYS  66           H        CYS  66   1.242   2.731  -7.103
  372    HA   CYS  66           HA       CYS  66   3.083   4.236  -5.699
  373    HB2  CYS  66           HB1      CYS  66   2.711   1.498  -6.364
  374    HB3  CYS  66           HB2      CYS  66   4.396   1.896  -6.708
  375    H    ARG  67           H        ARG  67   5.509   4.260  -6.160
  376    HA   ARG  67           HA       ARG  67   5.978   5.002  -8.973
  377    HB2  ARG  67           HB1      ARG  67   7.195   6.334  -6.544
  378    HB3  ARG  67           HB2      ARG  67   7.425   6.804  -8.235
  379    HG2  ARG  67           HG1      ARG  67   4.697   6.890  -7.985
  380    HG3  ARG  67           HG2      ARG  67   5.253   7.437  -6.394
  381    HD2  ARG  67           HD1      ARG  67   6.210   9.341  -7.212
  382    HD3  ARG  67           HD2      ARG  67   6.620   8.583  -8.758
  383    HE   ARG  67           HE       ARG  67   3.795   8.985  -8.355
  384   HH11  ARG  67          HH11      ARG  67   6.767  10.370  -9.524
  385   HH12  ARG  67          HH12      ARG  67   5.979  11.490 -10.586
  386   HH21  ARG  67          HH21      ARG  67   2.746  10.455  -9.749
  387   HH22  ARG  67          HH22      ARG  67   3.693  11.538 -10.712
  388    H    GLY  68           H        GLY  68   8.165   4.754  -9.734
  389    HA2  GLY  68           HA2      GLY  68   9.375   2.343  -8.757
  390    HA3  GLY  68           HA3      GLY  68   9.943   3.326 -10.099
  391    HA1  GLY  68           HA1      GLY  68   9.208   2.951  -8.139
  392    H    LEU  69           H        LEU  69  11.932   2.408  -8.760
  393    HA   LEU  69           HA       LEU  69  12.686   3.713  -6.384
  394    HB2  LEU  69           HB1      LEU  69  14.503   2.607  -8.530
  395    HB3  LEU  69           HB2      LEU  69  14.914   2.900  -6.832
  396    HG   LEU  69           HG       LEU  69  13.045   0.792  -7.906
  397   HD11  LEU  69          HD11      LEU  69  15.196  -0.012  -8.202
  398   HD12  LEU  69          HD12      LEU  69  14.764  -0.636  -6.611
  399   HD13  LEU  69          HD13      LEU  69  15.804   0.781  -6.750
  400   HD21  LEU  69          HD21      LEU  69  12.987   0.072  -5.481
  401   HD22  LEU  69          HD22      LEU  69  12.062   1.519  -5.886
  402   HD23  LEU  69          HD23      LEU  69  13.628   1.667  -5.088
  403    H    ARG  70           H        ARG  70  13.929   4.263  -9.686
  404    HA   ARG  70           HA       ARG  70  15.399   6.538  -9.193
  405    HB2  ARG  70           HB1      ARG  70  13.917   5.552 -11.612
  406    HB3  ARG  70           HB2      ARG  70  14.726   7.125 -11.647
  407    HG2  ARG  70           HG1      ARG  70  16.668   5.466 -10.614
  408    HG3  ARG  70           HG2      ARG  70  15.851   4.451 -11.813
  409    HD2  ARG  70           HD1      ARG  70  16.528   7.247 -12.596
  410    HD3  ARG  70           HD2      ARG  70  17.847   6.074 -12.466
  411    HE   ARG  70           HE       ARG  70  15.846   4.877 -13.974
  412   HH11  ARG  70          HH11      ARG  70  17.973   7.624 -14.197
  413   HH12  ARG  70          HH12      ARG  70  18.041   7.596 -15.928
  414   HH21  ARG  70          HH21      ARG  70  15.928   4.830 -16.253
  415   HH22  ARG  70          HH22      ARG  70  16.877   6.007 -17.096
  416    H    ARG  71           H        ARG  71  11.945   6.188  -9.468
  417    HA   ARG  71           HA       ARG  71  11.197   8.826  -9.976
  418    HB2  ARG  71           HB1      ARG  71   9.923   6.394  -9.191
  419    HB3  ARG  71           HB2      ARG  71   9.334   7.695  -8.147
  420    HG2  ARG  71           HG1      ARG  71   7.920   7.377 -10.129
  421    HG3  ARG  71           HG2      ARG  71   8.652   8.990 -10.066
  422    HD2  ARG  71           HD1      ARG  71  10.190   8.502 -11.771
  423    HD3  ARG  71           HD2      ARG  71   9.952   6.759 -11.589
  424    HE   ARG  71           HE       ARG  71   7.520   7.921 -12.364
  425   HH11  ARG  71          HH11      ARG  71  10.698   7.276 -13.629
  426   HH12  ARG  71          HH12      ARG  71  10.163   7.156 -15.272
  427   HH21  ARG  71          HH21      ARG  71   6.803   7.767 -14.524
  428   HH22  ARG  71          HH22      ARG  71   7.947   7.437 -15.780
  429    H    ARG  72           H        ARG  72  10.812  10.601  -8.706
  430    HA   ARG  72           HA       ARG  72  12.353  10.854  -6.331
  431    HB2  ARG  72           HB1      ARG  72  10.382  12.644  -7.743
  432    HB3  ARG  72           HB2      ARG  72  11.114  13.106  -6.200
  433    HG2  ARG  72           HG1      ARG  72  13.210  12.253  -7.910
  434    HG3  ARG  72           HG2      ARG  72  12.178  13.371  -8.817
  435    HD2  ARG  72           HD1      ARG  72  13.125  14.004  -6.029
  436    HD3  ARG  72           HD2      ARG  72  14.104  14.365  -7.456
  437    HE   ARG  72           HE       ARG  72  11.766  15.768  -6.572
  438   HH11  ARG  72          HH11      ARG  72  13.720  14.956  -9.336
  439   HH12  ARG  72          HH12      ARG  72  13.225  16.339 -10.255
  440   HH21  ARG  72          HH21      ARG  72  11.107  17.592  -7.772
  441   HH22  ARG  72          HH22      ARG  72  11.740  17.838  -9.364
  442    H    CYS  73           H        CYS  73  11.509  11.573  -4.237
  443    HA   CYS  73           HA       CYS  73   8.758  10.939  -3.603
  444    HB2  CYS  73           HB1      CYS  73   9.195   9.206  -2.016
  445    HB3  CYS  73           HB2      CYS  73   9.962   8.737  -3.534
  446    H    GLN  74           H        GLN  74   8.045  11.942  -1.762
  447    HA   GLN  74           HA       GLN  74  10.026  13.622  -0.372
  448    HB2  GLN  74           HB1      GLN  74   7.314  14.139  -1.410
  449    HB3  GLN  74           HB2      GLN  74   7.631  14.785   0.208
  450    HG2  GLN  74           HG1      GLN  74   9.885  15.521  -1.187
  451    HG3  GLN  74           HG2      GLN  74   8.592  15.688  -2.383
  452   HE21  GLN  74          HE21      GLN  74   6.668  16.921  -1.678
  453   HE22  GLN  74          HE22      GLN  74   6.915  18.294  -0.658
  454    H    ARG  75           H        ARG  75   7.687  11.148  -0.025
  455    HA   ARG  75           HA       ARG  75   7.923  11.334   2.907
  456    HB2  ARG  75           HB1      ARG  75   5.606  11.743   1.721
  457    HB3  ARG  75           HB2      ARG  75   5.587   9.975   1.627
  458    HG2  ARG  75           HG1      ARG  75   5.892   9.860   4.077
  459    HG3  ARG  75           HG2      ARG  75   5.799  11.629   4.134
  460    HD2  ARG  75           HD1      ARG  75   3.555  10.940   2.677
  461    HD3  ARG  75           HD2      ARG  75   3.671   9.653   3.885
  462    HE   ARG  75           HE       ARG  75   4.000  12.212   5.079
  463   HH11  ARG  75          HH11      ARG  75   1.607  10.032   3.796
  464   HH12  ARG  75          HH12      ARG  75   0.323  10.656   4.778
  465   HH21  ARG  75          HH21      ARG  75   2.318  13.041   6.377
  466   HH22  ARG  75          HH22      ARG  75   0.728  12.368   6.246
  467    H    ASP  76           H        ASP  76   7.911   9.309   4.053
  468    HA   ASP  76           HA       ASP  76   9.404   7.276   2.655
  469    HB2  ASP  76           HB1      ASP  76   9.297   6.137   4.960
  470    HB3  ASP  76           HB2      ASP  76  10.185   7.662   4.836
  471    HD2  ASP  76           HD       ASP  76   8.215   9.062   7.240
  472    H    ALA  77           H        ALA  77   6.137   7.770   3.710
  473    HA   ALA  77           HA       ALA  77   5.382   4.994   3.443
  474    HB1  ALA  77           HB1      ALA  77   3.458   7.286   3.620
  475    HB2  ALA  77           HB2      ALA  77   3.261   5.626   4.181
  476    HB3  ALA  77           HB3      ALA  77   4.349   6.722   5.034
  477    H    MET  78           H        MET  78   4.920   7.998   1.617
  478    HA   MET  78           HA       MET  78   3.213   7.100  -0.361
  479    HB2  MET  78           HB1      MET  78   4.003   8.910  -1.729
  480    HB3  MET  78           HB2      MET  78   3.972   9.455  -0.045
  481    HG2  MET  78           HG1      MET  78   6.062  10.150  -0.324
  482    HG3  MET  78           HG2      MET  78   6.526   8.447  -0.366
  483    HE1  MET  78           HE1      MET  78   5.128  11.336  -2.298
  484    HE2  MET  78           HE2      MET  78   5.868  11.258  -3.897
  485    HE3  MET  78           HE3      MET  78   4.475  10.243  -3.519
  486    H    CYS  79           H        CYS  79   6.588   6.428   0.105
  487    HA   CYS  79           HA       CYS  79   6.960   5.359  -2.559
  488    HB2  CYS  79           HB1      CYS  79   8.766   6.519  -1.230
  489    HB3  CYS  79           HB2      CYS  79   8.806   5.099  -0.181
  490    H    CYS  80           H        CYS  80   6.916   3.259  -3.158
  491    HA   CYS  80           HA       CYS  80   5.403   1.396  -1.799
  492    HB2  CYS  80           HB1      CYS  80   7.191   1.393  -4.117
  493    HB3  CYS  80           HB2      CYS  80   7.126  -0.168  -3.295
  494    HA   PRO  81           HA       PRO  81   7.883  -0.405   1.341
  495    HB2  PRO  81           HB1      PRO  81   7.109  -3.030   1.240
  496    HB3  PRO  81           HB2      PRO  81   6.082  -1.737   1.853
  497    HG2  PRO  81           HG1      PRO  81   6.125  -3.002  -0.866
  498    HG3  PRO  81           HG2      PRO  81   4.714  -2.600   0.182
  499    HD2  PRO  81           HD1      PRO  81   5.463  -1.057  -1.923
  500    HD3  PRO  81           HD2      PRO  81   4.756  -0.383  -0.446
  501    H    GLY  82           H        GLY  82   9.665  -1.817   1.781
  502    HA2  GLY  82           HA2      GLY  82  11.480  -3.164   1.251
  503    HA3  GLY  82           HA3      GLY  82  10.807  -3.386  -0.357
  504    HA1  GLY  82           HA1      GLY  82  11.377  -2.298   1.378
  505    H    THR  83           H        THR  83  11.064  -0.145   0.700
  506    HA   THR  83           HA       THR  83  13.697   0.220  -0.508
  507    HB   THR  83           HB       THR  83  12.819   2.135  -1.889
  508    HG1  THR  83           HG1      THR  83  10.420   1.100  -0.877
  509   HG21  THR  83          HG21      THR  83  12.048  -0.713  -2.457
  510   HG22  THR  83          HG22      THR  83  13.395   0.220  -3.111
  511   HG23  THR  83          HG23      THR  83  11.746   0.573  -3.625
  512    H    LEU  84           H        LEU  84  14.499   2.466  -0.227
  513    HA   LEU  84           HA       LEU  84  13.279   3.805   2.092
  514    HB2  LEU  84           HB1      LEU  84  16.097   2.898   1.679
  515    HB3  LEU  84           HB2      LEU  84  15.791   4.376   2.608
  516    HG   LEU  84           HG       LEU  84  16.080   2.471   4.084
  517   HD11  LEU  84          HD11      LEU  84  13.156   3.086   4.175
  518   HD12  LEU  84          HD12      LEU  84  14.347   4.352   4.472
  519   HD13  LEU  84          HD13      LEU  84  14.307   2.920   5.500
  520   HD21  LEU  84          HD21      LEU  84  13.552   1.195   3.236
  521   HD22  LEU  84          HD22      LEU  84  15.026   0.477   3.886
  522   HD23  LEU  84          HD23      LEU  84  14.953   0.956   2.189
  523    H    CYS  85           H        CYS  85  12.977   5.926   1.848
  524    HA   CYS  85           HA       CYS  85  13.558   7.207  -0.613
  525    HB2  CYS  85           HB1      CYS  85  12.231   7.905   1.930
  526    HB3  CYS  85           HB2      CYS  85  12.945   9.269   1.066
  527    H    VAL  86           H        VAL  86  15.442   7.996  -1.249
  528    HA   VAL  86           HA       VAL  86  17.150   9.369   0.697
  529    HB   VAL  86           HB       VAL  86  18.168   7.277  -1.232
  530   HG11  VAL  86          HG11      VAL  86  19.656   8.988   0.757
  531   HG12  VAL  86          HG12      VAL  86  20.356   7.705  -0.233
  532   HG13  VAL  86          HG13      VAL  86  19.709   9.157  -0.998
  533   HG21  VAL  86          HG21      VAL  86  18.876   6.115   0.861
  534   HG22  VAL  86          HG22      VAL  86  17.932   7.293   1.773
  535   HG23  VAL  86          HG23      VAL  86  17.129   6.207   0.641
  536    H    ASN  87           H        ASN  87  18.108  11.171  -0.078
  537    HA   ASN  87           HA       ASN  87  18.510  12.933  -1.461
  538    HB2  ASN  87           HB1      ASN  87  19.877  10.879  -2.477
  539    HB3  ASN  87           HB2      ASN  87  18.771  11.140  -3.829
  540   HD21  ASN  87          HD21      ASN  87  20.335  11.860  -5.225
  541   HD22  ASN  87          HD22      ASN  87  21.125  13.386  -5.047
  542    H    ASP  88           H        ASP  88  15.786  12.186  -1.113
  543    HA   ASP  88           HA       ASP  88  13.725  12.739  -1.904
  544    HB2  ASP  88           HB1      ASP  88  15.373  14.716  -2.818
  545    HB3  ASP  88           HB2      ASP  88  14.677  14.117  -4.329
  546    HD2  ASP  88           HD       ASP  88  12.392  16.182  -1.891
  547    H    VAL  89           H        VAL  89  15.191  10.346  -2.859
  548    HA   VAL  89           HA       VAL  89  13.401   9.717  -5.077
  549    HB   VAL  89           HB       VAL  89  16.382   9.243  -5.217
  550   HG11  VAL  89          HG11      VAL  89  15.860   8.359  -7.488
  551   HG12  VAL  89          HG12      VAL  89  15.240   7.364  -6.169
  552   HG13  VAL  89          HG13      VAL  89  14.149   8.421  -7.065
  553   HG21  VAL  89          HG21      VAL  89  16.028  11.493  -5.778
  554   HG22  VAL  89          HG22      VAL  89  16.094  10.653  -7.327
  555   HG23  VAL  89          HG23      VAL  89  14.538  11.132  -6.649
  556    H    CYS  90           H        CYS  90  12.784   7.584  -5.169
  557    HA   CYS  90           HA       CYS  90  12.993   6.065  -2.796
  558    HB2  CYS  90           HB1      CYS  90  11.911   5.521  -5.549
  559    HB3  CYS  90           HB2      CYS  90  11.992   4.229  -4.350
  560    H    THR  91           H        THR  91  14.895   5.253  -2.166
  561    HA   THR  91           HA       THR  91  16.521   3.813  -4.157
  562    HB   THR  91           HB       THR  91  17.406   5.095  -1.563
  563    HG1  THR  91           HG1      THR  91  17.711   5.790  -4.301
  564   HG21  THR  91          HG21      THR  91  18.975   3.585  -3.656
  565   HG22  THR  91          HG22      THR  91  18.706   3.097  -1.983
  566   HG23  THR  91          HG23      THR  91  19.689   4.517  -2.340
  567    H    THR  92           H        THR  92  16.298   1.686  -4.016
  568    HA   THR  92           HA       THR  92  15.063   0.254  -2.010
  569    HB   THR  92           HB       THR  92  17.138  -1.377  -3.153
  570    HG1  THR  92           HG1      THR  92  17.312  -0.518  -5.070
  571   HG21  THR  92          HG21      THR  92  14.491  -1.607  -2.520
  572   HG22  THR  92          HG22      THR  92  15.403  -2.774  -3.479
  573   HG23  THR  92          HG23      THR  92  14.434  -1.537  -4.281
  574    H    MET  93           H        MET  93  15.987  -1.343  -0.506
  575    HA   MET  93           HA       MET  93  17.853  -0.134   1.248
  576    HB2  MET  93           HB1      MET  93  16.133  -2.467   1.223
  577    HB3  MET  93           HB2      MET  93  17.712  -2.844   1.929
  578    HG2  MET  93           HG1      MET  93  16.743  -0.334   2.955
  579    HG3  MET  93           HG2      MET  93  15.536  -1.604   3.170
  580    HE1  MET  93           HE1      MET  93  17.490   0.069   5.517
  581    HE2  MET  93           HE2      MET  93  19.000  -0.797   5.796
  582    HE3  MET  93           HE3      MET  93  18.710  -0.007   4.246
  583    H    GLU  94           H        GLU  94  18.091  -2.792  -1.075
  584    HA   GLU  94           HA       GLU  94  20.621  -3.735  -0.467
  585    HB2  GLU  94           HB1      GLU  94  19.250  -3.483  -3.152
  586    HB3  GLU  94           HB2      GLU  94  20.741  -4.401  -2.884
  587    HG2  GLU  94           HG1      GLU  94  18.375  -5.015  -1.181
  588    HG3  GLU  94           HG2      GLU  94  18.383  -5.564  -2.862
  589    HE2  GLU  94           HE       GLU  94  21.385  -7.046  -0.734
  590    H    ASP  95           H        ASP  95  19.677  -0.922  -2.359
  591    HA   ASP  95           HA       ASP  95  22.408  -0.326  -3.109
  592    HB2  ASP  95           HB1      ASP  95  20.252   0.149  -4.479
  593    HB3  ASP  95           HB2      ASP  95  20.096   1.565  -3.432
  594    HD2  ASP  95           HD       ASP  95  22.112   2.350  -6.409
  595    H    ALA  96           H        ALA  96  19.920   1.082  -1.004
  596    HA   ALA  96           HA       ALA  96  21.490   3.230  -0.062
  597    HB1  ALA  96           HB1      ALA  96  19.781   2.944   1.952
  598    HB2  ALA  96           HB2      ALA  96  19.296   3.617   0.395
  599    HB3  ALA  96           HB3      ALA  96  18.959   1.927   0.768
  600    H    THR  97           H        THR  97  22.997   3.369   1.487
  601    HA   THR  97           HA       THR  97  23.407   1.048   3.252
  602    HB   THR  97           HB       THR  97  25.930   1.834   3.071
  603    HG1  THR  97           HG1      THR  97  25.210   3.522   1.508
  604   HG21  THR  97          HG21      THR  97  26.270  -0.118   1.987
  605   HG22  THR  97          HG22      THR  97  25.166   0.299   0.677
  606   HG23  THR  97          HG23      THR  97  24.533  -0.320   2.201
  607    H    GLU  98           H        GLU  98  22.786   1.818   5.184
  608    HA   GLU  98           HA       GLU  98  24.233   4.113   6.256
  609    HB2  GLU  98           HB1      GLU  98  22.182   5.103   7.196
  610    HB3  GLU  98           HB2      GLU  98  22.170   5.092   5.425
  611    HG2  GLU  98           HG1      GLU  98  20.307   3.889   5.349
  612    HG3  GLU  98           HG2      GLU  98  20.959   2.699   6.484
  613    HE2  GLU  98           HE       GLU  98  18.580   5.531   7.876
  614    H    ASN  99           H        ASN  99  23.472   4.376   8.691
  615    HA   ASN  99           HA       ASN  99  23.068   1.736   9.897
  616    HB2  ASN  99           HB1      ASN  99  25.572   2.943   9.752
  617    HB3  ASN  99           HB2      ASN  99  25.006   3.328  11.382
  618   HD21  ASN  99          HD21      ASN  99  25.751   0.738   9.158
  619   HD22  ASN  99          HD22      ASN  99  25.931  -0.496  10.353
  620    H    LEU 100           H        LEU 100  22.585   1.889  12.251
  621    HA   LEU 100           HA       LEU 100  20.660   3.987  12.694
  622    HB2  LEU 100           HB1      LEU 100  21.476   1.489  14.126
  623    HB3  LEU 100           HB2      LEU 100  20.533   2.720  14.982
  624    HG   LEU 100           HG       LEU 100  18.987   2.456  12.820
  625   HD11  LEU 100          HD11      LEU 100  20.796   0.560  12.220
  626   HD12  LEU 100          HD12      LEU 100  19.104   0.490  11.724
  627   HD13  LEU 100          HD13      LEU 100  19.642  -0.398  13.149
  628   HD21  LEU 100          HD21      LEU 100  18.885   0.463  15.073
  629   HD22  LEU 100          HD22      LEU 100  17.538   1.125  14.146
  630   HD23  LEU 100          HD23      LEU 100  18.436   2.159  15.258
  631    H    TYR 101           H        TYR 101  20.587   5.139  14.814
  632    HA   TYR 101           HA       TYR 101  23.255   6.184  15.424
  633    HB2  TYR 101           HB1      TYR 101  20.638   7.352  15.135
  634    HB3  TYR 101           HB2      TYR 101  21.274   7.711  16.742
  635    HD1  TYR 101           HD1      TYR 101  22.596   9.583  17.013
  636    HD2  TYR 101           HD2      TYR 101  22.416   7.741  13.182
  637    HE1  TYR 101           HE1      TYR 101  23.998  11.381  16.090
  638    HE2  TYR 101           HE2      TYR 101  23.819   9.533  12.248
  639    HH   TYR 101           HH       TYR 101  24.229  12.175  13.090
  640    H    PHE 102           H        PHE 102  23.325   7.085  17.807
  641    HA   PHE 102           HA       PHE 102  22.088   5.283  19.722
  642    HB2  PHE 102           HB1      PHE 102  24.115   4.461  20.674
  643    HB3  PHE 102           HB2      PHE 102  24.209   4.171  18.937
  644    HD1  PHE 102           HD1      PHE 102  25.603   5.646  17.498
  645    HD2  PHE 102           HD2      PHE 102  25.702   5.858  21.748
  646    HE1  PHE 102           HE1      PHE 102  27.747   6.849  17.385
  647    HE2  PHE 102           HE2      PHE 102  27.846   7.061  21.642
  648    HZ   PHE 102           HZ       PHE 102  28.870   7.559  19.457
  649    H    GLN 103           H        GLN 103  22.233   6.016  21.896
  650    HA   GLN 103           HA       GLN 103  23.172   8.791  22.184
  651    HB2  GLN 103           HB1      GLN 103  21.240   9.150  23.743
  652    HB3  GLN 103           HB2      GLN 103  20.788   8.910  22.049
  653    HG2  GLN 103           HG1      GLN 103  19.396   7.309  22.670
  654    HG3  GLN 103           HG2      GLN 103  20.787   6.362  23.216
  655   HE21  GLN 103          HE21      GLN 103  17.900   7.524  24.155
  656   HE22  GLN 103          HE22      GLN 103  18.144   7.606  25.864
  657    H    SER 104           H        SER 104  24.290   9.274  24.002
  658    HA   SER 104           HA       SER 104  24.292   7.426  26.250
  659    HB2  SER 104           HB1      SER 104  26.270   7.237  24.263
  660    HB3  SER 104           HB2      SER 104  27.034   8.101  25.610
  661    HG   SER 104           HG       SER 104  27.306   6.054  26.204
  662    H    LEU 105           H        LEU 105  26.340   8.383  27.722
  663    HA   LEU 105           HA       LEU 105  25.334  10.919  28.582
  664    HB2  LEU 105           HB1      LEU 105  27.001   8.831  29.627
  665    HB3  LEU 105           HB2      LEU 105  27.805  10.397  29.835
  666    HG   LEU 105           HG       LEU 105  25.124  10.726  30.676
  667   HD11  LEU 105          HD11      LEU 105  25.332   8.152  30.815
  668   HD12  LEU 105          HD12      LEU 105  24.694   9.037  32.199
  669   HD13  LEU 105          HD13      LEU 105  26.365   8.476  32.207
  670   HD21  LEU 105          HD21      LEU 105  26.268  11.035  32.897
  671   HD22  LEU 105          HD22      LEU 105  26.895  12.021  31.576
  672   HD23  LEU 105          HD23      LEU 105  27.774  10.583  32.097
  673    H    GLU 106           H        GLU 106  25.839  12.786  27.662
  674    HA   GLU 106           HA       GLU 106  28.520  13.635  27.308
  675    HB2  GLU 106           HB1      GLU 106  28.357  13.992  24.811
  676    HB3  GLU 106           HB2      GLU 106  28.576  12.314  25.336
  677    HG2  GLU 106           HG1      GLU 106  26.430  11.694  24.760
  678    HG3  GLU 106           HG2      GLU 106  25.826  13.355  24.847
  679    HE2  GLU 106           HE       GLU 106  26.060  13.363  21.421
  680    H    HIS 107           H        HIS 107  28.429  15.735  25.764
  681    HA   HIS 107           HA       HIS 107  27.705  17.882  25.558
  682    HB2  HIS 107           HB1      HIS 107  25.369  16.236  25.231
  683    HB3  HIS 107           HB2      HIS 107  24.925  17.727  26.067
  684    HD1  HIS 107           HD1      HIS 107  24.780  16.583  22.845
  685    HD2  HIS 107           HD2      HIS 107  26.535  19.969  24.492
  686    HE1  HIS 107           HE1      HIS 107  24.998  18.218  20.947
  687    HE2  HIS 107           HE2      HIS 107  26.071  20.288  21.953
  688    H    HIS 108           H        HIS 108  28.588  18.869  27.306
  689    HA   HIS 108           HA       HIS 108  27.199  18.712  29.876
  690    HB2  HIS 108           HB1      HIS 108  29.884  18.706  29.216
  691    HB3  HIS 108           HB2      HIS 108  29.614  20.360  29.774
  692    HD1  HIS 108           HD1      HIS 108  30.127  20.601  32.169
  693    HD2  HIS 108           HD2      HIS 108  28.539  16.858  31.313
  694    HE1  HIS 108           HE1      HIS 108  30.039  19.388  34.370
  695    HE2  HIS 108           HE2      HIS 108  29.067  17.101  33.848
  696    H    HIS 109           H        HIS 109  27.784  21.070  31.052
  697    HA   HIS 109           HA       HIS 109  25.816  22.804  30.010
  698    HB2  HIS 109           HB1      HIS 109  27.988  23.371  32.044
  699    HB3  HIS 109           HB2      HIS 109  26.563  24.376  31.760
  700    HD1  HIS 109           HD1      HIS 109  27.165  23.056  34.522
  701    HD2  HIS 109           HD2      HIS 109  24.608  21.503  31.640
  702    HE1  HIS 109           HE1      HIS 109  25.576  21.559  35.770
  703    HE2  HIS 109           HE2      HIS 109  24.012  20.610  34.009
  704    H    HIS 110           H        HIS 110  26.150  25.076  29.397
  705    HA   HIS 110           HA       HIS 110  28.739  25.696  28.206
  706    HB2  HIS 110           HB1      HIS 110  26.724  24.600  26.647
  707    HB3  HIS 110           HB2      HIS 110  26.565  26.336  26.365
  708    HD1  HIS 110           HD1      HIS 110  28.737  23.446  25.595
  709    HD2  HIS 110           HD2      HIS 110  28.835  27.576  25.163
  710    HE1  HIS 110           HE1      HIS 110  30.603  23.909  23.974
  711    HE2  HIS 110           HE2      HIS 110  30.664  26.433  23.708
  712    H    HIS 111           H        HIS 111  28.566  27.974  27.128
  713    HA   HIS 111           HA       HIS 111  28.381  30.209  27.523
  714    HB2  HIS 111           HB1      HIS 111  25.589  29.199  27.993
  715    HB3  HIS 111           HB2      HIS 111  25.969  30.908  28.225
  716    HD1  HIS 111           HD1      HIS 111  24.628  28.833  25.745
  717    HD2  HIS 111           HD2      HIS 111  27.470  31.862  25.699
  718    HE1  HIS 111           HE1      HIS 111  24.733  29.619  23.358
  719    HE2  HIS 111           HE2      HIS 111  26.470  31.471  23.329
  720    H    HIS 112           H        HIS 112  29.421  28.643  29.667
  721    HA   HIS 112           HA       HIS 112  29.001  30.524  31.830
  722    HB2  HIS 112           HB1      HIS 112  27.416  28.356  31.917
  723    HB3  HIS 112           HB2      HIS 112  28.855  27.683  32.689
  724    HD1  HIS 112           HD1      HIS 112  29.735  29.037  34.855
  725    HD2  HIS 112           HD2      HIS 112  25.865  29.866  33.594
  726    HE1  HIS 112           HE1      HIS 112  28.619  30.167  36.806
  727    HE2  HIS 112           HE2      HIS 112  26.253  30.674  36.036
  Start of MODEL   52
    1    H1   MET  18           H        MET  18 -37.473  17.364  54.806
    2    HA   MET  18           HA       MET  18 -39.570  19.052  55.828
    3    HB2  MET  18           HB1      MET  18 -36.941  20.001  56.009
    4    HB3  MET  18           HB2      MET  18 -37.627  20.803  54.587
    5    HG2  MET  18           HG1      MET  18 -39.552  21.538  55.976
    6    HG3  MET  18           HG2      MET  18 -38.741  20.838  57.380
    7    HE1  MET  18           HE1      MET  18 -35.697  22.295  57.894
    8    HE2  MET  18           HE2      MET  18 -36.833  23.259  58.839
    9    HE3  MET  18           HE3      MET  18 -37.134  21.540  58.582
   10    H    LEU  19           H        LEU  19 -40.209  20.694  54.029
   11    HA   LEU  19           HA       LEU  19 -39.813  19.474  51.383
   12    HB2  LEU  19           HB1      LEU  19 -42.202  19.894  50.882
   13    HB3  LEU  19           HB2      LEU  19 -41.936  18.686  52.152
   14    HG   LEU  19           HG       LEU  19 -42.380  21.432  53.117
   15   HD11  LEU  19          HD11      LEU  19 -44.241  20.134  51.264
   16   HD12  LEU  19          HD12      LEU  19 -44.122  21.821  51.763
   17   HD13  LEU  19          HD13      LEU  19 -44.962  20.656  52.786
   18   HD21  LEU  19          HD21      LEU  19 -43.451  18.705  53.831
   19   HD22  LEU  19          HD22      LEU  19 -43.844  20.194  54.691
   20   HD23  LEU  19          HD23      LEU  19 -42.182  19.603  54.666
   21    H    VAL  20           H        VAL  20 -38.234  21.400  51.601
   22    HA   VAL  20           HA       VAL  20 -39.291  24.037  51.394
   23    HB   VAL  20           HB       VAL  20 -36.993  23.582  52.176
   24   HG11  VAL  20          HG11      VAL  20 -35.241  22.984  50.631
   25   HG12  VAL  20          HG12      VAL  20 -36.508  21.756  50.574
   26   HG13  VAL  20          HG13      VAL  20 -36.385  22.958  49.289
   27   HG21  VAL  20          HG21      VAL  20 -37.883  25.666  50.613
   28   HG22  VAL  20          HG22      VAL  20 -36.391  25.644  51.555
   29   HG23  VAL  20          HG23      VAL  20 -36.362  25.209  49.846
   30    H    LEU  21           H        LEU  21 -39.699  25.288  49.624
   31    HA   LEU  21           HA       LEU  21 -40.124  23.887  47.126
   32    HB2  LEU  21           HB1      LEU  21 -40.970  26.457  48.332
   33    HB3  LEU  21           HB2      LEU  21 -40.817  26.424  46.567
   34    HG   LEU  21           HG       LEU  21 -43.111  26.005  47.254
   35   HD11  LEU  21          HD11      LEU  21 -43.208  24.779  45.411
   36   HD12  LEU  21          HD12      LEU  21 -42.812  23.352  46.367
   37   HD13  LEU  21          HD13      LEU  21 -41.526  24.287  45.608
   38   HD21  LEU  21          HD21      LEU  21 -41.876  23.753  48.820
   39   HD22  LEU  21          HD22      LEU  21 -43.589  23.796  48.398
   40   HD23  LEU  21          HD23      LEU  21 -42.896  25.066  49.408
   41    H    ASP  22           H        ASP  22 -39.170  24.371  45.160
   42    HA   ASP  22           HA       ASP  22 -36.865  26.198  45.231
   43    HB2  ASP  22           HB1      ASP  22 -36.044  23.896  45.442
   44    HB3  ASP  22           HB2      ASP  22 -36.920  23.447  43.973
   45    HD2  ASP  22           HD       ASP  22 -34.277  24.409  42.045
   46    H    PHE  23           H        PHE  23 -36.815  27.617  43.612
   47    HA   PHE  23           HA       PHE  23 -38.906  27.891  41.785
   48    HB2  PHE  23           HB1      PHE  23 -37.531  29.605  40.699
   49    HB3  PHE  23           HB2      PHE  23 -37.476  29.763  42.456
   50    HD1  PHE  23           HD1      PHE  23 -35.565  28.758  39.488
   51    HD2  PHE  23           HD2      PHE  23 -35.461  29.417  43.692
   52    HE1  PHE  23           HE1      PHE  23 -33.106  28.673  39.437
   53    HE2  PHE  23           HE2      PHE  23 -33.001  29.334  43.647
   54    HZ   PHE  23           HZ       PHE  23 -31.821  28.962  41.518
   55    H    ASN  24           H        ASN  24 -39.157  27.394  39.636
   56    HA   ASN  24           HA       ASN  24 -37.828  25.067  38.688
   57    HB2  ASN  24           HB1      ASN  24 -39.899  26.939  37.602
   58    HB3  ASN  24           HB2      ASN  24 -39.102  25.812  36.496
   59   HD21  ASN  24          HD21      ASN  24 -41.564  25.302  36.502
   60   HD22  ASN  24          HD22      ASN  24 -42.028  23.998  37.536
   61    H    ASN  25           H        ASN  25 -36.461  24.823  36.893
   62    HA   ASN  25           HA       ASN  25 -35.200  27.271  35.873
   63    HB2  ASN  25           HB1      ASN  25 -32.986  26.388  36.165
   64    HB3  ASN  25           HB2      ASN  25 -33.821  26.277  37.719
   65   HD21  ASN  25          HD21      ASN  25 -33.722  24.417  38.744
   66   HD22  ASN  25          HD22      ASN  25 -33.340  22.886  38.040
   67    H    ILE  26           H        ILE  26 -34.498  27.184  33.763
   68    HA   ILE  26           HA       ILE  26 -34.691  24.649  32.324
   69    HB   ILE  26           HB       ILE  26 -36.184  25.380  30.683
   70   HG12  ILE  26          HG11      ILE  26 -35.228  27.565  30.252
   71   HG13  ILE  26          HG12      ILE  26 -36.976  27.723  30.500
   72   HG21  ILE  26          HG21      ILE  26 -37.183  26.522  33.289
   73   HG22  ILE  26          HG22      ILE  26 -38.186  26.113  31.898
   74   HG23  ILE  26          HG23      ILE  26 -37.320  24.844  32.763
   75   HD11  ILE  26          HD11      ILE  26 -36.431  28.320  32.907
   76   HD12  ILE  26          HD12      ILE  26 -34.764  28.507  32.362
   77   HD13  ILE  26          HD13      ILE  26 -36.037  29.513  31.671
   78    H    ARG  27           H        ARG  27 -33.988  24.996  29.964
   79    HA   ARG  27           HA       ARG  27 -32.259  27.214  29.422
   80    HB2  ARG  27           HB1      ARG  27 -30.998  25.577  31.014
   81    HB3  ARG  27           HB2      ARG  27 -30.840  24.577  29.563
   82    HG2  ARG  27           HG1      ARG  27 -30.052  27.063  28.675
   83    HG3  ARG  27           HG2      ARG  27 -29.412  26.990  30.327
   84    HD2  ARG  27           HD1      ARG  27 -29.046  24.643  28.500
   85    HD3  ARG  27           HD2      ARG  27 -28.010  26.066  28.322
   86    HE   ARG  27           HE       ARG  27 -27.952  25.431  31.002
   87   HH11  ARG  27          HH11      ARG  27 -27.138  23.857  28.007
   88   HH12  ARG  27          HH12      ARG  27 -25.884  22.887  28.706
   89   HH21  ARG  27          HH21      ARG  27 -26.302  24.162  31.935
   90   HH22  ARG  27          HH22      ARG  27 -25.409  23.061  30.940
   91    H    SER  28           H        SER  28 -32.322  27.547  27.303
   92    HA   SER  28           HA       SER  28 -33.543  25.644  25.554
   93    HB2  SER  28           HB1      SER  28 -32.268  28.351  25.114
   94    HB3  SER  28           HB2      SER  28 -32.922  27.380  23.782
   95    HG   SER  28           HG       SER  28 -34.246  28.975  25.428
   96    H    SER  29           H        SER  29 -32.370  25.478  23.257
   97    HA   SER  29           HA       SER  29 -29.533  25.067  23.382
   98    HB2  SER  29           HB1      SER  29 -29.919  22.553  22.678
   99    HB3  SER  29           HB2      SER  29 -29.861  23.009  24.389
  100    HG   SER  29           HG       SER  29 -32.341  23.100  23.114
  101    H    ALA  30           H        ALA  30 -29.575  26.449  21.588
  102    HA   ALA  30           HA       ALA  30 -31.132  26.016  19.276
  103    HB1  ALA  30           HB1      ALA  30 -30.193  27.910  18.529
  104    HB2  ALA  30           HB2      ALA  30 -29.518  28.024  20.155
  105    HB3  ALA  30           HB3      ALA  30 -28.554  27.339  18.846
  106    H    ASP  31           H        ASP  31 -30.941  24.561  17.709
  107    HA   ASP  31           HA       ASP  31 -28.776  22.678  17.712
  108    HB2  ASP  31           HB1      ASP  31 -31.240  23.053  16.017
  109    HB3  ASP  31           HB2      ASP  31 -30.007  21.859  15.593
  110    HD2  ASP  31           HD       ASP  31 -32.063  21.194  18.932
  111    H    LEU  32           H        LEU  32 -27.126  24.405  17.365
  112    HA   LEU  32           HA       LEU  32 -26.818  24.994  14.494
  113    HB2  LEU  32           HB1      LEU  32 -26.615  26.674  16.834
  114    HB3  LEU  32           HB2      LEU  32 -25.086  26.654  15.938
  115    HG   LEU  32           HG       LEU  32 -27.269  27.039  14.115
  116   HD11  LEU  32          HD11      LEU  32 -28.369  28.889  14.906
  117   HD12  LEU  32          HD12      LEU  32 -27.085  29.306  16.040
  118   HD13  LEU  32          HD13      LEU  32 -28.170  27.963  16.393
  119   HD21  LEU  32          HD21      LEU  32 -25.903  29.316  14.006
  120   HD22  LEU  32          HD22      LEU  32 -25.289  27.816  13.312
  121   HD23  LEU  32          HD23      LEU  32 -24.727  28.350  14.896
  122    H    HIS  33           H        HIS  33 -25.617  23.264  13.851
  123    HA   HIS  33           HA       HIS  33 -22.858  23.210  14.745
  124    HB2  HIS  33           HB1      HIS  33 -22.817  20.826  15.215
  125    HB3  HIS  33           HB2      HIS  33 -23.982  21.628  16.272
  126    HD1  HIS  33           HD1      HIS  33 -26.451  21.013  16.026
  127    HD2  HIS  33           HD2      HIS  33 -23.986  19.118  13.271
  128    HE1  HIS  33           HE1      HIS  33 -27.877  19.239  14.958
  129    HE2  HIS  33           HE2      HIS  33 -26.371  18.080  13.273
  130    H    GLY  34           H        GLY  34 -21.556  21.633  13.393
  131    HA2  GLY  34           HA2      GLY  34 -21.369  20.373  11.351
  132    HA3  GLY  34           HA3      GLY  34 -22.753  21.258  10.728
  133    HA1  GLY  34           HA1      GLY  34 -20.952  20.989  11.826
  134    H    ALA  35           H        ALA  35 -19.341  21.169  11.045
  135    HA   ALA  35           HA       ALA  35 -18.961  23.904  10.155
  136    HB1  ALA  35           HB1      ALA  35 -16.503  23.069  10.078
  137    HB2  ALA  35           HB2      ALA  35 -17.292  23.311  11.637
  138    HB3  ALA  35           HB3      ALA  35 -17.133  21.685  10.970
  139    H    ARG  36           H        ARG  36 -17.790  20.762   8.929
  140    HA   ARG  36           HA       ARG  36 -18.449  21.629   6.210
  141    HB2  ARG  36           HB1      ARG  36 -15.738  20.845   7.240
  142    HB3  ARG  36           HB2      ARG  36 -16.173  20.555   5.549
  143    HG2  ARG  36           HG1      ARG  36 -15.655  22.642   5.036
  144    HG3  ARG  36           HG2      ARG  36 -16.881  23.225   6.174
  145    HD2  ARG  36           HD1      ARG  36 -15.173  22.919   8.014
  146    HD3  ARG  36           HD2      ARG  36 -13.983  22.639   6.735
  147    HE   ARG  36           HE       ARG  36 -15.065  25.155   7.547
  148   HH11  ARG  36          HH11      ARG  36 -13.754  23.391   4.847
  149   HH12  ARG  36          HH12      ARG  36 -13.208  24.811   4.018
  150   HH21  ARG  36          HH21      ARG  36 -14.351  27.031   6.465
  151   HH22  ARG  36          HH22      ARG  36 -13.549  26.881   4.939
  152    H    LYS  37           H        LYS  37 -17.964  19.711   4.646
  153    HA   LYS  37           HA       LYS  37 -18.317  17.095   5.838
  154    HB2  LYS  37           HB1      LYS  37 -20.613  18.226   5.645
  155    HB3  LYS  37           HB2      LYS  37 -20.414  18.042   3.896
  156    HG2  LYS  37           HG1      LYS  37 -20.637  15.764   3.952
  157    HG3  LYS  37           HG2      LYS  37 -20.047  15.648   5.620
  158    HD2  LYS  37           HD1      LYS  37 -22.236  16.977   6.187
  159    HD3  LYS  37           HD2      LYS  37 -22.775  16.345   4.621
  160    HE2  LYS  37           HE1      LYS  37 -23.488  14.622   5.932
  161    HE3  LYS  37           HE2      LYS  37 -21.828  14.080   5.644
  162    HZ1  LYS  37           HZ1      LYS  37 -22.132  15.844   7.912
  163    HZ2  LYS  37           HZ2      LYS  37 -21.266  14.399   7.773
  164    HZ3  LYS  37           HZ3      LYS  37 -22.932  14.362   8.071
  165    H    GLY  38           H        GLY  38 -17.695  15.435   4.498
  166    HA2  GLY  38           HA2      GLY  38 -17.551  14.820   2.023
  167    HA3  GLY  38           HA3      GLY  38 -16.582  16.282   1.901
  168    HA1  GLY  38           HA1      GLY  38 -17.399  14.567   2.855
  169    H    SER  39           H        SER  39 -16.328  13.067   1.952
  170    HA   SER  39           HA       SER  39 -13.570  13.181   2.895
  171    HB2  SER  39           HB1      SER  39 -15.617  12.087   4.492
  172    HB3  SER  39           HB2      SER  39 -14.760  10.703   3.793
  173    HG   SER  39           HG       SER  39 -13.774  12.738   5.465
  174    H    GLN  40           H        GLN  40 -12.434  12.507   1.210
  175    HA   GLN  40           HA       GLN  40 -13.560  10.764  -0.784
  176    HB2  GLN  40           HB1      GLN  40 -11.504  12.675  -0.697
  177    HB3  GLN  40           HB2      GLN  40 -10.705  11.131  -1.032
  178    HG2  GLN  40           HG1      GLN  40 -11.252  12.242  -3.103
  179    HG3  GLN  40           HG2      GLN  40 -12.212  10.767  -2.927
  180   HE21  GLN  40          HE21      GLN  40 -13.724  11.575  -4.415
  181   HE22  GLN  40          HE22      GLN  40 -14.876  12.779  -3.965
  182    H    CYS  41           H        CYS  41 -10.826  10.549   1.487
  183    HA   CYS  41           HA       CYS  41 -11.225   7.663   1.634
  184    HB2  CYS  41           HB1      CYS  41  -8.936   7.111   1.185
  185    HB3  CYS  41           HB2      CYS  41  -9.532   8.082  -0.162
  186    H    LEU  42           H        LEU  42 -10.648   6.772   3.581
  187    HA   LEU  42           HA       LEU  42 -10.257   8.622   5.755
  188    HB2  LEU  42           HB1      LEU  42 -11.344   6.023   5.418
  189    HB3  LEU  42           HB2      LEU  42 -10.018   5.903   6.589
  190    HG   LEU  42           HG       LEU  42 -11.123   7.729   7.902
  191   HD11  LEU  42          HD11      LEU  42 -13.125   8.633   7.339
  192   HD12  LEU  42          HD12      LEU  42 -13.668   7.186   6.490
  193   HD13  LEU  42          HD13      LEU  42 -12.530   8.288   5.715
  194   HD21  LEU  42          HD21      LEU  42 -11.366   5.223   8.286
  195   HD22  LEU  42          HD22      LEU  42 -12.950   5.374   7.526
  196   HD23  LEU  42          HD23      LEU  42 -12.592   6.267   9.004
  197    H    SER  43           H        SER  43  -8.325   6.383   3.927
  198    HA   SER  43           HA       SER  43  -5.910   7.430   5.056
  199    HB2  SER  43           HB1      SER  43  -5.156   4.963   5.623
  200    HB3  SER  43           HB2      SER  43  -6.038   5.933   6.815
  201    HG   SER  43           HG       SER  43  -7.103   4.021   6.739
  202    H    ASP  44           H        ASP  44  -3.961   6.214   4.126
  203    HA   ASP  44           HA       ASP  44  -4.157   6.209   1.326
  204    HB2  ASP  44           HB1      ASP  44  -2.018   5.018   3.113
  205    HB3  ASP  44           HB2      ASP  44  -1.854   5.284   1.372
  206    HD2  ASP  44           HD       ASP  44  -1.802   8.487   3.720
  207    H    THR  45           H        THR  45  -4.601   3.699   3.676
  208    HA   THR  45           HA       THR  45  -4.251   1.477   1.937
  209    HB   THR  45           HB       THR  45  -5.656   0.273   3.717
  210    HG1  THR  45           HG1      THR  45  -6.705   2.027   4.644
  211   HG21  THR  45          HG21      THR  45  -3.045   0.667   3.550
  212   HG22  THR  45          HG22      THR  45  -3.768  -0.102   4.963
  213   HG23  THR  45          HG23      THR  45  -3.332   1.605   5.016
  214    H    ASP  46           H        ASP  46  -6.862   3.671   2.538
  215    HA   ASP  46           HA       ASP  46  -8.981   2.040   1.585
  216    HB2  ASP  46           HB1      ASP  46  -9.047   4.255   2.967
  217    HB3  ASP  46           HB2      ASP  46  -9.012   5.034   1.380
  218    HD2  ASP  46           HD       ASP  46 -12.423   3.844   2.622
  219    H    CYS  47           H        CYS  47  -6.561   3.984   0.040
  220    HA   CYS  47           HA       CYS  47  -7.735   4.529  -2.412
  221    HB2  CYS  47           HB1      CYS  47  -5.189   4.753  -1.286
  222    HB3  CYS  47           HB2      CYS  47  -4.955   3.730  -2.704
  223    H    ASN  48           H        ASN  48  -5.858   1.657  -1.463
  224    HA   ASN  48           HA       ASN  48  -7.438  -0.111  -2.995
  225    HB2  ASN  48           HB1      ASN  48  -5.355   1.248  -4.431
  226    HB3  ASN  48           HB2      ASN  48  -4.954  -0.471  -4.316
  227   HD21  ASN  48          HD21      ASN  48  -5.338  -1.064  -6.378
  228   HD22  ASN  48          HD22      ASN  48  -6.890  -0.997  -7.135
  229    H    THR  49           H        THR  49  -3.922   0.024  -2.437
  230    HA   THR  49           HA       THR  49  -4.065  -1.779  -0.206
  231    HB   THR  49           HB       THR  49  -2.604  -2.847  -2.612
  232    HG1  THR  49           HG1      THR  49  -4.532  -4.301  -2.692
  233   HG21  THR  49          HG21      THR  49  -3.756  -4.502  -0.417
  234   HG22  THR  49          HG22      THR  49  -2.299  -3.564  -0.089
  235   HG23  THR  49          HG23      THR  49  -2.305  -4.762  -1.382
  236    H    ARG  50           H        ARG  50  -1.682  -1.105  -2.777
  237    HA   ARG  50           HA       ARG  50   0.138  -0.109  -0.684
  238    HB2  ARG  50           HB1      ARG  50   0.674  -1.627  -3.233
  239    HB3  ARG  50           HB2      ARG  50   1.945  -0.717  -2.404
  240    HG2  ARG  50           HG1      ARG  50   2.147  -2.221  -0.738
  241    HG3  ARG  50           HG2      ARG  50   0.410  -2.573  -0.714
  242    HD2  ARG  50           HD1      ARG  50   2.071  -3.462  -3.047
  243    HD3  ARG  50           HD2      ARG  50   2.105  -4.381  -1.536
  244    HE   ARG  50           HE       ARG  50  -0.569  -3.948  -2.234
  245   HH11  ARG  50          HH11      ARG  50   2.223  -5.690  -3.373
  246   HH12  ARG  50          HH12      ARG  50   1.295  -6.948  -4.119
  247   HH21  ARG  50          HH21      ARG  50  -1.802  -5.600  -3.213
  248   HH22  ARG  50          HH22      ARG  50  -0.994  -6.896  -4.028
  249    H    LYS  51           H        LYS  51  -1.598   1.714  -1.587
  250    HA   LYS  51           HA       LYS  51   0.091   3.445  -3.253
  251    HB2  LYS  51           HB1      LYS  51  -2.827   2.806  -3.646
  252    HB3  LYS  51           HB2      LYS  51  -2.129   4.323  -4.236
  253    HG2  LYS  51           HG1      LYS  51  -1.795   3.142  -6.119
  254    HG3  LYS  51           HG2      LYS  51  -0.359   2.567  -5.252
  255    HD2  LYS  51           HD1      LYS  51  -1.964   0.735  -4.321
  256    HD3  LYS  51           HD2      LYS  51  -2.974   1.182  -5.706
  257    HE2  LYS  51           HE1      LYS  51  -0.394   0.939  -6.760
  258    HE3  LYS  51           HE2      LYS  51  -0.561  -0.408  -5.624
  259    HZ1  LYS  51           HZ1      LYS  51  -1.940   0.075  -8.132
  260    HZ2  LYS  51           HZ2      LYS  51  -2.898  -0.547  -6.883
  261    HZ3  LYS  51           HZ3      LYS  51  -1.519  -1.387  -7.390
  262    H    PHE  52           H        PHE  52  -0.360   5.734  -2.996
  263    HA   PHE  52           HA       PHE  52  -1.358   6.324  -0.297
  264    HB2  PHE  52           HB1      PHE  52  -0.066   8.478  -0.582
  265    HB3  PHE  52           HB2      PHE  52   0.909   7.008  -0.520
  266    HD1  PHE  52           HD1      PHE  52   2.534   6.658  -2.111
  267    HD2  PHE  52           HD2      PHE  52  -0.719   9.252  -3.010
  268    HE1  PHE  52           HE1      PHE  52   3.595   7.240  -4.253
  269    HE2  PHE  52           HE2      PHE  52   0.336   9.838  -5.153
  270    HZ   PHE  52           HZ       PHE  52   2.495   8.831  -5.778
  271    H    CYS  53           H        CYS  53  -2.693   8.142   0.066
  272    HA   CYS  53           HA       CYS  53  -4.541   8.646  -2.100
  273    HB2  CYS  53           HB1      CYS  53  -4.805   8.441   0.631
  274    HB3  CYS  53           HB2      CYS  53  -4.908  10.183   0.374
  275    H    LEU  54           H        LEU  54  -3.642   9.983  -3.596
  276    HA   LEU  54           HA       LEU  54  -2.177  12.344  -2.835
  277    HB2  LEU  54           HB1      LEU  54  -2.091  10.765  -5.010
  278    HB3  LEU  54           HB2      LEU  54  -3.175  12.034  -5.602
  279    HG   LEU  54           HG       LEU  54  -0.863  12.457  -6.255
  280   HD11  LEU  54          HD11      LEU  54  -0.652  14.751  -5.242
  281   HD12  LEU  54          HD12      LEU  54  -2.059  14.356  -4.254
  282   HD13  LEU  54          HD13      LEU  54  -2.199  14.396  -6.012
  283   HD21  LEU  54          HD21      LEU  54   0.874  12.196  -4.892
  284   HD22  LEU  54          HD22      LEU  54  -0.247  11.502  -3.721
  285   HD23  LEU  54          HD23      LEU  54   0.144  13.221  -3.655
  286    H    GLN  55           H        GLN  55  -3.215  14.054  -2.053
  287    HA   GLN  55           HA       GLN  55  -5.693  14.909  -3.391
  288    HB2  GLN  55           HB1      GLN  55  -6.387  15.841  -1.138
  289    HB3  GLN  55           HB2      GLN  55  -6.419  14.078  -1.295
  290    HG2  GLN  55           HG1      GLN  55  -4.790  13.759   0.224
  291    HG3  GLN  55           HG2      GLN  55  -3.903  15.205  -0.276
  292   HE21  GLN  55          HE21      GLN  55  -6.713  14.101   1.535
  293   HE22  GLN  55          HE22      GLN  55  -6.762  15.438   2.628
  294    HA   PRO  56           HA       PRO  56  -2.674  18.335  -3.752
  295    HB2  PRO  56           HB1      PRO  56  -3.637  19.211  -6.164
  296    HB3  PRO  56           HB2      PRO  56  -2.475  17.894  -5.998
  297    HG2  PRO  56           HG1      PRO  56  -5.454  17.774  -6.331
  298    HG3  PRO  56           HG2      PRO  56  -4.174  16.814  -7.163
  299    HD2  PRO  56           HD1      PRO  56  -5.643  15.825  -5.104
  300    HD3  PRO  56           HD2      PRO  56  -3.948  15.381  -5.371
  301    H    ARG  57           H        ARG  57  -2.963  20.542  -3.455
  302    HA   ARG  57           HA       ARG  57  -5.555  21.319  -2.440
  303    HB2  ARG  57           HB1      ARG  57  -2.809  22.182  -2.130
  304    HB3  ARG  57           HB2      ARG  57  -3.872  23.561  -2.450
  305    HG2  ARG  57           HG1      ARG  57  -5.295  22.953  -0.576
  306    HG3  ARG  57           HG2      ARG  57  -4.288  21.528  -0.270
  307    HD2  ARG  57           HD1      ARG  57  -3.108  22.813   1.130
  308    HD3  ARG  57           HD2      ARG  57  -2.462  23.594  -0.320
  309    HE   ARG  57           HE       ARG  57  -4.949  24.732   0.511
  310   HH11  ARG  57          HH11      ARG  57  -1.515  24.728   1.083
  311   HH12  ARG  57          HH12      ARG  57  -1.489  26.334   1.730
  312   HH21  ARG  57          HH21      ARG  57  -4.927  26.849   1.361
  313   HH22  ARG  57          HH22      ARG  57  -3.430  27.540   1.888
  314    H    ASP  58           H        ASP  58  -3.638  21.832  -5.290
  315    HA   ASP  58           HA       ASP  58  -5.315  24.019  -6.220
  316    HB2  ASP  58           HB1      ASP  58  -2.822  22.679  -7.224
  317    HB3  ASP  58           HB2      ASP  58  -3.794  23.666  -8.322
  318    HD2  ASP  58           HD       ASP  58  -1.481  25.474  -5.757
  319    H    GLU  59           H        GLU  59  -5.052  20.599  -6.545
  320    HA   GLU  59           HA       GLU  59  -7.135  20.654  -8.629
  321    HB2  GLU  59           HB1      GLU  59  -4.770  18.823  -8.288
  322    HB3  GLU  59           HB2      GLU  59  -6.202  18.309  -9.192
  323    HG2  GLU  59           HG1      GLU  59  -5.466  19.341 -11.002
  324    HG3  GLU  59           HG2      GLU  59  -5.454  20.878 -10.128
  325    HE2  GLU  59           HE       GLU  59  -2.035  20.914 -10.016
  326    H    LYS  60           H        LYS  60  -8.116  18.232  -8.669
  327    HA   LYS  60           HA       LYS  60  -9.362  17.953  -6.067
  328    HB2  LYS  60           HB1      LYS  60  -9.929  17.038  -8.837
  329    HB3  LYS  60           HB2      LYS  60 -10.526  16.015  -7.520
  330    HG2  LYS  60           HG1      LYS  60 -12.280  17.345  -7.290
  331    HG3  LYS  60           HG2      LYS  60 -11.192  18.674  -6.855
  332    HD2  LYS  60           HD1      LYS  60 -10.883  18.710  -9.530
  333    HD3  LYS  60           HD2      LYS  60 -12.539  18.085  -9.422
  334    HE2  LYS  60           HE1      LYS  60 -12.905  20.048  -7.743
  335    HE3  LYS  60           HE2      LYS  60 -11.447  20.713  -8.494
  336    HZ1  LYS  60           HZ1      LYS  60 -13.577  21.456  -9.511
  337    HZ2  LYS  60           HZ2      LYS  60 -13.834  19.871 -10.040
  338    HZ3  LYS  60           HZ3      LYS  60 -12.500  20.745 -10.606
  339    HA   PRO  61           HA       PRO  61  -7.196  14.417  -4.634
  340    HB2  PRO  61           HB1      PRO  61  -9.189  12.918  -3.501
  341    HB3  PRO  61           HB2      PRO  61  -8.586  14.421  -2.804
  342    HG2  PRO  61           HG1      PRO  61 -11.001  13.955  -4.521
  343    HG3  PRO  61           HG2      PRO  61 -10.845  14.933  -3.014
  344    HD2  PRO  61           HD1      PRO  61 -10.877  16.049  -5.489
  345    HD3  PRO  61           HD2      PRO  61  -9.926  16.715  -4.150
  346    H    PHE  62           H        PHE  62  -6.473  12.494  -5.381
  347    HA   PHE  62           HA       PHE  62  -8.185  10.684  -6.832
  348    HB2  PHE  62           HB1      PHE  62  -6.621  10.687  -8.845
  349    HB3  PHE  62           HB2      PHE  62  -7.720  12.061  -8.697
  350    HD1  PHE  62           HD1      PHE  62  -6.888  14.179  -8.981
  351    HD2  PHE  62           HD2      PHE  62  -4.261  11.087  -7.696
  352    HE1  PHE  62           HE1      PHE  62  -4.993  15.745  -9.100
  353    HE2  PHE  62           HE2      PHE  62  -2.362  12.647  -7.812
  354    HZ   PHE  62           HZ       PHE  62  -2.727  14.979  -8.514
  355    H    CYS  63           H        CYS  63  -7.206   8.636  -7.224
  356    HA   CYS  63           HA       CYS  63  -5.181   7.984  -5.275
  357    HB2  CYS  63           HB1      CYS  63  -7.283   6.608  -5.950
  358    HB3  CYS  63           HB2      CYS  63  -6.284   6.052  -7.293
  359    H    ALA  64           H        ALA  64  -3.081   7.559  -5.626
  360    HA   ALA  64           HA       ALA  64  -2.145   7.345  -8.407
  361    HB1  ALA  64           HB1      ALA  64  -1.411   9.340  -6.377
  362    HB2  ALA  64           HB2      ALA  64  -0.057   8.609  -7.241
  363    HB3  ALA  64           HB3      ALA  64  -1.337   9.427  -8.136
  364    H    THR  65           H        THR  65  -0.213   6.159  -8.712
  365    HA   THR  65           HA       THR  65   0.129   4.028  -6.798
  366    HB   THR  65           HB       THR  65   1.780   3.140  -8.455
  367    HG1  THR  65           HG1      THR  65   1.941   4.230 -10.449
  368   HG21  THR  65          HG21      THR  65  -0.926   3.892  -9.567
  369   HG22  THR  65          HG22      THR  65  -0.572   2.485  -8.565
  370   HG23  THR  65          HG23      THR  65   0.119   2.612 -10.182
  371    H    CYS  66           H        CYS  66   2.388   3.296  -6.243
  372    HA   CYS  66           HA       CYS  66   3.701   5.311  -4.773
  373    HB2  CYS  66           HB1      CYS  66   5.317   3.632  -4.186
  374    HB3  CYS  66           HB2      CYS  66   3.722   2.879  -4.210
  375    H    ARG  67           H        ARG  67   6.208   5.516  -4.988
  376    HA   ARG  67           HA       ARG  67   6.707   6.472  -7.708
  377    HB2  ARG  67           HB1      ARG  67   8.217   6.986  -5.134
  378    HB3  ARG  67           HB2      ARG  67   8.569   7.731  -6.700
  379    HG2  ARG  67           HG1      ARG  67   5.941   8.037  -5.250
  380    HG3  ARG  67           HG2      ARG  67   7.291   9.178  -5.128
  381    HD2  ARG  67           HD1      ARG  67   6.260  10.218  -6.847
  382    HD3  ARG  67           HD2      ARG  67   7.065   8.973  -7.814
  383    HE   ARG  67           HE       ARG  67   4.604   7.960  -6.937
  384   HH11  ARG  67          HH11      ARG  67   5.874  10.393  -9.079
  385   HH12  ARG  67          HH12      ARG  67   4.518  10.339 -10.156
  386   HH21  ARG  67          HH21      ARG  67   2.813   7.878  -8.347
  387   HH22  ARG  67          HH22      ARG  67   2.777   8.908  -9.739
  388    H    GLY  68           H        GLY  68   7.922   5.328  -9.058
  389    HA2  GLY  68           HA2      GLY  68   9.155   2.901  -8.373
  390    HA3  GLY  68           HA3      GLY  68   9.423   3.792  -9.863
  391    HA1  GLY  68           HA1      GLY  68   9.281   3.521  -7.760
  392    H    LEU  69           H        LEU  69  11.541   2.495  -9.023
  393    HA   LEU  69           HA       LEU  69  13.174   3.705  -7.095
  394    HB2  LEU  69           HB1      LEU  69  13.978   2.201  -9.592
  395    HB3  LEU  69           HB2      LEU  69  15.033   2.556  -8.213
  396    HG   LEU  69           HG       LEU  69  12.640   0.720  -8.238
  397   HD11  LEU  69          HD11      LEU  69  14.446  -0.408  -9.209
  398   HD12  LEU  69          HD12      LEU  69  14.469  -0.909  -7.519
  399   HD13  LEU  69          HD13      LEU  69  15.610   0.307  -8.093
  400   HD21  LEU  69          HD21      LEU  69  13.317   0.224  -5.892
  401   HD22  LEU  69          HD22      LEU  69  12.658   1.842  -6.124
  402   HD23  LEU  69          HD23      LEU  69  14.399   1.614  -5.960
  403    H    ARG  70           H        ARG  70  12.498   4.544 -10.402
  404    HA   ARG  70           HA       ARG  70  14.637   6.541 -10.418
  405    HB2  ARG  70           HB1      ARG  70  12.842   5.391 -12.544
  406    HB3  ARG  70           HB2      ARG  70  13.766   6.873 -12.825
  407    HG2  ARG  70           HG1      ARG  70  15.765   5.354 -11.951
  408    HG3  ARG  70           HG2      ARG  70  14.705   4.076 -12.571
  409    HD2  ARG  70           HD1      ARG  70  14.601   5.213 -14.751
  410    HD3  ARG  70           HD2      ARG  70  15.672   6.476 -14.124
  411    HE   ARG  70           HE       ARG  70  17.004   4.087 -13.741
  412   HH11  ARG  70          HH11      ARG  70  15.740   5.904 -16.429
  413   HH12  ARG  70          HH12      ARG  70  16.926   5.321 -17.550
  414   HH21  ARG  70          HH21      ARG  70  18.571   3.312 -15.207
  415   HH22  ARG  70          HH22      ARG  70  18.534   3.845 -16.854
  416    H    ARG  71           H        ARG  71  11.832   6.517  -9.029
  417    HA   ARG  71           HA       ARG  71  10.914   9.116 -10.056
  418    HB2  ARG  71           HB1      ARG  71   9.478   7.056  -8.364
  419    HB3  ARG  71           HB2      ARG  71   8.801   8.619  -8.846
  420    HG2  ARG  71           HG1      ARG  71   9.596   6.369 -10.698
  421    HG3  ARG  71           HG2      ARG  71   7.950   6.865 -10.272
  422    HD2  ARG  71           HD1      ARG  71   7.987   8.226 -12.041
  423    HD3  ARG  71           HD2      ARG  71   9.171   9.201 -11.159
  424    HE   ARG  71           HE       ARG  71  10.783   8.466 -12.597
  425   HH11  ARG  71          HH11      ARG  71   8.063   6.299 -12.762
  426   HH12  ARG  71          HH12      ARG  71   8.708   5.381 -14.082
  427   HH21  ARG  71          HH21      ARG  71  11.643   7.265 -14.336
  428   HH22  ARG  71          HH22      ARG  71  10.744   5.931 -14.976
  429    H    ARG  72           H        ARG  72  10.469  10.815  -8.610
  430    HA   ARG  72           HA       ARG  72  12.242  10.922  -6.357
  431    HB2  ARG  72           HB1      ARG  72  10.185  12.909  -7.352
  432    HB3  ARG  72           HB2      ARG  72  11.395  13.230  -6.100
  433    HG2  ARG  72           HG1      ARG  72  12.646  12.208  -8.496
  434    HG3  ARG  72           HG2      ARG  72  11.663  13.642  -8.837
  435    HD2  ARG  72           HD1      ARG  72  13.663  13.522  -6.578
  436    HD3  ARG  72           HD2      ARG  72  14.072  14.073  -8.208
  437    HE   ARG  72           HE       ARG  72  11.811  15.432  -7.064
  438   HH11  ARG  72          HH11      ARG  72  15.282  15.362  -7.328
  439   HH12  ARG  72          HH12      ARG  72  15.473  17.048  -6.974
  440   HH21  ARG  72          HH21      ARG  72  12.049  17.652  -6.597
  441   HH22  ARG  72          HH22      ARG  72  13.634  18.348  -6.558
  442    H    CYS  73           H        CYS  73  11.599  11.481  -4.185
  443    HA   CYS  73           HA       CYS  73   8.840  11.008  -3.423
  444    HB2  CYS  73           HB1      CYS  73   9.379   9.228  -1.832
  445    HB3  CYS  73           HB2      CYS  73   9.758   8.738  -3.485
  446    H    GLN  74           H        GLN  74   8.497  11.382  -1.080
  447    HA   GLN  74           HA       GLN  74  10.470  13.302  -0.033
  448    HB2  GLN  74           HB1      GLN  74   7.455  13.285   0.136
  449    HB3  GLN  74           HB2      GLN  74   8.465  14.301   1.177
  450    HG2  GLN  74           HG1      GLN  74   9.034  15.728  -0.493
  451    HG3  GLN  74           HG2      GLN  74   8.953  14.469  -1.734
  452   HE21  GLN  74          HE21      GLN  74   6.796  16.147   0.532
  453   HE22  GLN  74          HE22      GLN  74   5.494  16.342  -0.586
  454    H    ARG  75           H        ARG  75   8.509  10.521   0.613
  455    HA   ARG  75           HA       ARG  75   9.802  10.264   3.234
  456    HB2  ARG  75           HB1      ARG  75   6.858  10.052   2.627
  457    HB3  ARG  75           HB2      ARG  75   7.576   9.238   4.025
  458    HG2  ARG  75           HG1      ARG  75   8.196  11.274   5.043
  459    HG3  ARG  75           HG2      ARG  75   7.891  12.186   3.555
  460    HD2  ARG  75           HD1      ARG  75   5.495  11.706   3.728
  461    HD3  ARG  75           HD2      ARG  75   5.795  10.765   5.195
  462    HE   ARG  75           HE       ARG  75   5.982  12.719   6.387
  463   HH11  ARG  75          HH11      ARG  75   6.060  13.419   2.978
  464   HH12  ARG  75          HH12      ARG  75   5.930  15.133   3.193
  465   HH21  ARG  75          HH21      ARG  75   5.810  14.975   6.685
  466   HH22  ARG  75          HH22      ARG  75   5.789  16.016   5.303
  467    H    ASP  76           H        ASP  76   9.743   8.031   4.070
  468    HA   ASP  76           HA       ASP  76  10.355   6.172   1.956
  469    HB2  ASP  76           HB1      ASP  76  10.229   5.525   4.903
  470    HB3  ASP  76           HB2      ASP  76  11.207   4.750   3.649
  471    HD2  ASP  76           HD       ASP  76  13.705   7.120   3.900
  472    H    ALA  77           H        ALA  77   7.682   6.837   4.047
  473    HA   ALA  77           HA       ALA  77   6.416   4.282   3.803
  474    HB1  ALA  77           HB1      ALA  77   4.631   5.199   5.010
  475    HB2  ALA  77           HB2      ALA  77   6.060   6.018   5.640
  476    HB3  ALA  77           HB3      ALA  77   5.007   6.841   4.491
  477    H    MET  78           H        MET  78   5.989   7.438   2.233
  478    HA   MET  78           HA       MET  78   3.785   6.781   0.645
  479    HB2  MET  78           HB1      MET  78   4.357   8.695  -0.712
  480    HB3  MET  78           HB2      MET  78   4.648   9.082   0.991
  481    HG2  MET  78           HG1      MET  78   6.742   9.640   0.546
  482    HG3  MET  78           HG2      MET  78   7.046   8.019  -0.085
  483    HE1  MET  78           HE1      MET  78   5.652  11.535  -0.882
  484    HE2  MET  78           HE2      MET  78   5.556  11.553  -2.643
  485    HE3  MET  78           HE3      MET  78   4.428  10.571  -1.708
  486    H    CYS  79           H        CYS  79   7.081   5.842   0.403
  487    HA   CYS  79           HA       CYS  79   6.941   5.150  -2.404
  488    HB2  CYS  79           HB1      CYS  79   9.006   5.415  -0.386
  489    HB3  CYS  79           HB2      CYS  79   9.183   3.902  -1.276
  490    H    CYS  80           H        CYS  80   7.079   3.025  -3.234
  491    HA   CYS  80           HA       CYS  80   5.358   1.161  -2.138
  492    HB2  CYS  80           HB1      CYS  80   7.324   1.217  -4.316
  493    HB3  CYS  80           HB2      CYS  80   7.074  -0.393  -3.636
  494    HA   PRO  81           HA       PRO  81   7.496  -1.067   0.977
  495    HB2  PRO  81           HB1      PRO  81   6.679  -3.643   0.533
  496    HB3  PRO  81           HB2      PRO  81   5.628  -2.387   1.184
  497    HG2  PRO  81           HG1      PRO  81   5.895  -3.368  -1.638
  498    HG3  PRO  81           HG2      PRO  81   4.402  -3.033  -0.683
  499    HD2  PRO  81           HD1      PRO  81   5.373  -1.306  -2.541
  500    HD3  PRO  81           HD2      PRO  81   4.548  -0.765  -1.069
  501    H    GLY  82           H        GLY  82   9.346  -2.258   1.397
  502    HA2  GLY  82           HA2      GLY  82  11.119  -3.722   0.892
  503    HA3  GLY  82           HA3      GLY  82  10.608  -3.726  -0.789
  504    HA1  GLY  82           HA1      GLY  82  11.013  -2.874   1.117
  505    H    THR  83           H        THR  83  10.444  -0.670  -0.530
  506    HA   THR  83           HA       THR  83  13.330  -0.188  -0.889
  507    HB   THR  83           HB       THR  83  12.438   1.807  -2.318
  508    HG1  THR  83           HG1      THR  83  10.218   1.436  -1.817
  509   HG21  THR  83          HG21      THR  83  11.934  -0.301  -4.096
  510   HG22  THR  83          HG22      THR  83  13.091  -0.931  -2.924
  511   HG23  THR  83          HG23      THR  83  13.465   0.533  -3.832
  512    H    LEU  84           H        LEU  84  13.837   2.251  -0.689
  513    HA   LEU  84           HA       LEU  84  12.285   3.477   1.478
  514    HB2  LEU  84           HB1      LEU  84  14.878   2.311   1.723
  515    HB3  LEU  84           HB2      LEU  84  15.026   4.067   1.904
  516    HG   LEU  84           HG       LEU  84  13.353   4.002   3.715
  517   HD11  LEU  84          HD11      LEU  84  13.128   1.229   2.812
  518   HD12  LEU  84          HD12      LEU  84  11.973   2.242   3.675
  519   HD13  LEU  84          HD13      LEU  84  13.253   1.415   4.562
  520   HD21  LEU  84          HD21      LEU  84  15.661   2.109   4.151
  521   HD22  LEU  84          HD22      LEU  84  14.796   3.019   5.389
  522   HD23  LEU  84          HD23      LEU  84  15.770   3.869   4.188
  523    H    CYS  85           H        CYS  85  12.822   5.786   1.794
  524    HA   CYS  85           HA       CYS  85  13.239   7.056  -0.800
  525    HB2  CYS  85           HB1      CYS  85  11.269   7.563   0.766
  526    HB3  CYS  85           HB2      CYS  85  12.438   8.440   1.755
  527    H    VAL  86           H        VAL  86  15.181   7.780  -1.330
  528    HA   VAL  86           HA       VAL  86  16.853   9.027   0.731
  529    HB   VAL  86           HB       VAL  86  17.967   7.075  -1.284
  530   HG11  VAL  86          HG11      VAL  86  19.723   7.398   0.845
  531   HG12  VAL  86          HG12      VAL  86  19.888   8.079  -0.774
  532   HG13  VAL  86          HG13      VAL  86  19.129   9.023   0.508
  533   HG21  VAL  86          HG21      VAL  86  17.388   6.680   1.649
  534   HG22  VAL  86          HG22      VAL  86  16.607   5.854   0.301
  535   HG23  VAL  86          HG23      VAL  86  18.313   5.566   0.641
  536    H    ASN  87           H        ASN  87  17.884  10.831   0.070
  537    HA   ASN  87           HA       ASN  87  18.399  12.630  -1.223
  538    HB2  ASN  87           HB1      ASN  87  19.603  10.429  -2.359
  539    HB3  ASN  87           HB2      ASN  87  18.737  11.138  -3.726
  540   HD21  ASN  87          HD21      ASN  87  21.500  11.017  -3.613
  541   HD22  ASN  87          HD22      ASN  87  22.127  12.623  -3.502
  542    H    ASP  88           H        ASP  88  15.636  11.922  -1.037
  543    HA   ASP  88           HA       ASP  88  13.626  12.545  -1.901
  544    HB2  ASP  88           HB1      ASP  88  15.453  14.490  -2.752
  545    HB3  ASP  88           HB2      ASP  88  14.534  14.061  -4.201
  546    HD2  ASP  88           HD       ASP  88  11.886  15.928  -3.138
  547    H    VAL  89           H        VAL  89  15.123  10.199  -2.934
  548    HA   VAL  89           HA       VAL  89  13.441   9.734  -5.275
  549    HB   VAL  89           HB       VAL  89  16.412   9.181  -5.293
  550   HG11  VAL  89          HG11      VAL  89  14.162   8.332  -7.024
  551   HG12  VAL  89          HG12      VAL  89  15.674   8.779  -7.817
  552   HG13  VAL  89          HG13      VAL  89  15.656   7.491  -6.612
  553   HG21  VAL  89          HG21      VAL  89  14.729  11.261  -6.661
  554   HG22  VAL  89          HG22      VAL  89  16.158  11.494  -5.654
  555   HG23  VAL  89          HG23      VAL  89  16.318  10.789  -7.264
  556    H    CYS  90           H        CYS  90  12.714   7.666  -5.451
  557    HA   CYS  90           HA       CYS  90  12.904   5.977  -3.183
  558    HB2  CYS  90           HB1      CYS  90  11.151   6.232  -5.268
  559    HB3  CYS  90           HB2      CYS  90  11.985   4.735  -5.689
  560    H    THR  91           H        THR  91  14.362   4.486  -2.685
  561    HA   THR  91           HA       THR  91  15.976   3.298  -4.840
  562    HB   THR  91           HB       THR  91  17.287   5.055  -3.652
  563    HG1  THR  91           HG1      THR  91  18.196   3.016  -4.545
  564   HG21  THR  91          HG21      THR  91  16.246   4.758  -1.429
  565   HG22  THR  91          HG22      THR  91  18.007   4.678  -1.365
  566   HG23  THR  91          HG23      THR  91  17.053   3.197  -1.282
  567    H    THR  92           H        THR  92  17.070   1.273  -4.167
  568    HA   THR  92           HA       THR  92  15.200  -0.465  -2.880
  569    HB   THR  92           HB       THR  92  17.032  -2.197  -3.205
  570    HG1  THR  92           HG1      THR  92  18.286  -0.357  -4.915
  571   HG21  THR  92          HG21      THR  92  16.872  -1.466  -5.897
  572   HG22  THR  92          HG22      THR  92  15.410  -0.816  -5.156
  573   HG23  THR  92          HG23      THR  92  15.779  -2.535  -5.020
  574    H    MET  93           H        MET  93  15.521  -1.715  -0.999
  575    HA   MET  93           HA       MET  93  16.530  -0.356   1.214
  576    HB2  MET  93           HB1      MET  93  15.374  -2.979   0.659
  577    HB3  MET  93           HB2      MET  93  16.564  -3.022   1.969
  578    HG2  MET  93           HG1      MET  93  14.984  -0.766   2.481
  579    HG3  MET  93           HG2      MET  93  13.866  -2.038   1.984
  580    HE1  MET  93           HE1      MET  93  15.059  -0.264   4.503
  581    HE2  MET  93           HE2      MET  93  13.786  -1.070   5.418
  582    HE3  MET  93           HE3      MET  93  15.470  -1.240   5.914
  583    H    GLU  94           H        GLU  94  18.059  -2.634  -0.955
  584    HA   GLU  94           HA       GLU  94  20.344  -3.136   0.671
  585    HB2  GLU  94           HB1      GLU  94  19.647  -3.591  -2.214
  586    HB3  GLU  94           HB2      GLU  94  21.313  -3.817  -1.659
  587    HG2  GLU  94           HG1      GLU  94  20.720  -5.568  -0.204
  588    HG3  GLU  94           HG2      GLU  94  18.998  -5.183  -0.330
  589    HE2  GLU  94           HE       GLU  94  18.702  -6.873  -3.367
  590    H    ASP  95           H        ASP  95  19.438  -0.631  -1.546
  591    HA   ASP  95           HA       ASP  95  22.081   0.363  -2.008
  592    HB2  ASP  95           HB1      ASP  95  19.343   1.071  -2.781
  593    HB3  ASP  95           HB2      ASP  95  20.377   2.479  -2.502
  594    HD2  ASP  95           HD       ASP  95  21.968   0.105  -5.223
  595    H    ALA  96           H        ALA  96  19.394   1.309   0.107
  596    HA   ALA  96           HA       ALA  96  20.661   3.555   1.251
  597    HB1  ALA  96           HB1      ALA  96  18.402   1.803   2.175
  598    HB2  ALA  96           HB2      ALA  96  18.970   3.185   3.111
  599    HB3  ALA  96           HB3      ALA  96  18.325   3.425   1.487
  600    H    THR  97           H        THR  97  21.311   3.737   3.549
  601    HA   THR  97           HA       THR  97  22.682   3.195   5.284
  602    HB   THR  97           HB       THR  97  21.883   0.325   4.776
  603    HG1  THR  97           HG1      THR  97  20.524   2.474   5.980
  604   HG21  THR  97          HG21      THR  97  22.159   0.371   7.368
  605   HG22  THR  97          HG22      THR  97  23.149   1.798   7.053
  606   HG23  THR  97          HG23      THR  97  23.588   0.244   6.342
  607    H    GLU  98           H        GLU  98  24.438   3.835   3.834
  608    HA   GLU  98           HA       GLU  98  26.181   1.549   3.190
  609    HB2  GLU  98           HB1      GLU  98  27.050   2.733   1.275
  610    HB3  GLU  98           HB2      GLU  98  25.288   2.635   1.147
  611    HG2  GLU  98           HG1      GLU  98  25.672   5.024   2.463
  612    HG3  GLU  98           HG2      GLU  98  27.018   4.964   1.315
  613    HE2  GLU  98           HE       GLU  98  24.778   5.009  -1.422
  614    H    ASN  99           H        ASN  99  28.511   2.714   2.655
  615    HA   ASN  99           HA       ASN  99  29.392   3.601   5.233
  616    HB2  ASN  99           HB1      ASN  99  30.660   2.850   2.653
  617    HB3  ASN  99           HB2      ASN  99  31.574   3.956   3.686
  618   HD21  ASN  99          HD21      ASN  99  32.990   1.961   3.543
  619   HD22  ASN  99          HD22      ASN  99  32.794   0.792   4.802
  620    H    LEU 100           H        LEU 100  28.447   5.589   5.644
  621    HA   LEU 100           HA       LEU 100  28.629   7.767   3.788
  622    HB2  LEU 100           HB1      LEU 100  27.344   7.212   6.322
  623    HB3  LEU 100           HB2      LEU 100  28.108   8.812   6.323
  624    HG   LEU 100           HG       LEU 100  26.804   8.977   3.993
  625   HD11  LEU 100          HD11      LEU 100  24.992   7.263   5.680
  626   HD12  LEU 100          HD12      LEU 100  25.898   6.669   4.288
  627   HD13  LEU 100          HD13      LEU 100  24.670   7.916   4.073
  628   HD21  LEU 100          HD21      LEU 100  25.075   9.433   6.341
  629   HD22  LEU 100          HD22      LEU 100  25.547  10.532   5.044
  630   HD23  LEU 100          HD23      LEU 100  26.660  10.207   6.375
  631    H    TYR 101           H        TYR 101  29.513   9.934   4.699
  632    HA   TYR 101           HA       TYR 101  31.325  11.196   5.236
  633    HB2  TYR 101           HB1      TYR 101  30.850  10.115   7.487
  634    HB3  TYR 101           HB2      TYR 101  32.133   8.965   7.103
  635    HD1  TYR 101           HD1      TYR 101  34.416   9.517   7.376
  636    HD2  TYR 101           HD2      TYR 101  31.458  12.561   7.671
  637    HE1  TYR 101           HE1      TYR 101  36.113  11.074   8.240
  638    HE2  TYR 101           HE2      TYR 101  33.146  14.126   8.535
  639    HH   TYR 101           HH       TYR 101  35.405  13.891   9.785
  640    H    PHE 102           H        PHE 102  32.477  11.211   3.369
  641    HA   PHE 102           HA       PHE 102  34.047   8.990   2.489
  642    HB2  PHE 102           HB1      PHE 102  33.433  11.720   1.537
  643    HB3  PHE 102           HB2      PHE 102  35.014  11.098   1.059
  644    HD1  PHE 102           HD1      PHE 102  31.602   9.608   1.350
  645    HD2  PHE 102           HD2      PHE 102  35.039  10.271  -1.072
  646    HE1  PHE 102           HE1      PHE 102  30.566   8.314  -0.468
  647    HE2  PHE 102           HE2      PHE 102  34.008   8.979  -2.894
  648    HZ   PHE 102           HZ       PHE 102  31.768   7.999  -2.594
  649    H    GLN 103           H        GLN 103  36.438   9.559   1.819
  650    HA   GLN 103           HA       GLN 103  38.585   9.811   2.526
  651    HB2  GLN 103           HB1      GLN 103  37.306  12.247   2.972
  652    HB3  GLN 103           HB2      GLN 103  38.161  11.912   4.487
  653    HG2  GLN 103           HG1      GLN 103  40.248  11.959   3.493
  654    HG3  GLN 103           HG2      GLN 103  39.591  11.641   1.882
  655   HE21  GLN 103          HE21      GLN 103  40.698  13.396   1.009
  656   HE22  GLN 103          HE22      GLN 103  40.197  15.026   1.289
  657    H    SER 104           H        SER 104  39.974  10.019   4.640
  658    HA   SER 104           HA       SER 104  38.677   8.875   6.972
  659    HB2  SER 104           HB1      SER 104  39.791   7.157   5.075
  660    HB3  SER 104           HB2      SER 104  41.034   7.294   6.331
  661    HG   SER 104           HG       SER 104  39.759   6.326   7.737
  662    H    LEU 105           H        LEU 105  41.951   9.264   5.602
  663    HA   LEU 105           HA       LEU 105  43.170   9.904   8.059
  664    HB2  LEU 105           HB1      LEU 105  43.915   9.846   5.229
  665    HB3  LEU 105           HB2      LEU 105  44.752  11.101   6.158
  666    HG   LEU 105           HG       LEU 105  44.928   8.740   7.684
  667   HD11  LEU 105          HD11      LEU 105  45.891   8.208   4.890
  668   HD12  LEU 105          HD12      LEU 105  44.317   7.656   5.461
  669   HD13  LEU 105          HD13      LEU 105  45.788   7.094   6.254
  670   HD21  LEU 105          HD21      LEU 105  47.012  10.026   5.925
  671   HD22  LEU 105          HD22      LEU 105  47.293   9.025   7.350
  672   HD23  LEU 105          HD23      LEU 105  46.545  10.614   7.521
  673    H    GLU 106           H        GLU 106  44.425  12.062   8.288
  674    HA   GLU 106           HA       GLU 106  43.103  14.406   7.280
  675    HB2  GLU 106           HB1      GLU 106  42.458  15.277   9.517
  676    HB3  GLU 106           HB2      GLU 106  41.517  13.865   9.013
  677    HG2  GLU 106           HG1      GLU 106  43.898  13.166  10.552
  678    HG3  GLU 106           HG2      GLU 106  42.753  14.187  11.435
  679    HE2  GLU 106           HE       GLU 106  40.310  11.671  11.414
  680    H    HIS 107           H        HIS 107  44.343  16.234   7.483
  681    HA   HIS 107           HA       HIS 107  46.919  15.900   8.877
  682    HB2  HIS 107           HB1      HIS 107  46.844  15.984   6.276
  683    HB3  HIS 107           HB2      HIS 107  46.567  17.712   6.507
  684    HD1  HIS 107           HD1      HIS 107  48.580  17.615   9.130
  685    HD2  HIS 107           HD2      HIS 107  49.390  16.652   5.170
  686    HE1  HIS 107           HE1      HIS 107  51.069  17.863   8.873
  687    HE2  HIS 107           HE2      HIS 107  51.565  17.275   6.453
  688    H    HIS 108           H        HIS 108  46.678  17.014  10.726
  689    HA   HIS 108           HA       HIS 108  45.894  19.842  10.498
  690    HB2  HIS 108           HB1      HIS 108  45.077  17.866  12.640
  691    HB3  HIS 108           HB2      HIS 108  44.877  19.614  12.796
  692    HD1  HIS 108           HD1      HIS 108  42.628  20.409  12.182
  693    HD2  HIS 108           HD2      HIS 108  43.663  16.972  10.090
  694    HE1  HIS 108           HE1      HIS 108  40.622  19.851  10.772
  695    HE2  HIS 108           HE2      HIS 108  41.254  17.750   9.492
  696    H    HIS 109           H        HIS 109  47.442  21.163  11.167
  697    HA   HIS 109           HA       HIS 109  49.486  20.114  13.007
  698    HB2  HIS 109           HB1      HIS 109  49.764  21.322  10.503
  699    HB3  HIS 109           HB2      HIS 109  50.206  22.584  11.658
  700    HD1  HIS 109           HD1      HIS 109  51.323  19.246  10.399
  701    HD2  HIS 109           HD2      HIS 109  52.570  22.154  13.090
  702    HE1  HIS 109           HE1      HIS 109  53.684  18.629  11.009
  703    HE2  HIS 109           HE2      HIS 109  54.447  20.407  12.653
  704    H    HIS 110           H        HIS 110  47.829  23.151  12.148
  705    HA   HIS 110           HA       HIS 110  47.155  24.925  13.403
  706    HB2  HIS 110           HB1      HIS 110  46.090  22.921  14.657
  707    HB3  HIS 110           HB2      HIS 110  47.350  23.206  15.863
  708    HD1  HIS 110           HD1      HIS 110  47.032  25.115  17.478
  709    HD2  HIS 110           HD2      HIS 110  44.232  25.115  14.408
  710    HE1  HIS 110           HE1      HIS 110  45.330  26.851  18.120
  711    HE2  HIS 110           HE2      HIS 110  43.617  26.852  16.244
  712    H    HIS 111           H        HIS 111  49.979  24.477  12.958
  713    HA   HIS 111           HA       HIS 111  50.995  26.314  14.948
  714    HB2  HIS 111           HB1      HIS 111  51.619  23.465  15.005
  715    HB3  HIS 111           HB2      HIS 111  53.068  24.465  14.867
  716    HD1  HIS 111           HD1      HIS 111  50.177  23.818  17.183
  717    HD2  HIS 111           HD2      HIS 111  53.783  25.880  17.136
  718    HE1  HIS 111           HE1      HIS 111  50.566  24.546  19.558
  719    HE2  HIS 111           HE2      HIS 111  52.771  25.806  19.530
  720    H    HIS 112           H        HIS 112  52.154  24.094  12.404
  721    HA   HIS 112           HA       HIS 112  53.389  24.447  10.526
  722    HB2  HIS 112           HB1      HIS 112  51.504  26.254  10.315
  723    HB3  HIS 112           HB2      HIS 112  52.816  27.387  10.659
  724    HD1  HIS 112           HD1      HIS 112  54.595  27.759   8.845
  725    HD2  HIS 112           HD2      HIS 112  51.682  24.991   7.792
  726    HE1  HIS 112           HE1      HIS 112  54.897  27.370   6.378
  727    HE2  HIS 112           HE2      HIS 112  53.116  25.679   5.734
  Start of MODEL   53
    1    H1   MET  18           H        MET  18 -73.086  21.545  19.995
    2    HA   MET  18           HA       MET  18 -74.502  20.220  22.186
    3    HB2  MET  18           HB1      MET  18 -75.439  20.389  19.458
    4    HB3  MET  18           HB2      MET  18 -75.114  18.706  19.898
    5    HG2  MET  18           HG1      MET  18 -76.568  18.919  21.857
    6    HG3  MET  18           HG2      MET  18 -76.885  20.600  21.425
    7    HE1  MET  18           HE1      MET  18 -79.173  17.165  20.742
    8    HE2  MET  18           HE2      MET  18 -78.495  18.099  22.076
    9    HE3  MET  18           HE3      MET  18 -79.965  18.650  21.269
   10    H    LEU  19           H        LEU  19 -73.826  18.086  22.594
   11    HA   LEU  19           HA       LEU  19 -72.334  16.377  22.750
   12    HB2  LEU  19           HB1      LEU  19 -71.492  17.057  19.934
   13    HB3  LEU  19           HB2      LEU  19 -71.370  15.498  20.765
   14    HG   LEU  19           HG       LEU  19 -74.119  16.323  20.646
   15   HD11  LEU  19          HD11      LEU  19 -72.506  16.753  18.216
   16   HD12  LEU  19          HD12      LEU  19 -74.046  17.464  18.703
   17   HD13  LEU  19          HD13      LEU  19 -74.004  15.843  18.006
   18   HD21  LEU  19          HD21      LEU  19 -72.526  14.032  19.511
   19   HD22  LEU  19          HD22      LEU  19 -74.282  14.151  19.403
   20   HD23  LEU  19          HD23      LEU  19 -73.501  14.048  20.981
   21    H    VAL  20           H        VAL  20 -69.967  15.860  22.720
   22    HA   VAL  20           HA       VAL  20 -68.494  18.183  23.601
   23    HB   VAL  20           HB       VAL  20 -66.713  16.574  24.179
   24   HG11  VAL  20          HG11      VAL  20 -68.115  16.877  25.973
   25   HG12  VAL  20          HG12      VAL  20 -69.514  16.207  25.132
   26   HG13  VAL  20          HG13      VAL  20 -68.251  15.135  25.738
   27   HG21  VAL  20          HG21      VAL  20 -66.585  14.558  23.255
   28   HG22  VAL  20          HG22      VAL  20 -68.200  14.146  23.831
   29   HG23  VAL  20          HG23      VAL  20 -67.998  14.957  22.277
   30    H    LEU  21           H        LEU  21 -66.612  18.999  22.706
   31    HA   LEU  21           HA       LEU  21 -66.369  18.705  19.859
   32    HB2  LEU  21           HB1      LEU  21 -64.507  20.358  20.125
   33    HB3  LEU  21           HB2      LEU  21 -66.084  20.887  20.736
   34    HG   LEU  21           HG       LEU  21 -64.346  19.654  22.759
   35   HD11  LEU  21          HD11      LEU  21 -63.119  21.922  22.938
   36   HD12  LEU  21          HD12      LEU  21 -63.507  22.082  21.226
   37   HD13  LEU  21          HD13      LEU  21 -62.536  20.721  21.786
   38   HD21  LEU  21          HD21      LEU  21 -66.146  20.625  23.741
   39   HD22  LEU  21          HD22      LEU  21 -66.304  21.861  22.493
   40   HD23  LEU  21          HD23      LEU  21 -65.071  22.022  23.744
   41    H    ASP  22           H        ASP  22 -64.488  18.061  18.719
   42    HA   ASP  22           HA       ASP  22 -62.420  16.640  20.200
   43    HB2  ASP  22           HB1      ASP  22 -64.595  15.303  18.890
   44    HB3  ASP  22           HB2      ASP  22 -63.092  14.942  18.029
   45    HD2  ASP  22           HD       ASP  22 -61.885  13.004  20.613
   46    H    PHE  23           H        PHE  23 -60.472  16.498  19.125
   47    HA   PHE  23           HA       PHE  23 -60.347  17.519  16.381
   48    HB2  PHE  23           HB1      PHE  23 -59.746  19.131  18.530
   49    HB3  PHE  23           HB2      PHE  23 -58.164  18.484  18.092
   50    HD1  PHE  23           HD1      PHE  23 -56.915  19.634  16.554
   51    HD2  PHE  23           HD2      PHE  23 -61.158  19.949  16.412
   52    HE1  PHE  23           HE1      PHE  23 -56.729  21.263  14.719
   53    HE2  PHE  23           HE2      PHE  23 -60.979  21.578  14.577
   54    HZ   PHE  23           HZ       PHE  23 -58.763  22.236  13.728
   55    H    ASN  24           H        ASN  24 -58.473  16.901  15.216
   56    HA   ASN  24           HA       ASN  24 -56.531  15.155  16.441
   57    HB2  ASN  24           HB1      ASN  24 -58.850  13.973  15.468
   58    HB3  ASN  24           HB2      ASN  24 -57.690  13.769  14.151
   59   HD21  ASN  24          HD21      ASN  24 -56.310  12.142  14.260
   60   HD22  ASN  24          HD22      ASN  24 -55.973  11.199  15.668
   61    H    ASN  25           H        ASN  25 -54.645  15.072  15.306
   62    HA   ASN  25           HA       ASN  25 -54.575  15.937  12.532
   63    HB2  ASN  25           HB1      ASN  25 -52.904  17.683  12.930
   64    HB3  ASN  25           HB2      ASN  25 -54.412  18.046  13.780
   65   HD21  ASN  25          HD21      ASN  25 -51.223  18.232  14.106
   66   HD22  ASN  25          HD22      ASN  25 -51.062  18.063  15.818
   67    H    ILE  26           H        ILE  26 -52.499  15.561  11.515
   68    HA   ILE  26           HA       ILE  26 -50.371  14.266  12.873
   69    HB   ILE  26           HB       ILE  26 -52.037  12.422  12.896
   70   HG12  ILE  26          HG11      ILE  26 -50.510  10.734  11.711
   71   HG13  ILE  26          HG12      ILE  26 -49.500  12.129  11.296
   72   HG21  ILE  26          HG21      ILE  26 -52.638  11.313  10.814
   73   HG22  ILE  26          HG22      ILE  26 -53.189  12.988  10.814
   74   HG23  ILE  26          HG23      ILE  26 -51.753  12.532   9.896
   75   HD11  ILE  26          HD11      ILE  26 -50.265  11.546  14.132
   76   HD12  ILE  26          HD12      ILE  26 -48.858  10.806  13.367
   77   HD13  ILE  26          HD13      ILE  26 -48.956  12.560  13.525
   78    H    ARG  27           H        ARG  27 -48.550  14.301  11.661
   79    HA   ARG  27           HA       ARG  27 -48.766  14.580   8.760
   80    HB2  ARG  27           HB1      ARG  27 -47.028  16.451   8.901
   81    HB3  ARG  27           HB2      ARG  27 -48.697  16.860   9.325
   82    HG2  ARG  27           HG1      ARG  27 -48.234  17.060  11.583
   83    HG3  ARG  27           HG2      ARG  27 -46.775  16.060  11.465
   84    HD2  ARG  27           HD1      ARG  27 -45.660  18.009  11.496
   85    HD3  ARG  27           HD2      ARG  27 -46.154  18.128   9.802
   86    HE   ARG  27           HE       ARG  27 -47.542  19.851  10.368
   87   HH11  ARG  27          HH11      ARG  27 -46.710  18.081  13.250
   88   HH12  ARG  27          HH12      ARG  27 -47.475  19.209  14.319
   89   HH21  ARG  27          HH21      ARG  27 -48.552  21.343  11.767
   90   HH22  ARG  27          HH22      ARG  27 -48.522  21.063  13.476
   91    H    SER  28           H        SER  28 -47.263  13.426   7.727
   92    HA   SER  28           HA       SER  28 -44.676  12.919   8.940
   93    HB2  SER  28           HB1      SER  28 -44.872  10.684   9.333
   94    HB3  SER  28           HB2      SER  28 -46.589  11.094   9.507
   95    HG   SER  28           HG       SER  28 -46.511   9.430   8.070
   96    H    SER  29           H        SER  29 -43.586  11.119   7.333
   97    HA   SER  29           HA       SER  29 -42.585  10.869   5.304
   98    HB2  SER  29           HB1      SER  29 -45.483  11.138   4.704
   99    HB3  SER  29           HB2      SER  29 -44.374  11.336   3.336
  100    HG   SER  29           HG       SER  29 -44.451   9.115   5.104
  101    H    ALA  30           H        ALA  30 -41.213  12.674   5.601
  102    HA   ALA  30           HA       ALA  30 -42.019  15.098   4.135
  103    HB1  ALA  30           HB1      ALA  30 -41.017  16.373   5.682
  104    HB2  ALA  30           HB2      ALA  30 -41.131  14.938   6.702
  105    HB3  ALA  30           HB3      ALA  30 -39.637  15.285   5.831
  106    H    ASP  31           H        ASP  31 -40.021  16.296   3.229
  107    HA   ASP  31           HA       ASP  31 -38.662  14.427   1.474
  108    HB2  ASP  31           HB1      ASP  31 -39.758  16.739   0.869
  109    HB3  ASP  31           HB2      ASP  31 -38.201  17.387   1.406
  110    HD2  ASP  31           HD       ASP  31 -37.723  14.868  -1.597
  111    H    LEU  32           H        LEU  32 -36.482  14.071   1.380
  112    HA   LEU  32           HA       LEU  32 -34.794  15.425   3.368
  113    HB2  LEU  32           HB1      LEU  32 -35.370  12.532   3.081
  114    HB3  LEU  32           HB2      LEU  32 -33.683  12.984   3.383
  115    HG   LEU  32           HG       LEU  32 -35.679  14.202   5.185
  116   HD11  LEU  32          HD11      LEU  32 -35.357  11.889   6.498
  117   HD12  LEU  32          HD12      LEU  32 -35.405  11.283   4.843
  118   HD13  LEU  32          HD13      LEU  32 -36.749  12.235   5.472
  119   HD21  LEU  32          HD21      LEU  32 -33.361  14.630   5.561
  120   HD22  LEU  32          HD22      LEU  32 -32.974  12.910   5.494
  121   HD23  LEU  32          HD23      LEU  32 -33.919  13.550   6.839
  122    H    HIS  33           H        HIS  33 -32.768  15.927   2.699
  123    HA   HIS  33           HA       HIS  33 -31.573  14.671   0.398
  124    HB2  HIS  33           HB1      HIS  33 -31.467  16.566  -1.038
  125    HB3  HIS  33           HB2      HIS  33 -33.159  16.386  -0.560
  126    HD1  HIS  33           HD1      HIS  33 -34.095  18.124   1.190
  127    HD2  HIS  33           HD2      HIS  33 -30.306  18.968  -0.290
  128    HE1  HIS  33           HE1      HIS  33 -33.658  20.526   1.792
  129    HE2  HIS  33           HE2      HIS  33 -31.342  21.043   0.889
  130    H    GLY  34           H        GLY  34 -29.509  16.123  -0.213
  131    HA2  GLY  34           HA2      GLY  34 -28.331  17.416   2.099
  132    HA3  GLY  34           HA3      GLY  34 -27.618  15.864   1.682
  133    HA1  GLY  34           HA1      GLY  34 -28.671  17.677   1.327
  134    H    ALA  35           H        ALA  35 -25.707  16.280   0.781
  135    HA   ALA  35           HA       ALA  35 -25.652  18.001  -1.585
  136    HB1  ALA  35           HB1      ALA  35 -23.236  18.596  -0.458
  137    HB2  ALA  35           HB2      ALA  35 -24.667  19.626  -0.403
  138    HB3  ALA  35           HB3      ALA  35 -24.301  18.553   0.948
  139    H    ARG  36           H        ARG  36 -23.618  15.920   0.481
  140    HA   ARG  36           HA       ARG  36 -22.080  14.318  -0.019
  141    HB2  ARG  36           HB1      ARG  36 -24.408  13.654  -1.289
  142    HB3  ARG  36           HB2      ARG  36 -23.252  13.637  -2.630
  143    HG2  ARG  36           HG1      ARG  36 -21.825  12.226  -0.878
  144    HG3  ARG  36           HG2      ARG  36 -23.450  11.854  -0.277
  145    HD2  ARG  36           HD1      ARG  36 -24.126  11.090  -2.502
  146    HD3  ARG  36           HD2      ARG  36 -22.519  11.494  -3.123
  147    HE   ARG  36           HE       ARG  36 -21.751   9.518  -2.283
  148   HH11  ARG  36          HH11      ARG  36 -24.723  10.337  -0.666
  149   HH12  ARG  36          HH12      ARG  36 -24.814   8.841   0.204
  150   HH21  ARG  36          HH21      ARG  36 -21.860   7.544  -1.144
  151   HH22  ARG  36          HH22      ARG  36 -23.184   7.254  -0.068
  152    H    LYS  37           H        LYS  37 -20.858  13.390  -2.217
  153    HA   LYS  37           HA       LYS  37 -20.161  15.295  -4.171
  154    HB2  LYS  37           HB1      LYS  37 -18.910  15.671  -1.630
  155    HB3  LYS  37           HB2      LYS  37 -17.682  15.121  -2.782
  156    HG2  LYS  37           HG1      LYS  37 -19.107  17.043  -4.192
  157    HG3  LYS  37           HG2      LYS  37 -18.975  17.697  -2.550
  158    HD2  LYS  37           HD1      LYS  37 -16.520  17.233  -2.620
  159    HD3  LYS  37           HD2      LYS  37 -16.714  16.770  -4.319
  160    HE2  LYS  37           HE1      LYS  37 -16.555  18.904  -4.936
  161    HE3  LYS  37           HE2      LYS  37 -17.981  19.284  -3.958
  162    HZ1  LYS  37           HZ1      LYS  37 -16.334  20.645  -3.096
  163    HZ2  LYS  37           HZ2      LYS  37 -15.134  19.458  -3.199
  164    HZ3  LYS  37           HZ3      LYS  37 -16.338  19.342  -2.016
  165    H    GLY  38           H        GLY  38 -18.343  12.937  -2.191
  166    HA2  GLY  38           HA2      GLY  38 -17.896  10.703  -2.922
  167    HA3  GLY  38           HA3      GLY  38 -18.107  11.240  -4.582
  168    HA1  GLY  38           HA1      GLY  38 -17.494  11.394  -2.552
  169    H    SER  39           H        SER  39 -15.885  10.526  -2.156
  170    HA   SER  39           HA       SER  39 -13.735  12.059  -3.424
  171    HB2  SER  39           HB1      SER  39 -12.490  11.808  -1.470
  172    HB3  SER  39           HB2      SER  39 -14.149  11.901  -0.850
  173    HG   SER  39           HG       SER  39 -12.507  10.033  -0.298
  174    H    GLN  40           H        GLN  40 -11.540  10.588  -3.043
  175    HA   GLN  40           HA       GLN  40 -12.036   8.180  -4.661
  176    HB2  GLN  40           HB1      GLN  40 -10.184  10.376  -4.944
  177    HB3  GLN  40           HB2      GLN  40  -9.311   8.841  -4.821
  178    HG2  GLN  40           HG1      GLN  40  -9.654   9.171  -7.115
  179    HG3  GLN  40           HG2      GLN  40 -10.852   7.965  -6.622
  180   HE21  GLN  40          HE21      GLN  40 -12.346   8.354  -8.177
  181   HE22  GLN  40          HE22      GLN  40 -13.222   9.835  -8.323
  182    H    CYS  41           H        CYS  41  -9.954   9.505  -2.107
  183    HA   CYS  41           HA       CYS  41 -10.023   7.056  -0.640
  184    HB2  CYS  41           HB1      CYS  41  -7.505   6.744  -0.687
  185    HB3  CYS  41           HB2      CYS  41  -8.375   6.260  -2.144
  186    H    LEU  42           H        LEU  42  -9.055   7.237   1.441
  187    HA   LEU  42           HA       LEU  42  -8.664  10.028   2.261
  188    HB2  LEU  42           HB1      LEU  42  -9.751   7.590   3.576
  189    HB3  LEU  42           HB2      LEU  42  -8.914   8.775   4.596
  190    HG   LEU  42           HG       LEU  42 -10.984   9.876   2.807
  191   HD11  LEU  42          HD11      LEU  42 -12.477   8.278   3.328
  192   HD12  LEU  42          HD12      LEU  42 -12.565   9.134   4.867
  193   HD13  LEU  42          HD13      LEU  42 -11.543   7.705   4.710
  194   HD21  LEU  42          HD21      LEU  42 -11.180  10.443   5.630
  195   HD22  LEU  42          HD22      LEU  42 -10.877  11.538   4.280
  196   HD23  LEU  42          HD23      LEU  42  -9.534  10.683   5.043
  197    H    SER  43           H        SER  43  -7.117   6.932   2.091
  198    HA   SER  43           HA       SER  43  -4.584   8.119   2.799
  199    HB2  SER  43           HB1      SER  43  -4.336   5.963   4.421
  200    HB3  SER  43           HB2      SER  43  -4.820   7.569   4.994
  201    HG   SER  43           HG       SER  43  -6.547   6.579   5.660
  202    H    ASP  44           H        ASP  44  -2.851   6.259   2.817
  203    HA   ASP  44           HA       ASP  44  -2.801   5.142   0.259
  204    HB2  ASP  44           HB1      ASP  44  -0.835   3.876   1.024
  205    HB3  ASP  44           HB2      ASP  44  -0.767   5.564   1.549
  206    HD2  ASP  44           HD       ASP  44  -1.035   2.741   4.292
  207    H    THR  45           H        THR  45  -3.588   3.661   3.382
  208    HA   THR  45           HA       THR  45  -3.899   1.027   2.518
  209    HB   THR  45           HB       THR  45  -3.863   1.744   4.905
  210    HG1  THR  45           HG1      THR  45  -4.584  -0.264   4.896
  211   HG21  THR  45          HG21      THR  45  -5.605   3.603   4.417
  212   HG22  THR  45          HG22      THR  45  -5.678   2.750   5.959
  213   HG23  THR  45          HG23      THR  45  -6.794   2.325   4.661
  214    H    ASP  46           H        ASP  46  -5.934   3.791   2.091
  215    HA   ASP  46           HA       ASP  46  -8.376   2.433   1.603
  216    HB2  ASP  46           HB1      ASP  46  -7.766   5.013   1.997
  217    HB3  ASP  46           HB2      ASP  46  -7.834   5.015   0.230
  218    HD2  ASP  46           HD       ASP  46 -11.174   5.649   1.492
  219    H    CYS  47           H        CYS  47  -5.590   3.161  -0.355
  220    HA   CYS  47           HA       CYS  47  -6.967   2.109  -2.732
  221    HB2  CYS  47           HB1      CYS  47  -5.616   4.418  -2.556
  222    HB3  CYS  47           HB2      CYS  47  -4.273   3.346  -2.959
  223    H    ASN  48           H        ASN  48  -6.387   0.156  -1.020
  224    HA   ASN  48           HA       ASN  48  -5.360  -1.865  -0.846
  225    HB2  ASN  48           HB1      ASN  48  -5.339  -1.264  -3.548
  226    HB3  ASN  48           HB2      ASN  48  -3.648  -1.655  -3.209
  227   HD21  ASN  48          HD21      ASN  48  -6.750  -2.886  -3.745
  228   HD22  ASN  48          HD22      ASN  48  -6.408  -4.552  -3.440
  229    H    THR  49           H        THR  49  -2.867  -2.802  -1.376
  230    HA   THR  49           HA       THR  49  -1.234  -1.138   0.386
  231    HB   THR  49           HB       THR  49   0.038  -3.041   0.898
  232    HG1  THR  49           HG1      THR  49  -1.139  -4.550  -1.190
  233   HG21  THR  49          HG21      THR  49  -2.520  -3.072   1.480
  234   HG22  THR  49          HG22      THR  49  -1.516  -4.487   1.798
  235   HG23  THR  49          HG23      THR  49  -2.547  -4.440   0.368
  236    H    ARG  50           H        ARG  50  -1.321  -2.388  -2.873
  237    HA   ARG  50           HA       ARG  50   1.394  -1.687  -3.492
  238    HB2  ARG  50           HB1      ARG  50  -0.807  -2.163  -5.496
  239    HB3  ARG  50           HB2      ARG  50   0.932  -2.430  -5.690
  240    HG2  ARG  50           HG1      ARG  50  -0.854  -4.012  -3.838
  241    HG3  ARG  50           HG2      ARG  50  -0.349  -4.523  -5.458
  242    HD2  ARG  50           HD1      ARG  50   1.985  -3.742  -4.017
  243    HD3  ARG  50           HD2      ARG  50   1.032  -4.825  -2.992
  244    HE   ARG  50           HE       ARG  50   2.509  -5.547  -5.310
  245   HH11  ARG  50          HH11      ARG  50  -0.380  -6.291  -3.517
  246   HH12  ARG  50          HH12      ARG  50  -0.454  -7.933  -4.064
  247   HH21  ARG  50          HH21      ARG  50   2.424  -7.707  -6.037
  248   HH22  ARG  50          HH22      ARG  50   1.142  -8.738  -5.497
  249    H    LYS  51           H        LYS  51  -1.674  -0.090  -3.535
  250    HA   LYS  51           HA       LYS  51  -0.458   2.214  -4.912
  251    HB2  LYS  51           HB1      LYS  51  -3.146   0.986  -5.041
  252    HB3  LYS  51           HB2      LYS  51  -3.113   2.756  -4.999
  253    HG2  LYS  51           HG1      LYS  51  -2.081   2.940  -7.039
  254    HG3  LYS  51           HG2      LYS  51  -1.328   1.340  -6.914
  255    HD2  LYS  51           HD1      LYS  51  -4.259   1.257  -6.939
  256    HD3  LYS  51           HD2      LYS  51  -3.545   1.938  -8.411
  257    HE2  LYS  51           HE1      LYS  51  -2.429  -0.019  -8.952
  258    HE3  LYS  51           HE2      LYS  51  -2.430  -0.589  -7.276
  259    HZ1  LYS  51           HZ1      LYS  51  -3.992  -1.736  -8.883
  260    HZ2  LYS  51           HZ2      LYS  51  -4.934  -0.332  -8.830
  261    HZ3  LYS  51           HZ3      LYS  51  -4.663  -1.221  -7.417
  262    H    PHE  52           H        PHE  52  -0.859   4.302  -4.088
  263    HA   PHE  52           HA       PHE  52  -1.829   4.360  -1.306
  264    HB2  PHE  52           HB1      PHE  52  -0.153   6.150  -0.871
  265    HB3  PHE  52           HB2      PHE  52   0.571   4.586  -1.252
  266    HD1  PHE  52           HD1      PHE  52   1.648   4.189  -3.419
  267    HD2  PHE  52           HD2      PHE  52   0.151   8.024  -2.335
  268    HE1  PHE  52           HE1      PHE  52   2.975   5.213  -5.220
  269    HE2  PHE  52           HE2      PHE  52   1.475   9.052  -4.137
  270    HZ   PHE  52           HZ       PHE  52   2.888   7.646  -5.582
  271    H    CYS  53           H        CYS  53  -2.208   6.769  -0.638
  272    HA   CYS  53           HA       CYS  53  -3.812   8.001  -2.778
  273    HB2  CYS  53           HB1      CYS  53  -4.967   7.122  -0.682
  274    HB3  CYS  53           HB2      CYS  53  -4.172   8.437   0.186
  275    H    LEU  54           H        LEU  54  -3.046   9.826  -3.589
  276    HA   LEU  54           HA       LEU  54  -1.144  11.399  -2.000
  277    HB2  LEU  54           HB1      LEU  54  -0.323  10.627  -4.156
  278    HB3  LEU  54           HB2      LEU  54  -1.702  11.391  -4.962
  279    HG   LEU  54           HG       LEU  54  -0.724  13.578  -3.883
  280   HD11  LEU  54          HD11      LEU  54   1.662  11.740  -3.988
  281   HD12  LEU  54          HD12      LEU  54   1.007  12.560  -2.569
  282   HD13  LEU  54          HD13      LEU  54   1.754  13.498  -3.862
  283   HD21  LEU  54          HD21      LEU  54   0.468  12.203  -6.288
  284   HD22  LEU  54          HD22      LEU  54   0.606  13.924  -5.927
  285   HD23  LEU  54          HD23      LEU  54  -0.975  13.218  -6.264
  286    H    GLN  55           H        GLN  55  -1.693  13.332  -1.229
  287    HA   GLN  55           HA       GLN  55  -4.155  14.583  -2.253
  288    HB2  GLN  55           HB1      GLN  55  -4.209  15.714   0.028
  289    HB3  GLN  55           HB2      GLN  55  -4.565  13.979  -0.010
  290    HG2  GLN  55           HG1      GLN  55  -2.659  13.402   1.090
  291    HG3  GLN  55           HG2      GLN  55  -1.755  14.786   0.461
  292   HE21  GLN  55          HE21      GLN  55  -4.601  14.183   2.498
  293   HE22  GLN  55          HE22      GLN  55  -4.196  15.352   3.705
  294    HA   PRO  56           HA       PRO  56  -0.828  17.498  -3.446
  295    HB2  PRO  56           HB1      PRO  56  -2.133  18.406  -5.676
  296    HB3  PRO  56           HB2      PRO  56  -1.157  16.937  -5.649
  297    HG2  PRO  56           HG1      PRO  56  -4.129  17.253  -5.381
  298    HG3  PRO  56           HG2      PRO  56  -3.191  16.077  -6.377
  299    HD2  PRO  56           HD1      PRO  56  -4.330  15.408  -4.005
  300    HD3  PRO  56           HD2      PRO  56  -2.805  14.704  -4.567
  301    H    ARG  57           H        ARG  57  -0.731  19.717  -3.205
  302    HA   ARG  57           HA       ARG  57  -2.950  20.922  -1.798
  303    HB2  ARG  57           HB1      ARG  57  -1.435  22.802  -1.418
  304    HB3  ARG  57           HB2      ARG  57  -0.659  21.267  -1.003
  305    HG2  ARG  57           HG1      ARG  57   0.706  21.298  -2.924
  306    HG3  ARG  57           HG2      ARG  57  -0.255  22.587  -3.666
  307    HD2  ARG  57           HD1      ARG  57   0.448  23.941  -1.525
  308    HD3  ARG  57           HD2      ARG  57   1.755  22.749  -1.466
  309    HE   ARG  57           HE       ARG  57   1.436  23.991  -4.041
  310   HH11  ARG  57          HH11      ARG  57   2.924  24.230  -0.903
  311   HH12  ARG  57          HH12      ARG  57   4.215  25.248  -1.449
  312   HH21  ARG  57          HH21      ARG  57   3.130  25.332  -4.772
  313   HH22  ARG  57          HH22      ARG  57   4.331  25.876  -3.649
  314    H    ASP  58           H        ASP  58  -1.566  21.002  -4.971
  315    HA   ASP  58           HA       ASP  58  -3.013  23.417  -5.715
  316    HB2  ASP  58           HB1      ASP  58  -0.614  22.441  -6.530
  317    HB3  ASP  58           HB2      ASP  58  -1.666  21.828  -7.812
  318    HD2  ASP  58           HD       ASP  58  -1.748  24.895  -9.301
  319    H    GLU  59           H        GLU  59  -3.345  19.990  -5.876
  320    HA   GLU  59           HA       GLU  59  -5.754  20.322  -7.540
  321    HB2  GLU  59           HB1      GLU  59  -3.676  18.140  -7.559
  322    HB3  GLU  59           HB2      GLU  59  -5.309  17.870  -8.187
  323    HG2  GLU  59           HG1      GLU  59  -4.918  19.901  -9.671
  324    HG3  GLU  59           HG2      GLU  59  -3.216  19.758  -9.210
  325    HE2  GLU  59           HE       GLU  59  -4.631  16.673 -11.283
  326    H    LYS  60           H        LYS  60  -7.058  18.070  -7.282
  327    HA   LYS  60           HA       LYS  60  -7.818  18.036  -4.487
  328    HB2  LYS  60           HB1      LYS  60  -9.006  17.140  -7.056
  329    HB3  LYS  60           HB2      LYS  60  -9.468  16.228  -5.611
  330    HG2  LYS  60           HG1      LYS  60 -10.078  18.435  -4.543
  331    HG3  LYS  60           HG2      LYS  60  -9.874  19.156  -6.148
  332    HD2  LYS  60           HD1      LYS  60 -12.068  18.685  -6.383
  333    HD3  LYS  60           HD2      LYS  60 -11.476  17.055  -6.747
  334    HE2  LYS  60           HE1      LYS  60 -11.779  17.599  -3.874
  335    HE3  LYS  60           HE2      LYS  60 -13.287  17.673  -4.796
  336    HZ1  LYS  60           HZ1      LYS  60 -12.917  15.449  -3.998
  337    HZ2  LYS  60           HZ2      LYS  60 -11.391  15.388  -4.726
  338    HZ3  LYS  60           HZ3      LYS  60 -12.782  15.458  -5.686
  339    HA   PRO  61           HA       PRO  61  -5.909  14.277  -3.272
  340    HB2  PRO  61           HB1      PRO  61  -7.837  13.106  -1.719
  341    HB3  PRO  61           HB2      PRO  61  -6.923  14.531  -1.225
  342    HG2  PRO  61           HG1      PRO  61  -9.653  14.353  -2.453
  343    HG3  PRO  61           HG2      PRO  61  -9.094  15.346  -1.056
  344    HD2  PRO  61           HD1      PRO  61  -9.437  16.379  -3.543
  345    HD3  PRO  61           HD2      PRO  61  -8.176  16.948  -2.435
  346    H    PHE  62           H        PHE  62  -5.501  12.503  -4.417
  347    HA   PHE  62           HA       PHE  62  -7.681  10.771  -5.264
  348    HB2  PHE  62           HB1      PHE  62  -6.679  10.622  -7.588
  349    HB3  PHE  62           HB2      PHE  62  -7.530  12.121  -7.213
  350    HD1  PHE  62           HD1      PHE  62  -6.543  14.109  -7.784
  351    HD2  PHE  62           HD2      PHE  62  -4.075  10.727  -7.022
  352    HE1  PHE  62           HE1      PHE  62  -4.557  15.424  -8.402
  353    HE2  PHE  62           HE2      PHE  62  -2.084  12.036  -7.638
  354    HZ   PHE  62           HZ       PHE  62  -2.324  14.388  -8.328
  355    H    CYS  63           H        CYS  63  -6.565   8.853  -6.598
  356    HA   CYS  63           HA       CYS  63  -4.457   7.859  -4.827
  357    HB2  CYS  63           HB1      CYS  63  -6.464   6.476  -5.051
  358    HB3  CYS  63           HB2      CYS  63  -6.226   6.397  -6.798
  359    H    ALA  64           H        ALA  64  -2.433   7.493  -5.495
  360    HA   ALA  64           HA       ALA  64  -1.852   7.874  -8.359
  361    HB1  ALA  64           HB1      ALA  64  -0.701   9.030  -6.005
  362    HB2  ALA  64           HB2      ALA  64   0.530   8.129  -6.890
  363    HB3  ALA  64           HB3      ALA  64  -0.384   9.401  -7.700
  364    H    THR  65           H        THR  65  -0.860   6.297  -9.468
  365    HA   THR  65           HA       THR  65  -0.745   3.681  -8.557
  366    HB   THR  65           HB       THR  65   1.267   4.107 -10.584
  367    HG1  THR  65           HG1      THR  65   0.301   5.506 -11.855
  368   HG21  THR  65          HG21      THR  65  -0.377   2.760 -11.923
  369   HG22  THR  65          HG22      THR  65  -1.460   2.820 -10.533
  370   HG23  THR  65          HG23      THR  65   0.109   2.026 -10.395
  371    H    CYS  66           H        CYS  66   1.191   2.283  -8.362
  372    HA   CYS  66           HA       CYS  66   2.846   3.079  -6.276
  373    HB2  CYS  66           HB1      CYS  66   2.349   0.722  -6.974
  374    HB3  CYS  66           HB2      CYS  66   3.478   0.936  -8.313
  375    H    ARG  67           H        ARG  67   4.927   3.836  -6.130
  376    HA   ARG  67           HA       ARG  67   5.973   5.092  -8.560
  377    HB2  ARG  67           HB1      ARG  67   6.686   5.527  -5.650
  378    HB3  ARG  67           HB2      ARG  67   7.364   6.426  -7.014
  379    HG2  ARG  67           HG1      ARG  67   4.417   6.408  -6.843
  380    HG3  ARG  67           HG2      ARG  67   5.273   7.273  -5.554
  381    HD2  ARG  67           HD1      ARG  67   6.401   8.684  -7.130
  382    HD3  ARG  67           HD2      ARG  67   5.813   7.709  -8.484
  383    HE   ARG  67           HE       ARG  67   4.364   9.754  -7.062
  384   HH11  ARG  67          HH11      ARG  67   4.125   6.938  -9.098
  385   HH12  ARG  67          HH12      ARG  67   2.559   7.353  -9.710
  386   HH21  ARG  67          HH21      ARG  67   2.302  10.310  -7.861
  387   HH22  ARG  67          HH22      ARG  67   1.522   9.272  -9.007
  388    H    GLY  68           H        GLY  68   7.822   4.466  -9.505
  389    HA2  GLY  68           HA2      GLY  68   9.091   2.049  -8.616
  390    HA3  GLY  68           HA3      GLY  68   9.532   3.002 -10.026
  391    HA1  GLY  68           HA1      GLY  68   8.995   2.668  -7.995
  392    H    LEU  69           H        LEU  69  11.701   2.261  -9.120
  393    HA   LEU  69           HA       LEU  69  12.684   3.587  -6.782
  394    HB2  LEU  69           HB1      LEU  69  13.884   1.913  -8.955
  395    HB3  LEU  69           HB2      LEU  69  14.939   2.833  -7.870
  396    HG   LEU  69           HG       LEU  69  12.960   0.720  -7.019
  397   HD11  LEU  69          HD11      LEU  69  15.349  -0.229  -6.288
  398   HD12  LEU  69          HD12      LEU  69  15.828   0.669  -7.727
  399   HD13  LEU  69          HD13      LEU  69  14.604  -0.595  -7.844
  400   HD21  LEU  69          HD21      LEU  69  14.834   2.507  -5.501
  401   HD22  LEU  69          HD22      LEU  69  14.294   0.959  -4.849
  402   HD23  LEU  69          HD23      LEU  69  13.115   2.217  -5.226
  403    H    ARG  70           H        ARG  70  12.465   4.355 -10.148
  404    HA   ARG  70           HA       ARG  70  14.361   6.560  -9.907
  405    HB2  ARG  70           HB1      ARG  70  12.875   5.320 -12.218
  406    HB3  ARG  70           HB2      ARG  70  13.706   6.875 -12.377
  407    HG2  ARG  70           HG1      ARG  70  15.508   5.035 -11.164
  408    HG3  ARG  70           HG2      ARG  70  14.791   4.273 -12.593
  409    HD2  ARG  70           HD1      ARG  70  16.549   5.359 -13.583
  410    HD3  ARG  70           HD2      ARG  70  15.306   6.613 -13.690
  411    HE   ARG  70           HE       ARG  70  16.821   6.805 -11.276
  412   HH11  ARG  70          HH11      ARG  70  16.834   7.562 -14.675
  413   HH12  ARG  70          HH12      ARG  70  17.920   8.902 -14.506
  414   HH21  ARG  70          HH21      ARG  70  18.251   8.567 -11.041
  415   HH22  ARG  70          HH22      ARG  70  18.727   9.472 -12.439
  416    H    ARG  71           H        ARG  71  11.452   6.255  -8.792
  417    HA   ARG  71           HA       ARG  71  10.259   8.654  -9.960
  418    HB2  ARG  71           HB1      ARG  71   9.276   6.347  -8.372
  419    HB3  ARG  71           HB2      ARG  71   8.475   7.900  -8.087
  420    HG2  ARG  71           HG1      ARG  71   8.825   6.714 -10.836
  421    HG3  ARG  71           HG2      ARG  71   7.409   6.419  -9.814
  422    HD2  ARG  71           HD1      ARG  71   6.997   8.857  -9.703
  423    HD3  ARG  71           HD2      ARG  71   8.374   9.106 -10.785
  424    HE   ARG  71           HE       ARG  71   6.600   7.317 -12.009
  425   HH11  ARG  71          HH11      ARG  71   6.777  10.662 -11.059
  426   HH12  ARG  71          HH12      ARG  71   5.708  11.208 -12.308
  427   HH21  ARG  71          HH21      ARG  71   5.191   8.024 -13.658
  428   HH22  ARG  71          HH22      ARG  71   4.805   9.707 -13.785
  429    H    ARG  72           H        ARG  72  10.421  10.584  -9.032
  430    HA   ARG  72           HA       ARG  72  11.910  10.965  -6.644
  431    HB2  ARG  72           HB1      ARG  72  10.168  12.912  -8.176
  432    HB3  ARG  72           HB2      ARG  72  11.339  13.346  -6.923
  433    HG2  ARG  72           HG1      ARG  72  12.337  11.763  -9.230
  434    HG3  ARG  72           HG2      ARG  72  11.921  13.462  -9.506
  435    HD2  ARG  72           HD1      ARG  72  13.751  12.524  -7.290
  436    HD3  ARG  72           HD2      ARG  72  14.315  13.046  -8.883
  437    HE   ARG  72           HE       ARG  72  12.634  14.974  -7.572
  438   HH11  ARG  72          HH11      ARG  72  15.885  13.780  -7.931
  439   HH12  ARG  72          HH12      ARG  72  16.625  15.271  -7.448
  440   HH21  ARG  72          HH21      ARG  72  13.596  16.942  -6.936
  441   HH22  ARG  72          HH22      ARG  72  15.322  17.068  -6.881
  442    H    CYS  73           H        CYS  73  11.261  10.995  -4.595
  443    HA   CYS  73           HA       CYS  73   8.386  11.327  -4.039
  444    HB2  CYS  73           HB1      CYS  73   8.591   9.730  -2.204
  445    HB3  CYS  73           HB2      CYS  73   9.051   8.983  -3.735
  446    H    GLN  74           H        GLN  74   7.874  12.198  -1.929
  447    HA   GLN  74           HA       GLN  74   9.994  13.986  -0.944
  448    HB2  GLN  74           HB1      GLN  74   7.186  14.386  -1.587
  449    HB3  GLN  74           HB2      GLN  74   7.570  14.922   0.056
  450    HG2  GLN  74           HG1      GLN  74   8.239  16.835  -0.848
  451    HG3  GLN  74           HG2      GLN  74   9.646  15.938  -1.439
  452   HE21  GLN  74          HE21      GLN  74   8.180  18.232  -2.573
  453   HE22  GLN  74          HE22      GLN  74   7.729  17.747  -4.169
  454    H    ARG  75           H        ARG  75   7.411  11.793   0.030
  455    HA   ARG  75           HA       ARG  75   8.523  11.803   2.761
  456    HB2  ARG  75           HB1      ARG  75   5.921  12.357   1.971
  457    HB3  ARG  75           HB2      ARG  75   5.848  10.672   2.508
  458    HG2  ARG  75           HG1      ARG  75   7.203  11.633   4.569
  459    HG3  ARG  75           HG2      ARG  75   6.406  13.133   4.064
  460    HD2  ARG  75           HD1      ARG  75   4.355  11.285   3.960
  461    HD3  ARG  75           HD2      ARG  75   5.295  10.776   5.371
  462    HE   ARG  75           HE       ARG  75   4.573  12.639   6.483
  463   HH11  ARG  75          HH11      ARG  75   4.014  13.062   3.072
  464   HH12  ARG  75          HH12      ARG  75   3.113  14.529   3.269
  465   HH21  ARG  75          HH21      ARG  75   3.387  14.569   6.755
  466   HH22  ARG  75          HH22      ARG  75   2.758  15.385   5.364
  467    H    ASP  76           H        ASP  76   8.061   9.681   3.934
  468    HA   ASP  76           HA       ASP  76   9.213   7.559   2.385
  469    HB2  ASP  76           HB1      ASP  76   9.541   8.142   4.914
  470    HB3  ASP  76           HB2      ASP  76   8.080   7.170   5.136
  471    HD2  ASP  76           HD       ASP  76  10.803   4.937   3.411
  472    H    ALA  77           H        ALA  77   6.056   8.203   3.838
  473    HA   ALA  77           HA       ALA  77   4.935   5.687   3.054
  474    HB1  ALA  77           HB1      ALA  77   3.368   8.149   3.774
  475    HB2  ALA  77           HB2      ALA  77   2.912   6.456   3.975
  476    HB3  ALA  77           HB3      ALA  77   4.177   7.154   4.987
  477    H    MET  78           H        MET  78   5.234   8.839   1.608
  478    HA   MET  78           HA       MET  78   3.197   8.774  -0.277
  479    HB2  MET  78           HB1      MET  78   5.747  10.188   0.062
  480    HB3  MET  78           HB2      MET  78   5.251  10.005  -1.628
  481    HG2  MET  78           HG1      MET  78   2.955  10.893  -0.806
  482    HG3  MET  78           HG2      MET  78   3.878  11.460   0.589
  483    HE1  MET  78           HE1      MET  78   5.315  11.523  -3.307
  484    HE2  MET  78           HE2      MET  78   3.570  11.323  -3.150
  485    HE3  MET  78           HE3      MET  78   4.233  12.844  -3.749
  486    H    CYS  79           H        CYS  79   6.213   7.048  -0.179
  487    HA   CYS  79           HA       CYS  79   5.937   6.154  -2.942
  488    HB2  CYS  79           HB1      CYS  79   8.113   6.506  -1.131
  489    HB3  CYS  79           HB2      CYS  79   8.050   4.801  -1.580
  490    H    CYS  80           H        CYS  80   6.789   3.634  -2.980
  491    HA   CYS  80           HA       CYS  80   4.577   2.198  -1.750
  492    HB2  CYS  80           HB1      CYS  80   6.430   1.744  -4.022
  493    HB3  CYS  80           HB2      CYS  80   5.891   0.301  -3.163
  494    HA   PRO  81           HA       PRO  81   6.835   0.188   1.427
  495    HB2  PRO  81           HB1      PRO  81   5.796  -2.345   1.382
  496    HB3  PRO  81           HB2      PRO  81   4.904  -0.939   1.959
  497    HG2  PRO  81           HG1      PRO  81   4.831  -2.267  -0.730
  498    HG3  PRO  81           HG2      PRO  81   3.463  -1.698   0.298
  499    HD2  PRO  81           HD1      PRO  81   4.376  -0.291  -1.838
  500    HD3  PRO  81           HD2      PRO  81   3.735   0.488  -0.382
  501    H    GLY  82           H        GLY  82   8.584  -1.171   1.861
  502    HA2  GLY  82           HA2      GLY  82  10.089  -2.943   1.326
  503    HA3  GLY  82           HA3      GLY  82   9.585  -2.822  -0.352
  504    HA1  GLY  82           HA1      GLY  82  10.097  -2.096   1.580
  505    H    THR  83           H        THR  83   9.819   0.194  -0.094
  506    HA   THR  83           HA       THR  83  12.758   0.333  -0.293
  507    HB   THR  83           HB       THR  83  12.323   2.250  -1.920
  508    HG1  THR  83           HG1      THR  83   9.793   0.989  -2.214
  509   HG21  THR  83          HG21      THR  83  13.103   0.579  -3.198
  510   HG22  THR  83          HG22      THR  83  11.419   0.317  -3.651
  511   HG23  THR  83          HG23      THR  83  12.142  -0.634  -2.353
  512    H    LEU  84           H        LEU  84  13.529   2.695  -0.143
  513    HA   LEU  84           HA       LEU  84  12.007   4.102   1.949
  514    HB2  LEU  84           HB1      LEU  84  14.140   2.795   2.642
  515    HB3  LEU  84           HB2      LEU  84  14.999   4.130   1.855
  516    HG   LEU  84           HG       LEU  84  13.597   5.638   3.439
  517   HD11  LEU  84          HD11      LEU  84  12.075   4.300   4.496
  518   HD12  LEU  84          HD12      LEU  84  13.393   4.253   5.666
  519   HD13  LEU  84          HD13      LEU  84  13.162   2.910   4.545
  520   HD21  LEU  84          HD21      LEU  84  15.973   5.514   3.609
  521   HD22  LEU  84          HD22      LEU  84  15.895   3.908   4.335
  522   HD23  LEU  84          HD23      LEU  84  15.311   5.309   5.231
  523    H    CYS  85           H        CYS  85  11.886   6.297   1.797
  524    HA   CYS  85           HA       CYS  85  12.504   7.466  -0.745
  525    HB2  CYS  85           HB1      CYS  85  10.486   7.954   0.783
  526    HB3  CYS  85           HB2      CYS  85  11.594   8.986   1.689
  527    H    VAL  86           H        VAL  86  14.617   7.798  -1.146
  528    HA   VAL  86           HA       VAL  86  16.088   9.502   0.752
  529    HB   VAL  86           HB       VAL  86  17.247   7.198  -0.823
  530   HG11  VAL  86          HG11      VAL  86  19.340   7.724   0.336
  531   HG12  VAL  86          HG12      VAL  86  18.803   9.065  -0.677
  532   HG13  VAL  86          HG13      VAL  86  18.576   9.133   1.070
  533   HG21  VAL  86          HG21      VAL  86  17.702   7.041   1.987
  534   HG22  VAL  86          HG22      VAL  86  15.976   7.262   1.701
  535   HG23  VAL  86          HG23      VAL  86  16.829   5.918   0.943
  536    H    ASN  87           H        ASN  87  17.342  11.108  -0.122
  537    HA   ASN  87           HA       ASN  87  17.990  12.677  -1.636
  538    HB2  ASN  87           HB1      ASN  87  19.076  10.380  -2.482
  539    HB3  ASN  87           HB2      ASN  87  18.034  10.710  -3.870
  540   HD21  ASN  87          HD21      ASN  87  20.886  11.583  -2.198
  541   HD22  ASN  87          HD22      ASN  87  21.417  12.815  -3.286
  542    H    ASP  88           H        ASP  88  15.160  12.163  -1.290
  543    HA   ASP  88           HA       ASP  88  13.176  12.876  -2.144
  544    HB2  ASP  88           HB1      ASP  88  15.151  14.555  -3.298
  545    HB3  ASP  88           HB2      ASP  88  14.004  14.146  -4.580
  546    HD2  ASP  88           HD       ASP  88  11.716  16.345  -3.333
  547    H    VAL  89           H        VAL  89  14.501  10.356  -3.042
  548    HA   VAL  89           HA       VAL  89  12.655   9.784  -5.220
  549    HB   VAL  89           HB       VAL  89  14.750  10.420  -6.358
  550   HG11  VAL  89          HG11      VAL  89  15.908   8.158  -4.741
  551   HG12  VAL  89          HG12      VAL  89  16.700   8.864  -6.152
  552   HG13  VAL  89          HG13      VAL  89  16.394   9.852  -4.723
  553   HG21  VAL  89          HG21      VAL  89  14.158   7.469  -6.548
  554   HG22  VAL  89          HG22      VAL  89  13.230   8.745  -7.335
  555   HG23  VAL  89          HG23      VAL  89  14.912   8.470  -7.788
  556    H    CYS  90           H        CYS  90  12.115   7.593  -5.415
  557    HA   CYS  90           HA       CYS  90  12.195   6.102  -3.020
  558    HB2  CYS  90           HB1      CYS  90  10.816   5.993  -5.477
  559    HB3  CYS  90           HB2      CYS  90  11.633   4.438  -5.309
  560    H    THR  91           H        THR  91  14.046   5.312  -2.242
  561    HA   THR  91           HA       THR  91  15.800   3.824  -4.088
  562    HB   THR  91           HB       THR  91  16.593   5.316  -1.579
  563    HG1  THR  91           HG1      THR  91  16.338   6.775  -3.231
  564   HG21  THR  91          HG21      THR  91  18.888   4.725  -2.186
  565   HG22  THR  91          HG22      THR  91  18.291   3.784  -3.554
  566   HG23  THR  91          HG23      THR  91  17.920   3.278  -1.906
  567    H    THR  92           H        THR  92  15.872   1.712  -3.736
  568    HA   THR  92           HA       THR  92  14.500   0.338  -1.785
  569    HB   THR  92           HB       THR  92  15.206  -0.939  -3.625
  570    HG1  THR  92           HG1      THR  92  16.460  -2.610  -2.627
  571   HG21  THR  92          HG21      THR  92  17.730  -1.305  -4.000
  572   HG22  THR  92          HG22      THR  92  17.938   0.148  -3.021
  573   HG23  THR  92          HG23      THR  92  17.023   0.222  -4.527
  574    H    MET  93           H        MET  93  15.231  -0.910   0.048
  575    HA   MET  93           HA       MET  93  17.015   0.614   1.726
  576    HB2  MET  93           HB1      MET  93  15.039  -1.559   2.086
  577    HB3  MET  93           HB2      MET  93  16.397  -1.558   3.223
  578    HG2  MET  93           HG1      MET  93  15.799   0.982   3.487
  579    HG3  MET  93           HG2      MET  93  14.234   0.456   2.861
  580    HE1  MET  93           HE1      MET  93  16.917  -0.289   5.741
  581    HE2  MET  93           HE2      MET  93  16.097   1.269   5.826
  582    HE3  MET  93           HE3      MET  93  15.791   0.043   7.057
  583    H    GLU  94           H        GLU  94  17.564  -1.614  -0.591
  584    HA   GLU  94           HA       GLU  94  19.586  -3.161   0.805
  585    HB2  GLU  94           HB1      GLU  94  18.881  -3.137  -2.139
  586    HB3  GLU  94           HB2      GLU  94  19.876  -4.338  -1.300
  587    HG2  GLU  94           HG1      GLU  94  17.015  -3.841  -0.529
  588    HG3  GLU  94           HG2      GLU  94  17.460  -4.953  -1.830
  589    HE2  GLU  94           HE       GLU  94  19.227  -6.896   0.722
  590    H    ASP  95           H        ASP  95  19.382  -0.562  -1.557
  591    HA   ASP  95           HA       ASP  95  22.272  -0.460  -1.854
  592    HB2  ASP  95           HB1      ASP  95  19.995   0.439  -3.371
  593    HB3  ASP  95           HB2      ASP  95  21.084   1.800  -3.067
  594    HD2  ASP  95           HD       ASP  95  23.664   0.248  -4.914
  595    H    ALA  96           H        ALA  96  19.682   1.320  -0.292
  596    HA   ALA  96           HA       ALA  96  21.131   3.629   0.404
  597    HB1  ALA  96           HB1      ALA  96  18.610   3.228   0.516
  598    HB2  ALA  96           HB2      ALA  96  18.924   2.483   2.085
  599    HB3  ALA  96           HB3      ALA  96  19.343   4.175   1.811
  600    H    THR  97           H        THR  97  23.038   3.491   1.421
  601    HA   THR  97           HA       THR  97  23.303   1.654   3.697
  602    HB   THR  97           HB       THR  97  25.501   3.143   2.253
  603    HG1  THR  97           HG1      THR  97  25.665   1.443   0.948
  604   HG21  THR  97          HG21      THR  97  26.879   1.290   3.340
  605   HG22  THR  97          HG22      THR  97  25.471   0.999   4.363
  606   HG23  THR  97          HG23      THR  97  26.281   2.565   4.401
  607    H    GLU  98           H        GLU  98  24.567   4.881   2.835
  608    HA   GLU  98           HA       GLU  98  24.528   5.623   5.653
  609    HB2  GLU  98           HB1      GLU  98  25.775   7.601   4.967
  610    HB3  GLU  98           HB2      GLU  98  26.528   6.134   4.323
  611    HG2  GLU  98           HG1      GLU  98  24.760   6.927   2.329
  612    HG3  GLU  98           HG2      GLU  98  25.473   8.431   2.929
  613    HE2  GLU  98           HE       GLU  98  28.505   7.744   1.467
  614    H    ASN  99           H        ASN  99  23.878   8.014   6.048
  615    HA   ASN  99           HA       ASN  99  21.675   8.955   4.433
  616    HB2  ASN  99           HB1      ASN  99  20.535   7.298   5.808
  617    HB3  ASN  99           HB2      ASN  99  21.219   8.012   7.273
  618   HD21  ASN  99          HD21      ASN  99  19.941   9.321   8.343
  619   HD22  ASN  99          HD22      ASN  99  18.629  10.232   7.686
  620    H    LEU 100           H        LEU 100  22.065  11.054   4.276
  621    HA   LEU 100           HA       LEU 100  22.616  13.202   4.778
  622    HB2  LEU 100           HB1      LEU 100  20.908  12.431   6.706
  623    HB3  LEU 100           HB2      LEU 100  22.336  12.791   7.693
  624    HG   LEU 100           HG       LEU 100  22.223  15.045   6.232
  625   HD11  LEU 100          HD11      LEU 100  20.324  14.821   4.978
  626   HD12  LEU 100          HD12      LEU 100  19.663  15.597   6.417
  627   HD13  LEU 100          HD13      LEU 100  19.495  13.855   6.198
  628   HD21  LEU 100          HD21      LEU 100  22.084  14.485   8.805
  629   HD22  LEU 100          HD22      LEU 100  20.383  14.885   8.565
  630   HD23  LEU 100          HD23      LEU 100  21.631  16.073   8.186
  631    H    TYR 101           H        TYR 101  24.118  14.576   6.236
  632    HA   TYR 101           HA       TYR 101  26.543  12.996   6.797
  633    HB2  TYR 101           HB1      TYR 101  26.165  15.103   4.957
  634    HB3  TYR 101           HB2      TYR 101  27.115  15.775   6.285
  635    HD1  TYR 101           HD1      TYR 101  27.049  12.658   4.214
  636    HD2  TYR 101           HD2      TYR 101  29.408  15.638   6.125
  637    HE1  TYR 101           HE1      TYR 101  29.084  11.617   3.310
  638    HE2  TYR 101           HE2      TYR 101  31.452  14.604   5.227
  639    HH   TYR 101           HH       TYR 101  32.304  12.912   4.070
  640    H    PHE 102           H        PHE 102  28.043  14.034   8.362
  641    HA   PHE 102           HA       PHE 102  26.621  15.637  10.377
  642    HB2  PHE 102           HB1      PHE 102  27.554  14.317  12.171
  643    HB3  PHE 102           HB2      PHE 102  26.699  13.246  11.060
  644    HD1  PHE 102           HD1      PHE 102  27.842  11.588   9.772
  645    HD2  PHE 102           HD2      PHE 102  30.011  14.294  12.239
  646    HE1  PHE 102           HE1      PHE 102  29.854  10.193   9.527
  647    HE2  PHE 102           HE2      PHE 102  32.027  12.905  11.998
  648    HZ   PHE 102           HZ       PHE 102  31.950  10.852  10.639
  649    H    GLN 103           H        GLN 103  27.894  17.050  11.604
  650    HA   GLN 103           HA       GLN 103  30.729  17.191  11.320
  651    HB2  GLN 103           HB1      GLN 103  29.102  18.561   9.376
  652    HB3  GLN 103           HB2      GLN 103  30.005  19.735  10.347
  653    HG2  GLN 103           HG1      GLN 103  32.065  18.954   9.648
  654    HG3  GLN 103           HG2      GLN 103  31.415  17.376   9.186
  655   HE21  GLN 103          HE21      GLN 103  31.138  20.808   8.347
  656   HE22  GLN 103          HE22      GLN 103  30.979  20.557   6.645
  657    H    SER 104           H        SER 104  31.623  18.360  12.942
  658    HA   SER 104           HA       SER 104  30.321  20.516  14.257
  659    HB2  SER 104           HB1      SER 104  28.908  18.937  15.313
  660    HB3  SER 104           HB2      SER 104  30.242  17.797  15.559
  661    HG   SER 104           HG       SER 104  29.856  20.287  16.863
  662    H    LEU 105           H        LEU 105  32.253  21.582  14.053
  663    HA   LEU 105           HA       LEU 105  34.447  20.577  15.738
  664    HB2  LEU 105           HB1      LEU 105  35.070  20.264  13.421
  665    HB3  LEU 105           HB2      LEU 105  34.658  21.950  13.063
  666    HG   LEU 105           HG       LEU 105  36.595  22.021  15.108
  667   HD11  LEU 105          HD11      LEU 105  37.152  19.965  13.000
  668   HD12  LEU 105          HD12      LEU 105  37.391  19.862  14.744
  669   HD13  LEU 105          HD13      LEU 105  38.456  20.871  13.767
  670   HD21  LEU 105          HD21      LEU 105  36.364  22.789  12.249
  671   HD22  LEU 105          HD22      LEU 105  37.969  22.801  12.980
  672   HD23  LEU 105          HD23      LEU 105  36.677  23.786  13.670
  673    H    GLU 106           H        GLU 106  34.643  21.881  17.427
  674    HA   GLU 106           HA       GLU 106  34.696  24.770  16.988
  675    HB2  GLU 106           HB1      GLU 106  32.915  23.341  18.965
  676    HB3  GLU 106           HB2      GLU 106  33.328  25.057  19.108
  677    HG2  GLU 106           HG1      GLU 106  32.295  25.531  16.969
  678    HG3  GLU 106           HG2      GLU 106  31.950  23.812  16.739
  679    HE2  GLU 106           HE       GLU 106  29.863  24.888  19.836
  680    H    HIS 107           H        HIS 107  36.810  25.028  17.477
  681    HA   HIS 107           HA       HIS 107  37.630  24.313  20.208
  682    HB2  HIS 107           HB1      HIS 107  39.297  24.014  17.697
  683    HB3  HIS 107           HB2      HIS 107  39.906  23.807  19.343
  684    HD1  HIS 107           HD1      HIS 107  38.478  21.871  20.755
  685    HD2  HIS 107           HD2      HIS 107  38.513  21.659  16.605
  686    HE1  HIS 107           HE1      HIS 107  37.835  19.504  20.196
  687    HE2  HIS 107           HE2      HIS 107  37.857  19.373  17.660
  688    H    HIS 108           H        HIS 108  39.580  25.568  20.920
  689    HA   HIS 108           HA       HIS 108  40.551  27.569  21.399
  690    HB2  HIS 108           HB1      HIS 108  41.286  27.146  18.953
  691    HB3  HIS 108           HB2      HIS 108  40.107  28.394  18.541
  692    HD1  HIS 108           HD1      HIS 108  40.498  30.741  19.983
  693    HD2  HIS 108           HD2      HIS 108  43.737  28.189  19.474
  694    HE1  HIS 108           HE1      HIS 108  42.538  32.149  20.409
  695    HE2  HIS 108           HE2      HIS 108  44.518  30.591  20.098
  696    H    HIS 109           H        HIS 109  38.893  28.305  22.744
  697    HA   HIS 109           HA       HIS 109  37.396  30.560  21.647
  698    HB2  HIS 109           HB1      HIS 109  36.222  28.039  22.552
  699    HB3  HIS 109           HB2      HIS 109  35.566  29.441  23.402
  700    HD1  HIS 109           HD1      HIS 109  34.741  31.451  21.685
  701    HD2  HIS 109           HD2      HIS 109  34.976  27.585  20.181
  702    HE1  HIS 109           HE1      HIS 109  33.318  31.448  19.612
  703    HE2  HIS 109           HE2      HIS 109  33.461  29.086  18.692
  704    H    HIS 110           H        HIS 110  37.488  32.278  22.946
  705    HA   HIS 110           HA       HIS 110  37.907  31.889  25.819
  706    HB2  HIS 110           HB1      HIS 110  39.989  32.567  24.124
  707    HB3  HIS 110           HB2      HIS 110  39.458  34.128  24.758
  708    HD1  HIS 110           HD1      HIS 110  41.039  34.728  26.564
  709    HD2  HIS 110           HD2      HIS 110  39.920  30.731  26.750
  710    HE1  HIS 110           HE1      HIS 110  42.117  33.824  28.648
  711    HE2  HIS 110           HE2      HIS 110  41.434  31.380  28.763
  712    H    HIS 111           H        HIS 111  37.908  34.224  26.876
  713    HA   HIS 111           HA       HIS 111  36.070  36.045  25.558
  714    HB2  HIS 111           HB1      HIS 111  34.450  36.037  27.398
  715    HB3  HIS 111           HB2      HIS 111  34.552  34.450  26.627
  716    HD1  HIS 111           HD1      HIS 111  36.001  32.610  27.958
  717    HD2  HIS 111           HD2      HIS 111  34.897  35.993  30.103
  718    HE1  HIS 111           HE1      HIS 111  36.302  31.999  30.380
  719    HE2  HIS 111           HE2      HIS 111  35.628  34.067  31.691
  720    H    HIS 112           H        HIS 112  38.756  36.362  26.266
  721    HA   HIS 112           HA       HIS 112  40.198  37.731  27.381
  722    HB2  HIS 112           HB1      HIS 112  37.618  39.282  27.398
  723    HB3  HIS 112           HB2      HIS 112  39.070  39.939  28.161
  724    HD1  HIS 112           HD1      HIS 112  37.374  39.912  25.012
  725    HD2  HIS 112           HD2      HIS 112  41.352  39.991  26.208
  726    HE1  HIS 112           HE1      HIS 112  38.660  40.744  23.017
  727    HE2  HIS 112           HE2      HIS 112  41.091  40.791  23.748
  Start of MODEL   54
    1    H1   MET  18           H        MET  18 -10.788  27.507   8.771
    2    HA   MET  18           HA       MET  18 -12.818  28.071   9.837
    3    HB2  MET  18           HB1      MET  18 -13.720  28.902   7.067
    4    HB3  MET  18           HB2      MET  18 -14.681  29.028   8.548
    5    HG2  MET  18           HG1      MET  18 -13.881  31.073   8.836
    6    HG3  MET  18           HG2      MET  18 -12.297  30.348   9.122
    7    HE1  MET  18           HE1      MET  18 -13.840  32.914   5.949
    8    HE2  MET  18           HE2      MET  18 -14.230  31.315   5.317
    9    HE3  MET  18           HE3      MET  18 -14.782  31.786   6.926
   10    H    LEU  19           H        LEU  19 -15.077  27.068   9.651
   11    HA   LEU  19           HA       LEU  19 -16.308  25.159   9.525
   12    HB2  LEU  19           HB1      LEU  19 -15.034  24.774   6.817
   13    HB3  LEU  19           HB2      LEU  19 -16.613  24.195   7.373
   14    HG   LEU  19           HG       LEU  19 -15.985  27.123   7.081
   15   HD11  LEU  19          HD11      LEU  19 -15.810  26.696   4.882
   16   HD12  LEU  19          HD12      LEU  19 -17.567  26.559   4.962
   17   HD13  LEU  19          HD13      LEU  19 -16.566  25.108   5.022
   18   HD21  LEU  19          HD21      LEU  19 -18.581  25.588   7.150
   19   HD22  LEU  19          HD22      LEU  19 -18.407  27.338   7.004
   20   HD23  LEU  19          HD23      LEU  19 -17.901  26.520   8.484
   21    H    VAL  20           H        VAL  20 -15.288  23.972  11.127
   22    HA   VAL  20           HA       VAL  20 -13.222  22.075  10.228
   23    HB   VAL  20           HB       VAL  20 -12.572  21.836  12.570
   24   HG11  VAL  20          HG11      VAL  20 -11.322  23.756  12.675
   25   HG12  VAL  20          HG12      VAL  20 -11.822  23.789  10.982
   26   HG13  VAL  20          HG13      VAL  20 -12.661  24.786  12.171
   27   HG21  VAL  20          HG21      VAL  20 -14.107  22.261  14.127
   28   HG22  VAL  20          HG22      VAL  20 -13.758  23.972  13.882
   29   HG23  VAL  20          HG23      VAL  20 -15.085  23.209  13.007
   30    H    LEU  21           H        LEU  21 -13.458  19.899  10.606
   31    HA   LEU  21           HA       LEU  21 -16.179  19.018  11.178
   32    HB2  LEU  21           HB1      LEU  21 -15.554  16.913  10.228
   33    HB3  LEU  21           HB2      LEU  21 -14.980  18.210   9.166
   34    HG   LEU  21           HG       LEU  21 -12.777  17.755  10.713
   35   HD11  LEU  21          HD11      LEU  21 -14.264  15.697  11.498
   36   HD12  LEU  21          HD12      LEU  21 -12.517  15.578  11.301
   37   HD13  LEU  21          HD13      LEU  21 -13.589  14.987  10.031
   38   HD21  LEU  21          HD21      LEU  21 -11.799  17.055   8.755
   39   HD22  LEU  21          HD22      LEU  21 -13.239  17.866   8.139
   40   HD23  LEU  21          HD23      LEU  21 -13.202  16.106   8.264
   41    H    ASP  22           H        ASP  22 -16.743  17.667  12.838
   42    HA   ASP  22           HA       ASP  22 -14.892  16.318  14.503
   43    HB2  ASP  22           HB1      ASP  22 -14.504  18.717  15.187
   44    HB3  ASP  22           HB2      ASP  22 -16.170  18.740  15.780
   45    HD2  ASP  22           HD       ASP  22 -14.680  17.756  18.743
   46    H    PHE  23           H        PHE  23 -17.035  15.336  13.263
   47    HA   PHE  23           HA       PHE  23 -18.884  14.789  15.478
   48    HB2  PHE  23           HB1      PHE  23 -19.587  16.309  13.269
   49    HB3  PHE  23           HB2      PHE  23 -20.171  14.695  12.855
   50    HD1  PHE  23           HD1      PHE  23 -21.143  17.662  14.280
   51    HD2  PHE  23           HD2      PHE  23 -21.329  13.470  14.991
   52    HE1  PHE  23           HE1      PHE  23 -23.125  17.994  15.699
   53    HE2  PHE  23           HE2      PHE  23 -23.311  13.795  16.411
   54    HZ   PHE  23           HZ       PHE  23 -24.213  16.058  16.766
   55    H    ASN  24           H        ASN  24 -18.074  12.780  15.908
   56    HA   ASN  24           HA       ASN  24 -18.213  10.814  13.717
   57    HB2  ASN  24           HB1      ASN  24 -16.454  10.669  16.177
   58    HB3  ASN  24           HB2      ASN  24 -16.451   9.552  14.808
   59   HD21  ASN  24          HD21      ASN  24 -15.139  12.371  16.097
   60   HD22  ASN  24          HD22      ASN  24 -14.243  12.886  14.713
   61    H    ASN  25           H        ASN  25 -19.734   9.320  13.931
   62    HA   ASN  25           HA       ASN  25 -20.291   7.942  16.327
   63    HB2  ASN  25           HB1      ASN  25 -21.462  10.403  16.378
   64    HB3  ASN  25           HB2      ASN  25 -22.742   9.437  15.633
   65   HD21  ASN  25          HD21      ASN  25 -23.569   7.620  16.772
   66   HD22  ASN  25          HD22      ASN  25 -23.475   7.551  18.497
   67    H    ILE  26           H        ILE  26 -21.960   6.326  16.068
   68    HA   ILE  26           HA       ILE  26 -22.399   5.677  13.238
   69    HB   ILE  26           HB       ILE  26 -22.603   3.840  15.626
   70   HG12  ILE  26          HG11      ILE  26 -20.313   4.619  15.347
   71   HG13  ILE  26          HG12      ILE  26 -20.445   2.923  14.853
   72   HG21  ILE  26          HG21      ILE  26 -22.548   2.057  13.927
   73   HG22  ILE  26          HG22      ILE  26 -23.956   3.105  13.758
   74   HG23  ILE  26          HG23      ILE  26 -22.586   3.284  12.662
   75   HD11  ILE  26          HD11      ILE  26 -19.519   5.167  13.346
   76   HD12  ILE  26          HD12      ILE  26 -19.489   3.451  12.934
   77   HD13  ILE  26          HD13      ILE  26 -20.902   4.429  12.537
   78    H    ARG  27           H        ARG  27 -24.092   5.230  16.351
   79    HA   ARG  27           HA       ARG  27 -26.304   5.215  16.886
   80    HB2  ARG  27           HB1      ARG  27 -25.814   7.615  15.882
   81    HB3  ARG  27           HB2      ARG  27 -26.914   7.053  14.616
   82    HG2  ARG  27           HG1      ARG  27 -28.709   6.782  16.135
   83    HG3  ARG  27           HG2      ARG  27 -27.633   6.973  17.530
   84    HD2  ARG  27           HD1      ARG  27 -28.115   9.150  17.541
   85    HD3  ARG  27           HD2      ARG  27 -27.272   9.282  15.991
   86    HE   ARG  27           HE       ARG  27 -29.859   8.397  15.462
   87   HH11  ARG  27          HH11      ARG  27 -28.265  11.213  16.747
   88   HH12  ARG  27          HH12      ARG  27 -29.494  12.312  16.213
   89   HH21  ARG  27          HH21      ARG  27 -31.483   9.834  14.755
   90   HH22  ARG  27          HH22      ARG  27 -31.323  11.527  15.081
   91    H    SER  28           H        SER  28 -25.628   3.064  15.382
   92    HA   SER  28           HA       SER  28 -26.461   1.403  14.069
   93    HB2  SER  28           HB1      SER  28 -29.158   2.747  14.217
   94    HB3  SER  28           HB2      SER  28 -28.780   1.017  14.176
   95    HG   SER  28           HG       SER  28 -28.455   2.828  16.322
   96    H    SER  29           H        SER  29 -28.165   1.123  12.075
   97    HA   SER  29           HA       SER  29 -27.312   3.151  10.121
   98    HB2  SER  29           HB1      SER  29 -27.314   0.252  10.088
   99    HB3  SER  29           HB2      SER  29 -28.245   0.901   8.727
  100    HG   SER  29           HG       SER  29 -26.166   0.837   8.031
  101    H    ALA  30           H        ALA  30 -28.783   3.884   8.547
  102    HA   ALA  30           HA       ALA  30 -31.545   3.895   9.466
  103    HB1  ALA  30           HB1      ALA  30 -31.469   5.997   8.767
  104    HB2  ALA  30           HB2      ALA  30 -29.850   5.742   8.115
  105    HB3  ALA  30           HB3      ALA  30 -31.263   5.431   7.109
  106    H    ASP  31           H        ASP  31 -33.183   4.027   7.515
  107    HA   ASP  31           HA       ASP  31 -33.140   1.439   6.294
  108    HB2  ASP  31           HB1      ASP  31 -35.079   3.611   5.537
  109    HB3  ASP  31           HB2      ASP  31 -35.343   1.864   5.635
  110    HD2  ASP  31           HD       ASP  31 -35.814   4.031   8.889
  111    H    LEU  32           H        LEU  32 -34.213   1.726   3.825
  112    HA   LEU  32           HA       LEU  32 -32.008   2.108   2.176
  113    HB2  LEU  32           HB1      LEU  32 -34.290   0.920   1.766
  114    HB3  LEU  32           HB2      LEU  32 -34.792   2.508   1.157
  115    HG   LEU  32           HG       LEU  32 -32.970   2.409  -0.513
  116   HD11  LEU  32          HD11      LEU  32 -32.184  -0.109  -0.809
  117   HD12  LEU  32          HD12      LEU  32 -32.391  -0.107   0.942
  118   HD13  LEU  32          HD13      LEU  32 -31.293   1.046   0.183
  119   HD21  LEU  32          HD21      LEU  32 -35.397   1.416  -0.731
  120   HD22  LEU  32          HD22      LEU  32 -34.520  -0.110  -0.856
  121   HD23  LEU  32          HD23      LEU  32 -34.200   1.188  -2.008
  122    H    HIS  33           H        HIS  33 -31.221   3.780   0.986
  123    HA   HIS  33           HA       HIS  33 -32.607   6.181   0.452
  124    HB2  HIS  33           HB1      HIS  33 -31.406   6.005   3.047
  125    HB3  HIS  33           HB2      HIS  33 -30.523   7.201   2.092
  126    HD1  HIS  33           HD1      HIS  33 -33.130   7.152   4.396
  127    HD2  HIS  33           HD2      HIS  33 -32.682   8.941   0.674
  128    HE1  HIS  33           HE1      HIS  33 -34.808   9.024   4.343
  129    HE2  HIS  33           HE2      HIS  33 -34.535  10.119   2.069
  130    H    GLY  34           H        GLY  34 -31.345   7.692  -0.765
  131    HA2  GLY  34           HA2      GLY  34 -29.177   6.392  -2.185
  132    HA3  GLY  34           HA3      GLY  34 -29.930   7.925  -2.602
  133    HA1  GLY  34           HA1      GLY  34 -29.092   6.460  -1.311
  134    H    ALA  35           H        ALA  35 -27.264   7.787  -2.827
  135    HA   ALA  35           HA       ALA  35 -26.376   9.559  -0.675
  136    HB1  ALA  35           HB1      ALA  35 -25.619   7.196  -0.211
  137    HB2  ALA  35           HB2      ALA  35 -24.612   7.327  -1.653
  138    HB3  ALA  35           HB3      ALA  35 -24.343   8.412  -0.289
  139    H    ARG  36           H        ARG  36 -24.125  10.484  -1.288
  140    HA   ARG  36           HA       ARG  36 -24.034  10.978  -4.190
  141    HB2  ARG  36           HB1      ARG  36 -23.709  12.994  -1.956
  142    HB3  ARG  36           HB2      ARG  36 -23.369  13.324  -3.661
  143    HG2  ARG  36           HG1      ARG  36 -25.795  12.617  -4.099
  144    HG3  ARG  36           HG2      ARG  36 -26.010  12.801  -2.350
  145    HD2  ARG  36           HD1      ARG  36 -24.668  15.116  -3.103
  146    HD3  ARG  36           HD2      ARG  36 -25.814  14.826  -4.419
  147    HE   ARG  36           HE       ARG  36 -26.438  15.582  -1.712
  148   HH11  ARG  36          HH11      ARG  36 -27.625  14.125  -4.642
  149   HH12  ARG  36          HH12      ARG  36 -29.288  14.458  -4.288
  150   HH21  ARG  36          HH21      ARG  36 -28.624  16.026  -1.234
  151   HH22  ARG  36          HH22      ARG  36 -29.855  15.539  -2.350
  152    H    LYS  37           H        LYS  37 -22.116  10.617  -5.089
  153    HA   LYS  37           HA       LYS  37 -19.918   9.671  -3.584
  154    HB2  LYS  37           HB1      LYS  37 -20.156  10.553  -6.468
  155    HB3  LYS  37           HB2      LYS  37 -18.695   9.820  -5.782
  156    HG2  LYS  37           HG1      LYS  37 -19.846   7.766  -5.328
  157    HG3  LYS  37           HG2      LYS  37 -21.395   8.489  -5.802
  158    HD2  LYS  37           HD1      LYS  37 -21.033   8.100  -7.975
  159    HD3  LYS  37           HD2      LYS  37 -19.386   8.753  -7.884
  160    HE2  LYS  37           HE1      LYS  37 -19.031   6.528  -8.481
  161    HE3  LYS  37           HE2      LYS  37 -18.796   6.525  -6.727
  162    HZ1  LYS  37           HZ1      LYS  37 -20.975   5.381  -8.306
  163    HZ2  LYS  37           HZ2      LYS  37 -21.353   5.981  -6.771
  164    HZ3  LYS  37           HZ3      LYS  37 -20.192   4.763  -6.940
  165    H    GLY  38           H        GLY  38 -17.629  10.694  -4.330
  166    HA2  GLY  38           HA2      GLY  38 -17.438  13.504  -4.509
  167    HA3  GLY  38           HA3      GLY  38 -17.324  13.028  -2.821
  168    HA1  GLY  38           HA1      GLY  38 -17.190  12.767  -4.927
  169    H    SER  39           H        SER  39 -15.507  11.940  -2.088
  170    HA   SER  39           HA       SER  39 -13.179  12.197  -3.826
  171    HB2  SER  39           HB1      SER  39 -13.093  11.346  -0.935
  172    HB3  SER  39           HB2      SER  39 -11.859  12.194  -1.883
  173    HG   SER  39           HG       SER  39 -13.038  13.552  -0.395
  174    H    GLN  40           H        GLN  40 -11.532  10.475  -3.810
  175    HA   GLN  40           HA       GLN  40 -12.814   7.886  -4.167
  176    HB2  GLN  40           HB1      GLN  40 -10.329   9.194  -5.115
  177    HB3  GLN  40           HB2      GLN  40 -10.242   7.443  -4.863
  178    HG2  GLN  40           HG1      GLN  40 -12.502   8.608  -6.441
  179    HG3  GLN  40           HG2      GLN  40 -10.911   8.390  -7.184
  180   HE21  GLN  40          HE21      GLN  40 -11.917   6.898  -8.620
  181   HE22  GLN  40          HE22      GLN  40 -12.227   5.274  -8.119
  182    H    CYS  41           H        CYS  41  -9.881   9.120  -2.552
  183    HA   CYS  41           HA       CYS  41 -10.328   7.214  -0.382
  184    HB2  CYS  41           HB1      CYS  41  -7.845   6.661  -0.431
  185    HB3  CYS  41           HB2      CYS  41  -8.835   5.937  -1.699
  186    H    LEU  42           H        LEU  42  -9.020   7.689   1.531
  187    HA   LEU  42           HA       LEU  42  -8.329  10.549   1.677
  188    HB2  LEU  42           HB1      LEU  42 -10.071   8.912   3.269
  189    HB3  LEU  42           HB2      LEU  42  -8.748   9.536   4.272
  190    HG   LEU  42           HG       LEU  42  -9.601  11.767   2.884
  191   HD11  LEU  42          HD11      LEU  42 -11.598  10.089   2.364
  192   HD12  LEU  42          HD12      LEU  42 -11.857  11.809   2.654
  193   HD13  LEU  42          HD13      LEU  42 -12.125  10.646   3.952
  194   HD21  LEU  42          HD21      LEU  42 -10.112  10.695   5.636
  195   HD22  LEU  42          HD22      LEU  42 -10.756  12.257   5.131
  196   HD23  LEU  42          HD23      LEU  42  -9.015  11.977   5.126
  197    H    SER  43           H        SER  43  -7.284   7.307   2.247
  198    HA   SER  43           HA       SER  43  -4.659   8.327   3.063
  199    HB2  SER  43           HB1      SER  43  -6.052   7.503   5.054
  200    HB3  SER  43           HB2      SER  43  -5.854   5.882   4.364
  201    HG   SER  43           HG       SER  43  -3.848   5.849   5.005
  202    H    ASP  44           H        ASP  44  -3.064   6.342   3.095
  203    HA   ASP  44           HA       ASP  44  -3.112   5.273   0.429
  204    HB2  ASP  44           HB1      ASP  44  -0.913   4.380   0.937
  205    HB3  ASP  44           HB2      ASP  44  -1.021   6.051   1.505
  206    HD2  ASP  44           HD       ASP  44  -1.153   4.897   4.885
  207    H    THR  45           H        THR  45  -3.946   4.152   3.590
  208    HA   THR  45           HA       THR  45  -3.799   1.354   3.005
  209    HB   THR  45           HB       THR  45  -5.670   2.020   5.124
  210    HG1  THR  45           HG1      THR  45  -4.596   3.560   6.091
  211   HG21  THR  45          HG21      THR  45  -4.705  -0.098   5.220
  212   HG22  THR  45          HG22      THR  45  -3.795   0.804   6.432
  213   HG23  THR  45          HG23      THR  45  -3.095   0.512   4.840
  214    H    ASP  46           H        ASP  46  -6.100   3.842   2.428
  215    HA   ASP  46           HA       ASP  46  -8.445   2.253   2.303
  216    HB2  ASP  46           HB1      ASP  46  -7.737   4.917   1.047
  217    HB3  ASP  46           HB2      ASP  46  -9.341   4.182   0.943
  218    HD2  ASP  46           HD       ASP  46  -9.585   6.278   3.790
  219    H    CYS  47           H        CYS  47  -5.810   2.787   0.129
  220    HA   CYS  47           HA       CYS  47  -7.262   1.691  -2.147
  221    HB2  CYS  47           HB1      CYS  47  -5.363   3.606  -2.024
  222    HB3  CYS  47           HB2      CYS  47  -4.346   2.196  -2.335
  223    H    ASN  48           H        ASN  48  -5.214   0.650   0.378
  224    HA   ASN  48           HA       ASN  48  -4.340  -1.376   0.931
  225    HB2  ASN  48           HB1      ASN  48  -5.910  -2.524  -1.386
  226    HB3  ASN  48           HB2      ASN  48  -5.379  -3.354   0.083
  227   HD21  ASN  48          HD21      ASN  48  -8.064  -2.746  -1.209
  228   HD22  ASN  48          HD22      ASN  48  -9.018  -2.136   0.096
  229    H    THR  49           H        THR  49  -3.217  -3.410  -0.200
  230    HA   THR  49           HA       THR  49  -1.323  -4.075  -1.281
  231    HB   THR  49           HB       THR  49  -1.707  -2.581  -3.742
  232    HG1  THR  49           HG1      THR  49  -3.888  -4.244  -3.039
  233   HG21  THR  49          HG21      THR  49  -1.482  -5.401  -2.835
  234   HG22  THR  49          HG22      THR  49  -0.581  -4.539  -4.082
  235   HG23  THR  49          HG23      THR  49  -2.220  -5.105  -4.409
  236    H    ARG  50           H        ARG  50   0.388  -2.993  -3.068
  237    HA   ARG  50           HA       ARG  50   1.731  -1.011  -1.483
  238    HB2  ARG  50           HB1      ARG  50   3.461  -1.125  -3.289
  239    HB3  ARG  50           HB2      ARG  50   3.081  -2.682  -2.540
  240    HG2  ARG  50           HG1      ARG  50   1.790  -3.379  -4.420
  241    HG3  ARG  50           HG2      ARG  50   1.868  -1.757  -5.130
  242    HD2  ARG  50           HD1      ARG  50   3.425  -3.300  -6.238
  243    HD3  ARG  50           HD2      ARG  50   4.270  -1.973  -5.431
  244    HE   ARG  50           HE       ARG  50   4.111  -4.161  -3.675
  245   HH11  ARG  50          HH11      ARG  50   5.698  -3.176  -6.612
  246   HH12  ARG  50          HH12      ARG  50   7.092  -4.170  -6.347
  247   HH21  ARG  50          HH21      ARG  50   5.941  -5.474  -3.313
  248   HH22  ARG  50          HH22      ARG  50   7.229  -5.478  -4.471
  249    H    LYS  51           H        LYS  51  -0.396   0.334  -1.925
  250    HA   LYS  51           HA       LYS  51   0.334   2.288  -3.984
  251    HB2  LYS  51           HB1      LYS  51  -1.815   0.529  -4.259
  252    HB3  LYS  51           HB2      LYS  51  -2.549   2.047  -3.717
  253    HG2  LYS  51           HG1      LYS  51  -2.442   2.831  -5.782
  254    HG3  LYS  51           HG2      LYS  51  -0.674   2.718  -5.712
  255    HD2  LYS  51           HD1      LYS  51  -0.888   1.274  -7.420
  256    HD3  LYS  51           HD2      LYS  51  -1.377   0.119  -6.168
  257    HE2  LYS  51           HE1      LYS  51  -3.664   1.674  -6.857
  258    HE3  LYS  51           HE2      LYS  51  -2.898   1.121  -8.354
  259    HZ1  LYS  51           HZ1      LYS  51  -2.840  -1.096  -6.814
  260    HZ2  LYS  51           HZ2      LYS  51  -4.016  -0.757  -7.982
  261    HZ3  LYS  51           HZ3      LYS  51  -4.310  -0.393  -6.356
  262    H    PHE  52           H        PHE  52  -0.841   4.381  -3.673
  263    HA   PHE  52           HA       PHE  52  -1.689   4.848  -0.910
  264    HB2  PHE  52           HB1      PHE  52  -0.121   6.461  -0.427
  265    HB3  PHE  52           HB2      PHE  52   0.843   5.368  -1.422
  266    HD1  PHE  52           HD1      PHE  52   0.528   8.634  -0.831
  267    HD2  PHE  52           HD2      PHE  52   0.196   5.957  -4.123
  268    HE1  PHE  52           HE1      PHE  52   1.055  10.474  -2.377
  269    HE2  PHE  52           HE2      PHE  52   0.724   7.793  -5.674
  270    HZ   PHE  52           HZ       PHE  52   1.155  10.055  -4.802
  271    H    CYS  53           H        CYS  53  -2.259   7.374  -0.786
  272    HA   CYS  53           HA       CYS  53  -4.035   7.880  -3.080
  273    HB2  CYS  53           HB1      CYS  53  -4.945   7.454  -0.676
  274    HB3  CYS  53           HB2      CYS  53  -4.418   9.109  -0.367
  275    H    LEU  54           H        LEU  54  -3.416   9.479  -4.360
  276    HA   LEU  54           HA       LEU  54  -1.585  11.516  -3.354
  277    HB2  LEU  54           HB1      LEU  54  -0.959  10.442  -5.419
  278    HB3  LEU  54           HB2      LEU  54  -2.530  10.841  -6.133
  279    HG   LEU  54           HG       LEU  54  -1.670  13.320  -5.596
  280   HD11  LEU  54          HD11      LEU  54   0.446  12.522  -4.637
  281   HD12  LEU  54          HD12      LEU  54   0.696  13.519  -6.069
  282   HD13  LEU  54          HD13      LEU  54   0.846  11.766  -6.180
  283   HD21  LEU  54          HD21      LEU  54  -2.438  12.434  -7.760
  284   HD22  LEU  54          HD22      LEU  54  -0.847  11.717  -8.015
  285   HD23  LEU  54          HD23      LEU  54  -1.020  13.470  -7.925
  286    H    GLN  55           H        GLN  55  -2.234  13.488  -2.806
  287    HA   GLN  55           HA       GLN  55  -4.896  14.379  -3.698
  288    HB2  GLN  55           HB1      GLN  55  -3.401  15.265  -1.222
  289    HB3  GLN  55           HB2      GLN  55  -5.070  15.662  -1.660
  290    HG2  GLN  55           HG1      GLN  55  -5.476  14.006  -0.163
  291    HG3  GLN  55           HG2      GLN  55  -5.337  13.040  -1.638
  292   HE21  GLN  55          HE21      GLN  55  -4.958  11.496   0.286
  293   HE22  GLN  55          HE22      GLN  55  -3.302  11.215   0.689
  294    HA   PRO  56           HA       PRO  56  -2.001  17.263  -5.768
  295    HB2  PRO  56           HB1      PRO  56  -3.631  17.684  -7.929
  296    HB3  PRO  56           HB2      PRO  56  -2.533  16.311  -7.791
  297    HG2  PRO  56           HG1      PRO  56  -5.469  16.467  -7.195
  298    HG3  PRO  56           HG2      PRO  56  -4.553  15.203  -8.100
  299    HD2  PRO  56           HD1      PRO  56  -5.345  14.877  -5.524
  300    HD3  PRO  56           HD2      PRO  56  -3.839  14.191  -6.155
  301    H    ARG  57           H        ARG  57  -2.068  19.490  -5.886
  302    HA   ARG  57           HA       ARG  57  -4.214  20.765  -4.431
  303    HB2  ARG  57           HB1      ARG  57  -1.458  21.271  -4.890
  304    HB3  ARG  57           HB2      ARG  57  -2.363  22.658  -5.512
  305    HG2  ARG  57           HG1      ARG  57  -3.565  22.742  -3.294
  306    HG3  ARG  57           HG2      ARG  57  -2.379  21.559  -2.717
  307    HD2  ARG  57           HD1      ARG  57  -1.607  23.739  -2.082
  308    HD3  ARG  57           HD2      ARG  57  -0.570  23.140  -3.385
  309    HE   ARG  57           HE       ARG  57  -2.554  24.611  -4.613
  310   HH11  ARG  57          HH11      ARG  57  -0.043  25.179  -2.271
  311   HH12  ARG  57          HH12      ARG  57   0.178  26.839  -2.718
  312   HH21  ARG  57          HH21      ARG  57  -2.273  26.794  -5.210
  313   HH22  ARG  57          HH22      ARG  57  -1.092  27.756  -4.389
  314    H    ASP  58           H        ASP  58  -3.184  20.416  -7.721
  315    HA   ASP  58           HA       ASP  58  -4.910  22.566  -8.657
  316    HB2  ASP  58           HB1      ASP  58  -2.537  21.533  -9.595
  317    HB3  ASP  58           HB2      ASP  58  -3.725  20.800 -10.679
  318    HD2  ASP  58           HD       ASP  58  -4.729  24.081 -11.741
  319    H    GLU  59           H        GLU  59  -4.957  19.145  -8.237
  320    HA   GLU  59           HA       GLU  59  -7.548  19.029  -9.637
  321    HB2  GLU  59           HB1      GLU  59  -5.202  17.537 -10.165
  322    HB3  GLU  59           HB2      GLU  59  -6.362  16.427  -9.418
  323    HG2  GLU  59           HG1      GLU  59  -7.894  16.637 -11.131
  324    HG3  GLU  59           HG2      GLU  59  -7.244  18.200 -11.646
  325    HE2  GLU  59           HE       GLU  59  -4.432  16.133 -12.955
  326    H    LYS  60           H        LYS  60  -8.620  16.769  -8.870
  327    HA   LYS  60           HA       LYS  60  -9.068  17.152  -6.033
  328    HB2  LYS  60           HB1      LYS  60 -10.482  15.875  -8.282
  329    HB3  LYS  60           HB2      LYS  60 -10.648  15.039  -6.730
  330    HG2  LYS  60           HG1      LYS  60 -11.264  17.354  -5.777
  331    HG3  LYS  60           HG2      LYS  60 -11.515  17.805  -7.473
  332    HD2  LYS  60           HD1      LYS  60 -13.414  16.601  -7.656
  333    HD3  LYS  60           HD2      LYS  60 -12.766  15.266  -6.687
  334    HE2  LYS  60           HE1      LYS  60 -13.460  17.862  -5.354
  335    HE3  LYS  60           HE2      LYS  60 -14.740  16.714  -5.775
  336    HZ1  LYS  60           HZ1      LYS  60 -14.187  15.399  -4.089
  337    HZ2  LYS  60           HZ2      LYS  60 -13.209  16.656  -3.518
  338    HZ3  LYS  60           HZ3      LYS  60 -12.540  15.433  -4.476
  339    HA   PRO  61           HA       PRO  61  -6.746  13.764  -4.491
  340    HB2  PRO  61           HB1      PRO  61  -8.391  12.748  -2.552
  341    HB3  PRO  61           HB2      PRO  61  -7.543  14.287  -2.401
  342    HG2  PRO  61           HG1      PRO  61 -10.372  13.748  -3.244
  343    HG3  PRO  61           HG2      PRO  61  -9.740  14.986  -2.096
  344    HD2  PRO  61           HD1      PRO  61 -10.436  15.577  -4.653
  345    HD3  PRO  61           HD2      PRO  61  -9.110  16.395  -3.809
  346    H    PHE  62           H        PHE  62  -6.353  11.677  -4.991
  347    HA   PHE  62           HA       PHE  62  -8.365   9.701  -5.298
  348    HB2  PHE  62           HB1      PHE  62  -8.353   9.344  -7.652
  349    HB3  PHE  62           HB2      PHE  62  -8.668  11.062  -7.403
  350    HD1  PHE  62           HD1      PHE  62  -6.855   8.822  -9.315
  351    HD2  PHE  62           HD2      PHE  62  -6.423  12.534  -7.278
  352    HE1  PHE  62           HE1      PHE  62  -4.960   9.397 -10.774
  353    HE2  PHE  62           HE2      PHE  62  -4.528  13.116  -8.735
  354    HZ   PHE  62           HZ       PHE  62  -3.794  11.548 -10.486
  355    H    CYS  63           H        CYS  63  -7.491   7.608  -5.844
  356    HA   CYS  63           HA       CYS  63  -4.886   7.211  -4.774
  357    HB2  CYS  63           HB1      CYS  63  -6.784   5.598  -4.560
  358    HB3  CYS  63           HB2      CYS  63  -6.605   5.228  -6.275
  359    H    ALA  64           H        ALA  64  -2.967   6.981  -5.754
  360    HA   ALA  64           HA       ALA  64  -2.842   6.472  -8.623
  361    HB1  ALA  64           HB1      ALA  64  -2.813   8.772  -8.828
  362    HB2  ALA  64           HB2      ALA  64  -1.942   9.001  -7.310
  363    HB3  ALA  64           HB3      ALA  64  -1.093   8.393  -8.730
  364    H    THR  65           H        THR  65  -0.711   5.868  -9.358
  365    HA   THR  65           HA       THR  65   0.582   4.024  -7.767
  366    HB   THR  65           HB       THR  65   2.608   4.802  -9.439
  367    HG1  THR  65           HG1      THR  65   0.268   5.209 -10.970
  368   HG21  THR  65          HG21      THR  65   0.233   3.045 -10.067
  369   HG22  THR  65          HG22      THR  65   1.730   2.550  -9.276
  370   HG23  THR  65          HG23      THR  65   1.749   3.052 -10.967
  371    H    CYS  66           H        CYS  66   2.310   4.027  -6.399
  372    HA   CYS  66           HA       CYS  66   2.911   6.417  -5.008
  373    HB2  CYS  66           HB1      CYS  66   4.519   5.074  -3.753
  374    HB3  CYS  66           HB2      CYS  66   2.989   4.213  -3.932
  375    H    ARG  67           H        ARG  67   5.115   7.280  -4.677
  376    HA   ARG  67           HA       ARG  67   6.236   8.258  -7.001
  377    HB2  ARG  67           HB1      ARG  67   7.393   7.900  -4.238
  378    HB3  ARG  67           HB2      ARG  67   8.283   8.707  -5.537
  379    HG2  ARG  67           HG1      ARG  67   5.548   9.583  -4.619
  380    HG3  ARG  67           HG2      ARG  67   7.063  10.227  -3.961
  381    HD2  ARG  67           HD1      ARG  67   7.647  11.281  -5.948
  382    HD3  ARG  67           HD2      ARG  67   6.615  10.219  -6.915
  383    HE   ARG  67           HE       ARG  67   4.835  11.564  -5.394
  384   HH11  ARG  67          HH11      ARG  67   7.471  12.571  -7.432
  385   HH12  ARG  67          HH12      ARG  67   6.736  14.080  -7.860
  386   HH21  ARG  67          HH21      ARG  67   3.856  13.549  -5.950
  387   HH22  ARG  67          HH22      ARG  67   4.680  14.636  -7.015
  388    H    GLY  68           H        GLY  68   7.232   7.236  -8.602
  389    HA2  GLY  68           HA2      GLY  68   8.119   4.598  -8.553
  390    HA3  GLY  68           HA3      GLY  68   8.610   5.797  -9.740
  391    HA1  GLY  68           HA1      GLY  68   8.291   5.010  -7.791
  392    H    LEU  69           H        LEU  69  10.516   4.137  -9.358
  393    HA   LEU  69           HA       LEU  69  12.164   4.577  -7.079
  394    HB2  LEU  69           HB1      LEU  69  12.405   3.150  -9.675
  395    HB3  LEU  69           HB2      LEU  69  13.905   3.580  -8.835
  396    HG   LEU  69           HG       LEU  69  11.681   1.885  -7.700
  397   HD11  LEU  69          HD11      LEU  69  14.221   0.587  -7.940
  398   HD12  LEU  69          HD12      LEU  69  13.722   1.219  -9.509
  399   HD13  LEU  69          HD13      LEU  69  12.660   0.125  -8.622
  400   HD21  LEU  69          HD21      LEU  69  12.732   3.034  -5.909
  401   HD22  LEU  69          HD22      LEU  69  14.337   2.769  -6.590
  402   HD23  LEU  69          HD23      LEU  69  13.418   1.409  -5.942
  403    H    ARG  70           H        ARG  70  11.664   6.283 -10.006
  404    HA   ARG  70           HA       ARG  70  14.199   7.727  -9.755
  405    HB2  ARG  70           HB1      ARG  70  12.108   8.118 -11.897
  406    HB3  ARG  70           HB2      ARG  70  13.823   8.559 -11.946
  407    HG2  ARG  70           HG1      ARG  70  13.904   6.689 -13.231
  408    HG3  ARG  70           HG2      ARG  70  14.132   5.950 -11.637
  409    HD2  ARG  70           HD1      ARG  70  12.351   4.668 -12.034
  410    HD3  ARG  70           HD2      ARG  70  11.363   6.135 -11.975
  411    HE   ARG  70           HE       ARG  70  12.452   5.938 -14.538
  412   HH11  ARG  70          HH11      ARG  70  10.198   4.251 -12.491
  413   HH12  ARG  70          HH12      ARG  70   9.250   3.647 -13.809
  414   HH21  ARG  70          HH21      ARG  70  11.212   5.150 -16.283
  415   HH22  ARG  70          HH22      ARG  70   9.829   4.160 -15.967
  416    H    ARG  71           H        ARG  71  11.062   7.941  -8.670
  417    HA   ARG  71           HA       ARG  71  10.779  10.810  -8.844
  418    HB2  ARG  71           HB1      ARG  71   9.121   8.535  -8.063
  419    HB3  ARG  71           HB2      ARG  71   8.934   9.921  -6.981
  420    HG2  ARG  71           HG1      ARG  71   7.288   9.925  -8.810
  421    HG3  ARG  71           HG2      ARG  71   8.341  11.350  -8.829
  422    HD2  ARG  71           HD1      ARG  71   9.626  10.505 -10.644
  423    HD3  ARG  71           HD2      ARG  71   8.894   8.901 -10.485
  424    HE   ARG  71           HE       ARG  71   6.875  10.784 -11.018
  425   HH11  ARG  71          HH11      ARG  71   9.578   9.226 -12.562
  426   HH12  ARG  71          HH12      ARG  71   8.901   9.335 -14.152
  427   HH21  ARG  71          HH21      ARG  71   5.972  10.934 -13.106
  428   HH22  ARG  71          HH22      ARG  71   6.850  10.308 -14.461
  429    H    ARG  72           H        ARG  72  11.053  12.289  -7.219
  430    HA   ARG  72           HA       ARG  72  12.905  11.605  -5.153
  431    HB2  ARG  72           HB1      ARG  72  12.604  13.999  -4.461
  432    HB3  ARG  72           HB2      ARG  72  13.098  13.771  -6.145
  433    HG2  ARG  72           HG1      ARG  72  10.191  13.896  -5.752
  434    HG3  ARG  72           HG2      ARG  72  11.068  15.376  -5.322
  435    HD2  ARG  72           HD1      ARG  72  12.268  14.745  -7.681
  436    HD3  ARG  72           HD2      ARG  72  10.630  14.131  -7.952
  437    HE   ARG  72           HE       ARG  72   9.862  16.290  -8.030
  438   HH11  ARG  72          HH11      ARG  72  13.072  16.256  -6.681
  439   HH12  ARG  72          HH12      ARG  72  13.242  17.981  -6.705
  440   HH21  ARG  72          HH21      ARG  72  10.073  18.561  -8.066
  441   HH22  ARG  72          HH22      ARG  72  11.535  19.290  -7.492
  442    H    CYS  73           H        CYS  73  12.568  12.028  -2.862
  443    HA   CYS  73           HA       CYS  73   9.850  12.117  -1.879
  444    HB2  CYS  73           HB1      CYS  73   9.850  10.023  -0.746
  445    HB3  CYS  73           HB2      CYS  73  10.289   9.697  -2.423
  446    H    GLN  74           H        GLN  74   9.707  12.713   0.281
  447    HA   GLN  74           HA       GLN  74  12.270  13.421   1.550
  448    HB2  GLN  74           HB1      GLN  74   9.597  14.819   1.812
  449    HB3  GLN  74           HB2      GLN  74  11.102  15.296   2.615
  450    HG2  GLN  74           HG1      GLN  74  12.030  16.157   0.713
  451    HG3  GLN  74           HG2      GLN  74  11.098  15.090  -0.346
  452   HE21  GLN  74          HE21      GLN  74   8.909  15.594  -0.777
  453   HE22  GLN  74          HE22      GLN  74   8.323  17.211  -0.615
  454    H    ARG  75           H        ARG  75   9.184  11.892   1.913
  455    HA   ARG  75           HA       ARG  75   9.909  11.154   4.672
  456    HB2  ARG  75           HB1      ARG  75   7.189  11.767   3.506
  457    HB3  ARG  75           HB2      ARG  75   7.411  10.929   5.050
  458    HG2  ARG  75           HG1      ARG  75   8.349  12.808   6.087
  459    HG3  ARG  75           HG2      ARG  75   8.651  13.607   4.535
  460    HD2  ARG  75           HD1      ARG  75   6.041  13.458   4.279
  461    HD3  ARG  75           HD2      ARG  75   6.092  13.301   6.041
  462    HE   ARG  75           HE       ARG  75   7.629  15.471   5.601
  463   HH11  ARG  75          HH11      ARG  75   4.442  14.567   4.530
  464   HH12  ARG  75          HH12      ARG  75   3.869  16.199   4.437
  465   HH21  ARG  75          HH21      ARG  75   6.886  17.624   5.484
  466   HH22  ARG  75          HH22      ARG  75   5.259  17.938   4.978
  467    H    ASP  76           H        ASP  76   9.917   9.032   5.153
  468    HA   ASP  76           HA       ASP  76   9.987   7.092   3.161
  469    HB2  ASP  76           HB1      ASP  76  11.080   6.566   5.178
  470    HB3  ASP  76           HB2      ASP  76   9.645   6.926   6.145
  471    HD2  ASP  76           HD       ASP  76   9.561   3.465   4.190
  472    H    ALA  77           H        ALA  77   7.302   8.429   4.880
  473    HA   ALA  77           HA       ALA  77   5.467   6.299   4.347
  474    HB1  ALA  77           HB1      ALA  77   4.667   9.129   4.936
  475    HB2  ALA  77           HB2      ALA  77   3.833   7.632   5.352
  476    HB3  ALA  77           HB3      ALA  77   5.321   8.075   6.189
  477    H    MET  78           H        MET  78   6.284   9.358   2.791
  478    HA   MET  78           HA       MET  78   4.212   9.542   0.959
  479    HB2  MET  78           HB1      MET  78   6.981  10.553   1.144
  480    HB3  MET  78           HB2      MET  78   6.304  10.497  -0.490
  481    HG2  MET  78           HG1      MET  78   4.827  11.784   1.794
  482    HG3  MET  78           HG2      MET  78   6.027  12.654   0.834
  483    HE1  MET  78           HE1      MET  78   4.996  13.299  -2.323
  484    HE2  MET  78           HE2      MET  78   6.118  12.124  -1.639
  485    HE3  MET  78           HE3      MET  78   4.761  11.577  -2.626
  486    H    CYS  79           H        CYS  79   6.937   7.395   1.022
  487    HA   CYS  79           HA       CYS  79   6.375   6.475  -1.703
  488    HB2  CYS  79           HB1      CYS  79   8.721   6.420   0.093
  489    HB3  CYS  79           HB2      CYS  79   8.484   4.964  -0.876
  490    H    CYS  80           H        CYS  80   5.465   4.550  -2.132
  491    HA   CYS  80           HA       CYS  80   3.926   3.187  -0.304
  492    HB2  CYS  80           HB1      CYS  80   4.032   1.258  -1.957
  493    HB3  CYS  80           HB2      CYS  80   3.492   2.810  -2.600
  494    HA   PRO  81           HA       PRO  81   6.534   0.608   2.104
  495    HB2  PRO  81           HB1      PRO  81   4.975  -1.622   2.416
  496    HB3  PRO  81           HB2      PRO  81   4.643  -0.084   3.210
  497    HG2  PRO  81           HG1      PRO  81   3.471  -1.215   0.692
  498    HG3  PRO  81           HG2      PRO  81   2.640  -0.410   2.075
  499    HD2  PRO  81           HD1      PRO  81   3.175   0.868  -0.260
  500    HD3  PRO  81           HD2      PRO  81   3.193   1.692   1.308
  501    H    GLY  82           H        GLY  82   8.336  -0.331   1.379
  502    HA2  GLY  82           HA2      GLY  82   8.938  -2.730   0.597
  503    HA3  GLY  82           HA3      GLY  82   8.155  -2.199  -0.884
  504    HA1  GLY  82           HA1      GLY  82   9.228  -1.969   0.936
  505    H    THR  83           H        THR  83   9.327   0.581  -0.131
  506    HA   THR  83           HA       THR  83  12.037   0.043  -1.159
  507    HB   THR  83           HB       THR  83  11.653   2.536  -2.059
  508    HG1  THR  83           HG1      THR  83   9.087   1.380  -2.418
  509   HG21  THR  83          HG21      THR  83  12.209   1.316  -3.847
  510   HG22  THR  83          HG22      THR  83  10.483   1.039  -4.082
  511   HG23  THR  83          HG23      THR  83  11.450  -0.130  -3.182
  512    H    LEU  84           H        LEU  84  13.459   2.095  -0.859
  513    HA   LEU  84           HA       LEU  84  12.966   3.226   1.814
  514    HB2  LEU  84           HB1      LEU  84  14.821   1.352   1.402
  515    HB3  LEU  84           HB2      LEU  84  15.760   2.777   0.924
  516    HG   LEU  84           HG       LEU  84  14.428   2.410   3.608
  517   HD11  LEU  84          HD11      LEU  84  17.249   2.526   3.782
  518   HD12  LEU  84          HD12      LEU  84  16.836   1.301   2.583
  519   HD13  LEU  84          HD13      LEU  84  16.175   1.195   4.215
  520   HD21  LEU  84          HD21      LEU  84  15.969   4.606   2.324
  521   HD22  LEU  84          HD22      LEU  84  16.216   4.303   4.044
  522   HD23  LEU  84          HD23      LEU  84  14.603   4.681   3.437
  523    H    CYS  85           H        CYS  85  13.308   5.369   2.049
  524    HA   CYS  85           HA       CYS  85  13.712   6.937  -0.325
  525    HB2  CYS  85           HB1      CYS  85  12.922   7.439   2.491
  526    HB3  CYS  85           HB2      CYS  85  13.698   8.780   1.647
  527    H    VAL  86           H        VAL  86  15.781   6.793  -1.060
  528    HA   VAL  86           HA       VAL  86  17.939   7.515   0.810
  529    HB   VAL  86           HB       VAL  86  18.128   6.070  -1.837
  530   HG11  VAL  86          HG11      VAL  86  20.505   5.654  -0.674
  531   HG12  VAL  86          HG12      VAL  86  20.193   6.996  -1.776
  532   HG13  VAL  86          HG13      VAL  86  20.145   7.257  -0.032
  533   HG21  VAL  86          HG21      VAL  86  17.146   4.668  -0.126
  534   HG22  VAL  86          HG22      VAL  86  18.797   4.138  -0.454
  535   HG23  VAL  86          HG23      VAL  86  18.444   5.080   0.995
  536    H    ASN  87           H        ASN  87  19.162   9.284   0.453
  537    HA   ASN  87           HA       ASN  87  19.716  11.344  -0.348
  538    HB2  ASN  87           HB1      ASN  87  19.629   9.635  -2.825
  539    HB3  ASN  87           HB2      ASN  87  20.018  11.357  -2.930
  540   HD21  ASN  87          HD21      ASN  87  22.066  10.594  -3.765
  541   HD22  ASN  87          HD22      ASN  87  23.313  10.139  -2.660
  542    H    ASP  88           H        ASP  88  16.957  10.967   0.177
  543    HA   ASP  88           HA       ASP  88  14.973  12.048  -0.089
  544    HB2  ASP  88           HB1      ASP  88  16.847  13.945  -0.571
  545    HB3  ASP  88           HB2      ASP  88  15.986  13.953  -2.116
  546    HD2  ASP  88           HD       ASP  88  13.775  14.905   1.049
  547    H    VAL  89           H        VAL  89  15.685   9.839  -1.819
  548    HA   VAL  89           HA       VAL  89  13.684  10.290  -3.888
  549    HB   VAL  89           HB       VAL  89  16.446   9.249  -4.536
  550   HG11  VAL  89          HG11      VAL  89  14.034   9.608  -6.314
  551   HG12  VAL  89          HG12      VAL  89  15.642   9.104  -6.839
  552   HG13  VAL  89          HG13      VAL  89  14.697   8.068  -5.768
  553   HG21  VAL  89          HG21      VAL  89  16.643  11.223  -5.951
  554   HG22  VAL  89          HG22      VAL  89  15.043  11.764  -5.442
  555   HG23  VAL  89          HG23      VAL  89  16.361  11.685  -4.272
  556    H    CYS  90           H        CYS  90  12.590   8.449  -4.511
  557    HA   CYS  90           HA       CYS  90  12.549   6.300  -2.675
  558    HB2  CYS  90           HB1      CYS  90  10.858   7.283  -4.638
  559    HB3  CYS  90           HB2      CYS  90  11.353   5.714  -5.278
  560    H    THR  91           H        THR  91  14.227   4.950  -2.505
  561    HA   THR  91           HA       THR  91  15.239   3.701  -4.975
  562    HB   THR  91           HB       THR  91  16.857   4.330  -2.498
  563    HG1  THR  91           HG1      THR  91  16.213   6.032  -4.208
  564   HG21  THR  91          HG21      THR  91  17.516   2.249  -3.693
  565   HG22  THR  91          HG22      THR  91  18.759   3.501  -3.728
  566   HG23  THR  91          HG23      THR  91  17.760   3.208  -5.151
  567    H    THR  92           H        THR  92  15.280   1.530  -5.021
  568    HA   THR  92           HA       THR  92  13.828  -0.029  -3.270
  569    HB   THR  92           HB       THR  92  15.747  -1.784  -4.278
  570    HG1  THR  92           HG1      THR  92  15.871  -1.047  -6.497
  571   HG21  THR  92          HG21      THR  92  13.274  -0.950  -5.774
  572   HG22  THR  92          HG22      THR  92  13.192  -1.862  -4.266
  573   HG23  THR  92          HG23      THR  92  14.009  -2.550  -5.671
  574    H    MET  93           H        MET  93  14.460  -1.651  -1.733
  575    HA   MET  93           HA       MET  93  16.363  -0.704   0.154
  576    HB2  MET  93           HB1      MET  93  14.349  -2.807  -0.006
  577    HB3  MET  93           HB2      MET  93  15.800  -3.326   0.864
  578    HG2  MET  93           HG1      MET  93  15.443  -1.927   2.611
  579    HG3  MET  93           HG2      MET  93  14.722  -0.680   1.591
  580    HE1  MET  93           HE1      MET  93  12.554  -0.569   3.901
  581    HE2  MET  93           HE2      MET  93  12.875   0.108   2.305
  582    HE3  MET  93           HE3      MET  93  11.337  -0.691   2.631
  583    H    GLU  94           H        GLU  94  16.349  -3.327  -2.210
  584    HA   GLU  94           HA       GLU  94  18.818  -4.470  -1.392
  585    HB2  GLU  94           HB1      GLU  94  17.455  -4.616  -4.093
  586    HB3  GLU  94           HB2      GLU  94  18.729  -5.696  -3.503
  587    HG2  GLU  94           HG1      GLU  94  16.105  -5.414  -2.067
  588    HG3  GLU  94           HG2      GLU  94  16.325  -6.536  -3.418
  589    HE2  GLU  94           HE       GLU  94  17.717  -7.539   0.096
  590    H    ASP  95           H        ASP  95  17.958  -1.800  -3.429
  591    HA   ASP  95           HA       ASP  95  20.476  -1.634  -4.791
  592    HB2  ASP  95           HB1      ASP  95  17.917  -0.298  -4.885
  593    HB3  ASP  95           HB2      ASP  95  19.230   0.890  -4.862
  594    HD2  ASP  95           HD       ASP  95  18.500  -0.737  -8.227
  595    H    ALA  96           H        ALA  96  19.051  -0.192  -1.921
  596    HA   ALA  96           HA       ALA  96  20.886   1.847  -1.445
  597    HB1  ALA  96           HB1      ALA  96  20.089   1.892   0.783
  598    HB2  ALA  96           HB2      ALA  96  18.723   1.411  -0.223
  599    HB3  ALA  96           HB3      ALA  96  19.596   0.199   0.715
  600    H    THR  97           H        THR  97  22.953   1.889  -0.840
  601    HA   THR  97           HA       THR  97  24.197  -0.643   0.005
  602    HB   THR  97           HB       THR  97  26.347   0.378  -0.764
  603    HG1  THR  97           HG1      THR  97  26.193   2.250  -2.070
  604   HG21  THR  97          HG21      THR  97  26.060  -0.306  -2.946
  605   HG22  THR  97          HG22      THR  97  24.474   0.451  -3.088
  606   HG23  THR  97          HG23      THR  97  24.656  -1.049  -2.180
  607    H    GLU  98           H        GLU  98  23.928  -0.494   2.213
  608    HA   GLU  98           HA       GLU  98  24.709   1.908   3.627
  609    HB2  GLU  98           HB1      GLU  98  23.137  -0.436   4.185
  610    HB3  GLU  98           HB2      GLU  98  24.357  -0.221   5.449
  611    HG2  GLU  98           HG1      GLU  98  22.891   2.216   4.665
  612    HG3  GLU  98           HG2      GLU  98  21.940   0.960   5.471
  613    HE2  GLU  98           HE       GLU  98  23.099   2.180   8.450
  614    H    ASN  99           H        ASN  99  25.837  -1.458   3.417
  615    HA   ASN  99           HA       ASN  99  27.863  -2.413   3.814
  616    HB2  ASN  99           HB1      ASN  99  28.488  -0.385   2.295
  617    HB3  ASN  99           HB2      ASN  99  29.155   0.298   3.782
  618   HD21  ASN  99          HD21      ASN  99  30.439  -0.647   1.283
  619   HD22  ASN  99          HD22      ASN  99  31.634  -1.786   1.793
  620    H    LEU 100           H        LEU 100  27.713  -3.175   5.859
  621    HA   LEU 100           HA       LEU 100  28.892  -1.518   7.966
  622    HB2  LEU 100           HB1      LEU 100  26.314  -3.076   8.225
  623    HB3  LEU 100           HB2      LEU 100  27.186  -2.313   9.566
  624    HG   LEU 100           HG       LEU 100  26.206  -0.683   7.247
  625   HD11  LEU 100          HD11      LEU 100  24.586  -2.091   9.184
  626   HD12  LEU 100          HD12      LEU 100  24.099  -1.160   7.768
  627   HD13  LEU 100          HD13      LEU 100  24.378  -0.344   9.306
  628   HD21  LEU 100          HD21      LEU 100  27.813   0.290   8.849
  629   HD22  LEU 100          HD22      LEU 100  26.668  -0.023  10.154
  630   HD23  LEU 100          HD23      LEU 100  26.250   1.109   8.866
  631    H    TYR 101           H        TYR 101  30.132  -2.619   9.426
  632    HA   TYR 101           HA       TYR 101  30.318  -5.538   9.059
  633    HB2  TYR 101           HB1      TYR 101  32.744  -5.330   9.577
  634    HB3  TYR 101           HB2      TYR 101  32.276  -4.525   8.078
  635    HD1  TYR 101           HD1      TYR 101  32.156  -2.061   7.954
  636    HD2  TYR 101           HD2      TYR 101  33.592  -4.048  11.431
  637    HE1  TYR 101           HE1      TYR 101  33.157   0.045   8.736
  638    HE2  TYR 101           HE2      TYR 101  34.597  -1.948  12.223
  639    HH   TYR 101           HH       TYR 101  33.928   0.752  11.627
  640    H    PHE 102           H        PHE 102  30.270  -6.772  10.847
  641    HA   PHE 102           HA       PHE 102  30.776  -5.590  13.459
  642    HB2  PHE 102           HB1      PHE 102  28.106  -6.458  12.471
  643    HB3  PHE 102           HB2      PHE 102  28.534  -6.914  14.123
  644    HD1  PHE 102           HD1      PHE 102  27.741  -4.140  11.898
  645    HD2  PHE 102           HD2      PHE 102  28.876  -5.240  15.850
  646    HE1  PHE 102           HE1      PHE 102  27.117  -1.898  12.698
  647    HE2  PHE 102           HE2      PHE 102  28.253  -3.001  16.656
  648    HZ   PHE 102           HZ       PHE 102  27.371  -1.326  15.080
  649    H    GLN 103           H        GLN 103  32.603  -7.019  13.303
  650    HA   GLN 103           HA       GLN 103  31.947  -9.872  13.568
  651    HB2  GLN 103           HB1      GLN 103  33.590  -9.055  11.790
  652    HB3  GLN 103           HB2      GLN 103  34.696  -8.719  13.132
  653    HG2  GLN 103           HG1      GLN 103  34.983 -10.953  13.651
  654    HG3  GLN 103           HG2      GLN 103  33.478 -11.428  12.853
  655   HE21  GLN 103          HE21      GLN 103  34.522 -13.025  11.664
  656   HE22  GLN 103          HE22      GLN 103  35.543 -12.650  10.321
  657    H    SER 104           H        SER 104  32.780 -11.094  15.273
  658    HA   SER 104           HA       SER 104  33.862  -9.532  17.526
  659    HB2  SER 104           HB1      SER 104  31.565 -10.065  18.044
  660    HB3  SER 104           HB2      SER 104  31.816 -11.760  17.592
  661    HG   SER 104           HG       SER 104  32.542 -10.419  19.908
  662    H    LEU 105           H        LEU 105  35.125 -10.787  19.078
  663    HA   LEU 105           HA       LEU 105  36.226 -13.294  18.050
  664    HB2  LEU 105           HB1      LEU 105  38.536 -12.380  18.720
  665    HB3  LEU 105           HB2      LEU 105  37.833 -11.878  17.173
  666    HG   LEU 105           HG       LEU 105  37.208 -10.050  19.363
  667   HD11  LEU 105          HD11      LEU 105  39.481  -9.077  19.436
  668   HD12  LEU 105          HD12      LEU 105  40.081 -10.488  18.566
  669   HD13  LEU 105          HD13      LEU 105  39.386 -10.675  20.174
  670   HD21  LEU 105          HD21      LEU 105  37.988  -8.413  17.683
  671   HD22  LEU 105          HD22      LEU 105  36.753  -9.507  17.057
  672   HD23  LEU 105          HD23      LEU 105  38.447  -9.750  16.630
  673    H    GLU 106           H        GLU 106  37.015 -14.680  19.616
  674    HA   GLU 106           HA       GLU 106  37.228 -13.808  22.367
  675    HB2  GLU 106           HB1      GLU 106  34.821 -15.044  21.353
  676    HB3  GLU 106           HB2      GLU 106  35.581 -16.074  22.577
  677    HG2  GLU 106           HG1      GLU 106  35.699 -13.989  24.039
  678    HG3  GLU 106           HG2      GLU 106  34.585 -13.261  22.872
  679    HE2  GLU 106           HE       GLU 106  31.990 -15.437  23.874
  680    H    HIS 107           H        HIS 107  37.725 -15.784  23.804
  681    HA   HIS 107           HA       HIS 107  39.081 -17.925  22.361
  682    HB2  HIS 107           HB1      HIS 107  40.460 -15.687  23.471
  683    HB3  HIS 107           HB2      HIS 107  40.841 -17.105  24.453
  684    HD1  HIS 107           HD1      HIS 107  41.020 -19.287  22.344
  685    HD2  HIS 107           HD2      HIS 107  42.649 -15.496  21.859
  686    HE1  HIS 107           HE1      HIS 107  42.833 -19.550  20.622
  687    HE2  HIS 107           HE2      HIS 107  43.830 -17.234  20.324
  688    H    HIS 108           H        HIS 108  40.295 -19.282  24.280
  689    HA   HIS 108           HA       HIS 108  38.578 -19.481  26.619
  690    HB2  HIS 108           HB1      HIS 108  37.924 -21.001  24.447
  691    HB3  HIS 108           HB2      HIS 108  39.007 -22.091  25.318
  692    HD1  HIS 108           HD1      HIS 108  35.824 -22.382  24.988
  693    HD2  HIS 108           HD2      HIS 108  37.886 -21.127  28.370
  694    HE1  HIS 108           HE1      HIS 108  34.286 -22.844  26.923
  695    HE2  HIS 108           HE2      HIS 108  35.546 -22.077  28.991
  696    H    HIS 109           H        HIS 109  39.704 -20.046  28.378
  697    HA   HIS 109           HA       HIS 109  41.934 -21.814  28.331
  698    HB2  HIS 109           HB1      HIS 109  42.689 -19.403  27.464
  699    HB3  HIS 109           HB2      HIS 109  42.786 -19.096  29.201
  700    HD1  HIS 109           HD1      HIS 109  44.147 -21.598  26.685
  701    HD2  HIS 109           HD2      HIS 109  45.104 -19.904  30.356
  702    HE1  HIS 109           HE1      HIS 109  46.448 -22.449  27.239
  703    HE2  HIS 109           HE2      HIS 109  47.033 -21.415  29.483
  704    H    HIS 110           H        HIS 110  42.609 -22.417  30.400
  705    HA   HIS 110           HA       HIS 110  41.841 -21.045  32.761
  706    HB2  HIS 110           HB1      HIS 110  39.659 -22.116  31.812
  707    HB3  HIS 110           HB2      HIS 110  40.345 -23.625  32.423
  708    HD1  HIS 110           HD1      HIS 110  40.753 -20.396  34.295
  709    HD2  HIS 110           HD2      HIS 110  38.520 -23.894  34.499
  710    HE1  HIS 110           HE1      HIS 110  39.630 -20.348  36.544
  711    HE2  HIS 110           HE2      HIS 110  38.264 -22.485  36.669
  712    H    HIS 111           H        HIS 111  42.946 -21.794  34.510
  713    HA   HIS 111           HA       HIS 111  44.576 -24.210  34.081
  714    HB2  HIS 111           HB1      HIS 111  45.273 -21.544  34.876
  715    HB3  HIS 111           HB2      HIS 111  45.649 -22.654  36.198
  716    HD1  HIS 111           HD1      HIS 111  46.410 -22.233  32.508
  717    HD2  HIS 111           HD2      HIS 111  47.955 -24.072  35.897
  718    HE1  HIS 111           HE1      HIS 111  48.647 -23.148  31.815
  719    HE2  HIS 111           HE2      HIS 111  49.593 -24.272  33.886
  720    H    HIS 112           H        HIS 112  43.910 -25.897  35.220
  721    HA   HIS 112           HA       HIS 112  42.024 -25.844  37.268
  722    HB2  HIS 112           HB1      HIS 112  42.858 -28.171  37.792
  723    HB3  HIS 112           HB2      HIS 112  42.376 -27.895  36.116
  724    HD1  HIS 112           HD1      HIS 112  45.694 -26.583  37.109
  725    HD2  HIS 112           HD2      HIS 112  44.125 -29.998  35.340
  726    HE1  HIS 112           HE1      HIS 112  47.663 -27.786  36.110
  727    HE2  HIS 112           HE2      HIS 112  46.705 -29.875  35.028
  Start of MODEL   55
    1    H1   MET  18           H        MET  18 -66.266  34.196 -22.966
    2    HA   MET  18           HA       MET  18 -66.299  33.719 -20.644
    3    HB2  MET  18           HB1      MET  18 -67.197  31.385 -21.281
    4    HB3  MET  18           HB2      MET  18 -65.498  30.889 -21.267
    5    HG2  MET  18           HG1      MET  18 -65.655  32.152 -18.877
    6    HG3  MET  18           HG2      MET  18 -67.298  31.525 -19.037
    7    HE1  MET  18           HE1      MET  18 -64.020  31.247 -18.065
    8    HE2  MET  18           HE2      MET  18 -64.283  29.909 -16.946
    9    HE3  MET  18           HE3      MET  18 -63.368  29.649 -18.432
   10    H    LEU  19           H        LEU  19 -64.424  35.111 -21.598
   11    HA   LEU  19           HA       LEU  19 -61.844  33.760 -21.329
   12    HB2  LEU  19           HB1      LEU  19 -60.925  35.960 -22.112
   13    HB3  LEU  19           HB2      LEU  19 -61.972  35.113 -23.263
   14    HG   LEU  19           HG       LEU  19 -63.402  37.050 -21.604
   15   HD11  LEU  19          HD11      LEU  19 -62.403  38.878 -23.240
   16   HD12  LEU  19          HD12      LEU  19 -60.974  37.853 -23.108
   17   HD13  LEU  19          HD13      LEU  19 -61.695  38.552 -21.658
   18   HD21  LEU  19          HD21      LEU  19 -63.196  36.309 -24.500
   19   HD22  LEU  19          HD22      LEU  19 -64.053  37.766 -23.995
   20   HD23  LEU  19          HD23      LEU  19 -64.579  36.185 -23.413
   21    H    VAL  20           H        VAL  20 -62.380  33.518 -18.975
   22    HA   VAL  20           HA       VAL  20 -61.761  35.975 -17.474
   23    HB   VAL  20           HB       VAL  20 -63.061  33.444 -16.456
   24   HG11  VAL  20          HG11      VAL  20 -62.156  34.280 -14.544
   25   HG12  VAL  20          HG12      VAL  20 -62.105  35.933 -15.157
   26   HG13  VAL  20          HG13      VAL  20 -63.628  35.248 -14.589
   27   HG21  VAL  20          HG21      VAL  20 -64.160  35.596 -17.930
   28   HG22  VAL  20          HG22      VAL  20 -65.003  34.244 -17.174
   29   HG23  VAL  20          HG23      VAL  20 -64.739  35.736 -16.271
   30    H    LEU  21           H        LEU  21 -59.657  36.086 -17.033
   31    HA   LEU  21           HA       LEU  21 -57.955  33.809 -16.876
   32    HB2  LEU  21           HB1      LEU  21 -57.596  36.730 -16.246
   33    HB3  LEU  21           HB2      LEU  21 -56.314  35.542 -15.954
   34    HG   LEU  21           HG       LEU  21 -57.521  35.737 -18.679
   35   HD11  LEU  21          HD11      LEU  21 -57.021  37.931 -18.715
   36   HD12  LEU  21          HD12      LEU  21 -55.370  37.347 -18.918
   37   HD13  LEU  21          HD13      LEU  21 -55.947  37.819 -17.321
   38   HD21  LEU  21          HD21      LEU  21 -55.887  34.312 -19.137
   39   HD22  LEU  21          HD22      LEU  21 -55.396  34.335 -17.444
   40   HD23  LEU  21          HD23      LEU  21 -54.687  35.480 -18.584
   41    H    ASP  22           H        ASP  22 -56.776  33.059 -15.048
   42    HA   ASP  22           HA       ASP  22 -57.158  33.913 -12.413
   43    HB2  ASP  22           HB1      ASP  22 -59.417  32.574 -13.398
   44    HB3  ASP  22           HB2      ASP  22 -58.573  31.386 -12.395
   45    HD2  ASP  22           HD       ASP  22 -60.075  32.839  -9.689
   46    H    PHE  23           H        PHE  23 -55.592  33.047 -11.197
   47    HA   PHE  23           HA       PHE  23 -54.597  30.372 -11.765
   48    HB2  PHE  23           HB1      PHE  23 -53.208  32.823 -12.526
   49    HB3  PHE  23           HB2      PHE  23 -52.236  31.807 -11.459
   50    HD1  PHE  23           HD1      PHE  23 -52.772  32.499 -14.756
   51    HD2  PHE  23           HD2      PHE  23 -52.525  29.158 -12.129
   52    HE1  PHE  23           HE1      PHE  23 -52.166  31.055 -16.654
   53    HE2  PHE  23           HE2      PHE  23 -51.918  27.710 -14.022
   54    HZ   PHE  23           HZ       PHE  23 -51.737  28.657 -16.289
   55    H    ASN  24           H        ASN  24 -53.491  33.235  -9.947
   56    HA   ASN  24           HA       ASN  24 -52.929  33.519  -7.760
   57    HB2  ASN  24           HB1      ASN  24 -55.244  31.597  -7.563
   58    HB3  ASN  24           HB2      ASN  24 -54.417  32.193  -6.118
   59   HD21  ASN  24          HD21      ASN  24 -56.975  32.712  -8.080
   60   HD22  ASN  24          HD22      ASN  24 -57.254  34.388  -7.768
   61    H    ASN  25           H        ASN  25 -50.834  32.607  -8.111
   62    HA   ASN  25           HA       ASN  25 -50.470  30.069  -6.679
   63    HB2  ASN  25           HB1      ASN  25 -50.307  29.931  -9.272
   64    HB3  ASN  25           HB2      ASN  25 -48.752  30.743  -9.051
   65   HD21  ASN  25          HD21      ASN  25 -48.779  28.299 -10.180
   66   HD22  ASN  25          HD22      ASN  25 -48.124  27.123  -9.096
   67    H    ILE  26           H        ILE  26 -48.987  30.172  -5.119
   68    HA   ILE  26           HA       ILE  26 -46.958  32.301  -5.238
   69    HB   ILE  26           HB       ILE  26 -47.184  32.660  -2.824
   70   HG12  ILE  26          HG11      ILE  26 -49.581  31.751  -2.004
   71   HG13  ILE  26          HG12      ILE  26 -49.139  30.445  -3.117
   72   HG21  ILE  26          HG21      ILE  26 -49.244  33.929  -2.875
   73   HG22  ILE  26          HG22      ILE  26 -48.416  34.071  -4.425
   74   HG23  ILE  26          HG23      ILE  26 -49.811  33.002  -4.264
   75   HD11  ILE  26          HD11      ILE  26 -46.939  31.147  -1.378
   76   HD12  ILE  26          HD12      ILE  26 -48.378  30.668  -0.476
   77   HD13  ILE  26          HD13      ILE  26 -47.691  29.581  -1.681
   78    H    ARG  27           H        ARG  27 -44.943  31.778  -4.497
   79    HA   ARG  27           HA       ARG  27 -44.477  29.329  -3.038
   80    HB2  ARG  27           HB1      ARG  27 -44.654  28.789  -5.564
   81    HB3  ARG  27           HB2      ARG  27 -43.080  29.589  -5.685
   82    HG2  ARG  27           HG1      ARG  27 -41.974  27.938  -4.544
   83    HG3  ARG  27           HG2      ARG  27 -43.425  27.445  -3.654
   84    HD2  ARG  27           HD1      ARG  27 -43.675  25.769  -5.103
   85    HD3  ARG  27           HD2      ARG  27 -44.026  26.983  -6.341
   86    HE   ARG  27           HE       ARG  27 -41.221  26.609  -5.986
   87   HH11  ARG  27          HH11      ARG  27 -44.063  25.271  -7.486
   88   HH12  ARG  27          HH12      ARG  27 -43.182  24.481  -8.752
   89   HH21  ARG  27          HH21      ARG  27 -40.050  25.574  -7.647
   90   HH22  ARG  27          HH22      ARG  27 -40.900  24.654  -8.842
   91    H    SER  28           H        SER  28 -42.600  29.385  -1.891
   92    HA   SER  28           HA       SER  28 -40.520  31.294  -2.558
   93    HB2  SER  28           HB1      SER  28 -40.566  32.393  -0.352
   94    HB3  SER  28           HB2      SER  28 -42.074  32.661  -1.242
   95    HG   SER  28           HG       SER  28 -42.395  32.056   0.977
   96    H    SER  29           H        SER  29 -38.688  31.143  -0.936
   97    HA   SER  29           HA       SER  29 -38.327  28.317  -0.236
   98    HB2  SER  29           HB1      SER  29 -35.988  28.643  -0.438
   99    HB3  SER  29           HB2      SER  29 -36.703  29.540  -1.790
  100    HG   SER  29           HG       SER  29 -35.126  30.475   0.119
  101    H    ALA  30           H        ALA  30 -37.774  27.659   1.800
  102    HA   ALA  30           HA       ALA  30 -38.239  29.591   3.932
  103    HB1  ALA  30           HB1      ALA  30 -37.941  27.292   5.262
  104    HB2  ALA  30           HB2      ALA  30 -39.463  27.777   4.513
  105    HB3  ALA  30           HB3      ALA  30 -38.391  26.649   3.681
  106    H    ASP  31           H        ASP  31 -35.957  26.874   3.562
  107    HA   ASP  31           HA       ASP  31 -33.663  28.515   3.996
  108    HB2  ASP  31           HB1      ASP  31 -35.025  27.420   6.309
  109    HB3  ASP  31           HB2      ASP  31 -33.384  26.773   6.176
  110    HD2  ASP  31           HD       ASP  31 -33.838  30.481   7.314
  111    H    LEU  32           H        LEU  32 -31.667  27.290   3.957
  112    HA   LEU  32           HA       LEU  32 -31.986  24.524   3.012
  113    HB2  LEU  32           HB1      LEU  32 -31.609  26.330   1.200
  114    HB3  LEU  32           HB2      LEU  32 -29.953  26.383   1.829
  115    HG   LEU  32           HG       LEU  32 -30.006  23.806   1.391
  116   HD11  LEU  32          HD11      LEU  32 -32.557  24.284   0.672
  117   HD12  LEU  32          HD12      LEU  32 -31.592  22.951   0.043
  118   HD13  LEU  32          HD13      LEU  32 -31.755  24.437  -0.892
  119   HD21  LEU  32          HD21      LEU  32 -28.518  24.440  -0.125
  120   HD22  LEU  32          HD22      LEU  32 -29.175  26.076  -0.082
  121   HD23  LEU  32          HD23      LEU  32 -29.815  24.898  -1.229
  122    H    HIS  33           H        HIS  33 -31.279  23.683   4.967
  123    HA   HIS  33           HA       HIS  33 -29.110  24.509   6.481
  124    HB2  HIS  33           HB1      HIS  33 -29.956  21.630   6.094
  125    HB3  HIS  33           HB2      HIS  33 -29.140  22.325   7.500
  126    HD1  HIS  33           HD1      HIS  33 -31.962  20.845   7.525
  127    HD2  HIS  33           HD2      HIS  33 -31.323  24.948   7.658
  128    HE1  HIS  33           HE1      HIS  33 -34.023  21.812   8.591
  129    HE2  HIS  33           HE2      HIS  33 -33.634  24.321   8.673
  130    H    GLY  34           H        GLY  34 -27.121  24.871   5.729
  131    HA2  GLY  34           HA2      GLY  34 -26.022  23.180   3.622
  132    HA3  GLY  34           HA3      GLY  34 -25.314  24.664   4.244
  133    HA1  GLY  34           HA1      GLY  34 -26.310  22.789   4.359
  134    H    ALA  35           H        ALA  35 -25.057  21.347   4.180
  135    HA   ALA  35           HA       ALA  35 -23.505  21.279   6.682
  136    HB1  ALA  35           HB1      ALA  35 -24.905  19.111   5.143
  137    HB2  ALA  35           HB2      ALA  35 -23.707  18.762   6.390
  138    HB3  ALA  35           HB3      ALA  35 -25.182  19.635   6.805
  139    H    ARG  36           H        ARG  36 -21.365  20.952   6.620
  140    HA   ARG  36           HA       ARG  36 -20.141  20.467   3.992
  141    HB2  ARG  36           HB1      ARG  36 -19.634  22.390   5.981
  142    HB3  ARG  36           HB2      ARG  36 -18.265  21.268   6.031
  143    HG2  ARG  36           HG1      ARG  36 -18.728  21.772   3.309
  144    HG3  ARG  36           HG2      ARG  36 -18.850  23.335   4.133
  145    HD2  ARG  36           HD1      ARG  36 -16.653  22.291   5.352
  146    HD3  ARG  36           HD2      ARG  36 -16.519  21.588   3.734
  147    HE   ARG  36           HE       ARG  36 -16.017  23.662   2.905
  148   HH11  ARG  36          HH11      ARG  36 -17.361  24.001   6.098
  149   HH12  ARG  36          HH12      ARG  36 -17.008  25.693   6.209
  150   HH21  ARG  36          HH21      ARG  36 -15.547  25.890   3.038
  151   HH22  ARG  36          HH22      ARG  36 -15.977  26.767   4.467
  152    H    LYS  37           H        LYS  37 -18.984  18.680   3.622
  153    HA   LYS  37           HA       LYS  37 -18.106  17.062   5.912
  154    HB2  LYS  37           HB1      LYS  37 -18.721  15.021   4.504
  155    HB3  LYS  37           HB2      LYS  37 -20.055  15.916   5.250
  156    HG2  LYS  37           HG1      LYS  37 -20.497  17.054   3.126
  157    HG3  LYS  37           HG2      LYS  37 -19.166  16.150   2.380
  158    HD2  LYS  37           HD1      LYS  37 -20.641  14.133   3.494
  159    HD3  LYS  37           HD2      LYS  37 -21.897  15.293   3.024
  160    HE2  LYS  37           HE1      LYS  37 -20.082  15.183   0.864
  161    HE3  LYS  37           HE2      LYS  37 -20.364  13.512   1.376
  162    HZ1  LYS  37           HZ1      LYS  37 -22.386  15.503   0.524
  163    HZ2  LYS  37           HZ2      LYS  37 -22.797  14.050   1.285
  164    HZ3  LYS  37           HZ3      LYS  37 -22.010  14.026  -0.212
  165    H    GLY  38           H        GLY  38 -16.202  15.917   5.624
  166    HA2  GLY  38           HA2      GLY  38 -14.874  16.132   3.013
  167    HA3  GLY  38           HA3      GLY  38 -14.061  16.785   4.427
  168    HA1  GLY  38           HA1      GLY  38 -15.381  15.501   3.367
  169    H    SER  39           H        SER  39 -13.710  14.391   2.467
  170    HA   SER  39           HA       SER  39 -12.425  12.692   4.352
  171    HB2  SER  39           HB1      SER  39 -15.149  12.174   4.034
  172    HB3  SER  39           HB2      SER  39 -14.350  10.980   2.995
  173    HG   SER  39           HG       SER  39 -14.618  10.871   5.599
  174    H    GLN  40           H        GLN  40 -11.050  11.201   3.373
  175    HA   GLN  40           HA       GLN  40 -11.107  10.993   0.458
  176    HB2  GLN  40           HB1      GLN  40  -8.445  11.297   0.802
  177    HB3  GLN  40           HB2      GLN  40  -9.535  12.618   0.354
  178    HG2  GLN  40           HG1      GLN  40  -9.475  13.582   2.436
  179    HG3  GLN  40           HG2      GLN  40  -9.073  12.057   3.239
  180   HE21  GLN  40          HE21      GLN  40  -7.694  14.263   3.917
  181   HE22  GLN  40          HE22      GLN  40  -6.078  14.184   3.310
  182    H    CYS  41           H        CYS  41  -8.661  10.201   2.914
  183    HA   CYS  41           HA       CYS  41  -9.291   7.386   2.795
  184    HB2  CYS  41           HB1      CYS  41  -7.047   6.703   2.018
  185    HB3  CYS  41           HB2      CYS  41  -7.949   7.582   0.782
  186    H    LEU  42           H        LEU  42  -8.476   6.245   4.521
  187    HA   LEU  42           HA       LEU  42  -7.599   7.795   6.762
  188    HB2  LEU  42           HB1      LEU  42  -8.356   4.969   6.248
  189    HB3  LEU  42           HB2      LEU  42  -7.309   5.288   7.641
  190    HG   LEU  42           HG       LEU  42  -9.594   7.074   7.591
  191   HD11  LEU  42          HD11      LEU  42 -10.919   5.453   6.597
  192   HD12  LEU  42          HD12      LEU  42 -11.146   5.142   8.318
  193   HD13  LEU  42          HD13      LEU  42 -10.057   4.125   7.373
  194   HD21  LEU  42          HD21      LEU  42  -9.842   6.157   9.888
  195   HD22  LEU  42          HD22      LEU  42  -8.231   6.789   9.545
  196   HD23  LEU  42          HD23      LEU  42  -8.515   5.047   9.544
  197    H    SER  43           H        SER  43  -6.077   5.712   4.412
  198    HA   SER  43           HA       SER  43  -3.479   6.666   5.108
  199    HB2  SER  43           HB1      SER  43  -4.419   4.159   6.288
  200    HB3  SER  43           HB2      SER  43  -2.933   3.955   5.343
  201    HG   SER  43           HG       SER  43  -3.349   5.327   7.708
  202    H    ASP  44           H        ASP  44  -1.765   5.322   3.832
  203    HA   ASP  44           HA       ASP  44  -2.493   5.434   1.103
  204    HB2  ASP  44           HB1      ASP  44  -0.226   4.384   0.725
  205    HB3  ASP  44           HB2      ASP  44  -0.219   5.873   1.677
  206    HD2  ASP  44           HD       ASP  44   1.085   4.290   4.425
  207    H    THR  45           H        THR  45  -2.521   2.888   3.452
  208    HA   THR  45           HA       THR  45  -2.724   0.777   1.480
  209    HB   THR  45           HB       THR  45  -3.528  -0.130   4.065
  210    HG1  THR  45           HG1      THR  45  -2.498   1.416   5.165
  211   HG21  THR  45          HG21      THR  45  -2.045  -1.768   3.602
  212   HG22  THR  45          HG22      THR  45  -0.765  -0.631   3.186
  213   HG23  THR  45          HG23      THR  45  -2.009  -1.029   2.002
  214    H    ASP  46           H        ASP  46  -4.799   3.081   2.371
  215    HA   ASP  46           HA       ASP  46  -7.169   1.653   2.991
  216    HB2  ASP  46           HB1      ASP  46  -6.707   4.130   3.374
  217    HB3  ASP  46           HB2      ASP  46  -7.046   4.354   1.653
  218    HD2  ASP  46           HD       ASP  46 -10.454   3.464   2.182
  219    H    CYS  47           H        CYS  47  -5.527   2.397   0.031
  220    HA   CYS  47           HA       CYS  47  -7.798   1.847  -1.660
  221    HB2  CYS  47           HB1      CYS  47  -5.171   2.969  -1.968
  222    HB3  CYS  47           HB2      CYS  47  -5.392   1.676  -3.148
  223    H    ASN  48           H        ASN  48  -8.434  -0.078  -2.372
  224    HA   ASN  48           HA       ASN  48  -7.463  -2.488  -1.442
  225    HB2  ASN  48           HB1      ASN  48  -8.638  -3.446  -3.555
  226    HB3  ASN  48           HB2      ASN  48  -9.609  -2.591  -2.349
  227   HD21  ASN  48          HD21      ASN  48  -8.463  -2.611  -5.574
  228   HD22  ASN  48          HD22      ASN  48  -9.286  -1.190  -6.114
  229    H    THR  49           H        THR  49  -6.869  -1.035  -4.642
  230    HA   THR  49           HA       THR  49  -5.051  -3.030  -5.494
  231    HB   THR  49           HB       THR  49  -4.441  -0.560  -6.786
  232    HG1  THR  49           HG1      THR  49  -6.317   0.411  -6.935
  233   HG21  THR  49          HG21      THR  49  -5.046  -1.714  -8.717
  234   HG22  THR  49          HG22      THR  49  -6.284  -2.655  -7.884
  235   HG23  THR  49          HG23      THR  49  -4.577  -3.010  -7.616
  236    H    ARG  50           H        ARG  50  -2.745  -2.401  -6.164
  237    HA   ARG  50           HA       ARG  50  -1.337  -1.654  -3.768
  238    HB2  ARG  50           HB1      ARG  50   0.699  -2.145  -5.100
  239    HB3  ARG  50           HB2      ARG  50  -0.469  -3.476  -5.089
  240    HG2  ARG  50           HG1      ARG  50  -1.116  -1.893  -7.324
  241    HG3  ARG  50           HG2      ARG  50   0.646  -2.073  -7.316
  242    HD2  ARG  50           HD1      ARG  50   0.185  -4.008  -8.398
  243    HD3  ARG  50           HD2      ARG  50  -0.065  -4.601  -6.750
  244    HE   ARG  50           HE       ARG  50  -2.474  -3.524  -7.741
  245   HH11  ARG  50          HH11      ARG  50  -0.360  -6.262  -8.138
  246   HH12  ARG  50          HH12      ARG  50  -1.624  -7.329  -8.649
  247   HH21  ARG  50          HH21      ARG  50  -4.148  -4.920  -8.412
  248   HH22  ARG  50          HH22      ARG  50  -3.779  -6.565  -8.805
  249    H    LYS  51           H        LYS  51  -2.571   0.554  -4.130
  250    HA   LYS  51           HA       LYS  51  -0.613   2.375  -5.353
  251    HB2  LYS  51           HB1      LYS  51  -3.624   2.669  -5.479
  252    HB3  LYS  51           HB2      LYS  51  -2.443   3.829  -6.105
  253    HG2  LYS  51           HG1      LYS  51  -2.020   2.626  -7.964
  254    HG3  LYS  51           HG2      LYS  51  -2.185   1.077  -7.118
  255    HD2  LYS  51           HD1      LYS  51  -4.135   0.885  -8.210
  256    HD3  LYS  51           HD2      LYS  51  -4.741   2.055  -7.025
  257    HE2  LYS  51           HE1      LYS  51  -4.390   3.890  -8.507
  258    HE3  LYS  51           HE2      LYS  51  -3.462   2.877  -9.622
  259    HZ1  LYS  51           HZ1      LYS  51  -6.163   1.973  -9.092
  260    HZ2  LYS  51           HZ2      LYS  51  -5.315   2.052 -10.553
  261    HZ3  LYS  51           HZ3      LYS  51  -6.051   3.440  -9.926
  262    H    PHE  52           H        PHE  52  -0.440   4.440  -4.371
  263    HA   PHE  52           HA       PHE  52  -1.275   4.433  -1.564
  264    HB2  PHE  52           HB1      PHE  52   0.491   5.967  -1.132
  265    HB3  PHE  52           HB2      PHE  52   1.154   4.723  -2.193
  266    HD1  PHE  52           HD1      PHE  52   1.730   5.196  -4.498
  267    HD2  PHE  52           HD2      PHE  52   0.186   8.230  -1.943
  268    HE1  PHE  52           HE1      PHE  52   2.466   6.914  -6.099
  269    HE2  PHE  52           HE2      PHE  52   0.918   9.953  -3.540
  270    HZ   PHE  52           HZ       PHE  52   2.059   9.296  -5.621
  271    H    CYS  53           H        CYS  53  -1.448   6.879  -0.747
  272    HA   CYS  53           HA       CYS  53  -3.603   8.051  -2.356
  273    HB2  CYS  53           HB1      CYS  53  -3.374   7.483   0.380
  274    HB3  CYS  53           HB2      CYS  53  -3.255   9.238   0.264
  275    H    LEU  54           H        LEU  54  -3.008   9.664  -3.639
  276    HA   LEU  54           HA       LEU  54  -0.749  11.361  -2.873
  277    HB2  LEU  54           HB1      LEU  54  -0.610  10.398  -5.078
  278    HB3  LEU  54           HB2      LEU  54  -2.220  11.020  -5.481
  279    HG   LEU  54           HG       LEU  54  -0.822  13.306  -4.845
  280   HD11  LEU  54          HD11      LEU  54   1.010  11.301  -6.112
  281   HD12  LEU  54          HD12      LEU  54   1.319  12.394  -4.763
  282   HD13  LEU  54          HD13      LEU  54   1.197  13.031  -6.403
  283   HD21  LEU  54          HD21      LEU  54  -0.841  13.696  -7.281
  284   HD22  LEU  54          HD22      LEU  54  -2.378  13.077  -6.679
  285   HD23  LEU  54          HD23      LEU  54  -1.265  12.002  -7.528
  286    H    GLN  55           H        GLN  55  -1.138  13.238  -1.924
  287    HA   GLN  55           HA       GLN  55  -3.744  14.531  -2.364
  288    HB2  GLN  55           HB1      GLN  55  -3.509  14.033  -0.063
  289    HB3  GLN  55           HB2      GLN  55  -1.832  14.601  -0.038
  290    HG2  GLN  55           HG1      GLN  55  -2.427  16.700   0.390
  291    HG3  GLN  55           HG2      GLN  55  -3.679  16.678  -0.860
  292   HE21  GLN  55          HE21      GLN  55  -5.522  17.292   0.005
  293   HE22  GLN  55          HE22      GLN  55  -6.170  16.754   1.512
  294    HA   PRO  56           HA       PRO  56  -0.857  17.292  -4.601
  295    HB2  PRO  56           HB1      PRO  56  -2.726  18.121  -6.423
  296    HB3  PRO  56           HB2      PRO  56  -1.803  16.629  -6.587
  297    HG2  PRO  56           HG1      PRO  56  -4.573  17.041  -5.514
  298    HG3  PRO  56           HG2      PRO  56  -3.970  15.790  -6.664
  299    HD2  PRO  56           HD1      PRO  56  -4.399  15.275  -4.033
  300    HD3  PRO  56           HD2      PRO  56  -3.104  14.500  -4.960
  301    H    ARG  57           H        ARG  57  -0.667  19.515  -4.520
  302    HA   ARG  57           HA       ARG  57  -2.382  20.852  -2.618
  303    HB2  ARG  57           HB1      ARG  57  -0.798  22.759  -2.927
  304    HB3  ARG  57           HB2      ARG  57  -0.025  21.250  -2.419
  305    HG2  ARG  57           HG1      ARG  57   1.073  20.959  -4.399
  306    HG3  ARG  57           HG2      ARG  57  -0.160  21.830  -5.326
  307    HD2  ARG  57           HD1      ARG  57   1.567  23.268  -3.327
  308    HD3  ARG  57           HD2      ARG  57   2.140  22.943  -4.969
  309    HE   ARG  57           HE       ARG  57  -0.309  24.104  -5.317
  310   HH11  ARG  57          HH11      ARG  57   2.636  24.988  -3.685
  311   HH12  ARG  57          HH12      ARG  57   2.408  26.690  -3.916
  312   HH21  ARG  57          HH21      ARG  57  -0.621  26.342  -5.628
  313   HH22  ARG  57          HH22      ARG  57   0.554  27.459  -5.020
  314    H    ASP  58           H        ASP  58  -1.928  20.754  -6.055
  315    HA   ASP  58           HA       ASP  58  -3.517  23.156  -6.489
  316    HB2  ASP  58           HB1      ASP  58  -1.495  21.841  -7.937
  317    HB3  ASP  58           HB2      ASP  58  -2.971  21.639  -8.888
  318    HD2  ASP  58           HD       ASP  58  -1.214  25.048  -9.085
  319    H    GLU  59           H        GLU  59  -3.893  19.732  -6.385
  320    HA   GLU  59           HA       GLU  59  -6.657  20.021  -7.365
  321    HB2  GLU  59           HB1      GLU  59  -4.672  17.791  -7.764
  322    HB3  GLU  59           HB2      GLU  59  -6.415  17.516  -7.917
  323    HG2  GLU  59           HG1      GLU  59  -6.607  18.811  -9.817
  324    HG3  GLU  59           HG2      GLU  59  -5.137  19.728  -9.455
  325    HE2  GLU  59           HE       GLU  59  -4.449  16.079 -10.870
  326    H    LYS  60           H        LYS  60  -7.870  17.830  -6.612
  327    HA   LYS  60           HA       LYS  60  -7.853  17.997  -3.717
  328    HB2  LYS  60           HB1      LYS  60  -9.883  16.535  -3.897
  329    HB3  LYS  60           HB2      LYS  60 -10.010  18.082  -4.749
  330    HG2  LYS  60           HG1      LYS  60 -10.187  17.121  -6.771
  331    HG3  LYS  60           HG2      LYS  60  -9.002  15.861  -6.380
  332    HD2  LYS  60           HD1      LYS  60 -10.797  14.824  -4.900
  333    HD3  LYS  60           HD2      LYS  60 -11.928  15.937  -5.688
  334    HE2  LYS  60           HE1      LYS  60 -11.018  14.994  -7.908
  335    HE3  LYS  60           HE2      LYS  60 -10.348  13.696  -6.909
  336    HZ1  LYS  60           HZ1      LYS  60 -12.622  13.294  -6.064
  337    HZ2  LYS  60           HZ2      LYS  60 -12.469  13.016  -7.724
  338    HZ3  LYS  60           HZ3      LYS  60 -13.212  14.431  -7.170
  339    HA   PRO  61           HA       PRO  61  -5.707  14.261  -2.879
  340    HB2  PRO  61           HB1      PRO  61  -7.007  13.381  -0.635
  341    HB3  PRO  61           HB2      PRO  61  -5.923  14.772  -0.650
  342    HG2  PRO  61           HG1      PRO  61  -8.917  14.693  -0.826
  343    HG3  PRO  61           HG2      PRO  61  -7.861  15.761   0.172
  344    HD2  PRO  61           HD1      PRO  61  -9.019  16.591  -2.140
  345    HD3  PRO  61           HD2      PRO  61  -7.427  17.159  -1.608
  346    H    PHE  62           H        PHE  62  -5.765  12.236  -3.645
  347    HA   PHE  62           HA       PHE  62  -8.067  10.559  -3.475
  348    HB2  PHE  62           HB1      PHE  62  -8.652  10.363  -5.772
  349    HB3  PHE  62           HB2      PHE  62  -8.630  12.089  -5.407
  350    HD1  PHE  62           HD1      PHE  62  -7.668   9.735  -7.753
  351    HD2  PHE  62           HD2      PHE  62  -6.223  13.216  -5.778
  352    HE1  PHE  62           HE1      PHE  62  -6.091  10.125  -9.602
  353    HE2  PHE  62           HE2      PHE  62  -4.646  13.614  -7.623
  354    HZ   PHE  62           HZ       PHE  62  -4.579  12.068  -9.540
  355    H    CYS  63           H        CYS  63  -7.649   8.562  -5.064
  356    HA   CYS  63           HA       CYS  63  -5.029   7.584  -4.311
  357    HB2  CYS  63           HB1      CYS  63  -7.434   6.381  -4.372
  358    HB3  CYS  63           HB2      CYS  63  -6.843   5.918  -5.969
  359    H    ALA  64           H        ALA  64  -3.318   7.384  -5.611
  360    HA   ALA  64           HA       ALA  64  -3.720   7.553  -8.519
  361    HB1  ALA  64           HB1      ALA  64  -1.567   9.040  -7.021
  362    HB2  ALA  64           HB2      ALA  64  -1.865   9.075  -8.759
  363    HB3  ALA  64           HB3      ALA  64  -3.046   9.767  -7.647
  364    H    THR  65           H        THR  65  -1.882   6.747  -9.773
  365    HA   THR  65           HA       THR  65  -1.070   4.214  -9.040
  366    HB   THR  65           HB       THR  65   0.969   5.011 -10.715
  367    HG1  THR  65           HG1      THR  65  -1.336   6.390 -11.619
  368   HG21  THR  65          HG21      THR  65  -1.044   3.230 -10.795
  369   HG22  THR  65          HG22      THR  65  -0.034   3.610 -12.190
  370   HG23  THR  65          HG23      THR  65  -1.612   4.375 -12.009
  371    H    CYS  66           H        CYS  66   1.130   3.397  -8.637
  372    HA   CYS  66           HA       CYS  66   2.379   4.925  -6.507
  373    HB2  CYS  66           HB1      CYS  66   1.882   2.253  -6.840
  374    HB3  CYS  66           HB2      CYS  66   3.588   2.354  -7.278
  375    H    ARG  67           H        ARG  67   4.889   4.657  -6.425
  376    HA   ARG  67           HA       ARG  67   5.932   5.527  -9.038
  377    HB2  ARG  67           HB1      ARG  67   7.143   6.175  -6.350
  378    HB3  ARG  67           HB2      ARG  67   7.472   6.943  -7.910
  379    HG2  ARG  67           HG1      ARG  67   4.733   7.295  -7.514
  380    HG3  ARG  67           HG2      ARG  67   5.480   7.589  -5.935
  381    HD2  ARG  67           HD1      ARG  67   5.540   9.693  -6.930
  382    HD3  ARG  67           HD2      ARG  67   7.158   9.049  -7.241
  383    HE   ARG  67           HE       ARG  67   6.693   9.050  -9.481
  384   HH11  ARG  67          HH11      ARG  67   3.717   9.348  -7.701
  385   HH12  ARG  67          HH12      ARG  67   2.754   9.653  -9.108
  386   HH21  ARG  67          HH21      ARG  67   5.437   9.450 -11.342
  387   HH22  ARG  67          HH22      ARG  67   3.733   9.710 -11.178
  388    H    GLY  68           H        GLY  68   8.272   5.083  -9.389
  389    HA2  GLY  68           HA2      GLY  68   8.865   2.348  -8.500
  390    HA3  GLY  68           HA3      GLY  68   9.539   3.135  -9.919
  391    HA1  GLY  68           HA1      GLY  68   8.837   3.008  -7.917
  392    H    LEU  69           H        LEU  69  11.611   2.389  -9.147
  393    HA   LEU  69           HA       LEU  69  12.661   3.390  -6.673
  394    HB2  LEU  69           HB1      LEU  69  13.698   1.806  -8.975
  395    HB3  LEU  69           HB2      LEU  69  14.867   2.625  -7.926
  396    HG   LEU  69           HG       LEU  69  12.830   0.591  -7.020
  397   HD11  LEU  69          HD11      LEU  69  15.770   0.155  -6.917
  398   HD12  LEU  69          HD12      LEU  69  14.940  -0.048  -8.461
  399   HD13  LEU  69          HD13      LEU  69  14.454  -1.013  -7.065
  400   HD21  LEU  69          HD21      LEU  69  14.964   2.132  -5.562
  401   HD22  LEU  69          HD22      LEU  69  14.237   0.656  -4.928
  402   HD23  LEU  69          HD23      LEU  69  13.234   2.078  -5.222
  403    H    ARG  70           H        ARG  70  13.513   4.013 -10.083
  404    HA   ARG  70           HA       ARG  70  15.214   6.181  -9.564
  405    HB2  ARG  70           HB1      ARG  70  13.654   5.330 -11.999
  406    HB3  ARG  70           HB2      ARG  70  14.674   6.778 -12.006
  407    HG2  ARG  70           HG1      ARG  70  16.313   4.793 -10.950
  408    HG3  ARG  70           HG2      ARG  70  15.419   4.001 -12.259
  409    HD2  ARG  70           HD1      ARG  70  16.160   5.601 -13.865
  410    HD3  ARG  70           HD2      ARG  70  16.809   6.650 -12.595
  411    HE   ARG  70           HE       ARG  70  18.057   4.101 -12.534
  412   HH11  ARG  70          HH11      ARG  70  17.988   7.105 -14.294
  413   HH12  ARG  70          HH12      ARG  70  19.623   6.967 -14.850
  414   HH21  ARG  70          HH21      ARG  70  20.211   3.910 -13.259
  415   HH22  ARG  70          HH22      ARG  70  20.886   5.149 -14.261
  416    H    ARG  71           H        ARG  71  11.762   5.954  -9.733
  417    HA   ARG  71           HA       ARG  71  11.022   8.548 -10.351
  418    HB2  ARG  71           HB1      ARG  71   9.810   6.244  -9.065
  419    HB3  ARG  71           HB2      ARG  71   9.242   7.762  -8.355
  420    HG2  ARG  71           HG1      ARG  71   7.788   6.988 -10.174
  421    HG3  ARG  71           HG2      ARG  71   8.530   8.559 -10.522
  422    HD2  ARG  71           HD1      ARG  71   9.621   7.778 -12.319
  423    HD3  ARG  71           HD2      ARG  71  10.150   6.329 -11.452
  424    HE   ARG  71           HE       ARG  71   8.438   5.176 -12.423
  425   HH11  ARG  71          HH11      ARG  71   7.748   8.582 -12.623
  426   HH12  ARG  71          HH12      ARG  71   6.339   8.373 -13.608
  427   HH21  ARG  71          HH21      ARG  71   6.583   4.887 -13.720
  428   HH22  ARG  71          HH22      ARG  71   5.676   6.270 -14.230
  429    H    ARG  72           H        ARG  72  10.860  10.449  -9.252
  430    HA   ARG  72           HA       ARG  72  12.470  10.709  -6.869
  431    HB2  ARG  72           HB1      ARG  72  10.875  12.813  -8.352
  432    HB3  ARG  72           HB2      ARG  72  12.129  13.104  -7.138
  433    HG2  ARG  72           HG1      ARG  72  13.160  11.449  -9.262
  434    HG3  ARG  72           HG2      ARG  72  12.458  12.945  -9.902
  435    HD2  ARG  72           HD1      ARG  72  14.387  12.918  -7.581
  436    HD3  ARG  72           HD2      ARG  72  14.913  13.027  -9.266
  437    HE   ARG  72           HE       ARG  72  12.946  14.995  -8.521
  438   HH11  ARG  72          HH11      ARG  72  16.337  14.222  -8.677
  439   HH12  ARG  72          HH12      ARG  72  16.847  15.878  -8.691
  440   HH21  ARG  72          HH21      ARG  72  13.604  17.179  -8.538
  441   HH22  ARG  72          HH22      ARG  72  15.292  17.558  -8.611
  442    H    CYS  73           H        CYS  73  11.771  11.506  -4.866
  443    HA   CYS  73           HA       CYS  73   8.918  11.805  -4.394
  444    HB2  CYS  73           HB1      CYS  73   8.847  10.155  -2.603
  445    HB3  CYS  73           HB2      CYS  73   9.298   9.389  -4.127
  446    H    GLN  74           H        GLN  74   8.593  12.217  -1.917
  447    HA   GLN  74           HA       GLN  74  10.826  13.853  -0.922
  448    HB2  GLN  74           HB1      GLN  74   7.999  14.608  -1.435
  449    HB3  GLN  74           HB2      GLN  74   8.736  15.233   0.048
  450    HG2  GLN  74           HG1      GLN  74  10.679  15.766  -1.791
  451    HG3  GLN  74           HG2      GLN  74   9.201  15.976  -2.740
  452   HE21  GLN  74          HE21      GLN  74   7.941  17.726  -2.413
  453   HE22  GLN  74          HE22      GLN  74   8.294  18.981  -1.279
  454    H    ARG  75           H        ARG  75   7.903  12.034  -0.155
  455    HA   ARG  75           HA       ARG  75   8.757  11.894   2.654
  456    HB2  ARG  75           HB1      ARG  75   6.309  12.524   1.646
  457    HB3  ARG  75           HB2      ARG  75   6.129  10.784   1.914
  458    HG2  ARG  75           HG1      ARG  75   6.977  11.182   4.270
  459    HG3  ARG  75           HG2      ARG  75   6.760  12.907   3.939
  460    HD2  ARG  75           HD1      ARG  75   4.517  10.967   3.457
  461    HD3  ARG  75           HD2      ARG  75   4.843  11.593   5.079
  462    HE   ARG  75           HE       ARG  75   3.692  13.029   2.869
  463   HH11  ARG  75          HH11      ARG  75   5.420  13.302   5.879
  464   HH12  ARG  75          HH12      ARG  75   4.894  14.925   6.184
  465   HH21  ARG  75          HH21      ARG  75   2.992  15.164   3.260
  466   HH22  ARG  75          HH22      ARG  75   3.511  15.982   4.694
  467    H    ASP  76           H        ASP  76   8.352   9.785   3.753
  468    HA   ASP  76           HA       ASP  76   9.626   7.686   2.282
  469    HB2  ASP  76           HB1      ASP  76   9.209   6.369   4.423
  470    HB3  ASP  76           HB2      ASP  76  10.200   7.826   4.576
  471    HD2  ASP  76           HD       ASP  76   7.649   9.497   6.334
  472    H    ALA  77           H        ALA  77   6.422   8.012   3.807
  473    HA   ALA  77           HA       ALA  77   5.400   5.564   2.861
  474    HB1  ALA  77           HB1      ALA  77   3.488   6.137   3.920
  475    HB2  ALA  77           HB2      ALA  77   4.528   7.366   4.642
  476    HB3  ALA  77           HB3      ALA  77   3.493   7.779   3.275
  477    H    MET  78           H        MET  78   5.784   8.660   1.361
  478    HA   MET  78           HA       MET  78   3.841   8.624  -0.609
  479    HB2  MET  78           HB1      MET  78   6.491   9.873  -0.262
  480    HB3  MET  78           HB2      MET  78   5.959   9.708  -1.941
  481    HG2  MET  78           HG1      MET  78   3.763  10.786  -1.168
  482    HG3  MET  78           HG2      MET  78   4.662  11.236   0.283
  483    HE1  MET  78           HE1      MET  78   4.818  10.936  -3.368
  484    HE2  MET  78           HE2      MET  78   4.615  12.619  -3.853
  485    HE3  MET  78           HE3      MET  78   6.226  11.905  -3.803
  486    H    CYS  79           H        CYS  79   6.757   6.744  -0.339
  487    HA   CYS  79           HA       CYS  79   6.507   5.751  -3.072
  488    HB2  CYS  79           HB1      CYS  79   8.619   5.817  -1.021
  489    HB3  CYS  79           HB2      CYS  79   8.547   4.313  -1.943
  490    H    CYS  80           H        CYS  80   6.319   3.509  -3.548
  491    HA   CYS  80           HA       CYS  80   4.311   2.156  -2.222
  492    HB2  CYS  80           HB1      CYS  80   6.283   1.525  -4.301
  493    HB3  CYS  80           HB2      CYS  80   5.768   0.115  -3.373
  494    HA   PRO  81           HA       PRO  81   6.019   0.180   1.302
  495    HB2  PRO  81           HB1      PRO  81   4.796  -2.270   1.261
  496    HB3  PRO  81           HB2      PRO  81   3.957  -0.770   1.653
  497    HG2  PRO  81           HG1      PRO  81   4.091  -2.248  -0.955
  498    HG3  PRO  81           HG2      PRO  81   2.663  -1.521  -0.128
  499    HD2  PRO  81           HD1      PRO  81   3.926  -0.314  -2.206
  500    HD3  PRO  81           HD2      PRO  81   3.183   0.596  -0.879
  501    H    GLY  82           H        GLY  82   8.086  -0.430   1.438
  502    HA2  GLY  82           HA2      GLY  82   9.402  -2.595   1.388
  503    HA3  GLY  82           HA3      GLY  82   9.019  -2.606  -0.327
  504    HA1  GLY  82           HA1      GLY  82   9.415  -1.732   1.570
  505    H    THR  83           H        THR  83   9.319   0.422  -0.282
  506    HA   THR  83           HA       THR  83  12.265   0.453  -0.362
  507    HB   THR  83           HB       THR  83  11.775   2.459  -2.000
  508    HG1  THR  83           HG1      THR  83   9.866   2.136  -3.172
  509   HG21  THR  83          HG21      THR  83  12.143  -0.402  -2.368
  510   HG22  THR  83          HG22      THR  83  12.896   0.950  -3.215
  511   HG23  THR  83          HG23      THR  83  11.323   0.348  -3.737
  512    H    LEU  84           H        LEU  84  13.097   2.823  -0.305
  513    HA   LEU  84           HA       LEU  84  11.598   4.333   1.731
  514    HB2  LEU  84           HB1      LEU  84  14.458   3.461   1.704
  515    HB3  LEU  84           HB2      LEU  84  14.026   4.998   2.474
  516    HG   LEU  84           HG       LEU  84  12.250   3.402   3.688
  517   HD11  LEU  84          HD11      LEU  84  13.258   1.460   2.354
  518   HD12  LEU  84          HD12      LEU  84  13.023   1.239   4.087
  519   HD13  LEU  84          HD13      LEU  84  14.630   1.594   3.454
  520   HD21  LEU  84          HD21      LEU  84  13.447   3.866   5.537
  521   HD22  LEU  84          HD22      LEU  84  14.415   4.840   4.430
  522   HD23  LEU  84          HD23      LEU  84  14.940   3.213   4.864
  523    H    CYS  85           H        CYS  85  12.145   6.624   1.834
  524    HA   CYS  85           HA       CYS  85  12.776   7.663  -0.836
  525    HB2  CYS  85           HB1      CYS  85  10.590   8.208   0.418
  526    HB3  CYS  85           HB2      CYS  85  11.590   9.257   1.426
  527    H    VAL  86           H        VAL  86  14.919   7.986  -0.989
  528    HA   VAL  86           HA       VAL  86  16.184   9.651   1.089
  529    HB   VAL  86           HB       VAL  86  17.604   7.529  -0.522
  530   HG11  VAL  86          HG11      VAL  86  18.997   9.407   0.228
  531   HG12  VAL  86          HG12      VAL  86  18.485   9.112   1.891
  532   HG13  VAL  86          HG13      VAL  86  19.434   7.899   1.030
  533   HG21  VAL  86          HG21      VAL  86  17.708   6.319   1.687
  534   HG22  VAL  86          HG22      VAL  86  16.476   7.437   2.269
  535   HG23  VAL  86          HG23      VAL  86  16.122   6.361   0.919
  536    H    ASN  87           H        ASN  87  17.523  11.288   0.408
  537    HA   ASN  87           HA       ASN  87  18.301  12.926  -0.964
  538    HB2  ASN  87           HB1      ASN  87  19.245  10.511  -1.971
  539    HB3  ASN  87           HB2      ASN  87  18.583  11.333  -3.388
  540   HD21  ASN  87          HD21      ASN  87  21.347  10.739  -2.751
  541   HD22  ASN  87          HD22      ASN  87  22.178  12.255  -2.730
  542    H    ASP  88           H        ASP  88  15.452  12.424  -0.875
  543    HA   ASP  88           HA       ASP  88  13.548  13.204  -1.848
  544    HB2  ASP  88           HB1      ASP  88  15.623  14.909  -2.764
  545    HB3  ASP  88           HB2      ASP  88  14.580  14.570  -4.151
  546    HD2  ASP  88           HD       ASP  88  12.974  16.543  -1.100
  547    H    VAL  89           H        VAL  89  14.931  10.714  -2.759
  548    HA   VAL  89           HA       VAL  89  13.251  10.258  -5.093
  549    HB   VAL  89           HB       VAL  89  15.432  10.931  -6.036
  550   HG11  VAL  89          HG11      VAL  89  16.944  10.263  -4.317
  551   HG12  VAL  89          HG12      VAL  89  16.446   8.576  -4.454
  552   HG13  VAL  89          HG13      VAL  89  17.346   9.341  -5.765
  553   HG21  VAL  89          HG21      VAL  89  15.687   9.050  -7.546
  554   HG22  VAL  89          HG22      VAL  89  14.827   8.000  -6.420
  555   HG23  VAL  89          HG23      VAL  89  13.978   9.328  -7.211
  556    H    CYS  90           H        CYS  90  12.728   8.076  -5.438
  557    HA   CYS  90           HA       CYS  90  12.621   6.477  -3.112
  558    HB2  CYS  90           HB1      CYS  90  11.288   6.538  -5.513
  559    HB3  CYS  90           HB2      CYS  90  12.247   5.064  -5.661
  560    H    THR  91           H        THR  91  13.692   4.598  -2.552
  561    HA   THR  91           HA       THR  91  15.847   3.615  -4.239
  562    HB   THR  91           HB       THR  91  16.872   5.446  -2.889
  563    HG1  THR  91           HG1      THR  91  17.755   2.806  -2.262
  564   HG21  THR  91          HG21      THR  91  16.180   3.640  -0.568
  565   HG22  THR  91          HG22      THR  91  15.521   5.248  -0.872
  566   HG23  THR  91          HG23      THR  91  17.230   5.053  -0.483
  567    H    THR  92           H        THR  92  16.766   1.600  -3.454
  568    HA   THR  92           HA       THR  92  14.750  -0.073  -2.269
  569    HB   THR  92           HB       THR  92  16.776  -1.778  -2.457
  570    HG1  THR  92           HG1      THR  92  18.085  -1.087  -4.288
  571   HG21  THR  92          HG21      THR  92  15.862  -1.055  -5.146
  572   HG22  THR  92          HG22      THR  92  14.564  -1.209  -3.963
  573   HG23  THR  92          HG23      THR  92  15.662  -2.559  -4.246
  574    H    MET  93           H        MET  93  15.103  -1.466  -0.434
  575    HA   MET  93           HA       MET  93  16.081  -0.094   1.824
  576    HB2  MET  93           HB1      MET  93  14.417  -2.220   1.423
  577    HB3  MET  93           HB2      MET  93  15.859  -3.021   2.065
  578    HG2  MET  93           HG1      MET  93  15.473  -0.810   3.727
  579    HG3  MET  93           HG2      MET  93  13.859  -1.463   3.433
  580    HE1  MET  93           HE1      MET  93  16.902  -3.011   6.312
  581    HE2  MET  93           HE2      MET  93  17.410  -2.113   4.881
  582    HE3  MET  93           HE3      MET  93  16.271  -1.390   6.019
  583    H    GLU  94           H        GLU  94  17.454  -2.655  -0.178
  584    HA   GLU  94           HA       GLU  94  19.686  -3.227   1.442
  585    HB2  GLU  94           HB1      GLU  94  19.283  -3.502  -1.545
  586    HB3  GLU  94           HB2      GLU  94  20.675  -4.153  -0.666
  587    HG2  GLU  94           HG1      GLU  94  18.057  -4.931   0.424
  588    HG3  GLU  94           HG2      GLU  94  18.407  -5.530  -1.202
  589    HE2  GLU  94           HE       GLU  94  20.848  -7.696  -0.048
  590    H    ASP  95           H        ASP  95  19.049  -0.717  -0.893
  591    HA   ASP  95           HA       ASP  95  21.766   0.120  -1.193
  592    HB2  ASP  95           HB1      ASP  95  19.153   0.904  -2.211
  593    HB3  ASP  95           HB2      ASP  95  20.150   2.309  -1.809
  594    HD2  ASP  95           HD       ASP  95  20.864   0.771  -5.176
  595    H    ALA  96           H        ALA  96  18.982   1.456   0.586
  596    HA   ALA  96           HA       ALA  96  20.366   3.569   1.810
  597    HB1  ALA  96           HB1      ALA  96  18.281   2.635   3.524
  598    HB2  ALA  96           HB2      ALA  96  18.318   4.069   2.498
  599    HB3  ALA  96           HB3      ALA  96  17.747   2.533   1.847
  600    H    THR  97           H        THR  97  20.175   3.544   4.441
  601    HA   THR  97           HA       THR  97  21.277   2.935   6.338
  602    HB   THR  97           HB       THR  97  20.809   0.114   5.357
  603    HG1  THR  97           HG1      THR  97  18.941   0.414   6.886
  604   HG21  THR  97          HG21      THR  97  20.662  -0.187   7.943
  605   HG22  THR  97          HG22      THR  97  21.598   1.308   7.985
  606   HG23  THR  97          HG23      THR  97  22.242  -0.113   7.164
  607    H    GLU  98           H        GLU  98  23.184   3.864   5.139
  608    HA   GLU  98           HA       GLU  98  25.442   2.214   5.537
  609    HB2  GLU  98           HB1      GLU  98  24.383   1.477   3.247
  610    HB3  GLU  98           HB2      GLU  98  25.172   2.945   2.649
  611    HG2  GLU  98           HG1      GLU  98  26.859   1.497   2.252
  612    HG3  GLU  98           HG2      GLU  98  27.242   1.889   3.934
  613    HE2  GLU  98           HE       GLU  98  26.261  -1.279   5.034
  614    H    ASN  99           H        ASN  99  25.240   4.427   6.737
  615    HA   ASN  99           HA       ASN  99  27.315   6.083   5.768
  616    HB2  ASN  99           HB1      ASN  99  24.726   6.709   4.774
  617    HB3  ASN  99           HB2      ASN  99  25.160   7.961   5.945
  618   HD21  ASN  99          HD21      ASN  99  25.500   6.917   2.789
  619   HD22  ASN  99          HD22      ASN  99  26.784   7.964   2.304
  620    H    LEU 100           H        LEU 100  27.344   8.228   7.132
  621    HA   LEU 100           HA       LEU 100  26.258   7.748   9.811
  622    HB2  LEU 100           HB1      LEU 100  28.585   8.631  10.620
  623    HB3  LEU 100           HB2      LEU 100  28.343   6.917  10.245
  624    HG   LEU 100           HG       LEU 100  29.446   7.190   8.104
  625   HD11  LEU 100          HD11      LEU 100  29.085   9.252   7.233
  626   HD12  LEU 100          HD12      LEU 100  30.675   9.543   7.940
  627   HD13  LEU 100          HD13      LEU 100  29.221  10.062   8.794
  628   HD21  LEU 100          HD21      LEU 100  30.658   7.374  10.611
  629   HD22  LEU 100          HD22      LEU 100  31.488   8.561   9.606
  630   HD23  LEU 100          HD23      LEU 100  31.409   6.874   9.096
  631    H    TYR 101           H        TYR 101  26.750   9.727  11.251
  632    HA   TYR 101           HA       TYR 101  26.323  12.156   9.636
  633    HB2  TYR 101           HB1      TYR 101  25.116  13.029  11.676
  634    HB3  TYR 101           HB2      TYR 101  24.317  11.699  10.834
  635    HD1  TYR 101           HD1      TYR 101  23.547   9.886  12.049
  636    HD2  TYR 101           HD2      TYR 101  26.667  12.276  13.679
  637    HE1  TYR 101           HE1      TYR 101  23.444   8.587  14.136
  638    HE2  TYR 101           HE2      TYR 101  26.574  10.983  15.769
  639    HH   TYR 101           HH       TYR 101  25.817   8.624  16.442
  640    H    PHE 102           H        PHE 102  26.853  14.199  10.965
  641    HA   PHE 102           HA       PHE 102  29.217  13.815  12.649
  642    HB2  PHE 102           HB1      PHE 102  29.181  14.920   9.944
  643    HB3  PHE 102           HB2      PHE 102  29.876  16.037  11.119
  644    HD1  PHE 102           HD1      PHE 102  30.121  12.495  10.011
  645    HD2  PHE 102           HD2      PHE 102  32.090  15.843  11.748
  646    HE1  PHE 102           HE1      PHE 102  32.252  11.268   9.948
  647    HE2  PHE 102           HE2      PHE 102  34.225  14.623  11.688
  648    HZ   PHE 102           HZ       PHE 102  34.309  12.333  10.786
  649    H    GLN 103           H        GLN 103  29.916  15.955  13.634
  650    HA   GLN 103           HA       GLN 103  27.699  17.830  13.978
  651    HB2  GLN 103           HB1      GLN 103  27.919  17.784  16.420
  652    HB3  GLN 103           HB2      GLN 103  27.434  16.205  15.781
  653    HG2  GLN 103           HG1      GLN 103  30.183  16.031  15.827
  654    HG3  GLN 103           HG2      GLN 103  29.803  16.960  17.283
  655   HE21  GLN 103          HE21      GLN 103  30.152  13.917  16.046
  656   HE22  GLN 103          HE22      GLN 103  29.303  13.022  17.254
  657    H    SER 104           H        SER 104  28.310  19.912  14.479
  658    HA   SER 104           HA       SER 104  31.207  20.421  14.383
  659    HB2  SER 104           HB1      SER 104  29.121  21.440  12.806
  660    HB3  SER 104           HB2      SER 104  29.570  22.763  13.898
  661    HG   SER 104           HG       SER 104  31.356  23.004  12.829
  662    H    LEU 105           H        LEU 105  32.184  21.508  15.991
  663    HA   LEU 105           HA       LEU 105  30.496  22.414  18.220
  664    HB2  LEU 105           HB1      LEU 105  33.068  21.020  18.026
  665    HB3  LEU 105           HB2      LEU 105  33.055  22.357  19.190
  666    HG   LEU 105           HG       LEU 105  32.572  20.196  20.247
  667   HD11  LEU 105          HD11      LEU 105  31.670  21.908  21.488
  668   HD12  LEU 105          HD12      LEU 105  30.244  20.922  21.169
  669   HD13  LEU 105          HD13      LEU 105  30.539  22.379  20.220
  670   HD21  LEU 105          HD21      LEU 105  31.283  19.474  18.054
  671   HD22  LEU 105          HD22      LEU 105  29.898  20.088  18.956
  672   HD23  LEU 105          HD23      LEU 105  30.886  18.790  19.630
  673    H    GLU 106           H        GLU 106  30.085  24.527  17.876
  674    HA   GLU 106           HA       GLU 106  32.302  26.289  17.111
  675    HB2  GLU 106           HB1      GLU 106  30.523  27.987  16.724
  676    HB3  GLU 106           HB2      GLU 106  30.346  26.535  15.727
  677    HG2  GLU 106           HG1      GLU 106  28.900  26.482  18.293
  678    HG3  GLU 106           HG2      GLU 106  28.340  27.679  17.118
  679    HE2  GLU 106           HE       GLU 106  26.974  24.201  16.602
  680    H    HIS 107           H        HIS 107  32.217  28.517  18.158
  681    HA   HIS 107           HA       HIS 107  31.576  28.271  21.023
  682    HB2  HIS 107           HB1      HIS 107  34.118  29.009  19.681
  683    HB3  HIS 107           HB2      HIS 107  33.668  29.974  21.091
  684    HD1  HIS 107           HD1      HIS 107  34.717  26.520  20.117
  685    HD2  HIS 107           HD2      HIS 107  33.778  28.654  23.556
  686    HE1  HIS 107           HE1      HIS 107  35.453  25.067  22.032
  687    HE2  HIS 107           HE2      HIS 107  34.879  26.370  24.135
  688    H    HIS 108           H        HIS 108  31.467  30.431  22.126
  689    HA   HIS 108           HA       HIS 108  30.162  32.372  20.338
  690    HB2  HIS 108           HB1      HIS 108  29.024  31.125  22.432
  691    HB3  HIS 108           HB2      HIS 108  29.719  32.515  23.271
  692    HD1  HIS 108           HD1      HIS 108  27.758  33.987  23.692
  693    HD2  HIS 108           HD2      HIS 108  27.879  32.617  19.771
  694    HE1  HIS 108           HE1      HIS 108  25.904  35.197  22.499
  695    HE2  HIS 108           HE2      HIS 108  25.977  34.360  20.102
  696    H    HIS 109           H        HIS 109  30.168  34.662  21.422
  697    HA   HIS 109           HA       HIS 109  32.923  35.227  22.305
  698    HB2  HIS 109           HB1      HIS 109  32.683  37.429  21.146
  699    HB3  HIS 109           HB2      HIS 109  32.678  36.038  20.058
  700    HD1  HIS 109           HD1      HIS 109  31.234  36.820  18.180
  701    HD2  HIS 109           HD2      HIS 109  29.496  37.500  21.892
  702    HE1  HIS 109           HE1      HIS 109  28.906  37.637  17.693
  703    HE2  HIS 109           HE2      HIS 109  27.844  38.053  19.960
  704    H    HIS 110           H        HIS 110  32.897  37.698  23.129
  705    HA   HIS 110           HA       HIS 110  30.636  37.979  24.992
  706    HB2  HIS 110           HB1      HIS 110  33.527  37.737  25.570
  707    HB3  HIS 110           HB2      HIS 110  32.685  39.021  26.442
  708    HD1  HIS 110           HD1      HIS 110  33.127  35.367  26.372
  709    HD2  HIS 110           HD2      HIS 110  30.573  38.112  28.162
  710    HE1  HIS 110           HE1      HIS 110  31.956  34.101  28.204
  711    HE2  HIS 110           HE2      HIS 110  30.394  35.779  29.298
  712    H    HIS 111           H        HIS 111  30.783  40.240  26.092
  713    HA   HIS 111           HA       HIS 111  31.100  42.187  23.924
  714    HB2  HIS 111           HB1      HIS 111  29.270  41.882  26.207
  715    HB3  HIS 111           HB2      HIS 111  29.848  43.533  25.962
  716    HD1  HIS 111           HD1      HIS 111  29.069  44.784  23.855
  717    HD2  HIS 111           HD2      HIS 111  27.597  40.911  24.149
  718    HE1  HIS 111           HE1      HIS 111  27.261  44.620  22.116
  719    HE2  HIS 111           HE2      HIS 111  26.359  42.253  22.295
  720    H    HIS 112           H        HIS 112  31.603  42.057  27.456
  721    HA   HIS 112           HA       HIS 112  34.004  43.720  27.075
  722    HB2  HIS 112           HB1      HIS 112  31.776  44.699  28.211
  723    HB3  HIS 112           HB2      HIS 112  32.513  43.956  29.635
  724    HD1  HIS 112           HD1      HIS 112  32.837  46.854  27.363
  725    HD2  HIS 112           HD2      HIS 112  35.020  45.072  30.416
  726    HE1  HIS 112           HE1      HIS 112  34.570  48.550  28.029
  727    HE2  HIS 112           HE2      HIS 112  35.905  47.461  29.894
  Start of MODEL   56
    1    H1   MET  18           H        MET  18 -23.288 -25.469  41.630
    2    HA   MET  18           HA       MET  18 -24.364 -23.341  42.856
    3    HB2  MET  18           HB1      MET  18 -22.144 -22.183  42.645
    4    HB3  MET  18           HB2      MET  18 -22.061 -23.855  43.219
    5    HG2  MET  18           HG1      MET  18 -20.723 -24.443  41.552
    6    HG3  MET  18           HG2      MET  18 -21.860 -23.803  40.364
    7    HE1  MET  18           HE1      MET  18 -17.838 -22.437  40.468
    8    HE2  MET  18           HE2      MET  18 -18.496 -23.867  41.264
    9    HE3  MET  18           HE3      MET  18 -18.786 -23.602  39.543
   10    H    LEU  19           H        LEU  19 -26.090 -22.865  41.193
   11    HA   LEU  19           HA       LEU  19 -25.212 -20.587  39.554
   12    HB2  LEU  19           HB1      LEU  19 -26.114 -23.014  38.542
   13    HB3  LEU  19           HB2      LEU  19 -27.530 -21.952  38.468
   14    HG   LEU  19           HG       LEU  19 -26.364 -21.904  36.359
   15   HD11  LEU  19          HD11      LEU  19 -25.657 -19.304  37.662
   16   HD12  LEU  19          HD12      LEU  19 -27.340 -19.788  37.462
   17   HD13  LEU  19          HD13      LEU  19 -26.302 -19.606  36.049
   18   HD21  LEU  19          HD21      LEU  19 -23.951 -20.585  37.398
   19   HD22  LEU  19          HD22      LEU  19 -24.135 -21.757  36.092
   20   HD23  LEU  19          HD23      LEU  19 -24.091 -22.303  37.769
   21    H    VAL  20           H        VAL  20 -26.104 -18.830  40.396
   22    HA   VAL  20           HA       VAL  20 -28.572 -18.979  41.906
   23    HB   VAL  20           HB       VAL  20 -28.209 -16.574  42.336
   24   HG11  VAL  20          HG11      VAL  20 -26.874 -17.122  44.035
   25   HG12  VAL  20          HG12      VAL  20 -26.759 -18.725  43.305
   26   HG13  VAL  20          HG13      VAL  20 -25.534 -17.504  42.956
   27   HG21  VAL  20          HG21      VAL  20 -27.056 -15.405  40.833
   28   HG22  VAL  20          HG22      VAL  20 -25.594 -16.142  41.491
   29   HG23  VAL  20          HG23      VAL  20 -26.399 -16.867  40.101
   30    H    LEU  21           H        LEU  21 -30.539 -18.473  41.180
   31    HA   LEU  21           HA       LEU  21 -30.909 -17.806  38.411
   32    HB2  LEU  21           HB1      LEU  21 -32.516 -18.807  40.612
   33    HB3  LEU  21           HB2      LEU  21 -33.368 -17.560  39.686
   34    HG   LEU  21           HG       LEU  21 -32.089 -19.668  38.073
   35   HD11  LEU  21          HD11      LEU  21 -34.116 -21.155  38.534
   36   HD12  LEU  21          HD12      LEU  21 -34.279 -20.250  40.038
   37   HD13  LEU  21          HD13      LEU  21 -32.807 -21.165  39.715
   38   HD21  LEU  21          HD21      LEU  21 -34.944 -19.087  37.806
   39   HD22  LEU  21          HD22      LEU  21 -33.662 -19.068  36.595
   40   HD23  LEU  21          HD23      LEU  21 -33.903 -17.672  37.647
   41    H    ASP  22           H        ASP  22 -30.840 -15.813  37.635
   42    HA   ASP  22           HA       ASP  22 -32.336 -13.675  38.729
   43    HB2  ASP  22           HB1      ASP  22 -30.693 -13.386  40.387
   44    HB3  ASP  22           HB2      ASP  22 -29.374 -13.712  39.253
   45    HD2  ASP  22           HD       ASP  22 -29.210 -10.427  38.250
   46    H    PHE  23           H        PHE  23 -29.198 -13.863  37.044
   47    HA   PHE  23           HA       PHE  23 -28.587 -13.315  34.917
   48    HB2  PHE  23           HB1      PHE  23 -31.490 -12.965  34.182
   49    HB3  PHE  23           HB2      PHE  23 -30.143 -13.451  33.150
   50    HD1  PHE  23           HD1      PHE  23 -28.914 -15.678  33.980
   51    HD2  PHE  23           HD2      PHE  23 -32.955 -14.626  34.802
   52    HE1  PHE  23           HE1      PHE  23 -29.452 -18.051  34.351
   53    HE2  PHE  23           HE2      PHE  23 -33.500 -16.995  35.177
   54    HZ   PHE  23           HZ       PHE  23 -31.747 -18.711  34.952
   55    H    ASN  24           H        ASN  24 -31.595 -11.447  35.317
   56    HA   ASN  24           HA       ASN  24 -32.011  -9.211  35.317
   57    HB2  ASN  24           HB1      ASN  24 -30.336  -9.354  37.232
   58    HB3  ASN  24           HB2      ASN  24 -29.118  -8.805  36.074
   59   HD21  ASN  24          HD21      ASN  24 -31.931  -7.922  37.895
   60   HD22  ASN  24          HD22      ASN  24 -31.824  -6.219  37.625
   61    H    ASN  25           H        ASN  25 -31.443  -7.137  34.221
   62    HA   ASN  25           HA       ASN  25 -29.647  -7.452  31.936
   63    HB2  ASN  25           HB1      ASN  25 -32.592  -7.278  31.828
   64    HB3  ASN  25           HB2      ASN  25 -31.741  -6.179  30.737
   65   HD21  ASN  25          HD21      ASN  25 -30.228  -7.080  29.227
   66   HD22  ASN  25          HD22      ASN  25 -30.447  -8.693  28.649
   67    H    ILE  26           H        ILE  26 -28.533  -5.647  31.485
   68    HA   ILE  26           HA       ILE  26 -29.424  -3.137  32.750
   69    HB   ILE  26           HB       ILE  26 -27.002  -2.504  32.832
   70   HG12  ILE  26          HG11      ILE  26 -26.282  -5.391  32.648
   71   HG13  ILE  26          HG12      ILE  26 -26.545  -4.513  31.132
   72   HG21  ILE  26          HG21      ILE  26 -27.691  -4.986  34.398
   73   HG22  ILE  26          HG22      ILE  26 -26.539  -3.731  34.851
   74   HG23  ILE  26          HG23      ILE  26 -28.263  -3.364  34.785
   75   HD11  ILE  26          HD11      ILE  26 -24.910  -2.777  32.102
   76   HD12  ILE  26          HD12      ILE  26 -24.445  -4.072  33.206
   77   HD13  ILE  26          HD13      ILE  26 -24.272  -4.293  31.464
   78    H    ARG  27           H        ARG  27 -30.321  -3.759  30.226
   79    HA   ARG  27           HA       ARG  27 -30.523  -2.883  28.137
   80    HB2  ARG  27           HB1      ARG  27 -29.281  -0.776  29.739
   81    HB3  ARG  27           HB2      ARG  27 -28.892  -0.653  28.017
   82    HG2  ARG  27           HG1      ARG  27 -30.804   0.641  28.206
   83    HG3  ARG  27           HG2      ARG  27 -31.426  -0.919  27.644
   84    HD2  ARG  27           HD1      ARG  27 -31.692  -1.445  30.186
   85    HD3  ARG  27           HD2      ARG  27 -31.598   0.313  30.364
   86    HE   ARG  27           HE       ARG  27 -33.487  -0.220  28.391
   87   HH11  ARG  27          HH11      ARG  27 -33.041  -0.773  31.799
   88   HH12  ARG  27          HH12      ARG  27 -34.736  -0.762  32.155
   89   HH21  ARG  27          HH21      ARG  27 -35.722  -0.203  28.848
   90   HH22  ARG  27          HH22      ARG  27 -36.261  -0.438  30.477
   91    H    SER  28           H        SER  28 -29.258  -2.303  26.130
   92    HA   SER  28           HA       SER  28 -26.468  -2.920  26.043
   93    HB2  SER  28           HB1      SER  28 -27.677  -5.191  26.282
   94    HB3  SER  28           HB2      SER  28 -28.223  -4.913  24.620
   95    HG   SER  28           HG       SER  28 -25.859  -5.823  25.448
   96    H    SER  29           H        SER  29 -27.197  -0.688  25.164
   97    HA   SER  29           HA       SER  29 -27.317  -0.936  22.245
   98    HB2  SER  29           HB1      SER  29 -29.559  -0.368  22.665
   99    HB3  SER  29           HB2      SER  29 -29.122   0.727  23.987
  100    HG   SER  29           HG       SER  29 -29.255   2.214  22.507
  101    H    ALA  30           H        ALA  30 -25.620   0.044  21.389
  102    HA   ALA  30           HA       ALA  30 -24.787   2.656  22.307
  103    HB1  ALA  30           HB1      ALA  30 -22.357   1.786  22.474
  104    HB2  ALA  30           HB2      ALA  30 -23.445   1.556  23.844
  105    HB3  ALA  30           HB3      ALA  30 -23.113   0.215  22.748
  106    H    ASP  31           H        ASP  31 -25.792   2.561  19.997
  107    HA   ASP  31           HA       ASP  31 -23.664   2.048  18.030
  108    HB2  ASP  31           HB1      ASP  31 -26.068   0.984  17.902
  109    HB3  ASP  31           HB2      ASP  31 -26.505   2.565  17.241
  110    HD2  ASP  31           HD       ASP  31 -24.724   1.990  14.300
  111    H    LEU  32           H        LEU  32 -26.415   4.289  18.416
  112    HA   LEU  32           HA       LEU  32 -26.623   6.523  18.044
  113    HB2  LEU  32           HB1      LEU  32 -24.331   6.238  19.480
  114    HB3  LEU  32           HB2      LEU  32 -23.735   7.073  18.036
  115    HG   LEU  32           HG       LEU  32 -25.549   8.806  18.475
  116   HD11  LEU  32          HD11      LEU  32 -26.920   7.523  19.999
  117   HD12  LEU  32          HD12      LEU  32 -26.305   8.962  20.810
  118   HD13  LEU  32          HD13      LEU  32 -25.579   7.389  21.136
  119   HD21  LEU  32          HD21      LEU  32 -24.100  10.077  19.754
  120   HD22  LEU  32          HD22      LEU  32 -23.020   8.878  19.044
  121   HD23  LEU  32          HD23      LEU  32 -23.567   8.696  20.712
  122    H    HIS  33           H        HIS  33 -25.788   8.363  16.560
  123    HA   HIS  33           HA       HIS  33 -24.628   7.340  14.082
  124    HB2  HIS  33           HB1      HIS  33 -26.395   8.231  12.694
  125    HB3  HIS  33           HB2      HIS  33 -27.091   7.105  13.865
  126    HD1  HIS  33           HD1      HIS  33 -28.653   8.057  15.678
  127    HD2  HIS  33           HD2      HIS  33 -27.165  10.920  13.059
  128    HE1  HIS  33           HE1      HIS  33 -30.025  10.124  16.091
  129    HE2  HIS  33           HE2      HIS  33 -29.117  11.874  14.490
  130    H    GLY  34           H        GLY  34 -24.805   9.439  12.447
  131    HA2  GLY  34           HA2      GLY  34 -24.481  11.819  12.328
  132    HA3  GLY  34           HA3      GLY  34 -23.877  11.778  13.978
  133    HA1  GLY  34           HA1      GLY  34 -24.169  11.062  11.997
  134    H    ALA  35           H        ALA  35 -23.113  11.270  10.623
  135    HA   ALA  35           HA       ALA  35 -20.281  11.518  11.257
  136    HB1  ALA  35           HB1      ALA  35 -20.170   9.573   9.334
  137    HB2  ALA  35           HB2      ALA  35 -19.947   9.315  11.064
  138    HB3  ALA  35           HB3      ALA  35 -21.527   9.047  10.329
  139    H    ARG  36           H        ARG  36 -19.331  12.885   9.894
  140    HA   ARG  36           HA       ARG  36 -20.794  14.005   7.707
  141    HB2  ARG  36           HB1      ARG  36 -18.872  14.967   9.337
  142    HB3  ARG  36           HB2      ARG  36 -17.891  14.541   7.926
  143    HG2  ARG  36           HG1      ARG  36 -18.404  16.645   7.299
  144    HG3  ARG  36           HG2      ARG  36 -19.864  15.848   6.686
  145    HD2  ARG  36           HD1      ARG  36 -20.629  16.316   9.236
  146    HD3  ARG  36           HD2      ARG  36 -19.522  17.671   8.981
  147    HE   ARG  36           HE       ARG  36 -21.352  17.403   6.818
  148   HH11  ARG  36          HH11      ARG  36 -21.049  18.561  10.088
  149   HH12  ARG  36          HH12      ARG  36 -22.305  19.744   9.922
  150   HH21  ARG  36          HH21      ARG  36 -23.005  18.956   6.589
  151   HH22  ARG  36          HH22      ARG  36 -23.417  19.967   7.932
  152    H    LYS  37           H        LYS  37 -20.660  13.578   5.582
  153    HA   LYS  37           HA       LYS  37 -18.646  11.610   4.711
  154    HB2  LYS  37           HB1      LYS  37 -21.504  11.981   3.782
  155    HB3  LYS  37           HB2      LYS  37 -20.331  10.920   2.987
  156    HG2  LYS  37           HG1      LYS  37 -21.017  10.616   5.898
  157    HG3  LYS  37           HG2      LYS  37 -21.974   9.853   4.615
  158    HD2  LYS  37           HD1      LYS  37 -18.992   9.501   4.694
  159    HD3  LYS  37           HD2      LYS  37 -20.047   8.515   5.723
  160    HE2  LYS  37           HE1      LYS  37 -20.836   7.296   3.991
  161    HE3  LYS  37           HE2      LYS  37 -20.885   8.700   2.912
  162    HZ1  LYS  37           HZ1      LYS  37 -19.108   6.695   2.726
  163    HZ2  LYS  37           HZ2      LYS  37 -18.220   7.836   3.606
  164    HZ3  LYS  37           HZ3      LYS  37 -18.868   8.247   2.097
  165    H    GLY  38           H        GLY  38 -17.574  13.906   4.512
  166    HA2  GLY  38           HA2      GLY  38 -18.222  15.032   1.864
  167    HA3  GLY  38           HA3      GLY  38 -17.388  15.897   3.146
  168    HA1  GLY  38           HA1      GLY  38 -17.922  14.210   1.968
  169    H    SER  39           H        SER  39 -15.658  13.619   3.787
  170    HA   SER  39           HA       SER  39 -13.715  14.044   1.652
  171    HB2  SER  39           HB1      SER  39 -13.181  14.360   4.131
  172    HB3  SER  39           HB2      SER  39 -13.237  12.591   4.255
  173    HG   SER  39           HG       SER  39 -11.681  12.745   2.366
  174    H    GLN  40           H        GLN  40 -13.261  12.560   0.168
  175    HA   GLN  40           HA       GLN  40 -14.677  10.160  -0.077
  176    HB2  GLN  40           HB1      GLN  40 -12.882  11.648  -1.637
  177    HB3  GLN  40           HB2      GLN  40 -12.143  10.048  -1.463
  178    HG2  GLN  40           HG1      GLN  40 -15.016  10.048  -2.122
  179    HG3  GLN  40           HG2      GLN  40 -13.935  10.691  -3.368
  180   HE21  GLN  40          HE21      GLN  40 -15.412   7.977  -2.338
  181   HE22  GLN  40          HE22      GLN  40 -14.347   6.785  -2.991
  182    H    CYS  41           H        CYS  41 -11.272  10.683   0.839
  183    HA   CYS  41           HA       CYS  41 -11.363   8.114   2.272
  184    HB2  CYS  41           HB1      CYS  41  -9.142   7.556   1.552
  185    HB3  CYS  41           HB2      CYS  41 -10.108   7.913   0.120
  186    H    LEU  42           H        LEU  42 -10.202   8.002   4.188
  187    HA   LEU  42           HA       LEU  42  -9.500  10.600   5.331
  188    HB2  LEU  42           HB1      LEU  42 -10.871   8.358   6.304
  189    HB3  LEU  42           HB2      LEU  42  -9.323   8.384   7.166
  190    HG   LEU  42           HG       LEU  42  -9.905  10.859   7.660
  191   HD11  LEU  42          HD11      LEU  42 -11.906  10.641   6.020
  192   HD12  LEU  42          HD12      LEU  42 -12.104  11.546   7.520
  193   HD13  LEU  42          HD13      LEU  42 -12.722   9.899   7.395
  194   HD21  LEU  42          HD21      LEU  42 -10.144   8.546   9.070
  195   HD22  LEU  42          HD22      LEU  42 -11.786   9.184   9.162
  196   HD23  LEU  42          HD23      LEU  42 -10.428  10.158   9.726
  197    H    SER  43           H        SER  43  -8.106   7.534   4.445
  198    HA   SER  43           HA       SER  43  -5.447   8.629   4.809
  199    HB2  SER  43           HB1      SER  43  -6.397   7.273   6.936
  200    HB3  SER  43           HB2      SER  43  -5.760   5.920   5.985
  201    HG   SER  43           HG       SER  43  -4.366   8.173   6.974
  202    H    ASP  44           H        ASP  44  -3.774   6.905   4.097
  203    HA   ASP  44           HA       ASP  44  -4.332   6.201   1.440
  204    HB2  ASP  44           HB1      ASP  44  -2.189   4.886   1.583
  205    HB3  ASP  44           HB2      ASP  44  -2.059   6.577   2.086
  206    HD2  ASP  44           HD       ASP  44  -1.698   3.789   4.889
  207    H    THR  45           H        THR  45  -4.763   4.479   4.424
  208    HA   THR  45           HA       THR  45  -4.854   1.847   3.489
  209    HB   THR  45           HB       THR  45  -6.787   2.605   5.611
  210    HG1  THR  45           HG1      THR  45  -3.979   2.732   6.066
  211   HG21  THR  45          HG21      THR  45  -4.604   0.528   5.387
  212   HG22  THR  45          HG22      THR  45  -6.330   0.266   5.135
  213   HG23  THR  45          HG23      THR  45  -5.725   0.682   6.739
  214    H    ASP  46           H        ASP  46  -7.125   4.446   3.187
  215    HA   ASP  46           HA       ASP  46  -9.418   2.847   2.613
  216    HB2  ASP  46           HB1      ASP  46  -8.840   5.608   2.966
  217    HB3  ASP  46           HB2      ASP  46  -9.606   5.426   1.382
  218    HD2  ASP  46           HD       ASP  46 -12.673   5.059   2.829
  219    H    CYS  47           H        CYS  47  -6.767   4.110   0.742
  220    HA   CYS  47           HA       CYS  47  -7.982   3.749  -1.817
  221    HB2  CYS  47           HB1      CYS  47  -5.452   4.694  -0.759
  222    HB3  CYS  47           HB2      CYS  47  -5.201   3.639  -2.150
  223    H    ASN  48           H        ASN  48  -6.625   2.325  -3.450
  224    HA   ASN  48           HA       ASN  48  -7.157  -0.363  -2.786
  225    HB2  ASN  48           HB1      ASN  48  -6.003   1.102  -5.083
  226    HB3  ASN  48           HB2      ASN  48  -5.492  -0.584  -4.925
  227   HD21  ASN  48          HD21      ASN  48  -8.446   1.372  -4.758
  228   HD22  ASN  48          HD22      ASN  48  -9.447   0.236  -5.589
  229    H    THR  49           H        THR  49  -5.373  -2.090  -3.208
  230    HA   THR  49           HA       THR  49  -3.492  -1.867  -1.095
  231    HB   THR  49           HB       THR  49  -3.560  -3.925  -3.309
  232    HG1  THR  49           HG1      THR  49  -5.051  -3.587  -0.961
  233   HG21  THR  49          HG21      THR  49  -2.344  -5.342  -1.763
  234   HG22  THR  49          HG22      THR  49  -2.383  -4.080  -0.532
  235   HG23  THR  49          HG23      THR  49  -1.453  -3.841  -2.011
  236    H    ARG  50           H        ARG  50  -1.306  -1.536  -1.111
  237    HA   ARG  50           HA       ARG  50   0.712  -0.756  -1.810
  238    HB2  ARG  50           HB1      ARG  50  -0.039  -2.729  -3.644
  239    HB3  ARG  50           HB2      ARG  50   0.508  -1.369  -4.634
  240    HG2  ARG  50           HG1      ARG  50   2.584  -2.085  -4.326
  241    HG3  ARG  50           HG2      ARG  50   2.423  -1.574  -2.638
  242    HD2  ARG  50           HD1      ARG  50   3.166  -3.867  -2.682
  243    HD3  ARG  50           HD2      ARG  50   1.501  -3.808  -2.090
  244    HE   ARG  50           HE       ARG  50   0.883  -5.082  -3.874
  245   HH11  ARG  50          HH11      ARG  50   3.906  -3.524  -4.620
  246   HH12  ARG  50          HH12      ARG  50   4.106  -4.345  -6.132
  247   HH21  ARG  50          HH21      ARG  50   1.135  -6.169  -5.863
  248   HH22  ARG  50          HH22      ARG  50   2.528  -5.848  -6.839
  249    H    LYS  51           H        LYS  51  -1.736   0.891  -2.033
  250    HA   LYS  51           HA       LYS  51  -0.587   2.989  -3.704
  251    HB2  LYS  51           HB1      LYS  51  -3.480   2.117  -3.936
  252    HB3  LYS  51           HB2      LYS  51  -2.733   3.486  -4.774
  253    HG2  LYS  51           HG1      LYS  51  -1.102   1.683  -5.717
  254    HG3  LYS  51           HG2      LYS  51  -2.399   0.563  -5.263
  255    HD2  LYS  51           HD1      LYS  51  -3.968   2.142  -6.551
  256    HD3  LYS  51           HD2      LYS  51  -2.484   2.826  -7.237
  257    HE2  LYS  51           HE1      LYS  51  -2.871   1.235  -8.821
  258    HE3  LYS  51           HE2      LYS  51  -1.959   0.252  -7.667
  259    HZ1  LYS  51           HZ1      LYS  51  -4.614   0.162  -6.866
  260    HZ2  LYS  51           HZ2      LYS  51  -3.699  -1.088  -7.545
  261    HZ3  LYS  51           HZ3      LYS  51  -4.619  -0.076  -8.541
  262    H    PHE  52           H        PHE  52  -0.911   5.022  -2.922
  263    HA   PHE  52           HA       PHE  52  -2.359   5.204  -0.373
  264    HB2  PHE  52           HB1      PHE  52  -0.986   7.216   0.058
  265    HB3  PHE  52           HB2      PHE  52  -0.003   5.774  -0.205
  266    HD1  PHE  52           HD1      PHE  52   1.548   5.628  -1.975
  267    HD2  PHE  52           HD2      PHE  52  -1.175   8.893  -1.786
  268    HE1  PHE  52           HE1      PHE  52   2.810   6.779  -3.746
  269    HE2  PHE  52           HE2      PHE  52   0.081  10.049  -3.558
  270    HZ   PHE  52           HZ       PHE  52   2.077   8.993  -4.541
  271    H    CYS  53           H        CYS  53  -3.252   7.466   0.069
  272    HA   CYS  53           HA       CYS  53  -4.926   8.199  -2.208
  273    HB2  CYS  53           HB1      CYS  53  -5.421   7.894   0.521
  274    HB3  CYS  53           HB2      CYS  53  -5.456   9.639   0.262
  275    H    LEU  54           H        LEU  54  -4.257   9.787  -3.480
  276    HA   LEU  54           HA       LEU  54  -2.527  11.881  -2.381
  277    HB2  LEU  54           HB1      LEU  54  -1.764  10.657  -4.383
  278    HB3  LEU  54           HB2      LEU  54  -3.199  11.232  -5.249
  279    HG   LEU  54           HG       LEU  54  -2.150  13.593  -4.501
  280   HD11  LEU  54          HD11      LEU  54  -0.226  12.412  -3.428
  281   HD12  LEU  54          HD12      LEU  54   0.227  13.590  -4.660
  282   HD13  LEU  54          HD13      LEU  54   0.258  11.867  -5.033
  283   HD21  LEU  54          HD21      LEU  54  -1.667  13.895  -6.725
  284   HD22  LEU  54          HD22      LEU  54  -2.733  12.493  -6.806
  285   HD23  LEU  54          HD23      LEU  54  -0.985  12.279  -6.911
  286    H    GLN  55           H        GLN  55  -3.116  13.982  -2.282
  287    HA   GLN  55           HA       GLN  55  -5.674  14.771  -3.490
  288    HB2  GLN  55           HB1      GLN  55  -6.132  16.121  -1.409
  289    HB3  GLN  55           HB2      GLN  55  -6.253  14.364  -1.218
  290    HG2  GLN  55           HG1      GLN  55  -3.589  15.428  -0.641
  291    HG3  GLN  55           HG2      GLN  55  -4.861  16.044   0.420
  292   HE21  GLN  55          HE21      GLN  55  -5.479  14.835   2.075
  293   HE22  GLN  55          HE22      GLN  55  -5.084  13.169   2.308
  294    HA   PRO  56           HA       PRO  56  -2.457  17.808  -4.676
  295    HB2  PRO  56           HB1      PRO  56  -3.556  18.330  -7.131
  296    HB3  PRO  56           HB2      PRO  56  -2.485  16.967  -6.815
  297    HG2  PRO  56           HG1      PRO  56  -5.481  17.048  -6.906
  298    HG3  PRO  56           HG2      PRO  56  -4.349  15.852  -7.641
  299    HD2  PRO  56           HD1      PRO  56  -5.704  15.367  -5.341
  300    HD3  PRO  56           HD2      PRO  56  -4.076  14.738  -5.642
  301    H    ARG  57           H        ARG  57  -2.554  20.039  -4.704
  302    HA   ARG  57           HA       ARG  57  -5.006  21.200  -3.706
  303    HB2  ARG  57           HB1      ARG  57  -3.641  23.285  -3.537
  304    HB3  ARG  57           HB2      ARG  57  -2.965  21.905  -2.659
  305    HG2  ARG  57           HG1      ARG  57  -1.137  21.754  -3.990
  306    HG3  ARG  57           HG2      ARG  57  -2.017  22.295  -5.429
  307    HD2  ARG  57           HD1      ARG  57  -0.652  24.116  -5.044
  308    HD3  ARG  57           HD2      ARG  57  -2.116  24.579  -4.166
  309    HE   ARG  57           HE       ARG  57  -0.631  23.306  -2.286
  310   HH11  ARG  57          HH11      ARG  57  -0.011  25.931  -4.487
  311   HH12  ARG  57          HH12      ARG  57   1.125  26.713  -3.440
  312   HH21  ARG  57          HH21      ARG  57   0.863  24.327  -0.898
  313   HH22  ARG  57          HH22      ARG  57   1.623  25.799  -1.399
  314    H    ASP  58           H        ASP  58  -3.261  21.045  -6.696
  315    HA   ASP  58           HA       ASP  58  -4.799  23.212  -7.888
  316    HB2  ASP  58           HB1      ASP  58  -2.245  22.231  -8.327
  317    HB3  ASP  58           HB2      ASP  58  -3.164  21.611  -9.706
  318    HD2  ASP  58           HD       ASP  58  -3.998  25.155 -10.342
  319    H    GLU  59           H        GLU  59  -4.833  19.773  -7.658
  320    HA   GLU  59           HA       GLU  59  -7.031  19.681  -9.618
  321    HB2  GLU  59           HB1      GLU  59  -4.603  18.311  -9.743
  322    HB3  GLU  59           HB2      GLU  59  -5.766  17.110  -9.162
  323    HG2  GLU  59           HG1      GLU  59  -6.642  16.861 -11.181
  324    HG3  GLU  59           HG2      GLU  59  -6.892  18.606 -11.335
  325    HE2  GLU  59           HE       GLU  59  -3.332  17.394 -12.610
  326    H    LYS  60           H        LYS  60  -8.206  17.387  -9.214
  327    HA   LYS  60           HA       LYS  60  -9.305  17.633  -6.544
  328    HB2  LYS  60           HB1      LYS  60 -11.091  16.272  -7.289
  329    HB3  LYS  60           HB2      LYS  60 -10.693  17.336  -8.647
  330    HG2  LYS  60           HG1      LYS  60  -9.108  15.178  -9.170
  331    HG3  LYS  60           HG2      LYS  60 -10.531  14.425  -8.432
  332    HD2  LYS  60           HD1      LYS  60 -11.916  15.877 -10.035
  333    HD3  LYS  60           HD2      LYS  60 -10.388  16.143 -10.892
  334    HE2  LYS  60           HE1      LYS  60 -10.127  13.643 -11.038
  335    HE3  LYS  60           HE2      LYS  60 -11.768  13.511 -10.390
  336    HZ1  LYS  60           HZ1      LYS  60 -11.187  15.104 -12.812
  337    HZ2  LYS  60           HZ2      LYS  60 -12.675  14.496 -12.286
  338    HZ3  LYS  60           HZ3      LYS  60 -11.500  13.443 -12.896
  339    HA   PRO  61           HA       PRO  61  -7.211  14.254  -4.679
  340    HB2  PRO  61           HB1      PRO  61  -9.138  13.315  -2.975
  341    HB3  PRO  61           HB2      PRO  61  -8.273  14.832  -2.725
  342    HG2  PRO  61           HG1      PRO  61 -10.972  14.361  -3.944
  343    HG3  PRO  61           HG2      PRO  61 -10.468  15.599  -2.734
  344    HD2  PRO  61           HD1      PRO  61 -10.788  16.170  -5.369
  345    HD3  PRO  61           HD2      PRO  61  -9.565  16.961  -4.359
  346    H    PHE  62           H        PHE  62  -6.777  12.207  -5.234
  347    HA   PHE  62           HA       PHE  62  -8.877  10.332  -5.877
  348    HB2  PHE  62           HB1      PHE  62  -7.921   9.783  -8.120
  349    HB3  PHE  62           HB2      PHE  62  -8.678  11.375  -8.035
  350    HD1  PHE  62           HD1      PHE  62  -5.359   9.717  -7.819
  351    HD2  PHE  62           HD2      PHE  62  -7.526  13.272  -8.705
  352    HE1  PHE  62           HE1      PHE  62  -3.295  10.762  -8.653
  353    HE2  PHE  62           HE2      PHE  62  -5.466  14.323  -9.542
  354    HZ   PHE  62           HZ       PHE  62  -3.346  13.068  -9.517
  355    H    CYS  63           H        CYS  63  -7.720   8.217  -6.770
  356    HA   CYS  63           HA       CYS  63  -5.707   7.578  -4.771
  357    HB2  CYS  63           HB1      CYS  63  -7.824   6.176  -5.473
  358    HB3  CYS  63           HB2      CYS  63  -6.756   5.589  -6.750
  359    H    ALA  64           H        ALA  64  -3.605   7.270  -5.170
  360    HA   ALA  64           HA       ALA  64  -2.731   7.040  -7.973
  361    HB1  ALA  64           HB1      ALA  64  -2.263   9.288  -7.403
  362    HB2  ALA  64           HB2      ALA  64  -1.607   8.829  -5.830
  363    HB3  ALA  64           HB3      ALA  64  -0.729   8.424  -7.305
  364    H    THR  65           H        THR  65  -0.615   6.054  -8.252
  365    HA   THR  65           HA       THR  65  -0.159   3.976  -6.240
  366    HB   THR  65           HB       THR  65   1.287   3.953  -8.844
  367    HG1  THR  65           HG1      THR  65  -0.694   2.877  -9.692
  368   HG21  THR  65          HG21      THR  65   0.096   1.494  -8.321
  369   HG22  THR  65          HG22      THR  65   0.558   2.108  -6.733
  370   HG23  THR  65          HG23      THR  65   1.771   1.942  -8.002
  371    H    CYS  66           H        CYS  66   2.171   3.270  -5.984
  372    HA   CYS  66           HA       CYS  66   3.679   5.357  -4.887
  373    HB2  CYS  66           HB1      CYS  66   5.392   3.750  -4.488
  374    HB3  CYS  66           HB2      CYS  66   3.849   2.913  -4.302
  375    H    ARG  67           H        ARG  67   6.106   5.614  -5.543
  376    HA   ARG  67           HA       ARG  67   6.136   6.288  -8.408
  377    HB2  ARG  67           HB1      ARG  67   7.946   7.446  -6.289
  378    HB3  ARG  67           HB2      ARG  67   7.627   8.071  -7.914
  379    HG2  ARG  67           HG1      ARG  67   5.123   8.101  -6.863
  380    HG3  ARG  67           HG2      ARG  67   6.112   8.427  -5.430
  381    HD2  ARG  67           HD1      ARG  67   7.161  10.317  -6.495
  382    HD3  ARG  67           HD2      ARG  67   6.371   9.929  -8.029
  383    HE   ARG  67           HE       ARG  67   4.295  10.286  -6.315
  384   HH11  ARG  67          HH11      ARG  67   7.067  12.199  -7.196
  385   HH12  ARG  67          HH12      ARG  67   6.271  13.714  -6.925
  386   HH21  ARG  67          HH21      ARG  67   3.236  12.274  -5.955
  387   HH22  ARG  67          HH22      ARG  67   4.092  13.755  -6.218
  388    H    GLY  68           H        GLY  68   8.203   6.108  -9.533
  389    HA2  GLY  68           HA2      GLY  68   9.400   3.568  -9.116
  390    HA3  GLY  68           HA3      GLY  68   9.927   4.781 -10.274
  391    HA1  GLY  68           HA1      GLY  68   9.317   4.041  -8.377
  392    H    LEU  69           H        LEU  69  12.037   3.770  -9.531
  393    HA   LEU  69           HA       LEU  69  13.023   4.442  -6.938
  394    HB2  LEU  69           HB1      LEU  69  14.292   3.435  -9.472
  395    HB3  LEU  69           HB2      LEU  69  15.264   3.880  -8.059
  396    HG   LEU  69           HG       LEU  69  13.153   1.724  -8.140
  397   HD11  LEU  69          HD11      LEU  69  14.741   0.332  -8.808
  398   HD12  LEU  69          HD12      LEU  69  15.782   0.828  -7.474
  399   HD13  LEU  69          HD13      LEU  69  15.833   1.705  -9.003
  400   HD21  LEU  69          HD21      LEU  69  13.213   2.678  -5.950
  401   HD22  LEU  69          HD22      LEU  69  14.977   2.678  -5.938
  402   HD23  LEU  69          HD23      LEU  69  14.094   1.150  -5.899
  403    H    ARG  70           H        ARG  70  13.953   5.607 -10.183
  404    HA   ARG  70           HA       ARG  70  15.571   7.707  -9.340
  405    HB2  ARG  70           HB1      ARG  70  13.873   7.514 -11.840
  406    HB3  ARG  70           HB2      ARG  70  15.192   8.667 -11.589
  407    HG2  ARG  70           HG1      ARG  70  15.566   5.676 -11.510
  408    HG3  ARG  70           HG2      ARG  70  15.778   6.663 -12.967
  409    HD2  ARG  70           HD1      ARG  70  17.228   7.882 -10.823
  410    HD3  ARG  70           HD2      ARG  70  17.643   6.162 -10.895
  411    HE   ARG  70           HE       ARG  70  17.826   6.930 -13.477
  412   HH11  ARG  70          HH11      ARG  70  19.148   8.200 -10.518
  413   HH12  ARG  70          HH12      ARG  70  20.575   8.831 -11.273
  414   HH21  ARG  70          HH21      ARG  70  19.700   7.756 -14.482
  415   HH22  ARG  70          HH22      ARG  70  20.887   8.578 -13.528
  416    H    ARG  71           H        ARG  71  12.126   7.437  -9.418
  417    HA   ARG  71           HA       ARG  71  11.377  10.125  -9.519
  418    HB2  ARG  71           HB1      ARG  71  10.152   7.588  -8.771
  419    HB3  ARG  71           HB2      ARG  71   9.552   8.937  -7.795
  420    HG2  ARG  71           HG1      ARG  71   8.162   8.529  -9.781
  421    HG3  ARG  71           HG2      ARG  71   8.895  10.142  -9.782
  422    HD2  ARG  71           HD1      ARG  71  10.659   9.348 -11.301
  423    HD3  ARG  71           HD2      ARG  71   9.914   7.743 -11.300
  424    HE   ARG  71           HE       ARG  71   9.069  10.029 -12.799
  425   HH11  ARG  71          HH11      ARG  71   8.004   7.070 -11.305
  426   HH12  ARG  71          HH12      ARG  71   6.635   6.882 -12.350
  427   HH21  ARG  71          HH21      ARG  71   7.269   9.792 -14.182
  428   HH22  ARG  71          HH22      ARG  71   6.219   8.430 -13.986
  429    H    ARG  72           H        ARG  72  11.181  11.727  -8.021
  430    HA   ARG  72           HA       ARG  72  12.805  11.514  -5.663
  431    HB2  ARG  72           HB1      ARG  72  12.088  13.882  -5.279
  432    HB3  ARG  72           HB2      ARG  72  12.846  13.593  -6.852
  433    HG2  ARG  72           HG1      ARG  72   9.956  13.272  -6.951
  434    HG3  ARG  72           HG2      ARG  72  10.452  14.882  -6.404
  435    HD2  ARG  72           HD1      ARG  72  12.163  14.551  -8.470
  436    HD3  ARG  72           HD2      ARG  72  10.792  13.585  -9.033
  437    HE   ARG  72           HE       ARG  72   9.739  15.988  -8.163
  438   HH11  ARG  72          HH11      ARG  72  11.992  14.904 -10.586
  439   HH12  ARG  72          HH12      ARG  72  11.641  16.202 -11.679
  440   HH21  ARG  72          HH21      ARG  72   9.269  17.702  -9.593
  441   HH22  ARG  72          HH22      ARG  72  10.093  17.794 -11.113
  442    H    CYS  73           H        CYS  73  12.063  12.059  -3.502
  443    HA   CYS  73           HA       CYS  73   9.237  11.828  -2.930
  444    HB2  CYS  73           HB1      CYS  73   9.558   9.900  -1.377
  445    HB3  CYS  73           HB2      CYS  73   9.765   9.486  -3.080
  446    H    GLN  74           H        GLN  74   8.805  12.035  -0.569
  447    HA   GLN  74           HA       GLN  74  10.910  13.643   0.721
  448    HB2  GLN  74           HB1      GLN  74   7.948  14.007   0.522
  449    HB3  GLN  74           HB2      GLN  74   8.784  14.590   1.969
  450    HG2  GLN  74           HG1      GLN  74  10.222  16.004   0.622
  451    HG3  GLN  74           HG2      GLN  74   9.471  15.380  -0.852
  452   HE21  GLN  74          HE21      GLN  74   7.369  16.000  -1.378
  453   HE22  GLN  74          HE22      GLN  74   6.616  17.379  -0.659
  454    H    ARG  75           H        ARG  75   8.640  11.048   1.045
  455    HA   ARG  75           HA       ARG  75   9.684  10.525   3.747
  456    HB2  ARG  75           HB1      ARG  75   6.833  10.383   2.773
  457    HB3  ARG  75           HB2      ARG  75   7.380   9.494   4.201
  458    HG2  ARG  75           HG1      ARG  75   7.233  11.297   5.486
  459    HG3  ARG  75           HG2      ARG  75   8.203  12.247   4.349
  460    HD2  ARG  75           HD1      ARG  75   5.875  12.131   2.981
  461    HD3  ARG  75           HD2      ARG  75   5.272  12.056   4.643
  462    HE   ARG  75           HE       ARG  75   7.078  14.132   4.609
  463   HH11  ARG  75          HH11      ARG  75   4.131  13.321   2.944
  464   HH12  ARG  75          HH12      ARG  75   3.653  14.970   2.716
  465   HH21  ARG  75          HH21      ARG  75   6.461  16.307   4.314
  466   HH22  ARG  75          HH22      ARG  75   4.979  16.668   3.494
  467    H    ASP  76           H        ASP  76   9.040   8.156   4.380
  468    HA   ASP  76           HA       ASP  76  10.230   6.460   2.377
  469    HB2  ASP  76           HB1      ASP  76  10.925   6.080   4.628
  470    HB3  ASP  76           HB2      ASP  76   9.253   5.958   5.188
  471    HD2  ASP  76           HD       ASP  76  10.364   2.851   2.994
  472    H    ALA  77           H        ALA  77   7.140   6.439   4.157
  473    HA   ALA  77           HA       ALA  77   5.941   4.307   2.852
  474    HB1  ALA  77           HB1      ALA  77   3.853   5.127   3.662
  475    HB2  ALA  77           HB2      ALA  77   5.077   5.492   4.879
  476    HB3  ALA  77           HB3      ALA  77   4.489   6.766   3.809
  477    H    MET  78           H        MET  78   6.482   7.558   1.757
  478    HA   MET  78           HA       MET  78   4.557   7.806  -0.230
  479    HB2  MET  78           HB1      MET  78   7.250   8.955   0.265
  480    HB3  MET  78           HB2      MET  78   6.606   9.111  -1.376
  481    HG2  MET  78           HG1      MET  78   4.454   9.943  -0.049
  482    HG3  MET  78           HG2      MET  78   5.684  10.354   1.148
  483    HE1  MET  78           HE1      MET  78   4.865  12.017  -2.932
  484    HE2  MET  78           HE2      MET  78   6.278  10.969  -3.065
  485    HE3  MET  78           HE3      MET  78   4.765  10.331  -2.420
  486    H    CYS  79           H        CYS  79   7.409   5.844  -0.121
  487    HA   CYS  79           HA       CYS  79   7.167   5.208  -2.975
  488    HB2  CYS  79           HB1      CYS  79   9.394   5.760  -1.595
  489    HB3  CYS  79           HB2      CYS  79   9.326   4.021  -1.305
  490    H    CYS  80           H        CYS  80   7.168   2.987  -3.660
  491    HA   CYS  80           HA       CYS  80   5.257   1.396  -2.463
  492    HB2  CYS  80           HB1      CYS  80   7.262   1.077  -4.579
  493    HB3  CYS  80           HB2      CYS  80   6.844  -0.438  -3.776
  494    HA   PRO  81           HA       PRO  81   7.095  -0.757   0.887
  495    HB2  PRO  81           HB1      PRO  81   6.038  -3.271   0.630
  496    HB3  PRO  81           HB2      PRO  81   5.101  -1.868   1.146
  497    HG2  PRO  81           HG1      PRO  81   5.333  -3.104  -1.577
  498    HG3  PRO  81           HG2      PRO  81   3.860  -2.548  -0.699
  499    HD2  PRO  81           HD1      PRO  81   5.036  -1.087  -2.661
  500    HD3  PRO  81           HD2      PRO  81   4.237  -0.346  -1.264
  501    H    GLY  82           H        GLY  82   9.198  -1.237   0.980
  502    HA2  GLY  82           HA2      GLY  82  10.672  -3.274   0.767
  503    HA3  GLY  82           HA3      GLY  82  10.264  -3.212  -0.941
  504    HA1  GLY  82           HA1      GLY  82  10.628  -2.424   1.000
  505    H    THR  83           H        THR  83  10.344  -0.153  -0.623
  506    HA   THR  83           HA       THR  83  13.277   0.081  -0.816
  507    HB   THR  83           HB       THR  83  12.943   1.926  -2.394
  508    HG1  THR  83           HG1      THR  83  10.185   1.254  -2.441
  509   HG21  THR  83          HG21      THR  83  11.296   0.142  -3.884
  510   HG22  THR  83          HG22      THR  83  12.387  -0.813  -2.882
  511   HG23  THR  83          HG23      THR  83  13.037   0.386  -3.999
  512    H    LEU  84           H        LEU  84  13.960   2.484  -0.556
  513    HA   LEU  84           HA       LEU  84  12.424   3.760   1.595
  514    HB2  LEU  84           HB1      LEU  84  14.896   2.412   1.900
  515    HB3  LEU  84           HB2      LEU  84  15.218   4.150   2.040
  516    HG   LEU  84           HG       LEU  84  12.939   3.160   3.625
  517   HD11  LEU  84          HD11      LEU  84  14.572   1.305   3.822
  518   HD12  LEU  84          HD12      LEU  84  14.283   2.152   5.340
  519   HD13  LEU  84          HD13      LEU  84  15.759   2.461   4.426
  520   HD21  LEU  84          HD21      LEU  84  13.350   5.281   4.254
  521   HD22  LEU  84          HD22      LEU  84  15.031   5.226   3.721
  522   HD23  LEU  84          HD23      LEU  84  14.576   4.536   5.280
  523    H    CYS  85           H        CYS  85  12.985   6.030   1.936
  524    HA   CYS  85           HA       CYS  85  13.537   7.332  -0.606
  525    HB2  CYS  85           HB1      CYS  85  11.607   7.905   1.018
  526    HB3  CYS  85           HB2      CYS  85  12.843   8.737   1.963
  527    H    VAL  86           H        VAL  86  15.708   7.307  -0.960
  528    HA   VAL  86           HA       VAL  86  17.443   8.434   1.134
  529    HB   VAL  86           HB       VAL  86  18.200   6.762  -1.267
  530   HG11  VAL  86          HG11      VAL  86  20.440   6.721  -0.288
  531   HG12  VAL  86          HG12      VAL  86  19.941   8.368  -0.678
  532   HG13  VAL  86          HG13      VAL  86  19.902   7.807   0.994
  533   HG21  VAL  86          HG21      VAL  86  18.949   5.516   1.133
  534   HG22  VAL  86          HG22      VAL  86  17.287   6.059   1.362
  535   HG23  VAL  86          HG23      VAL  86  17.693   5.010   0.004
  536    H    ASN  87           H        ASN  87  18.571  10.266   0.782
  537    HA   ASN  87           HA       ASN  87  19.121  12.268  -0.151
  538    HB2  ASN  87           HB1      ASN  87  20.285  10.362  -1.649
  539    HB3  ASN  87           HB2      ASN  87  19.267  11.113  -2.885
  540   HD21  ASN  87          HD21      ASN  87  21.845  11.280  -3.339
  541   HD22  ASN  87          HD22      ASN  87  22.460  12.863  -3.021
  542    H    ASP  88           H        ASP  88  16.348  11.738   0.048
  543    HA   ASP  88           HA       ASP  88  14.354  12.634  -0.583
  544    HB2  ASP  88           HB1      ASP  88  16.110  14.628  -0.963
  545    HB3  ASP  88           HB2      ASP  88  15.576  14.406  -2.633
  546    HD2  ASP  88           HD       ASP  88  12.478  15.776  -1.996
  547    H    VAL  89           H        VAL  89  15.629  10.395  -2.072
  548    HA   VAL  89           HA       VAL  89  13.778  10.404  -4.324
  549    HB   VAL  89           HB       VAL  89  16.714   9.783  -4.680
  550   HG11  VAL  89          HG11      VAL  89  14.457   9.727  -6.681
  551   HG12  VAL  89          HG12      VAL  89  16.160   9.415  -7.021
  552   HG13  VAL  89          HG13      VAL  89  15.250   8.313  -5.987
  553   HG21  VAL  89          HG21      VAL  89  16.254  12.186  -4.546
  554   HG22  VAL  89          HG22      VAL  89  16.748  11.711  -6.172
  555   HG23  VAL  89          HG23      VAL  89  15.048  12.025  -5.822
  556    H    CYS  90           H        CYS  90  13.034   8.386  -4.889
  557    HA   CYS  90           HA       CYS  90  13.051   6.374  -2.959
  558    HB2  CYS  90           HB1      CYS  90  12.207   6.537  -5.823
  559    HB3  CYS  90           HB2      CYS  90  12.277   4.949  -5.057
  560    H    THR  91           H        THR  91  14.180   4.496  -2.689
  561    HA   THR  91           HA       THR  91  16.153   3.665  -4.643
  562    HB   THR  91           HB       THR  91  17.003   4.509  -1.865
  563    HG1  THR  91           HG1      THR  91  18.455   5.817  -3.405
  564   HG21  THR  91          HG21      THR  91  18.602   3.273  -4.110
  565   HG22  THR  91          HG22      THR  91  18.172   2.490  -2.590
  566   HG23  THR  91          HG23      THR  91  19.261   3.876  -2.592
  567    H    THR  92           H        THR  92  16.458   1.511  -4.608
  568    HA   THR  92           HA       THR  92  14.790  -0.138  -3.049
  569    HB   THR  92           HB       THR  92  16.826  -1.807  -3.929
  570    HG1  THR  92           HG1      THR  92  17.379  -1.047  -5.965
  571   HG21  THR  92          HG21      THR  92  15.261  -2.464  -5.645
  572   HG22  THR  92          HG22      THR  92  14.399  -0.933  -5.498
  573   HG23  THR  92          HG23      THR  92  14.369  -2.094  -4.171
  574    H    MET  93           H        MET  93  15.146  -1.362  -1.248
  575    HA   MET  93           HA       MET  93  16.919  -0.485   0.696
  576    HB2  MET  93           HB1      MET  93  14.904  -2.455   0.471
  577    HB3  MET  93           HB2      MET  93  16.343  -3.269   1.106
  578    HG2  MET  93           HG1      MET  93  15.987  -0.769   2.466
  579    HG3  MET  93           HG2      MET  93  14.484  -1.695   2.504
  580    HE1  MET  93           HE1      MET  93  17.695  -1.654   5.168
  581    HE2  MET  93           HE2      MET  93  16.452  -0.585   4.520
  582    HE3  MET  93           HE3      MET  93  16.052  -1.722   5.807
  583    H    GLU  94           H        GLU  94  17.258  -3.131  -1.625
  584    HA   GLU  94           HA       GLU  94  19.573  -4.312  -0.664
  585    HB2  GLU  94           HB1      GLU  94  18.313  -4.055  -3.356
  586    HB3  GLU  94           HB2      GLU  94  19.974  -4.662  -3.269
  587    HG2  GLU  94           HG1      GLU  94  19.371  -6.571  -2.101
  588    HG3  GLU  94           HG2      GLU  94  17.844  -5.865  -1.556
  589    HE2  GLU  94           HE       GLU  94  16.686  -6.346  -5.015
  590    H    ASP  95           H        ASP  95  19.161  -1.362  -2.505
  591    HA   ASP  95           HA       ASP  95  21.997  -1.033  -2.960
  592    HB2  ASP  95           HB1      ASP  95  19.880  -0.170  -4.352
  593    HB3  ASP  95           HB2      ASP  95  20.113   1.242  -3.315
  594    HD2  ASP  95           HD       ASP  95  23.328   0.451  -5.482
  595    H    ALA  96           H        ALA  96  19.525   0.278  -0.818
  596    HA   ALA  96           HA       ALA  96  21.224   2.241   0.373
  597    HB1  ALA  96           HB1      ALA  96  18.534   1.819   0.344
  598    HB2  ALA  96           HB2      ALA  96  18.959   1.309   1.979
  599    HB3  ALA  96           HB3      ALA  96  19.371   2.933   1.427
  600    H    THR  97           H        THR  97  22.814   1.890   1.762
  601    HA   THR  97           HA       THR  97  22.828  -0.621   3.296
  602    HB   THR  97           HB       THR  97  24.775  -0.373   1.866
  603    HG1  THR  97           HG1      THR  97  25.936  -1.172   3.439
  604   HG21  THR  97          HG21      THR  97  26.392   1.470   2.278
  605   HG22  THR  97          HG22      THR  97  25.202   2.231   3.334
  606   HG23  THR  97          HG23      THR  97  24.856   2.026   1.617
  607    H    GLU  98           H        GLU  98  22.972   2.859   3.551
  608    HA   GLU  98           HA       GLU  98  22.799   4.279   5.321
  609    HB2  GLU  98           HB1      GLU  98  21.278   1.950   6.020
  610    HB3  GLU  98           HB2      GLU  98  22.072   2.584   7.471
  611    HG2  GLU  98           HG1      GLU  98  20.990   4.649   7.323
  612    HG3  GLU  98           HG2      GLU  98  20.538   4.383   5.634
  613    HE2  GLU  98           HE       GLU  98  17.976   2.109   6.720
  614    H    ASN  99           H        ASN  99  23.445   4.367   7.847
  615    HA   ASN  99           HA       ASN  99  26.274   3.914   7.861
  616    HB2  ASN  99           HB1      ASN  99  24.757   5.806   8.987
  617    HB3  ASN  99           HB2      ASN  99  24.851   4.693  10.357
  618   HD21  ASN  99          HD21      ASN  99  26.324   7.241   8.851
  619   HD22  ASN  99          HD22      ASN  99  27.890   7.121   9.570
  620    H    LEU 100           H        LEU 100  26.974   1.880   8.103
  621    HA   LEU 100           HA       LEU 100  25.993   0.374  10.432
  622    HB2  LEU 100           HB1      LEU 100  25.909  -0.360   7.626
  623    HB3  LEU 100           HB2      LEU 100  26.833  -1.529   8.584
  624    HG   LEU 100           HG       LEU 100  24.551  -1.168  10.087
  625   HD11  LEU 100          HD11      LEU 100  22.701  -1.484   8.495
  626   HD12  LEU 100          HD12      LEU 100  23.815  -1.174   7.163
  627   HD13  LEU 100          HD13      LEU 100  23.466   0.097   8.335
  628   HD21  LEU 100          HD21      LEU 100  24.267  -3.404   9.751
  629   HD22  LEU 100          HD22      LEU 100  25.923  -3.235   9.170
  630   HD23  LEU 100          HD23      LEU 100  24.587  -3.301   8.019
  631    H    TYR 101           H        TYR 101  27.578  -1.600  10.768
  632    HA   TYR 101           HA       TYR 101  30.317  -1.157  10.086
  633    HB2  TYR 101           HB1      TYR 101  29.455   0.415  12.155
  634    HB3  TYR 101           HB2      TYR 101  30.057  -1.005  13.015
  635    HD1  TYR 101           HD1      TYR 101  31.146   1.235  10.222
  636    HD2  TYR 101           HD2      TYR 101  32.270  -1.012  13.656
  637    HE1  TYR 101           HE1      TYR 101  33.455   2.050   9.992
  638    HE2  TYR 101           HE2      TYR 101  34.582  -0.202  13.436
  639    HH   TYR 101           HH       TYR 101  35.728   1.354  10.658
  640    H    PHE 102           H        PHE 102  31.753  -2.762  11.089
  641    HA   PHE 102           HA       PHE 102  30.273  -5.153  11.970
  642    HB2  PHE 102           HB1      PHE 102  31.749  -6.555  10.727
  643    HB3  PHE 102           HB2      PHE 102  31.209  -5.279   9.634
  644    HD1  PHE 102           HD1      PHE 102  32.728  -3.321   9.186
  645    HD2  PHE 102           HD2      PHE 102  34.043  -6.859  11.152
  646    HE1  PHE 102           HE1      PHE 102  35.062  -2.731   8.679
  647    HE2  PHE 102           HE2      PHE 102  36.379  -6.275  10.650
  648    HZ   PHE 102           HZ       PHE 102  36.892  -4.208   9.412
  649    H    GLN 103           H        GLN 103  31.515  -6.667  13.291
  650    HA   GLN 103           HA       GLN 103  33.627  -5.324  14.846
  651    HB2  GLN 103           HB1      GLN 103  31.077  -6.280  15.715
  652    HB3  GLN 103           HB2      GLN 103  32.337  -7.278  16.459
  653    HG2  GLN 103           HG1      GLN 103  33.275  -4.677  16.738
  654    HG3  GLN 103           HG2      GLN 103  31.538  -4.570  17.056
  655   HE21  GLN 103          HE21      GLN 103  34.152  -4.579  18.700
  656   HE22  GLN 103          HE22      GLN 103  33.773  -5.622  20.025
  657    H    SER 104           H        SER 104  35.507  -6.348  14.815
  658    HA   SER 104           HA       SER 104  35.752  -8.955  13.645
  659    HB2  SER 104           HB1      SER 104  37.434  -7.118  13.339
  660    HB3  SER 104           HB2      SER 104  37.887  -7.325  15.041
  661    HG   SER 104           HG       SER 104  39.279  -8.594  13.926
  662    H    LEU 105           H        LEU 105  36.071 -10.882  14.614
  663    HA   LEU 105           HA       LEU 105  35.328 -11.229  17.311
  664    HB2  LEU 105           HB1      LEU 105  36.066 -12.896  15.050
  665    HB3  LEU 105           HB2      LEU 105  36.709 -13.526  16.578
  666    HG   LEU 105           HG       LEU 105  34.185 -13.112  17.342
  667   HD11  LEU 105          HD11      LEU 105  33.594 -14.124  14.635
  668   HD12  LEU 105          HD12      LEU 105  33.903 -12.394  14.774
  669   HD13  LEU 105          HD13      LEU 105  32.615 -13.139  15.721
  670   HD21  LEU 105          HD21      LEU 105  35.432 -15.212  17.485
  671   HD22  LEU 105          HD22      LEU 105  35.130 -15.509  15.773
  672   HD23  LEU 105          HD23      LEU 105  33.785 -15.475  16.914
  673    H    GLU 106           H        GLU 106  36.768 -12.618  18.818
  674    HA   GLU 106           HA       GLU 106  39.585 -11.912  18.702
  675    HB2  GLU 106           HB1      GLU 106  37.822 -11.094  21.023
  676    HB3  GLU 106           HB2      GLU 106  39.584 -10.940  20.962
  677    HG2  GLU 106           HG1      GLU 106  39.292  -9.454  18.954
  678    HG3  GLU 106           HG2      GLU 106  37.558  -9.469  19.303
  679    HE2  GLU 106           HE       GLU 106  38.682  -7.916  22.524
  680    H    HIS 107           H        HIS 107  40.882 -13.073  20.257
  681    HA   HIS 107           HA       HIS 107  39.710 -15.091  21.914
  682    HB2  HIS 107           HB1      HIS 107  40.808 -17.007  20.693
  683    HB3  HIS 107           HB2      HIS 107  39.399 -16.308  19.889
  684    HD1  HIS 107           HD1      HIS 107  39.952 -14.610  17.866
  685    HD2  HIS 107           HD2      HIS 107  43.068 -17.044  19.143
  686    HE1  HIS 107           HE1      HIS 107  41.650 -14.559  16.011
  687    HE2  HIS 107           HE2      HIS 107  43.554 -16.045  16.789
  688    H    HIS 108           H        HIS 108  41.188 -16.011  23.334
  689    HA   HIS 108           HA       HIS 108  43.452 -14.507  23.974
  690    HB2  HIS 108           HB1      HIS 108  44.024 -16.343  25.524
  691    HB3  HIS 108           HB2      HIS 108  42.323 -15.882  25.632
  692    HD1  HIS 108           HD1      HIS 108  40.614 -17.677  25.280
  693    HD2  HIS 108           HD2      HIS 108  44.416 -18.845  24.079
  694    HE1  HIS 108           HE1      HIS 108  40.426 -20.127  24.744
  695    HE2  HIS 108           HE2      HIS 108  42.749 -20.842  24.008
  696    H    HIS 109           H        HIS 109  45.709 -15.287  24.082
  697    HA   HIS 109           HA       HIS 109  46.407 -16.997  21.790
  698    HB2  HIS 109           HB1      HIS 109  47.717 -14.397  22.625
  699    HB3  HIS 109           HB2      HIS 109  48.386 -15.506  21.421
  700    HD1  HIS 109           HD1      HIS 109  46.460 -12.540  21.582
  701    HD2  HIS 109           HD2      HIS 109  46.306 -15.972  19.245
  702    HE1  HIS 109           HE1      HIS 109  45.132 -11.907  19.542
  703    HE2  HIS 109           HE2      HIS 109  45.039 -14.004  18.112
  704    H    HIS 110           H        HIS 110  48.810 -17.646  21.929
  705    HA   HIS 110           HA       HIS 110  50.011 -17.784  24.513
  706    HB2  HIS 110           HB1      HIS 110  49.893 -20.319  24.640
  707    HB3  HIS 110           HB2      HIS 110  48.409 -19.449  25.038
  708    HD1  HIS 110           HD1      HIS 110  46.595 -20.976  24.293
  709    HD2  HIS 110           HD2      HIS 110  49.561 -20.548  21.414
  710    HE1  HIS 110           HE1      HIS 110  45.748 -22.202  22.267
  711    HE2  HIS 110           HE2      HIS 110  47.560 -21.941  20.508
  712    H    HIS 111           H        HIS 111  50.878 -16.929  21.998
  713    HA   HIS 111           HA       HIS 111  53.294 -18.444  21.751
  714    HB2  HIS 111           HB1      HIS 111  51.241 -19.399  20.214
  715    HB3  HIS 111           HB2      HIS 111  52.014 -18.263  19.105
  716    HD1  HIS 111           HD1      HIS 111  52.043 -21.565  19.201
  717    HD2  HIS 111           HD2      HIS 111  55.153 -18.901  19.904
  718    HE1  HIS 111           HE1      HIS 111  54.154 -22.866  18.772
  719    HE2  HIS 111           HE2      HIS 111  56.055 -21.237  19.202
  720    H    HIS 112           H        HIS 112  52.368 -15.709  22.298
  721    HA   HIS 112           HA       HIS 112  53.361 -14.205  20.000
  722    HB2  HIS 112           HB1      HIS 112  51.306 -13.676  21.665
  723    HB3  HIS 112           HB2      HIS 112  52.593 -12.799  22.499
  724    HD1  HIS 112           HD1      HIS 112  50.672 -12.808  19.275
  725    HD2  HIS 112           HD2      HIS 112  53.476 -10.475  21.262
  726    HE1  HIS 112           HE1      HIS 112  50.781 -10.648  17.990
  727    HE2  HIS 112           HE2      HIS 112  52.494  -9.222  19.203
  Start of MODEL   57
    1    H1   MET  18           H        MET  18 -28.167 -14.853  -7.820
    2    HA   MET  18           HA       MET  18 -30.143 -14.912  -8.956
    3    HB2  MET  18           HB1      MET  18 -31.227 -16.159  -6.418
    4    HB3  MET  18           HB2      MET  18 -32.080 -16.075  -7.965
    5    HG2  MET  18           HG1      MET  18 -31.028 -17.861  -8.781
    6    HG3  MET  18           HG2      MET  18 -29.456 -17.277  -8.225
    7    HE1  MET  18           HE1      MET  18 -29.845 -20.132  -8.399
    8    HE2  MET  18           HE2      MET  18 -28.481 -19.758  -7.345
    9    HE3  MET  18           HE3      MET  18 -29.696 -20.932  -6.834
   10    H    LEU  19           H        LEU  19 -29.745 -12.531  -8.535
   11    HA   LEU  19           HA       LEU  19 -31.181 -11.132  -6.558
   12    HB2  LEU  19           HB1      LEU  19 -29.328 -10.488  -8.475
   13    HB3  LEU  19           HB2      LEU  19 -30.799  -9.716  -9.091
   14    HG   LEU  19           HG       LEU  19 -29.582  -8.099  -7.827
   15   HD11  LEU  19          HD11      LEU  19 -32.171  -8.554  -7.473
   16   HD12  LEU  19          HD12      LEU  19 -31.311  -7.287  -6.599
   17   HD13  LEU  19          HD13      LEU  19 -31.632  -8.833  -5.816
   18   HD21  LEU  19          HD21      LEU  19 -28.867  -8.402  -5.573
   19   HD22  LEU  19          HD22      LEU  19 -28.279  -9.777  -6.506
   20   HD23  LEU  19          HD23      LEU  19 -29.688  -9.959  -5.459
   21    H    VAL  20           H        VAL  20 -33.319 -11.441  -6.353
   22    HA   VAL  20           HA       VAL  20 -35.104 -11.962  -8.474
   23    HB   VAL  20           HB       VAL  20 -35.575 -12.548  -6.117
   24   HG11  VAL  20          HG11      VAL  20 -36.024 -11.005  -4.459
   25   HG12  VAL  20          HG12      VAL  20 -34.725 -10.208  -5.349
   26   HG13  VAL  20          HG13      VAL  20 -36.401  -9.722  -5.609
   27   HG21  VAL  20          HG21      VAL  20 -37.801 -12.519  -6.476
   28   HG22  VAL  20          HG22      VAL  20 -37.840 -10.779  -6.763
   29   HG23  VAL  20          HG23      VAL  20 -37.335 -11.872  -8.050
   30    H    LEU  21           H        LEU  21 -36.380 -10.666  -9.697
   31    HA   LEU  21           HA       LEU  21 -35.671  -7.887  -9.877
   32    HB2  LEU  21           HB1      LEU  21 -36.508  -9.736 -11.679
   33    HB3  LEU  21           HB2      LEU  21 -38.013  -8.851 -11.375
   34    HG   LEU  21           HG       LEU  21 -35.433  -7.579 -12.285
   35   HD11  LEU  21          HD11      LEU  21 -36.685  -7.307 -14.441
   36   HD12  LEU  21          HD12      LEU  21 -37.871  -8.453 -13.818
   37   HD13  LEU  21          HD13      LEU  21 -36.199  -8.959 -14.060
   38   HD21  LEU  21          HD21      LEU  21 -36.833  -6.046 -11.048
   39   HD22  LEU  21          HD22      LEU  21 -38.240  -6.509 -12.007
   40   HD23  LEU  21          HD23      LEU  21 -36.898  -5.651 -12.766
   41    H    ASP  22           H        ASP  22 -36.564  -6.317  -8.731
   42    HA   ASP  22           HA       ASP  22 -39.312  -6.690  -7.731
   43    HB2  ASP  22           HB1      ASP  22 -38.756  -5.333  -5.819
   44    HB3  ASP  22           HB2      ASP  22 -37.545  -6.613  -5.970
   45    HD2  ASP  22           HD       ASP  22 -35.335  -4.018  -7.341
   46    H    PHE  23           H        PHE  23 -39.918  -4.179  -6.919
   47    HA   PHE  23           HA       PHE  23 -39.482  -2.403  -9.203
   48    HB2  PHE  23           HB1      PHE  23 -41.821  -3.910  -8.911
   49    HB3  PHE  23           HB2      PHE  23 -42.250  -2.299  -8.333
   50    HD1  PHE  23           HD1      PHE  23 -40.647  -4.014 -11.215
   51    HD2  PHE  23           HD2      PHE  23 -42.811  -0.623  -9.826
   52    HE1  PHE  23           HE1      PHE  23 -40.897  -3.228 -13.533
   53    HE2  PHE  23           HE2      PHE  23 -43.065   0.168 -12.142
   54    HZ   PHE  23           HZ       PHE  23 -42.108  -1.135 -13.999
   55    H    ASN  24           H        ASN  24 -40.581  -0.208  -8.738
   56    HA   ASN  24           HA       ASN  24 -39.509   0.768  -6.289
   57    HB2  ASN  24           HB1      ASN  24 -41.454   2.331  -7.968
   58    HB3  ASN  24           HB2      ASN  24 -40.044   2.906  -7.069
   59   HD21  ASN  24          HD21      ASN  24 -41.121   2.611 -10.050
   60   HD22  ASN  24          HD22      ASN  24 -39.655   2.298 -10.909
   61    H    ASN  25           H        ASN  25 -42.839   0.470  -7.514
   62    HA   ASN  25           HA       ASN  25 -44.844   0.320  -6.452
   63    HB2  ASN  25           HB1      ASN  25 -42.937  -1.022  -4.710
   64    HB3  ASN  25           HB2      ASN  25 -44.283  -0.326  -3.799
   65   HD21  ASN  25          HD21      ASN  25 -43.505  -2.428  -6.512
   66   HD22  ASN  25          HD22      ASN  25 -44.940  -3.386  -6.417
   67    H    ILE  26           H        ILE  26 -45.500   2.428  -6.470
   68    HA   ILE  26           HA       ILE  26 -46.063   4.486  -5.679
   69    HB   ILE  26           HB       ILE  26 -45.490   3.359  -2.940
   70   HG12  ILE  26          HG11      ILE  26 -48.250   3.261  -3.462
   71   HG13  ILE  26          HG12      ILE  26 -47.469   2.579  -4.898
   72   HG21  ILE  26          HG21      ILE  26 -46.034   5.892  -3.520
   73   HG22  ILE  26          HG22      ILE  26 -47.684   5.272  -3.501
   74   HG23  ILE  26          HG23      ILE  26 -46.663   5.105  -2.072
   75   HD11  ILE  26          HD11      ILE  26 -46.917   0.701  -3.846
   76   HD12  ILE  26          HD12      ILE  26 -46.337   1.565  -2.422
   77   HD13  ILE  26          HD13      ILE  26 -48.056   1.213  -2.600
   78    H    ARG  27           H        ARG  27 -44.357   5.663  -6.522
   79    HA   ARG  27           HA       ARG  27 -41.814   5.835  -5.237
   80    HB2  ARG  27           HB1      ARG  27 -43.098   7.599  -7.336
   81    HB3  ARG  27           HB2      ARG  27 -41.400   7.685  -6.837
   82    HG2  ARG  27           HG1      ARG  27 -41.704   5.026  -7.478
   83    HG3  ARG  27           HG2      ARG  27 -42.711   5.856  -8.677
   84    HD2  ARG  27           HD1      ARG  27 -39.977   6.925  -8.120
   85    HD3  ARG  27           HD2      ARG  27 -40.139   5.456  -9.091
   86    HE   ARG  27           HE       ARG  27 -41.897   7.408 -10.087
   87   HH11  ARG  27          HH11      ARG  27 -38.491   6.725  -9.861
   88   HH12  ARG  27          HH12      ARG  27 -38.088   7.597 -11.303
   89   HH21  ARG  27          HH21      ARG  27 -41.379   8.559 -11.988
   90   HH22  ARG  27          HH22      ARG  27 -39.731   8.640 -12.511
   91    H    SER  28           H        SER  28 -41.303   6.977  -3.500
   92    HA   SER  28           HA       SER  28 -43.187   8.876  -2.398
   93    HB2  SER  28           HB1      SER  28 -41.455   7.098  -1.255
   94    HB3  SER  28           HB2      SER  28 -40.549   8.614  -1.105
   95    HG   SER  28           HG       SER  28 -41.778   8.798   0.616
   96    H    SER  29           H        SER  29 -41.690  10.750  -1.167
   97    HA   SER  29           HA       SER  29 -40.449  12.203  -3.411
   98    HB2  SER  29           HB1      SER  29 -42.078  13.208  -1.064
   99    HB3  SER  29           HB2      SER  29 -41.121  14.278  -2.106
  100    HG   SER  29           HG       SER  29 -42.790  14.266  -3.370
  101    H    ALA  30           H        ALA  30 -38.368  11.397  -2.951
  102    HA   ALA  30           HA       ALA  30 -37.070  11.343  -0.513
  103    HB1  ALA  30           HB1      ALA  30 -35.758  12.054  -3.131
  104    HB2  ALA  30           HB2      ALA  30 -35.012  11.290  -1.726
  105    HB3  ALA  30           HB3      ALA  30 -36.218  10.414  -2.670
  106    H    ASP  31           H        ASP  31 -36.624  13.915  -2.948
  107    HA   ASP  31           HA       ASP  31 -36.167  16.135  -2.751
  108    HB2  ASP  31           HB1      ASP  31 -38.310  15.831  -1.253
  109    HB3  ASP  31           HB2      ASP  31 -37.177  16.152   0.068
  110    HD2  ASP  31           HD       ASP  31 -36.967  19.499  -0.712
  111    H    LEU  32           H        LEU  32 -35.006  17.790  -1.245
  112    HA   LEU  32           HA       LEU  32 -33.076  18.400  -0.211
  113    HB2  LEU  32           HB1      LEU  32 -34.285  17.016   1.608
  114    HB3  LEU  32           HB2      LEU  32 -33.084  15.770   1.226
  115    HG   LEU  32           HG       LEU  32 -31.533  18.008   1.645
  116   HD11  LEU  32          HD11      LEU  32 -33.734  19.032   2.509
  117   HD12  LEU  32          HD12      LEU  32 -32.283  19.186   3.499
  118   HD13  LEU  32          HD13      LEU  32 -33.500  17.976   3.902
  119   HD21  LEU  32          HD21      LEU  32 -32.320  15.665   3.338
  120   HD22  LEU  32          HD22      LEU  32 -31.193  16.880   3.942
  121   HD23  LEU  32          HD23      LEU  32 -30.807  15.966   2.482
  122    H    HIS  33           H        HIS  33 -32.523  17.628  -2.629
  123    HA   HIS  33           HA       HIS  33 -30.519  15.508  -2.588
  124    HB2  HIS  33           HB1      HIS  33 -32.219  16.748  -4.604
  125    HB3  HIS  33           HB2      HIS  33 -30.539  16.620  -5.139
  126    HD1  HIS  33           HD1      HIS  33 -33.408  14.829  -5.638
  127    HD2  HIS  33           HD2      HIS  33 -29.682  13.709  -4.182
  128    HE1  HIS  33           HE1      HIS  33 -33.265  12.345  -5.999
  129    HE2  HIS  33           HE2      HIS  33 -30.988  11.659  -5.109
  130    H    GLY  34           H        GLY  34 -28.841  16.444  -1.416
  131    HA2  GLY  34           HA2      GLY  34 -27.653  18.887  -2.557
  132    HA3  GLY  34           HA3      GLY  34 -27.374  18.290  -0.928
  133    HA1  GLY  34           HA1      GLY  34 -27.712  18.140  -3.021
  134    H    ALA  35           H        ALA  35 -25.427  19.018  -2.973
  135    HA   ALA  35           HA       ALA  35 -23.731  16.717  -2.726
  136    HB1  ALA  35           HB1      ALA  35 -24.678  17.538  -5.467
  137    HB2  ALA  35           HB2      ALA  35 -23.319  16.456  -5.157
  138    HB3  ALA  35           HB3      ALA  35 -24.948  15.989  -4.667
  139    H    ARG  36           H        ARG  36 -22.712  18.516  -1.537
  140    HA   ARG  36           HA       ARG  36 -20.894  19.974  -3.306
  141    HB2  ARG  36           HB1      ARG  36 -22.947  21.157  -1.584
  142    HB3  ARG  36           HB2      ARG  36 -21.326  21.796  -1.280
  143    HG2  ARG  36           HG1      ARG  36 -21.173  22.815  -3.308
  144    HG3  ARG  36           HG2      ARG  36 -22.200  21.609  -4.102
  145    HD2  ARG  36           HD1      ARG  36 -24.025  22.680  -2.455
  146    HD3  ARG  36           HD2      ARG  36 -22.947  24.071  -2.635
  147    HE   ARG  36           HE       ARG  36 -23.427  23.100  -5.188
  148   HH11  ARG  36          HH11      ARG  36 -25.253  24.472  -2.560
  149   HH12  ARG  36          HH12      ARG  36 -26.453  25.178  -3.589
  150   HH21  ARG  36          HH21      ARG  36 -25.001  24.026  -6.554
  151   HH22  ARG  36          HH22      ARG  36 -26.309  24.924  -5.861
  152    H    LYS  37           H        LYS  37 -18.851  20.258  -2.495
  153    HA   LYS  37           HA       LYS  37 -17.020  19.882  -1.201
  154    HB2  LYS  37           HB1      LYS  37 -18.337  21.344   0.370
  155    HB3  LYS  37           HB2      LYS  37 -18.927  19.863   1.141
  156    HG2  LYS  37           HG1      LYS  37 -16.117  19.635   1.017
  157    HG3  LYS  37           HG2      LYS  37 -16.485  21.273   1.586
  158    HD2  LYS  37           HD1      LYS  37 -18.019  19.014   2.779
  159    HD3  LYS  37           HD2      LYS  37 -16.322  19.211   3.250
  160    HE2  LYS  37           HE1      LYS  37 -17.720  21.755   3.267
  161    HE3  LYS  37           HE2      LYS  37 -18.520  20.562   4.300
  162    HZ1  LYS  37           HZ1      LYS  37 -16.760  20.451   5.707
  163    HZ2  LYS  37           HZ2      LYS  37 -16.544  22.040   5.172
  164    HZ3  LYS  37           HZ3      LYS  37 -15.613  20.792   4.512
  165    H    GLY  38           H        GLY  38 -16.622  17.819  -2.039
  166    HA2  GLY  38           HA2      GLY  38 -17.088  15.665  -0.107
  167    HA3  GLY  38           HA3      GLY  38 -17.631  15.416  -1.759
  168    HA1  GLY  38           HA1      GLY  38 -16.429  16.243  -0.212
  169    H    SER  39           H        SER  39 -15.417  14.301   0.106
  170    HA   SER  39           HA       SER  39 -13.097  14.754  -1.620
  171    HB2  SER  39           HB1      SER  39 -13.292  13.244   1.005
  172    HB3  SER  39           HB2      SER  39 -11.801  13.642   0.134
  173    HG   SER  39           HG       SER  39 -12.222  15.141   1.806
  174    H    GLN  40           H        GLN  40 -11.678  12.626  -1.755
  175    HA   GLN  40           HA       GLN  40 -13.433  10.580  -2.929
  176    HB2  GLN  40           HB1      GLN  40 -10.600  11.425  -3.524
  177    HB3  GLN  40           HB2      GLN  40 -11.259   9.889  -4.108
  178    HG2  GLN  40           HG1      GLN  40 -13.114  11.959  -4.743
  179    HG3  GLN  40           HG2      GLN  40 -11.499  12.454  -5.264
  180   HE21  GLN  40          HE21      GLN  40 -14.207  10.632  -6.018
  181   HE22  GLN  40          HE22      GLN  40 -13.557   9.738  -7.346
  182    H    CYS  41           H        CYS  41 -10.190  10.704  -1.438
  183    HA   CYS  41           HA       CYS  41 -10.910   8.292   0.092
  184    HB2  CYS  41           HB1      CYS  41  -8.526   7.574  -0.124
  185    HB3  CYS  41           HB2      CYS  41  -9.421   7.564  -1.644
  186    H    LEU  42           H        LEU  42  -9.999   8.097   2.161
  187    HA   LEU  42           HA       LEU  42  -9.022  10.639   3.272
  188    HB2  LEU  42           HB1      LEU  42 -10.901   8.596   4.194
  189    HB3  LEU  42           HB2      LEU  42  -9.697   9.049   5.413
  190    HG   LEU  42           HG       LEU  42 -10.521  11.497   4.585
  191   HD11  LEU  42          HD11      LEU  42 -13.182  10.446   4.885
  192   HD12  LEU  42          HD12      LEU  42 -12.397   9.763   3.462
  193   HD13  LEU  42          HD13      LEU  42 -12.528  11.513   3.642
  194   HD21  LEU  42          HD21      LEU  42 -12.116  10.079   6.671
  195   HD22  LEU  42          HD22      LEU  42 -11.425  11.703   6.691
  196   HD23  LEU  42          HD23      LEU  42 -10.381  10.296   6.902
  197    H    SER  43           H        SER  43  -8.285   7.284   2.829
  198    HA   SER  43           HA       SER  43  -5.626   7.743   3.950
  199    HB2  SER  43           HB1      SER  43  -7.652   6.149   5.230
  200    HB3  SER  43           HB2      SER  43  -6.323   5.101   4.701
  201    HG   SER  43           HG       SER  43  -6.166   6.191   6.855
  202    H    ASP  44           H        ASP  44  -4.035   6.213   3.220
  203    HA   ASP  44           HA       ASP  44  -4.171   5.622   0.507
  204    HB2  ASP  44           HB1      ASP  44  -2.418   4.129   2.463
  205    HB3  ASP  44           HB2      ASP  44  -2.088   4.500   0.767
  206    HD2  ASP  44           HD       ASP  44  -1.100   7.132   3.474
  207    H    THR  45           H        THR  45  -5.258   3.804   3.247
  208    HA   THR  45           HA       THR  45  -5.424   1.277   1.905
  209    HB   THR  45           HB       THR  45  -6.767   0.563   3.859
  210    HG1  THR  45           HG1      THR  45  -7.292   2.019   5.441
  211   HG21  THR  45          HG21      THR  45  -4.298   0.501   3.924
  212   HG22  THR  45          HG22      THR  45  -5.005   0.773   5.517
  213   HG23  THR  45          HG23      THR  45  -4.295   2.119   4.626
  214    H    ASP  46           H        ASP  46  -7.448   4.069   2.182
  215    HA   ASP  46           HA       ASP  46  -9.931   2.841   1.574
  216    HB2  ASP  46           HB1      ASP  46  -8.957   5.480   2.093
  217    HB3  ASP  46           HB2      ASP  46  -9.913   5.516   0.605
  218    HD2  ASP  46           HD       ASP  46 -12.761   4.338   2.450
  219    H    CYS  47           H        CYS  47  -7.230   3.853  -0.345
  220    HA   CYS  47           HA       CYS  47  -8.577   4.040  -2.840
  221    HB2  CYS  47           HB1      CYS  47  -5.791   4.054  -1.878
  222    HB3  CYS  47           HB2      CYS  47  -5.998   3.409  -3.507
  223    H    ASN  48           H        ASN  48  -6.102   1.627  -1.997
  224    HA   ASN  48           HA       ASN  48  -7.850  -0.545  -2.795
  225    HB2  ASN  48           HB1      ASN  48  -7.023   0.054  -4.959
  226    HB3  ASN  48           HB2      ASN  48  -5.369   0.195  -4.351
  227   HD21  ASN  48          HD21      ASN  48  -4.527  -1.281  -5.782
  228   HD22  ASN  48          HD22      ASN  48  -4.845  -2.975  -5.675
  229    H    THR  49           H        THR  49  -4.315  -0.158  -2.600
  230    HA   THR  49           HA       THR  49  -4.011  -1.243  -0.029
  231    HB   THR  49           HB       THR  49  -2.830  -3.405  -1.289
  232    HG1  THR  49           HG1      THR  49  -3.890  -3.488  -3.144
  233   HG21  THR  49          HG21      THR  49  -3.834  -4.184   0.551
  234   HG22  THR  49          HG22      THR  49  -5.295  -4.340  -0.424
  235   HG23  THR  49          HG23      THR  49  -5.027  -2.885   0.536
  236    H    ARG  50           H        ARG  50  -2.473  -1.468  -3.241
  237    HA   ARG  50           HA       ARG  50   0.077  -0.696  -2.014
  238    HB2  ARG  50           HB1      ARG  50  -0.400  -1.664  -4.839
  239    HB3  ARG  50           HB2      ARG  50   1.148  -1.544  -3.986
  240    HG2  ARG  50           HG1      ARG  50   0.942  -3.628  -3.270
  241    HG3  ARG  50           HG2      ARG  50  -0.568  -3.199  -2.448
  242    HD2  ARG  50           HD1      ARG  50  -1.875  -4.083  -4.075
  243    HD3  ARG  50           HD2      ARG  50  -0.779  -3.563  -5.362
  244    HE   ARG  50           HE       ARG  50  -0.842  -6.118  -4.111
  245   HH11  ARG  50          HH11      ARG  50   1.288  -3.781  -5.567
  246   HH12  ARG  50          HH12      ARG  50   2.466  -4.959  -6.044
  247   HH21  ARG  50          HH21      ARG  50   0.701  -7.678  -4.735
  248   HH22  ARG  50          HH22      ARG  50   2.130  -7.175  -5.572
  249    H    LYS  51           H        LYS  51  -1.921   1.282  -2.301
  250    HA   LYS  51           HA       LYS  51  -0.510   3.124  -4.080
  251    HB2  LYS  51           HB1      LYS  51  -3.438   2.443  -4.200
  252    HB3  LYS  51           HB2      LYS  51  -2.858   4.038  -4.705
  253    HG2  LYS  51           HG1      LYS  51  -2.697   3.072  -6.725
  254    HG3  LYS  51           HG2      LYS  51  -1.165   2.452  -6.082
  255    HD2  LYS  51           HD1      LYS  51  -2.278   0.387  -5.370
  256    HD3  LYS  51           HD2      LYS  51  -3.815   1.007  -5.998
  257    HE2  LYS  51           HE1      LYS  51  -2.645   1.219  -8.257
  258    HE3  LYS  51           HE2      LYS  51  -1.347   0.250  -7.542
  259    HZ1  LYS  51           HZ1      LYS  51  -2.862  -1.170  -8.718
  260    HZ2  LYS  51           HZ2      LYS  51  -4.182  -0.573  -7.848
  261    HZ3  LYS  51           HZ3      LYS  51  -2.996  -1.488  -7.062
  262    H    PHE  52           H        PHE  52  -0.716   5.326  -3.511
  263    HA   PHE  52           HA       PHE  52  -1.561   5.721  -0.728
  264    HB2  PHE  52           HB1      PHE  52  -0.154   7.803  -0.867
  265    HB3  PHE  52           HB2      PHE  52   0.738   6.292  -1.047
  266    HD1  PHE  52           HD1      PHE  52   2.099   5.912  -2.890
  267    HD2  PHE  52           HD2      PHE  52  -0.795   9.030  -3.028
  268    HE1  PHE  52           HE1      PHE  52   3.045   6.691  -5.025
  269    HE2  PHE  52           HE2      PHE  52   0.145   9.814  -5.162
  270    HZ   PHE  52           HZ       PHE  52   2.067   8.644  -6.163
  271    H    CYS  53           H        CYS  53  -2.853   7.467  -0.127
  272    HA   CYS  53           HA       CYS  53  -4.725   8.319  -2.151
  273    HB2  CYS  53           HB1      CYS  53  -5.565   7.674   0.035
  274    HB3  CYS  53           HB2      CYS  53  -4.567   8.903   0.812
  275    H    LEU  54           H        LEU  54  -3.628   9.718  -3.506
  276    HA   LEU  54           HA       LEU  54  -2.196  11.988  -2.440
  277    HB2  LEU  54           HB1      LEU  54  -1.864  10.584  -4.681
  278    HB3  LEU  54           HB2      LEU  54  -2.953  11.834  -5.306
  279    HG   LEU  54           HG       LEU  54  -0.608  12.378  -5.729
  280   HD11  LEU  54          HD11      LEU  54  -0.609  14.641  -4.698
  281   HD12  LEU  54          HD12      LEU  54  -2.015  14.158  -3.750
  282   HD13  LEU  54          HD13      LEU  54  -2.118  14.220  -5.509
  283   HD21  LEU  54          HD21      LEU  54   1.014  12.210  -4.207
  284   HD22  LEU  54          HD22      LEU  54  -0.152  11.320  -3.228
  285   HD23  LEU  54          HD23      LEU  54   0.066  13.053  -2.981
  286    H    GLN  55           H        GLN  55  -3.309  13.630  -1.613
  287    HA   GLN  55           HA       GLN  55  -5.665  14.595  -3.094
  288    HB2  GLN  55           HB1      GLN  55  -6.502  15.419  -0.847
  289    HB3  GLN  55           HB2      GLN  55  -6.534  13.667  -1.096
  290    HG2  GLN  55           HG1      GLN  55  -5.106  13.270   0.573
  291    HG3  GLN  55           HG2      GLN  55  -4.056  14.616   0.108
  292   HE21  GLN  55          HE21      GLN  55  -3.764  15.770   1.887
  293   HE22  GLN  55          HE22      GLN  55  -5.016  16.364   2.919
  294    HA   PRO  56           HA       PRO  56  -2.614  18.012  -3.081
  295    HB2  PRO  56           HB1      PRO  56  -3.407  19.013  -5.504
  296    HB3  PRO  56           HB2      PRO  56  -2.268  17.681  -5.328
  297    HG2  PRO  56           HG1      PRO  56  -5.218  17.601  -5.864
  298    HG3  PRO  56           HG2      PRO  56  -3.889  16.672  -6.656
  299    HD2  PRO  56           HD1      PRO  56  -5.496  15.596  -4.752
  300    HD3  PRO  56           HD2      PRO  56  -3.790  15.152  -4.927
  301    H    ARG  57           H        ARG  57  -2.919  20.288  -2.932
  302    HA   ARG  57           HA       ARG  57  -5.505  21.016  -1.867
  303    HB2  ARG  57           HB1      ARG  57  -3.005  21.712  -1.154
  304    HB3  ARG  57           HB2      ARG  57  -3.399  23.072  -2.215
  305    HG2  ARG  57           HG1      ARG  57  -5.119  23.828  -0.855
  306    HG3  ARG  57           HG2      ARG  57  -5.295  22.256  -0.056
  307    HD2  ARG  57           HD1      ARG  57  -4.189  23.371   1.604
  308    HD3  ARG  57           HD2      ARG  57  -2.804  22.763   0.688
  309    HE   ARG  57           HE       ARG  57  -3.451  25.239  -0.386
  310   HH11  ARG  57          HH11      ARG  57  -2.360  23.937   2.653
  311   HH12  ARG  57          HH12      ARG  57  -1.507  25.374   3.111
  312   HH21  ARG  57          HH21      ARG  57  -2.330  27.136   0.205
  313   HH22  ARG  57          HH22      ARG  57  -1.491  27.192   1.718
  314    H    ASP  58           H        ASP  58  -3.423  22.049  -4.549
  315    HA   ASP  58           HA       ASP  58  -5.348  23.927  -5.549
  316    HB2  ASP  58           HB1      ASP  58  -3.799  24.405  -7.262
  317    HB3  ASP  58           HB2      ASP  58  -2.809  24.033  -5.845
  318    HD2  ASP  58           HD       ASP  58  -2.181  21.956  -9.012
  319    H    GLU  59           H        GLU  59  -4.733  20.560  -5.955
  320    HA   GLU  59           HA       GLU  59  -6.617  20.469  -8.217
  321    HB2  GLU  59           HB1      GLU  59  -4.087  19.159  -7.740
  322    HB3  GLU  59           HB2      GLU  59  -5.372  17.964  -7.978
  323    HG2  GLU  59           HG1      GLU  59  -5.980  19.489 -10.033
  324    HG3  GLU  59           HG2      GLU  59  -4.288  19.982  -9.871
  325    HE2  GLU  59           HE       GLU  59  -5.081  16.347 -11.198
  326    H    LYS  60           H        LYS  60  -7.566  18.031  -8.242
  327    HA   LYS  60           HA       LYS  60  -9.033  17.830  -5.721
  328    HB2  LYS  60           HB1      LYS  60 -10.528  16.292  -7.044
  329    HB3  LYS  60           HB2      LYS  60 -10.463  17.965  -7.621
  330    HG2  LYS  60           HG1      LYS  60  -9.480  17.414  -9.581
  331    HG3  LYS  60           HG2      LYS  60  -8.546  16.094  -8.854
  332    HD2  LYS  60           HD1      LYS  60 -10.497  14.662  -8.809
  333    HD3  LYS  60           HD2      LYS  60 -11.512  15.989  -9.398
  334    HE2  LYS  60           HE1      LYS  60  -9.140  14.979 -10.964
  335    HE3  LYS  60           HE2      LYS  60 -10.748  14.252 -11.105
  336    HZ1  LYS  60           HZ1      LYS  60 -10.477  15.885 -12.811
  337    HZ2  LYS  60           HZ2      LYS  60 -10.025  17.070 -11.694
  338    HZ3  LYS  60           HZ3      LYS  60 -11.608  16.474 -11.699
  339    HA   PRO  61           HA       PRO  61  -7.102  14.116  -4.400
  340    HB2  PRO  61           HB1      PRO  61  -9.189  12.815  -3.197
  341    HB3  PRO  61           HB2      PRO  61  -8.409  14.240  -2.516
  342    HG2  PRO  61           HG1      PRO  61 -10.925  14.040  -4.136
  343    HG3  PRO  61           HG2      PRO  61 -10.611  14.981  -2.629
  344    HD2  PRO  61           HD1      PRO  61 -10.628  16.122  -5.094
  345    HD3  PRO  61           HD2      PRO  61  -9.561  16.675  -3.789
  346    H    PHE  62           H        PHE  62  -6.607  12.141  -5.195
  347    HA   PHE  62           HA       PHE  62  -8.535  10.494  -6.542
  348    HB2  PHE  62           HB1      PHE  62  -7.613  10.516  -8.734
  349    HB3  PHE  62           HB2      PHE  62  -7.858  12.202  -8.278
  350    HD1  PHE  62           HD1      PHE  62  -5.737  13.262  -7.007
  351    HD2  PHE  62           HD2      PHE  62  -5.623  10.039  -9.785
  352    HE1  PHE  62           HE1      PHE  62  -3.376  13.762  -7.486
  353    HE2  PHE  62           HE2      PHE  62  -3.262  10.533 -10.267
  354    HZ   PHE  62           HZ       PHE  62  -2.134  12.396  -9.116
  355    H    CYS  63           H        CYS  63  -7.607   8.428  -7.244
  356    HA   CYS  63           HA       CYS  63  -5.601   7.542  -5.367
  357    HB2  CYS  63           HB1      CYS  63  -7.404   6.197  -7.359
  358    HB3  CYS  63           HB2      CYS  63  -6.044   5.311  -6.667
  359    H    ALA  64           H        ALA  64  -3.505   7.688  -5.774
  360    HA   ALA  64           HA       ALA  64  -2.589   7.621  -8.568
  361    HB1  ALA  64           HB1      ALA  64  -1.478   9.456  -7.978
  362    HB2  ALA  64           HB2      ALA  64  -1.843   9.210  -6.270
  363    HB3  ALA  64           HB3      ALA  64  -0.444   8.419  -6.996
  364    H    THR  65           H        THR  65  -1.071   6.172  -9.244
  365    HA   THR  65           HA       THR  65  -0.818   3.742  -7.807
  366    HB   THR  65           HB       THR  65  -0.773   3.858 -10.280
  367    HG1  THR  65           HG1      THR  65   0.467   2.110 -10.333
  368   HG21  THR  65          HG21      THR  65   0.948   5.907 -10.028
  369   HG22  THR  65          HG22      THR  65   0.825   4.925 -11.488
  370   HG23  THR  65          HG23      THR  65   2.091   4.594 -10.306
  371    H    CYS  66           H        CYS  66   1.430   2.710  -7.538
  372    HA   CYS  66           HA       CYS  66   2.867   4.274  -5.630
  373    HB2  CYS  66           HB1      CYS  66   2.507   1.607  -6.005
  374    HB3  CYS  66           HB2      CYS  66   4.132   1.811  -6.662
  375    H    ARG  67           H        ARG  67   5.384   4.188  -5.771
  376    HA   ARG  67           HA       ARG  67   6.131   5.265  -8.408
  377    HB2  ARG  67           HB1      ARG  67   7.255   5.863  -5.662
  378    HB3  ARG  67           HB2      ARG  67   7.907   6.506  -7.177
  379    HG2  ARG  67           HG1      ARG  67   5.027   6.948  -6.484
  380    HG3  ARG  67           HG2      ARG  67   6.293   7.953  -5.760
  381    HD2  ARG  67           HD1      ARG  67   6.837   8.965  -7.743
  382    HD3  ARG  67           HD2      ARG  67   6.377   7.550  -8.700
  383    HE   ARG  67           HE       ARG  67   4.276   8.419  -8.905
  384   HH11  ARG  67          HH11      ARG  67   5.889   9.991  -6.251
  385   HH12  ARG  67          HH12      ARG  67   4.628  11.152  -6.001
  386   HH21  ARG  67          HH21      ARG  67   2.609   9.943  -8.587
  387   HH22  ARG  67          HH22      ARG  67   2.761  11.123  -7.330
  388    H    GLY  68           H        GLY  68   8.454   4.995  -8.992
  389    HA2  GLY  68           HA2      GLY  68   9.273   2.245  -8.365
  390    HA3  GLY  68           HA3      GLY  68   9.780   3.175  -9.768
  391    HA1  GLY  68           HA1      GLY  68   9.259   2.860  -7.731
  392    H    LEU  69           H        LEU  69  11.917   2.330  -9.076
  393    HA   LEU  69           HA       LEU  69  13.115   3.277  -6.674
  394    HB2  LEU  69           HB1      LEU  69  14.018   1.864  -9.129
  395    HB3  LEU  69           HB2      LEU  69  15.248   2.711  -8.174
  396    HG   LEU  69           HG       LEU  69  13.425   0.536  -7.146
  397   HD11  LEU  69          HD11      LEU  69  15.552   0.200  -8.793
  398   HD12  LEU  69          HD12      LEU  69  15.020  -0.978  -7.594
  399   HD13  LEU  69          HD13      LEU  69  16.332   0.136  -7.213
  400   HD21  LEU  69          HD21      LEU  69  15.603   2.160  -5.854
  401   HD22  LEU  69          HD22      LEU  69  15.056   0.610  -5.213
  402   HD23  LEU  69          HD23      LEU  69  13.930   1.962  -5.333
  403    H    ARG  70           H        ARG  70  13.787   4.128 -10.077
  404    HA   ARG  70           HA       ARG  70  15.384   6.354  -9.514
  405    HB2  ARG  70           HB1      ARG  70  13.656   5.822 -11.944
  406    HB3  ARG  70           HB2      ARG  70  14.957   7.019 -11.851
  407    HG2  ARG  70           HG1      ARG  70  16.421   4.949 -11.179
  408    HG3  ARG  70           HG2      ARG  70  15.129   4.052 -11.991
  409    HD2  ARG  70           HD1      ARG  70  15.543   5.972 -13.831
  410    HD3  ARG  70           HD2      ARG  70  17.158   5.887 -13.112
  411    HE   ARG  70           HE       ARG  70  15.970   3.971 -14.844
  412   HH11  ARG  70          HH11      ARG  70  18.120   4.300 -12.126
  413   HH12  ARG  70          HH12      ARG  70  19.001   2.851 -12.480
  414   HH21  ARG  70          HH21      ARG  70  17.120   2.061 -15.321
  415   HH22  ARG  70          HH22      ARG  70  18.431   1.578 -14.298
  416    H    ARG  71           H        ARG  71  11.942   5.963  -9.538
  417    HA   ARG  71           HA       ARG  71  11.036   8.536  -9.972
  418    HB2  ARG  71           HB1      ARG  71  10.030   6.120  -8.692
  419    HB3  ARG  71           HB2      ARG  71   9.412   7.590  -7.926
  420    HG2  ARG  71           HG1      ARG  71   7.919   6.760  -9.690
  421    HG3  ARG  71           HG2      ARG  71   8.546   8.381 -10.036
  422    HD2  ARG  71           HD1      ARG  71  10.144   7.517 -11.607
  423    HD3  ARG  71           HD2      ARG  71   9.762   5.854 -11.137
  424    HE   ARG  71           HE       ARG  71   7.934   5.914 -12.518
  425   HH11  ARG  71          HH11      ARG  71   9.086   9.158 -11.996
  426   HH12  ARG  71          HH12      ARG  71   8.039   9.860 -13.184
  427   HH21  ARG  71          HH21      ARG  71   6.551   6.827 -14.085
  428   HH22  ARG  71          HH22      ARG  71   6.597   8.534 -14.371
  429    H    ARG  72           H        ARG  72  10.653  10.328  -8.678
  430    HA   ARG  72           HA       ARG  72  12.493  10.642  -6.468
  431    HB2  ARG  72           HB1      ARG  72  10.579  12.560  -7.812
  432    HB3  ARG  72           HB2      ARG  72  11.663  13.008  -6.486
  433    HG2  ARG  72           HG1      ARG  72  13.458  11.920  -8.164
  434    HG3  ARG  72           HG2      ARG  72  12.259  12.506  -9.330
  435    HD2  ARG  72           HD1      ARG  72  13.031  14.583  -9.112
  436    HD3  ARG  72           HD2      ARG  72  12.645  14.538  -7.386
  437    HE   ARG  72           HE       ARG  72  15.086  13.196  -7.875
  438   HH11  ARG  72          HH11      ARG  72  13.694  16.383  -7.725
  439   HH12  ARG  72          HH12      ARG  72  15.181  17.154  -7.281
  440   HH21  ARG  72          HH21      ARG  72  17.050  14.199  -7.290
  441   HH22  ARG  72          HH22      ARG  72  17.089  15.911  -7.034
  442    H    CYS  73           H        CYS  73  11.843  11.512  -4.394
  443    HA   CYS  73           HA       CYS  73   9.060  11.267  -3.628
  444    HB2  CYS  73           HB1      CYS  73   9.527   9.668  -1.799
  445    HB3  CYS  73           HB2      CYS  73   9.776   8.962  -3.396
  446    H    GLN  74           H        GLN  74   8.648  12.056  -1.460
  447    HA   GLN  74           HA       GLN  74  10.777  13.860  -0.515
  448    HB2  GLN  74           HB1      GLN  74   8.438  14.679  -1.522
  449    HB3  GLN  74           HB2      GLN  74   7.937  14.422   0.158
  450    HG2  GLN  74           HG1      GLN  74  10.400  15.842   0.188
  451    HG3  GLN  74           HG2      GLN  74   9.310  16.634  -0.957
  452   HE21  GLN  74          HE21      GLN  74   7.193  17.252  -0.192
  453   HE22  GLN  74          HE22      GLN  74   6.977  17.673   1.469
  454    H    ARG  75           H        ARG  75   8.465  11.426   0.332
  455    HA   ARG  75           HA       ARG  75   9.421  11.536   3.117
  456    HB2  ARG  75           HB1      ARG  75   6.650  11.083   2.039
  457    HB3  ARG  75           HB2      ARG  75   7.123  10.440   3.620
  458    HG2  ARG  75           HG1      ARG  75   7.650  12.678   4.414
  459    HG3  ARG  75           HG2      ARG  75   7.238  13.342   2.824
  460    HD2  ARG  75           HD1      ARG  75   4.955  12.050   3.286
  461    HD3  ARG  75           HD2      ARG  75   5.464  12.291   4.963
  462    HE   ARG  75           HE       ARG  75   4.451  14.275   3.190
  463   HH11  ARG  75          HH11      ARG  75   6.647  13.760   5.841
  464   HH12  ARG  75          HH12      ARG  75   6.550  15.394   6.410
  465   HH21  ARG  75          HH21      ARG  75   4.314  16.429   3.929
  466   HH22  ARG  75          HH22      ARG  75   5.222  16.911   5.322
  467    H    ASP  76           H        ASP  76   8.866   9.331   4.232
  468    HA   ASP  76           HA       ASP  76  10.257   7.313   2.718
  469    HB2  ASP  76           HB1      ASP  76   9.913   5.946   4.834
  470    HB3  ASP  76           HB2      ASP  76  10.849   7.436   5.011
  471    HD2  ASP  76           HD       ASP  76   8.341   8.950   6.912
  472    H    ALA  77           H        ALA  77   7.060   7.529   4.276
  473    HA   ALA  77           HA       ALA  77   6.098   5.066   3.299
  474    HB1  ALA  77           HB1      ALA  77   4.093   5.612   4.272
  475    HB2  ALA  77           HB2      ALA  77   5.193   6.658   5.171
  476    HB3  ALA  77           HB3      ALA  77   4.228   7.319   3.851
  477    H    MET  78           H        MET  78   6.359   8.208   1.862
  478    HA   MET  78           HA       MET  78   4.397   8.113  -0.096
  479    HB2  MET  78           HB1      MET  78   6.959   9.522   0.284
  480    HB3  MET  78           HB2      MET  78   6.434   9.372  -1.400
  481    HG2  MET  78           HG1      MET  78   4.171  10.277  -0.578
  482    HG3  MET  78           HG2      MET  78   5.060  10.754   0.871
  483    HE1  MET  78           HE1      MET  78   4.885  12.575  -3.183
  484    HE2  MET  78           HE2      MET  78   6.135  11.331  -3.250
  485    HE3  MET  78           HE3      MET  78   4.504  10.915  -2.723
  486    H    CYS  79           H        CYS  79   7.393   6.380   0.140
  487    HA   CYS  79           HA       CYS  79   7.145   5.420  -2.619
  488    HB2  CYS  79           HB1      CYS  79   9.355   5.764  -0.718
  489    HB3  CYS  79           HB2      CYS  79   9.394   4.222  -1.574
  490    H    CYS  80           H        CYS  80   7.149   3.178  -3.095
  491    HA   CYS  80           HA       CYS  80   5.400   1.616  -1.639
  492    HB2  CYS  80           HB1      CYS  80   7.267   1.203  -3.864
  493    HB3  CYS  80           HB2      CYS  80   6.974  -0.256  -2.914
  494    HA   PRO  81           HA       PRO  81   7.564  -0.173   1.729
  495    HB2  PRO  81           HB1      PRO  81   6.608  -2.739   1.753
  496    HB3  PRO  81           HB2      PRO  81   5.646  -1.339   2.222
  497    HG2  PRO  81           HG1      PRO  81   5.742  -2.789  -0.402
  498    HG3  PRO  81           HG2      PRO  81   4.310  -2.218   0.534
  499    HD2  PRO  81           HD1      PRO  81   5.281  -0.880  -1.620
  500    HD3  PRO  81           HD2      PRO  81   4.546  -0.058  -0.233
  501    H    GLY  82           H        GLY  82   9.489  -1.127   2.163
  502    HA2  GLY  82           HA2      GLY  82  11.086  -2.905   1.863
  503    HA3  GLY  82           HA3      GLY  82  10.568  -3.029   0.189
  504    HA1  GLY  82           HA1      GLY  82  11.034  -2.037   2.010
  505    H    THR  83           H        THR  83  10.593   0.044   0.175
  506    HA   THR  83           HA       THR  83  13.502   0.312  -0.225
  507    HB   THR  83           HB       THR  83  12.775   2.199  -1.842
  508    HG1  THR  83           HG1      THR  83  10.537   2.120  -1.253
  509   HG21  THR  83          HG21      THR  83  13.656   0.644  -3.185
  510   HG22  THR  83          HG22      THR  83  12.011   0.060  -3.438
  511   HG23  THR  83          HG23      THR  83  13.024  -0.669  -2.193
  512    H    LEU  84           H        LEU  84  14.157   2.725  -0.244
  513    HA   LEU  84           HA       LEU  84  12.726   4.185   1.869
  514    HB2  LEU  84           HB1      LEU  84  15.524   3.239   1.822
  515    HB3  LEU  84           HB2      LEU  84  15.283   4.913   2.351
  516    HG   LEU  84           HG       LEU  84  13.406   3.455   3.798
  517   HD11  LEU  84          HD11      LEU  84  15.887   2.036   4.437
  518   HD12  LEU  84          HD12      LEU  84  15.149   1.568   2.906
  519   HD13  LEU  84          HD13      LEU  84  14.222   1.458   4.401
  520   HD21  LEU  84          HD21      LEU  84  16.086   4.649   4.417
  521   HD22  LEU  84          HD22      LEU  84  15.117   3.868   5.668
  522   HD23  LEU  84          HD23      LEU  84  14.479   5.265   4.802
  523    H    CYS  85           H        CYS  85  13.313   6.503   1.957
  524    HA   CYS  85           HA       CYS  85  13.599   7.543  -0.759
  525    HB2  CYS  85           HB1      CYS  85  11.726   8.180   0.933
  526    HB3  CYS  85           HB2      CYS  85  12.962   9.213   1.655
  527    H    VAL  86           H        VAL  86  15.750   7.595  -1.218
  528    HA   VAL  86           HA       VAL  86  17.510   9.024   0.658
  529    HB   VAL  86           HB       VAL  86  18.276   7.186  -1.616
  530   HG11  VAL  86          HG11      VAL  86  19.931   8.946  -1.150
  531   HG12  VAL  86          HG12      VAL  86  19.988   8.429   0.536
  532   HG13  VAL  86          HG13      VAL  86  20.533   7.340  -0.742
  533   HG21  VAL  86          HG21      VAL  86  18.364   6.714   1.363
  534   HG22  VAL  86          HG22      VAL  86  17.193   6.007   0.249
  535   HG23  VAL  86          HG23      VAL  86  18.902   5.593   0.112
  536    H    ASN  87           H        ASN  87  18.389  10.921   0.099
  537    HA   ASN  87           HA       ASN  87  18.739  12.853  -1.054
  538    HB2  ASN  87           HB1      ASN  87  20.181  10.990  -2.270
  539    HB3  ASN  87           HB2      ASN  87  19.062  11.321  -3.599
  540   HD21  ASN  87          HD21      ASN  87  21.830  11.808  -3.673
  541   HD22  ASN  87          HD22      ASN  87  22.070  13.512  -3.838
  542    H    ASP  88           H        ASP  88  16.055  12.205  -0.770
  543    HA   ASP  88           HA       ASP  88  13.989  12.785  -1.524
  544    HB2  ASP  88           HB1      ASP  88  15.774  14.754  -2.478
  545    HB3  ASP  88           HB2      ASP  88  14.685  14.380  -3.819
  546    HD2  ASP  88           HD       ASP  88  12.871  15.702  -0.540
  547    H    VAL  89           H        VAL  89  15.470  10.491  -2.703
  548    HA   VAL  89           HA       VAL  89  13.664  10.056  -4.954
  549    HB   VAL  89           HB       VAL  89  16.644   9.605  -5.168
  550   HG11  VAL  89          HG11      VAL  89  14.425   9.046  -7.133
  551   HG12  VAL  89          HG12      VAL  89  16.151   8.903  -7.471
  552   HG13  VAL  89          HG13      VAL  89  15.394   7.845  -6.279
  553   HG21  VAL  89          HG21      VAL  89  16.201  11.208  -7.186
  554   HG22  VAL  89          HG22      VAL  89  14.804  11.701  -6.230
  555   HG23  VAL  89          HG23      VAL  89  16.429  11.863  -5.564
  556    H    CYS  90           H        CYS  90  12.995   7.967  -5.169
  557    HA   CYS  90           HA       CYS  90  13.152   6.237  -2.994
  558    HB2  CYS  90           HB1      CYS  90  11.743   6.337  -5.387
  559    HB3  CYS  90           HB2      CYS  90  12.682   4.850  -5.517
  560    H    THR  91           H        THR  91  14.314   4.381  -2.561
  561    HA   THR  91           HA       THR  91  16.380   3.501  -4.397
  562    HB   THR  91           HB       THR  91  17.165   4.413  -1.626
  563    HG1  THR  91           HG1      THR  91  16.774   6.243  -2.869
  564   HG21  THR  91          HG21      THR  91  18.571   2.633  -2.414
  565   HG22  THR  91          HG22      THR  91  19.467   4.146  -2.566
  566   HG23  THR  91          HG23      THR  91  18.742   3.404  -3.991
  567    H    THR  92           H        THR  92  17.066   1.409  -4.029
  568    HA   THR  92           HA       THR  92  15.320  -0.229  -2.467
  569    HB   THR  92           HB       THR  92  17.664  -1.672  -3.267
  570    HG1  THR  92           HG1      THR  92  17.474  -1.196  -5.550
  571   HG21  THR  92          HG21      THR  92  15.500  -2.701  -3.071
  572   HG22  THR  92          HG22      THR  92  16.009  -2.803  -4.757
  573   HG23  THR  92          HG23      THR  92  14.818  -1.599  -4.267
  574    H    MET  93           H        MET  93  15.682  -1.271  -0.561
  575    HA   MET  93           HA       MET  93  17.486  -0.160   1.281
  576    HB2  MET  93           HB1      MET  93  15.282  -1.744   1.465
  577    HB3  MET  93           HB2      MET  93  16.563  -2.907   1.834
  578    HG2  MET  93           HG1      MET  93  17.327  -1.632   3.691
  579    HG3  MET  93           HG2      MET  93  16.309  -0.265   3.235
  580    HE1  MET  93           HE1      MET  93  16.076  -2.468   6.375
  581    HE2  MET  93           HE2      MET  93  16.423  -0.824   5.841
  582    HE3  MET  93           HE3      MET  93  14.848  -1.212   6.532
  583    H    GLU  94           H        GLU  94  17.813  -2.755  -0.991
  584    HA   GLU  94           HA       GLU  94  20.064  -4.004   0.252
  585    HB2  GLU  94           HB1      GLU  94  18.683  -4.212  -2.391
  586    HB3  GLU  94           HB2      GLU  94  20.313  -4.886  -2.228
  587    HG2  GLU  94           HG1      GLU  94  19.352  -6.743  -1.489
  588    HG3  GLU  94           HG2      GLU  94  18.998  -5.847  -0.004
  589    HE2  GLU  94           HE       GLU  94  16.027  -6.465  -2.564
  590    H    ASP  95           H        ASP  95  19.607  -1.336  -1.918
  591    HA   ASP  95           HA       ASP  95  22.419  -1.227  -2.647
  592    HB2  ASP  95           HB1      ASP  95  20.656  -0.678  -4.308
  593    HB3  ASP  95           HB2      ASP  95  20.182   0.700  -3.306
  594    HD2  ASP  95           HD       ASP  95  23.046   2.504  -4.217
  595    H    ALA  96           H        ALA  96  20.079   0.896  -0.996
  596    HA   ALA  96           HA       ALA  96  21.814   2.893  -0.192
  597    HB1  ALA  96           HB1      ALA  96  19.467   1.854   1.389
  598    HB2  ALA  96           HB2      ALA  96  20.195   3.457   1.504
  599    HB3  ALA  96           HB3      ALA  96  19.355   2.973   0.031
  600    H    THR  97           H        THR  97  23.162   3.225   1.532
  601    HA   THR  97           HA       THR  97  24.584   2.736   3.242
  602    HB   THR  97           HB       THR  97  22.703   0.506   4.011
  603    HG1  THR  97           HG1      THR  97  21.628   2.584   3.734
  604   HG21  THR  97          HG21      THR  97  24.349   0.250   5.535
  605   HG22  THR  97          HG22      THR  97  23.597   1.648   6.305
  606   HG23  THR  97          HG23      THR  97  24.997   1.865   5.254
  607    H    GLU  98           H        GLU  98  26.367   2.012   2.177
  608    HA   GLU  98           HA       GLU  98  26.561  -0.898   1.754
  609    HB2  GLU  98           HB1      GLU  98  27.179   1.356  -0.006
  610    HB3  GLU  98           HB2      GLU  98  28.523   0.214   0.158
  611    HG2  GLU  98           HG1      GLU  98  27.528  -1.318  -1.109
  612    HG3  GLU  98           HG2      GLU  98  25.989  -1.131  -0.256
  613    HE2  GLU  98           HE       GLU  98  26.298   1.646  -3.027
  614    H    ASN  99           H        ASN  99  29.003  -1.540   1.610
  615    HA   ASN  99           HA       ASN  99  30.953  -1.874   2.730
  616    HB2  ASN  99           HB1      ASN  99  30.876   0.815   2.137
  617    HB3  ASN  99           HB2      ASN  99  31.164   0.818   3.881
  618   HD21  ASN  99          HD21      ASN  99  32.788   1.243   1.264
  619   HD22  ASN  99          HD22      ASN  99  34.263   0.408   1.599
  620    H    LEU 100           H        LEU 100  30.325  -3.254   4.332
  621    HA   LEU 100           HA       LEU 100  28.940  -2.403   6.677
  622    HB2  LEU 100           HB1      LEU 100  29.620  -4.849   5.450
  623    HB3  LEU 100           HB2      LEU 100  30.354  -4.869   7.063
  624    HG   LEU 100           HG       LEU 100  27.697  -3.966   7.387
  625   HD11  LEU 100          HD11      LEU 100  27.138  -4.875   5.225
  626   HD12  LEU 100          HD12      LEU 100  26.453  -5.896   6.487
  627   HD13  LEU 100          HD13      LEU 100  27.908  -6.408   5.633
  628   HD21  LEU 100          HD21      LEU 100  27.656  -6.480   8.326
  629   HD22  LEU 100          HD22      LEU 100  28.427  -5.140   9.174
  630   HD23  LEU 100          HD23      LEU 100  29.398  -6.239   8.195
  631    H    TYR 101           H        TYR 101  30.081  -3.421   8.835
  632    HA   TYR 101           HA       TYR 101  32.409  -1.711   9.211
  633    HB2  TYR 101           HB1      TYR 101  30.354  -1.825  10.775
  634    HB3  TYR 101           HB2      TYR 101  31.063  -3.332  11.362
  635    HD1  TYR 101           HD1      TYR 101  32.641  -0.072  10.443
  636    HD2  TYR 101           HD2      TYR 101  31.923  -2.966  13.478
  637    HE1  TYR 101           HE1      TYR 101  34.095   1.185  11.977
  638    HE2  TYR 101           HE2      TYR 101  33.373  -1.716  15.021
  639    HH   TYR 101           HH       TYR 101  34.254   1.376  14.621
  640    H    PHE 102           H        PHE 102  33.674  -3.236   7.824
  641    HA   PHE 102           HA       PHE 102  35.254  -4.851   7.558
  642    HB2  PHE 102           HB1      PHE 102  35.520  -3.803  10.219
  643    HB3  PHE 102           HB2      PHE 102  35.926  -5.520  10.230
  644    HD1  PHE 102           HD1      PHE 102  38.085  -6.145   9.776
  645    HD2  PHE 102           HD2      PHE 102  36.626  -2.471   8.198
  646    HE1  PHE 102           HE1      PHE 102  40.318  -5.653   8.867
  647    HE2  PHE 102           HE2      PHE 102  38.855  -1.974   7.284
  648    HZ   PHE 102           HZ       PHE 102  40.705  -3.565   7.618
  649    H    GLN 103           H        GLN 103  35.986  -7.115   8.736
  650    HA   GLN 103           HA       GLN 103  33.986  -8.705   9.886
  651    HB2  GLN 103           HB1      GLN 103  33.547 -10.167   7.842
  652    HB3  GLN 103           HB2      GLN 103  32.718  -8.604   7.903
  653    HG2  GLN 103           HG1      GLN 103  33.846  -7.760   6.136
  654    HG3  GLN 103           HG2      GLN 103  35.328  -8.640   6.534
  655   HE21  GLN 103          HE21      GLN 103  33.047  -8.365   4.268
  656   HE22  GLN 103          HE22      GLN 103  33.063  -9.961   3.606
  657    H    SER 104           H        SER 104  35.714  -9.443  11.097
  658    HA   SER 104           HA       SER 104  38.070 -10.534   9.889
  659    HB2  SER 104           HB1      SER 104  37.639 -11.441  12.611
  660    HB3  SER 104           HB2      SER 104  38.891 -10.363  11.971
  661    HG   SER 104           HG       SER 104  37.523  -8.626  12.242
  662    H    LEU 105           H        LEU 105  35.657 -12.103  11.998
  663    HA   LEU 105           HA       LEU 105  34.655 -14.152  11.876
  664    HB2  LEU 105           HB1      LEU 105  34.891 -13.496   9.278
  665    HB3  LEU 105           HB2      LEU 105  35.947 -14.918   9.331
  666    HG   LEU 105           HG       LEU 105  33.694 -15.509   8.610
  667   HD11  LEU 105          HD11      LEU 105  33.442 -17.409   9.942
  668   HD12  LEU 105          HD12      LEU 105  34.040 -16.593  11.386
  669   HD13  LEU 105          HD13      LEU 105  35.153 -17.009  10.083
  670   HD21  LEU 105          HD21      LEU 105  32.783 -13.606  10.257
  671   HD22  LEU 105          HD22      LEU 105  32.531 -15.019  11.284
  672   HD23  LEU 105          HD23      LEU 105  31.785 -14.944   9.687
  673    H    GLU 106           H        GLU 106  37.827 -14.458  10.264
  674    HA   GLU 106           HA       GLU 106  38.954 -15.882  12.472
  675    HB2  GLU 106           HB1      GLU 106  39.263 -18.031  11.453
  676    HB3  GLU 106           HB2      GLU 106  37.537 -17.638  11.401
  677    HG2  GLU 106           HG1      GLU 106  37.779 -16.931   9.054
  678    HG3  GLU 106           HG2      GLU 106  39.482 -17.409   9.117
  679    HE2  GLU 106           HE       GLU 106  38.076 -20.816   9.676
  680    H    HIS 107           H        HIS 107  41.040 -17.168  11.324
  681    HA   HIS 107           HA       HIS 107  42.288 -15.751   9.208
  682    HB2  HIS 107           HB1      HIS 107  42.399 -14.455  11.702
  683    HB3  HIS 107           HB2      HIS 107  43.991 -15.187  11.474
  684    HD1  HIS 107           HD1      HIS 107  45.601 -13.823  10.189
  685    HD2  HIS 107           HD2      HIS 107  41.670 -12.841   9.272
  686    HE1  HIS 107           HE1      HIS 107  45.747 -11.887   8.592
  687    HE2  HIS 107           HE2      HIS 107  43.345 -11.285   8.029
  688    H    HIS 108           H        HIS 108  44.094 -16.802   8.477
  689    HA   HIS 108           HA       HIS 108  44.523 -19.452   9.390
  690    HB2  HIS 108           HB1      HIS 108  45.345 -17.799   7.164
  691    HB3  HIS 108           HB2      HIS 108  46.716 -18.722   7.788
  692    HD1  HIS 108           HD1      HIS 108  44.493 -19.052   5.200
  693    HD2  HIS 108           HD2      HIS 108  45.509 -21.609   8.314
  694    HE1  HIS 108           HE1      HIS 108  43.856 -21.354   4.414
  695    HE2  HIS 108           HE2      HIS 108  44.475 -22.917   6.318
  696    H    HIS 109           H        HIS 109  46.700 -20.321   9.956
  697    HA   HIS 109           HA       HIS 109  48.566 -18.526  11.221
  698    HB2  HIS 109           HB1      HIS 109  46.437 -19.614  12.762
  699    HB3  HIS 109           HB2      HIS 109  47.921 -20.439  13.252
  700    HD1  HIS 109           HD1      HIS 109  46.057 -17.870  14.493
  701    HD2  HIS 109           HD2      HIS 109  50.051 -18.060  13.365
  702    HE1  HIS 109           HE1      HIS 109  47.193 -15.994  15.723
  703    HE2  HIS 109           HE2      HIS 109  49.635 -16.110  15.034
  704    H    HIS 110           H        HIS 110  50.217 -19.982  12.537
  705    HA   HIS 110           HA       HIS 110  50.601 -22.663  11.825
  706    HB2  HIS 110           HB1      HIS 110  51.068 -21.009   9.657
  707    HB3  HIS 110           HB2      HIS 110  52.685 -21.258  10.326
  708    HD1  HIS 110           HD1      HIS 110  53.755 -23.547  10.055
  709    HD2  HIS 110           HD2      HIS 110  49.828 -23.401   8.709
  710    HE1  HIS 110           HE1      HIS 110  53.389 -25.704   8.813
  711    HE2  HIS 110           HE2      HIS 110  50.988 -25.615   7.990
  712    H    HIS 111           H        HIS 111  52.659 -23.506  12.541
  713    HA   HIS 111           HA       HIS 111  54.650 -21.870  13.715
  714    HB2  HIS 111           HB1      HIS 111  54.259 -22.386  16.078
  715    HB3  HIS 111           HB2      HIS 111  52.917 -21.462  15.397
  716    HD1  HIS 111           HD1      HIS 111  50.718 -22.883  14.794
  717    HD2  HIS 111           HD2      HIS 111  53.518 -24.774  17.212
  718    HE1  HIS 111           HE1      HIS 111  49.502 -24.817  15.846
  719    HE2  HIS 111           HE2      HIS 111  51.212 -25.973  17.323
  720    H    HIS 112           H        HIS 112  56.437 -23.054  14.419
  721    HA   HIS 112           HA       HIS 112  56.750 -25.611  13.266
  722    HB2  HIS 112           HB1      HIS 112  58.470 -23.692  14.066
  723    HB3  HIS 112           HB2      HIS 112  58.615 -24.808  15.427
  724    HD1  HIS 112           HD1      HIS 112  60.508 -24.122  12.702
  725    HD2  HIS 112           HD2      HIS 112  58.715 -27.658  13.945
  726    HE1  HIS 112           HE1      HIS 112  61.806 -25.963  11.583
  727    HE2  HIS 112           HE2      HIS 112  60.710 -28.125  12.343
  Start of MODEL   58
    1    H1   MET  18           H        MET  18 -79.568  -6.750  23.753
    2    HA   MET  18           HA       MET  18 -77.953  -7.932  22.332
    3    HB2  MET  18           HB1      MET  18 -80.464  -8.359  20.700
    4    HB3  MET  18           HB2      MET  18 -78.833  -8.654  20.079
    5    HG2  MET  18           HG1      MET  18 -78.488 -10.496  21.424
    6    HG3  MET  18           HG2      MET  18 -79.683  -9.969  22.612
    7    HE1  MET  18           HE1      MET  18 -82.444 -11.136  22.413
    8    HE2  MET  18           HE2      MET  18 -82.044  -9.489  21.926
    9    HE3  MET  18           HE3      MET  18 -83.016 -10.511  20.866
   10    H    LEU  19           H        LEU  19 -77.323  -5.695  22.560
   11    HA   LEU  19           HA       LEU  19 -77.989  -4.095  20.177
   12    HB2  LEU  19           HB1      LEU  19 -78.083  -3.427  23.007
   13    HB3  LEU  19           HB2      LEU  19 -77.056  -2.313  22.085
   14    HG   LEU  19           HG       LEU  19 -79.411  -1.552  22.363
   15   HD11  LEU  19          HD11      LEU  19 -77.759  -1.455  20.121
   16   HD12  LEU  19          HD12      LEU  19 -79.107  -0.384  20.502
   17   HD13  LEU  19          HD13      LEU  19 -79.370  -1.806  19.495
   18   HD21  LEU  19          HD21      LEU  19 -80.230  -4.009  22.011
   19   HD22  LEU  19          HD22      LEU  19 -80.222  -3.557  20.306
   20   HD23  LEU  19          HD23      LEU  19 -81.213  -2.655  21.454
   21    H    VAL  20           H        VAL  20 -76.329  -3.582  18.909
   22    HA   VAL  20           HA       VAL  20 -73.604  -3.883  19.997
   23    HB   VAL  20           HB       VAL  20 -74.518  -4.242  17.138
   24   HG11  VAL  20          HG11      VAL  20 -72.021  -5.342  17.355
   25   HG12  VAL  20          HG12      VAL  20 -72.382  -3.753  16.679
   26   HG13  VAL  20          HG13      VAL  20 -71.889  -3.903  18.366
   27   HG21  VAL  20          HG21      VAL  20 -74.040  -6.128  19.384
   28   HG22  VAL  20          HG22      VAL  20 -75.240  -6.188  18.093
   29   HG23  VAL  20          HG23      VAL  20 -73.565  -6.629  17.762
   30    H    LEU  21           H        LEU  21 -72.293  -2.170  19.951
   31    HA   LEU  21           HA       LEU  21 -73.287   0.305  18.780
   32    HB2  LEU  21           HB1      LEU  21 -70.730  -0.002  20.333
   33    HB3  LEU  21           HB2      LEU  21 -71.746   1.436  20.134
   34    HG   LEU  21           HG       LEU  21 -73.439  -0.283  21.430
   35   HD11  LEU  21          HD11      LEU  21 -70.635  -0.970  22.113
   36   HD12  LEU  21          HD12      LEU  21 -72.078  -1.983  22.091
   37   HD13  LEU  21          HD13      LEU  21 -71.804  -0.867  23.429
   38   HD21  LEU  21          HD21      LEU  21 -73.224   1.181  23.262
   39   HD22  LEU  21          HD22      LEU  21 -72.870   2.154  21.835
   40   HD23  LEU  21          HD23      LEU  21 -71.553   1.574  22.855
   41    H    ASP  22           H        ASP  22 -71.963   1.653  17.445
   42    HA   ASP  22           HA       ASP  22 -70.126   0.095  15.759
   43    HB2  ASP  22           HB1      ASP  22 -70.542   1.936  14.071
   44    HB3  ASP  22           HB2      ASP  22 -71.942   0.929  14.461
   45    HD2  ASP  22           HD       ASP  22 -72.114   4.760  15.242
   46    H    PHE  23           H        PHE  23 -68.108   0.888  15.209
   47    HA   PHE  23           HA       PHE  23 -67.236   3.437  16.306
   48    HB2  PHE  23           HB1      PHE  23 -66.635   0.883  17.540
   49    HB3  PHE  23           HB2      PHE  23 -65.157   1.689  17.011
   50    HD1  PHE  23           HD1      PHE  23 -67.885   1.735  19.385
   51    HD2  PHE  23           HD2      PHE  23 -64.567   3.926  17.869
   52    HE1  PHE  23           HE1      PHE  23 -67.941   3.188  21.371
   53    HE2  PHE  23           HE2      PHE  23 -64.616   5.381  19.852
   54    HZ   PHE  23           HZ       PHE  23 -66.305   5.013  21.607
   55    H    ASN  24           H        ASN  24 -64.974   3.953  15.622
   56    HA   ASN  24           HA       ASN  24 -64.126   2.529  13.209
   57    HB2  ASN  24           HB1      ASN  24 -65.409   5.104  13.242
   58    HB3  ASN  24           HB2      ASN  24 -63.745   5.280  12.674
   59   HD21  ASN  24          HD21      ASN  24 -63.173   4.529  10.702
   60   HD22  ASN  24          HD22      ASN  24 -64.278   3.812   9.583
   61    H    ASN  25           H        ASN  25 -61.931   3.015  12.559
   62    HA   ASN  25           HA       ASN  25 -60.259   4.539  14.352
   63    HB2  ASN  25           HB1      ASN  25 -60.604   1.704  14.730
   64    HB3  ASN  25           HB2      ASN  25 -58.938   2.041  14.246
   65   HD21  ASN  25          HD21      ASN  25 -60.052   1.157  16.818
   66   HD22  ASN  25          HD22      ASN  25 -59.506   2.311  17.982
   67    H    ILE  26           H        ILE  26 -58.047   4.706  13.591
   68    HA   ILE  26           HA       ILE  26 -57.552   3.745  10.877
   69    HB   ILE  26           HB       ILE  26 -57.108   5.830   9.924
   70   HG12  ILE  26          HG11      ILE  26 -55.777   6.784  11.710
   71   HG13  ILE  26          HG12      ILE  26 -57.028   7.940  11.226
   72   HG21  ILE  26          HG21      ILE  26 -59.145   7.154  10.268
   73   HG22  ILE  26          HG22      ILE  26 -59.493   5.431  10.150
   74   HG23  ILE  26          HG23      ILE  26 -59.494   6.224  11.725
   75   HD11  ILE  26          HD11      ILE  26 -56.995   8.032  13.560
   76   HD12  ILE  26          HD12      ILE  26 -58.399   7.039  13.166
   77   HD13  ILE  26          HD13      ILE  26 -56.906   6.277  13.715
   78    H    ARG  27           H        ARG  27 -55.256   4.482  10.181
   79    HA   ARG  27           HA       ARG  27 -53.404   4.739  12.410
   80    HB2  ARG  27           HB1      ARG  27 -53.789   2.263  10.817
   81    HB3  ARG  27           HB2      ARG  27 -52.119   2.750  11.132
   82    HG2  ARG  27           HG1      ARG  27 -52.584   2.791  13.547
   83    HG3  ARG  27           HG2      ARG  27 -54.238   2.250  13.212
   84    HD2  ARG  27           HD1      ARG  27 -51.840   0.691  12.259
   85    HD3  ARG  27           HD2      ARG  27 -52.517   0.475  13.879
   86    HE   ARG  27           HE       ARG  27 -53.642  -0.440  11.399
   87   HH11  ARG  27          HH11      ARG  27 -54.325   0.456  14.693
   88   HH12  ARG  27          HH12      ARG  27 -55.777  -0.484  14.784
   89   HH21  ARG  27          HH21      ARG  27 -55.553  -1.682  11.507
   90   HH22  ARG  27          HH22      ARG  27 -56.474  -1.700  12.971
   91    H    SER  28           H        SER  28 -51.581   5.816  11.870
   92    HA   SER  28           HA       SER  28 -51.117   6.344   9.008
   93    HB2  SER  28           HB1      SER  28 -51.609   8.198  11.197
   94    HB3  SER  28           HB2      SER  28 -50.060   8.523  10.399
   95    HG   SER  28           HG       SER  28 -51.179   9.408   8.872
   96    H    SER  29           H        SER  29 -48.991   6.475   8.309
   97    HA   SER  29           HA       SER  29 -46.778   6.320  10.122
   98    HB2  SER  29           HB1      SER  29 -46.059   4.053   8.945
   99    HB3  SER  29           HB2      SER  29 -47.082   4.049  10.393
  100    HG   SER  29           HG       SER  29 -48.548   3.106   9.243
  101    H    ALA  30           H        ALA  30 -44.754   6.514   9.073
  102    HA   ALA  30           HA       ALA  30 -44.391   6.438   6.282
  103    HB1  ALA  30           HB1      ALA  30 -44.380   9.281   7.164
  104    HB2  ALA  30           HB2      ALA  30 -44.621   8.596   5.556
  105    HB3  ALA  30           HB3      ALA  30 -45.920   8.527   6.748
  106    H    ASP  31           H        ASP  31 -42.329   7.760   5.669
  107    HA   ASP  31           HA       ASP  31 -40.474   8.522   7.621
  108    HB2  ASP  31           HB1      ASP  31 -40.815   5.832   7.771
  109    HB3  ASP  31           HB2      ASP  31 -39.510   5.928   6.582
  110    HD2  ASP  31           HD       ASP  31 -37.623   7.733   9.164
  111    H    LEU  32           H        LEU  32 -38.226   8.680   6.715
  112    HA   LEU  32           HA       LEU  32 -37.689   8.294   3.983
  113    HB2  LEU  32           HB1      LEU  32 -39.414  10.415   4.397
  114    HB3  LEU  32           HB2      LEU  32 -37.824  11.187   4.284
  115    HG   LEU  32           HG       LEU  32 -38.077   9.317   2.145
  116   HD11  LEU  32          HD11      LEU  32 -40.565   9.858   2.750
  117   HD12  LEU  32          HD12      LEU  32 -40.030   9.854   1.071
  118   HD13  LEU  32          HD13      LEU  32 -40.216  11.381   1.932
  119   HD21  LEU  32          HD21      LEU  32 -37.230  11.038   0.937
  120   HD22  LEU  32          HD22      LEU  32 -36.863  11.658   2.547
  121   HD23  LEU  32          HD23      LEU  32 -38.290  12.233   1.684
  122    H    HIS  33           H        HIS  33 -35.669   9.413   3.296
  123    HA   HIS  33           HA       HIS  33 -34.052  10.800   5.158
  124    HB2  HIS  33           HB1      HIS  33 -32.454   9.139   5.776
  125    HB3  HIS  33           HB2      HIS  33 -34.050   8.497   6.173
  126    HD1  HIS  33           HD1      HIS  33 -35.070   6.812   4.259
  127    HD2  HIS  33           HD2      HIS  33 -30.961   7.423   4.278
  128    HE1  HIS  33           HE1      HIS  33 -34.100   4.898   2.949
  129    HE2  HIS  33           HE2      HIS  33 -31.587   5.272   2.960
  130    H    GLY  34           H        GLY  34 -31.582  10.502   4.373
  131    HA2  GLY  34           HA2      GLY  34 -30.933   9.821   1.782
  132    HA3  GLY  34           HA3      GLY  34 -31.584  11.450   1.680
  133    HA1  GLY  34           HA1      GLY  34 -30.663   9.780   2.620
  134    H    ALA  35           H        ALA  35 -30.004  12.887   1.543
  135    HA   ALA  35           HA       ALA  35 -28.078  14.031   1.941
  136    HB1  ALA  35           HB1      ALA  35 -29.001  13.199   4.444
  137    HB2  ALA  35           HB2      ALA  35 -27.271  12.855   4.438
  138    HB3  ALA  35           HB3      ALA  35 -27.846  14.488   4.101
  139    H    ARG  36           H        ARG  36 -25.678  13.744   2.373
  140    HA   ARG  36           HA       ARG  36 -24.531  11.150   2.301
  141    HB2  ARG  36           HB1      ARG  36 -23.620  11.245  -0.003
  142    HB3  ARG  36           HB2      ARG  36 -25.382  11.078   0.042
  143    HG2  ARG  36           HG1      ARG  36 -24.230  13.820  -0.156
  144    HG3  ARG  36           HG2      ARG  36 -24.205  12.776  -1.586
  145    HD2  ARG  36           HD1      ARG  36 -26.774  12.446  -0.611
  146    HD3  ARG  36           HD2      ARG  36 -26.434  14.157  -0.323
  147    HE   ARG  36           HE       ARG  36 -25.631  13.750  -2.894
  148   HH11  ARG  36          HH11      ARG  36 -28.587  13.208  -1.135
  149   HH12  ARG  36          HH12      ARG  36 -29.606  13.448  -2.515
  150   HH21  ARG  36          HH21      ARG  36 -26.963  14.068  -4.719
  151   HH22  ARG  36          HH22      ARG  36 -28.681  13.936  -4.553
  152    H    LYS  37           H        LYS  37 -22.132  11.493   1.230
  153    HA   LYS  37           HA       LYS  37 -21.078  13.922   2.527
  154    HB2  LYS  37           HB1      LYS  37 -20.572  11.334   3.258
  155    HB3  LYS  37           HB2      LYS  37 -19.218  11.672   2.168
  156    HG2  LYS  37           HG1      LYS  37 -18.284  12.365   4.118
  157    HG3  LYS  37           HG2      LYS  37 -19.066  13.877   3.622
  158    HD2  LYS  37           HD1      LYS  37 -20.405  13.870   5.407
  159    HD3  LYS  37           HD2      LYS  37 -20.902  12.198   5.093
  160    HE2  LYS  37           HE1      LYS  37 -19.881  12.252   7.259
  161    HE3  LYS  37           HE2      LYS  37 -18.768  11.440   6.148
  162    HZ1  LYS  37           HZ1      LYS  37 -17.279  13.127   6.248
  163    HZ2  LYS  37           HZ2      LYS  37 -17.973  13.334   7.775
  164    HZ3  LYS  37           HZ3      LYS  37 -18.451  14.324   6.489
  165    H    GLY  38           H        GLY  38 -19.298  14.969   1.554
  166    HA2  GLY  38           HA2      GLY  38 -19.008  14.342  -1.317
  167    HA3  GLY  38           HA3      GLY  38 -18.893  15.959  -0.639
  168    HA1  GLY  38           HA1      GLY  38 -18.664  13.846  -0.673
  169    H    SER  39           H        SER  39 -17.311  12.795  -0.707
  170    HA   SER  39           HA       SER  39 -14.723  14.101  -0.753
  171    HB2  SER  39           HB1      SER  39 -13.880  13.371   1.247
  172    HB3  SER  39           HB2      SER  39 -15.584  13.506   1.713
  173    HG   SER  39           HG       SER  39 -15.198  11.487   2.288
  174    H    GLN  40           H        GLN  40 -13.170  12.904  -1.774
  175    HA   GLN  40           HA       GLN  40 -14.082  10.644  -3.291
  176    HB2  GLN  40           HB1      GLN  40 -11.439  12.092  -3.110
  177    HB3  GLN  40           HB2      GLN  40 -11.678  10.668  -4.134
  178    HG2  GLN  40           HG1      GLN  40 -13.451  13.080  -4.370
  179    HG3  GLN  40           HG2      GLN  40 -11.898  12.974  -5.210
  180   HE21  GLN  40          HE21      GLN  40 -15.038  12.658  -5.716
  181   HE22  GLN  40          HE22      GLN  40 -15.057  11.430  -6.931
  182    H    CYS  41           H        CYS  41 -11.405  11.116  -0.980
  183    HA   CYS  41           HA       CYS  41 -11.816   8.397  -0.003
  184    HB2  CYS  41           HB1      CYS  41  -9.493   7.775  -0.221
  185    HB3  CYS  41           HB2      CYS  41 -10.114   8.236  -1.805
  186    H    LEU  42           H        LEU  42 -11.152   8.068   2.111
  187    HA   LEU  42           HA       LEU  42 -10.586  10.521   3.602
  188    HB2  LEU  42           HB1      LEU  42 -12.258   8.281   4.040
  189    HB3  LEU  42           HB2      LEU  42 -10.999   8.248   5.287
  190    HG   LEU  42           HG       LEU  42 -11.721  10.807   5.514
  191   HD11  LEU  42          HD11      LEU  42 -13.491  10.143   3.638
  192   HD12  LEU  42          HD12      LEU  42 -13.841  11.322   4.901
  193   HD13  LEU  42          HD13      LEU  42 -14.413   9.662   5.063
  194   HD21  LEU  42          HD21      LEU  42 -13.213   8.484   6.730
  195   HD22  LEU  42          HD22      LEU  42 -13.143  10.125   7.373
  196   HD23  LEU  42          HD23      LEU  42 -11.680   9.142   7.303
  197    H    SER  43           H        SER  43  -9.200   7.458   2.749
  198    HA   SER  43           HA       SER  43  -6.625   8.269   3.703
  199    HB2  SER  43           HB1      SER  43  -8.137   7.086   5.639
  200    HB3  SER  43           HB2      SER  43  -7.337   5.675   4.923
  201    HG   SER  43           HG       SER  43  -6.012   8.006   5.855
  202    H    ASP  44           H        ASP  44  -4.989   6.457   3.350
  203    HA   ASP  44           HA       ASP  44  -5.083   5.609   0.703
  204    HB2  ASP  44           HB1      ASP  44  -3.080   4.382   1.138
  205    HB3  ASP  44           HB2      ASP  44  -3.028   5.835   2.145
  206    HD2  ASP  44           HD       ASP  44  -2.793   2.401   3.914
  207    H    THR  45           H        THR  45  -6.287   4.100   3.591
  208    HA   THR  45           HA       THR  45  -6.488   1.447   2.706
  209    HB   THR  45           HB       THR  45  -8.644   1.641   4.338
  210    HG1  THR  45           HG1      THR  45  -8.223   3.246   5.872
  211   HG21  THR  45          HG21      THR  45  -7.219   0.889   6.102
  212   HG22  THR  45          HG22      THR  45  -5.810   1.657   5.369
  213   HG23  THR  45          HG23      THR  45  -6.558   0.262   4.592
  214    H    ASP  46           H        ASP  46  -8.355   4.261   1.950
  215    HA   ASP  46           HA       ASP  46 -10.704   2.940   1.047
  216    HB2  ASP  46           HB1      ASP  46 -10.515   5.379   1.681
  217    HB3  ASP  46           HB2      ASP  46  -9.687   5.635   0.140
  218    HD2  ASP  46           HD       ASP  46 -12.638   5.690  -1.590
  219    H    CYS  47           H        CYS  47  -7.609   3.600  -0.367
  220    HA   CYS  47           HA       CYS  47  -8.514   3.027  -3.066
  221    HB2  CYS  47           HB1      CYS  47  -6.091   4.122  -1.807
  222    HB3  CYS  47           HB2      CYS  47  -5.773   3.067  -3.184
  223    H    ASN  48           H        ASN  48  -6.997   1.405  -0.400
  224    HA   ASN  48           HA       ASN  48  -6.398  -0.760  -0.050
  225    HB2  ASN  48           HB1      ASN  48  -8.589  -0.835  -1.912
  226    HB3  ASN  48           HB2      ASN  48  -7.452  -2.132  -2.292
  227   HD21  ASN  48          HD21      ASN  48  -8.039  -3.963  -1.403
  228   HD22  ASN  48          HD22      ASN  48  -8.717  -4.164   0.175
  229    H    THR  49           H        THR  49  -5.370  -2.752  -1.269
  230    HA   THR  49           HA       THR  49  -3.499  -3.531  -2.309
  231    HB   THR  49           HB       THR  49  -3.501  -1.696  -4.574
  232    HG1  THR  49           HG1      THR  49  -5.632  -1.444  -4.504
  233   HG21  THR  49          HG21      THR  49  -4.193  -4.084  -5.580
  234   HG22  THR  49          HG22      THR  49  -3.540  -4.606  -4.027
  235   HG23  THR  49          HG23      THR  49  -2.536  -3.675  -5.138
  236    H    ARG  50           H        ARG  50  -1.490  -2.515  -3.758
  237    HA   ARG  50           HA       ARG  50  -0.124  -0.857  -1.843
  238    HB2  ARG  50           HB1      ARG  50   0.817  -1.833  -4.551
  239    HB3  ARG  50           HB2      ARG  50   1.831  -1.171  -3.259
  240    HG2  ARG  50           HG1      ARG  50   2.192  -3.301  -2.696
  241    HG3  ARG  50           HG2      ARG  50   0.574  -3.223  -1.980
  242    HD2  ARG  50           HD1      ARG  50  -0.143  -3.796  -4.488
  243    HD3  ARG  50           HD2      ARG  50   1.477  -4.508  -4.496
  244    HE   ARG  50           HE       ARG  50   0.020  -5.328  -2.201
  245   HH11  ARG  50          HH11      ARG  50   0.326  -5.870  -5.625
  246   HH12  ARG  50          HH12      ARG  50  -0.254  -7.500  -5.552
  247   HH21  ARG  50          HH21      ARG  50  -0.745  -7.473  -2.090
  248   HH22  ARG  50          HH22      ARG  50  -0.864  -8.412  -3.540
  249    H    LYS  51           H        LYS  51  -2.013   0.770  -2.450
  250    HA   LYS  51           HA       LYS  51  -0.761   2.775  -4.175
  251    HB2  LYS  51           HB1      LYS  51  -3.636   1.855  -4.373
  252    HB3  LYS  51           HB2      LYS  51  -3.025   3.346  -5.110
  253    HG2  LYS  51           HG1      LYS  51  -1.384   1.961  -6.393
  254    HG3  LYS  51           HG2      LYS  51  -2.215   0.525  -5.770
  255    HD2  LYS  51           HD1      LYS  51  -4.321   1.977  -6.720
  256    HD3  LYS  51           HD2      LYS  51  -3.036   2.422  -7.857
  257    HE2  LYS  51           HE1      LYS  51  -3.577   0.535  -8.947
  258    HE3  LYS  51           HE2      LYS  51  -2.702  -0.286  -7.648
  259    HZ1  LYS  51           HZ1      LYS  51  -4.900  -1.235  -7.985
  260    HZ2  LYS  51           HZ2      LYS  51  -5.621   0.261  -7.666
  261    HZ3  LYS  51           HZ3      LYS  51  -4.776  -0.547  -6.444
  262    H    PHE  52           H        PHE  52  -0.966   4.842  -3.456
  263    HA   PHE  52           HA       PHE  52  -2.403   5.194  -0.916
  264    HB2  PHE  52           HB1      PHE  52  -0.903   7.141  -0.557
  265    HB3  PHE  52           HB2      PHE  52  -0.031   5.615  -0.712
  266    HD1  PHE  52           HD1      PHE  52   1.654   5.340  -2.295
  267    HD2  PHE  52           HD2      PHE  52  -1.030   8.626  -2.634
  268    HE1  PHE  52           HE1      PHE  52   3.042   6.283  -4.094
  269    HE2  PHE  52           HE2      PHE  52   0.353   9.574  -4.434
  270    HZ   PHE  52           HZ       PHE  52   2.391   8.402  -5.168
  271    H    CYS  53           H        CYS  53  -3.307   7.389  -0.529
  272    HA   CYS  53           HA       CYS  53  -4.579   8.388  -2.987
  273    HB2  CYS  53           HB1      CYS  53  -5.805   7.431  -0.778
  274    HB3  CYS  53           HB2      CYS  53  -5.693   9.139  -0.346
  275    H    LEU  54           H        LEU  54  -3.106   9.925  -3.627
  276    HA   LEU  54           HA       LEU  54  -2.096  11.884  -1.765
  277    HB2  LEU  54           HB1      LEU  54  -0.621  11.177  -3.505
  278    HB3  LEU  54           HB2      LEU  54  -1.832  11.549  -4.744
  279    HG   LEU  54           HG       LEU  54  -1.351  13.964  -3.396
  280   HD11  LEU  54          HD11      LEU  54   1.188  12.458  -3.990
  281   HD12  LEU  54          HD12      LEU  54   0.669  13.114  -2.437
  282   HD13  LEU  54          HD13      LEU  54   1.099  14.203  -3.756
  283   HD21  LEU  54          HD21      LEU  54  -0.215  13.062  -6.035
  284   HD22  LEU  54          HD22      LEU  54  -0.598  14.710  -5.534
  285   HD23  LEU  54          HD23      LEU  54  -1.894  13.543  -5.800
  286    H    GLN  55           H        GLN  55  -2.806  13.921  -1.454
  287    HA   GLN  55           HA       GLN  55  -5.021  14.868  -3.147
  288    HB2  GLN  55           HB1      GLN  55  -5.839  16.045  -1.028
  289    HB3  GLN  55           HB2      GLN  55  -6.081  14.294  -1.130
  290    HG2  GLN  55           HG1      GLN  55  -4.775  13.874   0.632
  291    HG3  GLN  55           HG2      GLN  55  -3.553  15.042   0.113
  292   HE21  GLN  55          HE21      GLN  55  -3.429  16.949   1.114
  293   HE22  GLN  55          HE22      GLN  55  -4.548  17.523   2.298
  294    HA   PRO  56           HA       PRO  56  -1.703  18.018  -3.380
  295    HB2  PRO  56           HB1      PRO  56  -2.310  18.777  -5.941
  296    HB3  PRO  56           HB2      PRO  56  -1.291  17.392  -5.552
  297    HG2  PRO  56           HG1      PRO  56  -4.213  17.473  -6.228
  298    HG3  PRO  56           HG2      PRO  56  -2.932  16.357  -6.834
  299    HD2  PRO  56           HD1      PRO  56  -4.701  15.644  -4.901
  300    HD3  PRO  56           HD2      PRO  56  -3.031  15.053  -4.935
  301    H    ARG  57           H        ARG  57  -1.829  20.326  -3.598
  302    HA   ARG  57           HA       ARG  57  -4.368  21.377  -2.699
  303    HB2  ARG  57           HB1      ARG  57  -1.604  22.523  -3.026
  304    HB3  ARG  57           HB2      ARG  57  -2.992  23.565  -2.685
  305    HG2  ARG  57           HG1      ARG  57  -3.441  22.343  -0.622
  306    HG3  ARG  57           HG2      ARG  57  -2.073  21.270  -0.966
  307    HD2  ARG  57           HD1      ARG  57  -0.532  23.174  -0.871
  308    HD3  ARG  57           HD2      ARG  57  -1.898  24.252  -0.548
  309    HE   ARG  57           HE       ARG  57  -1.893  23.559   1.636
  310   HH11  ARG  57          HH11      ARG  57   0.015  21.359  -0.272
  311   HH12  ARG  57          HH12      ARG  57   0.630  20.497   1.100
  312   HH21  ARG  57          HH21      ARG  57  -1.090  22.433   3.449
  313   HH22  ARG  57          HH22      ARG  57   0.000  21.108   3.216
  314    H    ASP  58           H        ASP  58  -2.191  21.868  -5.460
  315    HA   ASP  58           HA       ASP  58  -3.951  23.720  -6.757
  316    HB2  ASP  58           HB1      ASP  58  -1.359  22.396  -7.399
  317    HB3  ASP  58           HB2      ASP  58  -2.324  22.994  -8.754
  318    HD2  ASP  58           HD       ASP  58  -0.167  25.579  -7.004
  319    H    GLU  59           H        GLU  59  -3.631  20.289  -6.652
  320    HA   GLU  59           HA       GLU  59  -5.546  20.035  -8.877
  321    HB2  GLU  59           HB1      GLU  59  -3.092  18.644  -8.296
  322    HB3  GLU  59           HB2      GLU  59  -4.444  17.503  -8.307
  323    HG2  GLU  59           HG1      GLU  59  -5.035  18.822 -10.545
  324    HG3  GLU  59           HG2      GLU  59  -3.287  19.093 -10.516
  325    HE2  GLU  59           HE       GLU  59  -4.275  15.833 -12.067
  326    H    LYS  60           H        LYS  60  -6.651  17.682  -8.570
  327    HA   LYS  60           HA       LYS  60  -7.994  17.861  -5.966
  328    HB2  LYS  60           HB1      LYS  60  -9.738  16.409  -7.104
  329    HB3  LYS  60           HB2      LYS  60  -9.563  18.056  -7.730
  330    HG2  LYS  60           HG1      LYS  60  -7.824  16.217  -9.133
  331    HG3  LYS  60           HG2      LYS  60  -9.520  15.701  -9.197
  332    HD2  LYS  60           HD1      LYS  60 -10.095  18.074  -9.882
  333    HD3  LYS  60           HD2      LYS  60  -8.352  18.330 -10.087
  334    HE2  LYS  60           HE1      LYS  60  -8.378  16.285 -11.616
  335    HE3  LYS  60           HE2      LYS  60 -10.142  16.433 -11.584
  336    HZ1  LYS  60           HZ1      LYS  60  -9.301  18.954 -12.156
  337    HZ2  LYS  60           HZ2      LYS  60  -9.879  17.828 -13.279
  338    HZ3  LYS  60           HZ3      LYS  60  -8.214  17.989 -13.022
  339    HA   PRO  61           HA       PRO  61  -6.423  14.017  -4.547
  340    HB2  PRO  61           HB1      PRO  61  -8.560  13.036  -3.141
  341    HB3  PRO  61           HB2      PRO  61  -7.576  14.394  -2.596
  342    HG2  PRO  61           HG1      PRO  61 -10.204  14.408  -4.042
  343    HG3  PRO  61           HG2      PRO  61  -9.681  15.381  -2.618
  344    HD2  PRO  61           HD1      PRO  61  -9.736  16.386  -5.140
  345    HD3  PRO  61           HD2      PRO  61  -8.528  16.876  -3.940
  346    H    PHE  62           H        PHE  62  -6.276  11.897  -5.136
  347    HA   PHE  62           HA       PHE  62  -8.418  10.390  -6.227
  348    HB2  PHE  62           HB1      PHE  62  -7.806  10.247  -8.522
  349    HB3  PHE  62           HB2      PHE  62  -7.881  11.965  -8.129
  350    HD1  PHE  62           HD1      PHE  62  -6.014   9.584  -9.800
  351    HD2  PHE  62           HD2      PHE  62  -5.544  12.936  -7.219
  352    HE1  PHE  62           HE1      PHE  62  -3.716   9.891 -10.622
  353    HE2  PHE  62           HE2      PHE  62  -3.245  13.249  -8.037
  354    HZ   PHE  62           HZ       PHE  62  -2.328  11.726  -9.742
  355    H    CYS  63           H        CYS  63  -7.615   8.272  -7.145
  356    HA   CYS  63           HA       CYS  63  -5.725   7.151  -5.340
  357    HB2  CYS  63           HB1      CYS  63  -7.789   6.128  -6.732
  358    HB3  CYS  63           HB2      CYS  63  -6.462   5.648  -7.793
  359    H    ALA  64           H        ALA  64  -3.616   7.543  -5.498
  360    HA   ALA  64           HA       ALA  64  -2.397   7.733  -8.164
  361    HB1  ALA  64           HB1      ALA  64  -1.691   9.634  -7.142
  362    HB2  ALA  64           HB2      ALA  64  -1.773   8.929  -5.526
  363    HB3  ALA  64           HB3      ALA  64  -0.416   8.549  -6.585
  364    H    THR  65           H        THR  65  -0.769   6.393  -8.798
  365    HA   THR  65           HA       THR  65  -0.534   3.877  -7.466
  366    HB   THR  65           HB       THR  65   1.263   3.468  -9.245
  367    HG1  THR  65           HG1      THR  65   1.584   5.006 -10.739
  368   HG21  THR  65          HG21      THR  65  -0.384   2.609 -10.497
  369   HG22  THR  65          HG22      THR  65  -1.085   4.199 -10.808
  370   HG23  THR  65          HG23      THR  65  -1.492   3.329  -9.329
  371    H    CYS  66           H        CYS  66   1.692   2.897  -7.100
  372    HA   CYS  66           HA       CYS  66   3.024   4.389  -5.096
  373    HB2  CYS  66           HB1      CYS  66   2.883   1.727  -5.830
  374    HB3  CYS  66           HB2      CYS  66   4.553   2.156  -6.208
  375    H    ARG  67           H        ARG  67   5.542   4.476  -5.163
  376    HA   ARG  67           HA       ARG  67   6.289   5.808  -7.680
  377    HB2  ARG  67           HB1      ARG  67   7.290   6.259  -4.858
  378    HB3  ARG  67           HB2      ARG  67   7.939   7.062  -6.297
  379    HG2  ARG  67           HG1      ARG  67   5.077   7.374  -6.192
  380    HG3  ARG  67           HG2      ARG  67   5.829   7.919  -4.683
  381    HD2  ARG  67           HD1      ARG  67   7.518   9.130  -6.264
  382    HD3  ARG  67           HD2      ARG  67   6.240   8.923  -7.469
  383    HE   ARG  67           HE       ARG  67   6.267  10.787  -5.314
  384   HH11  ARG  67          HH11      ARG  67   4.174   8.813  -7.277
  385   HH12  ARG  67          HH12      ARG  67   2.793   9.838  -7.065
  386   HH21  ARG  67          HH21      ARG  67   4.455  12.143  -5.028
  387   HH22  ARG  67          HH22      ARG  67   2.954  11.732  -5.786
  388    H    GLY  68           H        GLY  68   8.026   5.116  -8.792
  389    HA2  GLY  68           HA2      GLY  68   9.310   2.672  -7.909
  390    HA3  GLY  68           HA3      GLY  68   9.514   3.456  -9.468
  391    HA1  GLY  68           HA1      GLY  68   9.339   3.356  -7.352
  392    H    LEU  69           H        LEU  69  11.778   2.619  -8.690
  393    HA   LEU  69           HA       LEU  69  13.199   4.110  -6.762
  394    HB2  LEU  69           HB1      LEU  69  14.290   2.682  -9.193
  395    HB3  LEU  69           HB2      LEU  69  15.198   3.156  -7.747
  396    HG   LEU  69           HG       LEU  69  13.067   1.032  -7.933
  397   HD11  LEU  69          HD11      LEU  69  15.032  -0.357  -7.090
  398   HD12  LEU  69          HD12      LEU  69  16.047   0.999  -7.578
  399   HD13  LEU  69          HD13      LEU  69  15.066   0.155  -8.777
  400   HD21  LEU  69          HD21      LEU  69  14.340   0.889  -5.456
  401   HD22  LEU  69          HD22      LEU  69  12.676   1.380  -5.773
  402   HD23  LEU  69          HD23      LEU  69  13.950   2.596  -5.678
  403    H    ARG  70           H        ARG  70  12.367   4.736 -10.064
  404    HA   ARG  70           HA       ARG  70  14.268   6.945 -10.252
  405    HB2  ARG  70           HB1      ARG  70  12.399   5.643 -12.231
  406    HB3  ARG  70           HB2      ARG  70  13.263   7.146 -12.590
  407    HG2  ARG  70           HG1      ARG  70  15.301   5.565 -11.715
  408    HG3  ARG  70           HG2      ARG  70  14.241   4.391 -12.514
  409    HD2  ARG  70           HD1      ARG  70  14.347   6.658 -14.201
  410    HD3  ARG  70           HD2      ARG  70  16.005   6.319 -13.684
  411    HE   ARG  70           HE       ARG  70  14.954   3.887 -14.428
  412   HH11  ARG  70          HH11      ARG  70  15.502   6.974 -15.942
  413   HH12  ARG  70          HH12      ARG  70  15.731   6.304 -17.524
  414   HH21  ARG  70          HH21      ARG  70  15.252   2.993 -16.506
  415   HH22  ARG  70          HH22      ARG  70  15.586   4.040 -17.843
  416    H    ARG  71           H        ARG  71  11.590   6.691  -8.653
  417    HA   ARG  71           HA       ARG  71  10.342   9.160  -9.652
  418    HB2  ARG  71           HB1      ARG  71   9.326   6.799  -8.122
  419    HB3  ARG  71           HB2      ARG  71   8.538   8.368  -7.894
  420    HG2  ARG  71           HG1      ARG  71   8.933   7.075 -10.591
  421    HG3  ARG  71           HG2      ARG  71   7.472   6.899  -9.604
  422    HD2  ARG  71           HD1      ARG  71   7.748   9.599  -9.593
  423    HD3  ARG  71           HD2      ARG  71   8.430   9.199 -11.174
  424    HE   ARG  71           HE       ARG  71   5.949   7.875 -10.762
  425   HH11  ARG  71          HH11      ARG  71   7.352  10.959 -11.558
  426   HH12  ARG  71          HH12      ARG  71   5.968  11.508 -12.442
  427   HH21  ARG  71          HH21      ARG  71   4.120   8.585 -11.924
  428   HH22  ARG  71          HH22      ARG  71   4.129  10.156 -12.649
  429    H    ARG  72           H        ARG  72  10.254  10.963  -8.419
  430    HA   ARG  72           HA       ARG  72  12.005  11.148  -6.168
  431    HB2  ARG  72           HB1      ARG  72  11.188  13.513  -6.058
  432    HB3  ARG  72           HB2      ARG  72  11.853  13.038  -7.628
  433    HG2  ARG  72           HG1      ARG  72   9.034  12.519  -7.597
  434    HG3  ARG  72           HG2      ARG  72   9.348  14.187  -7.093
  435    HD2  ARG  72           HD1      ARG  72  11.035  14.053  -9.179
  436    HD3  ARG  72           HD2      ARG  72   9.827  12.869  -9.699
  437    HE   ARG  72           HE       ARG  72   8.368  14.584 -10.085
  438   HH11  ARG  72          HH11      ARG  72  10.935  15.727  -8.030
  439   HH12  ARG  72          HH12      ARG  72  10.423  17.381  -8.090
  440   HH21  ARG  72          HH21      ARG  72   7.685  16.760 -10.173
  441   HH22  ARG  72          HH22      ARG  72   8.574  17.967  -9.309
  442    H    CYS  73           H        CYS  73  11.456  11.757  -4.028
  443    HA   CYS  73           HA       CYS  73   8.685  11.636  -3.195
  444    HB2  CYS  73           HB1      CYS  73   9.103   9.827  -1.540
  445    HB3  CYS  73           HB2      CYS  73   9.196   9.277  -3.214
  446    H    GLN  74           H        GLN  74   8.489  11.991  -0.803
  447    HA   GLN  74           HA       GLN  74  10.666  13.747   0.116
  448    HB2  GLN  74           HB1      GLN  74   8.244  14.624  -0.412
  449    HB3  GLN  74           HB2      GLN  74   7.881  13.954   1.187
  450    HG2  GLN  74           HG1      GLN  74   9.005  15.564   2.286
  451    HG3  GLN  74           HG2      GLN  74  10.270  15.659   1.053
  452   HE21  GLN  74          HE21      GLN  74   8.484  17.660   2.489
  453   HE22  GLN  74          HE22      GLN  74   7.871  18.653   1.215
  454    H    ARG  75           H        ARG  75   8.624  11.059   0.897
  455    HA   ARG  75           HA       ARG  75  10.160  10.650   3.358
  456    HB2  ARG  75           HB1      ARG  75   7.990   9.821   4.432
  457    HB3  ARG  75           HB2      ARG  75   8.201  11.572   4.272
  458    HG2  ARG  75           HG1      ARG  75   6.738  11.645   2.363
  459    HG3  ARG  75           HG2      ARG  75   6.619   9.877   2.354
  460    HD2  ARG  75           HD1      ARG  75   5.509   9.894   4.518
  461    HD3  ARG  75           HD2      ARG  75   5.706  11.650   4.615
  462    HE   ARG  75           HE       ARG  75   3.661  10.248   3.231
  463   HH11  ARG  75          HH11      ARG  75   5.651  13.101   3.088
  464   HH12  ARG  75          HH12      ARG  75   4.507  14.011   2.159
  465   HH21  ARG  75          HH21      ARG  75   2.146  11.436   2.008
  466   HH22  ARG  75          HH22      ARG  75   2.513  13.064   1.546
  467    H    ASP  76           H        ASP  76   9.997   8.414   4.170
  468    HA   ASP  76           HA       ASP  76  10.180   6.554   1.978
  469    HB2  ASP  76           HB1      ASP  76  10.310   5.750   4.872
  470    HB3  ASP  76           HB2      ASP  76  11.182   5.079   3.485
  471    HD2  ASP  76           HD       ASP  76  13.805   7.236   3.919
  472    H    ALA  77           H        ALA  77   7.851   7.403   4.394
  473    HA   ALA  77           HA       ALA  77   6.346   5.040   4.498
  474    HB1  ALA  77           HB1      ALA  77   5.341   7.869   4.786
  475    HB2  ALA  77           HB2      ALA  77   4.548   6.406   5.371
  476    HB3  ALA  77           HB3      ALA  77   6.084   6.916   6.071
  477    H    MET  78           H        MET  78   6.083   7.864   2.363
  478    HA   MET  78           HA       MET  78   3.809   6.942   0.951
  479    HB2  MET  78           HB1      MET  78   4.182   8.732  -0.558
  480    HB3  MET  78           HB2      MET  78   4.683   9.317   1.035
  481    HG2  MET  78           HG1      MET  78   6.547   9.997   0.018
  482    HG3  MET  78           HG2      MET  78   7.013   8.295   0.060
  483    HE1  MET  78           HE1      MET  78   4.172   9.826  -2.625
  484    HE2  MET  78           HE2      MET  78   5.150  10.986  -1.724
  485    HE3  MET  78           HE3      MET  78   5.447  10.729  -3.444
  486    H    CYS  79           H        CYS  79   7.187   6.235   0.726
  487    HA   CYS  79           HA       CYS  79   7.086   5.189  -1.951
  488    HB2  CYS  79           HB1      CYS  79   9.110   5.634   0.113
  489    HB3  CYS  79           HB2      CYS  79   9.344   4.117  -0.758
  490    H    CYS  80           H        CYS  80   7.045   3.055  -2.595
  491    HA   CYS  80           HA       CYS  80   5.463   1.264  -1.215
  492    HB2  CYS  80           HB1      CYS  80   7.239   1.161  -3.557
  493    HB3  CYS  80           HB2      CYS  80   7.023  -0.396  -2.753
  494    HA   PRO  81           HA       PRO  81   7.907  -0.731   1.833
  495    HB2  PRO  81           HB1      PRO  81   7.080  -3.335   1.645
  496    HB3  PRO  81           HB2      PRO  81   6.080  -2.042   2.306
  497    HG2  PRO  81           HG1      PRO  81   6.093  -3.217  -0.455
  498    HG3  PRO  81           HG2      PRO  81   4.693  -2.821   0.610
  499    HD2  PRO  81           HD1      PRO  81   5.467  -1.224  -1.444
  500    HD3  PRO  81           HD2      PRO  81   4.777  -0.586   0.056
  501    H    GLY  82           H        GLY  82   9.840  -1.778   2.127
  502    HA2  GLY  82           HA2      GLY  82  11.552  -3.321   1.564
  503    HA3  GLY  82           HA3      GLY  82  10.901  -3.409  -0.066
  504    HA1  GLY  82           HA1      GLY  82  11.459  -2.464   1.755
  505    H    THR  83           H        THR  83  10.737  -0.344   0.056
  506    HA   THR  83           HA       THR  83  13.580   0.128  -0.566
  507    HB   THR  83           HB       THR  83  12.565   2.044  -2.016
  508    HG1  THR  83           HG1      THR  83  10.482   1.356  -2.864
  509   HG21  THR  83          HG21      THR  83  13.150  -0.731  -2.535
  510   HG22  THR  83          HG22      THR  83  13.461   0.684  -3.541
  511   HG23  THR  83          HG23      THR  83  11.907  -0.143  -3.636
  512    H    LEU  84           H        LEU  84  14.083   2.575  -0.530
  513    HA   LEU  84           HA       LEU  84  12.720   3.885   1.717
  514    HB2  LEU  84           HB1      LEU  84  15.681   3.420   1.388
  515    HB3  LEU  84           HB2      LEU  84  15.020   4.672   2.454
  516    HG   LEU  84           HG       LEU  84  14.148   1.834   2.802
  517   HD11  LEU  84          HD11      LEU  84  16.143   2.061   4.619
  518   HD12  LEU  84          HD12      LEU  84  16.850   2.900   3.240
  519   HD13  LEU  84          HD13      LEU  84  16.295   1.234   3.070
  520   HD21  LEU  84          HD21      LEU  84  14.081   2.619   5.185
  521   HD22  LEU  84          HD22      LEU  84  12.962   3.440   4.096
  522   HD23  LEU  84          HD23      LEU  84  14.457   4.237   4.591
  523    H    CYS  85           H        CYS  85  13.089   6.204   1.829
  524    HA   CYS  85           HA       CYS  85  13.328   7.347  -0.848
  525    HB2  CYS  85           HB1      CYS  85  11.371   7.824   0.718
  526    HB3  CYS  85           HB2      CYS  85  12.502   8.787   1.672
  527    H    VAL  86           H        VAL  86  15.468   7.574  -1.293
  528    HA   VAL  86           HA       VAL  86  17.075   9.151   0.610
  529    HB   VAL  86           HB       VAL  86  18.129   7.308  -1.537
  530   HG11  VAL  86          HG11      VAL  86  20.195   7.509  -0.012
  531   HG12  VAL  86          HG12      VAL  86  19.803   8.860  -1.078
  532   HG13  VAL  86          HG13      VAL  86  19.393   8.940   0.636
  533   HG21  VAL  86          HG21      VAL  86  16.894   6.055   0.177
  534   HG22  VAL  86          HG22      VAL  86  18.626   5.724   0.239
  535   HG23  VAL  86          HG23      VAL  86  17.891   6.799   1.428
  536    H    ASN  87           H        ASN  87  18.099  10.970  -0.081
  537    HA   ASN  87           HA       ASN  87  18.477  12.825  -1.344
  538    HB2  ASN  87           HB1      ASN  87  19.682  10.807  -2.619
  539    HB3  ASN  87           HB2      ASN  87  18.510  11.245  -3.867
  540   HD21  ASN  87          HD21      ASN  87  21.253  11.485  -4.219
  541   HD22  ASN  87          HD22      ASN  87  21.650  13.160  -4.368
  542    H    ASP  88           H        ASP  88  15.756  12.146  -0.867
  543    HA   ASP  88           HA       ASP  88  13.668  12.820  -1.467
  544    HB2  ASP  88           HB1      ASP  88  15.420  14.755  -2.507
  545    HB3  ASP  88           HB2      ASP  88  14.289  14.389  -3.816
  546    HD2  ASP  88           HD       ASP  88  12.929  16.270  -0.624
  547    H    VAL  89           H        VAL  89  15.003  10.487  -2.736
  548    HA   VAL  89           HA       VAL  89  13.017  10.067  -4.824
  549    HB   VAL  89           HB       VAL  89  15.963   9.636  -5.337
  550   HG11  VAL  89          HG11      VAL  89  13.583   9.130  -7.120
  551   HG12  VAL  89          HG12      VAL  89  15.278   8.920  -7.564
  552   HG13  VAL  89          HG13      VAL  89  14.556   7.892  -6.326
  553   HG21  VAL  89          HG21      VAL  89  15.330  11.986  -5.481
  554   HG22  VAL  89          HG22      VAL  89  15.697  11.336  -7.078
  555   HG23  VAL  89          HG23      VAL  89  14.019  11.576  -6.588
  556    H    CYS  90           H        CYS  90  12.415   7.940  -5.078
  557    HA   CYS  90           HA       CYS  90  12.876   6.195  -2.904
  558    HB2  CYS  90           HB1      CYS  90  11.030   6.377  -4.962
  559    HB3  CYS  90           HB2      CYS  90  11.909   4.894  -5.338
  560    H    THR  91           H        THR  91  14.095   4.347  -2.715
  561    HA   THR  91           HA       THR  91  15.744   3.459  -4.934
  562    HB   THR  91           HB       THR  91  17.064   5.283  -3.856
  563    HG1  THR  91           HG1      THR  91  18.809   4.138  -4.278
  564   HG21  THR  91          HG21      THR  91  17.053   3.406  -1.488
  565   HG22  THR  91          HG22      THR  91  16.304   5.001  -1.558
  566   HG23  THR  91          HG23      THR  91  18.059   4.845  -1.647
  567    H    THR  92           H        THR  92  16.882   1.451  -4.467
  568    HA   THR  92           HA       THR  92  15.266  -0.321  -2.903
  569    HB   THR  92           HB       THR  92  17.321  -1.904  -3.533
  570    HG1  THR  92           HG1      THR  92  18.680  -0.964  -4.842
  571   HG21  THR  92          HG21      THR  92  14.919  -1.010  -4.995
  572   HG22  THR  92          HG22      THR  92  15.422  -2.633  -4.524
  573   HG23  THR  92          HG23      THR  92  16.120  -1.874  -5.954
  574    H    MET  93           H        MET  93  16.061  -1.730  -1.217
  575    HA   MET  93           HA       MET  93  17.372  -0.351   0.850
  576    HB2  MET  93           HB1      MET  93  16.163  -2.963   0.446
  577    HB3  MET  93           HB2      MET  93  17.609  -3.062   1.461
  578    HG2  MET  93           HG1      MET  93  16.623  -1.195   2.856
  579    HG3  MET  93           HG2      MET  93  15.131  -1.440   1.945
  580    HE1  MET  93           HE1      MET  93  17.002  -3.600   5.279
  581    HE2  MET  93           HE2      MET  93  17.068  -1.938   4.696
  582    HE3  MET  93           HE3      MET  93  15.693  -2.482   5.658
  583    H    GLU  94           H        GLU  94  18.547  -2.480  -1.653
  584    HA   GLU  94           HA       GLU  94  21.077  -3.040  -0.500
  585    HB2  GLU  94           HB1      GLU  94  20.037  -3.132  -3.332
  586    HB3  GLU  94           HB2      GLU  94  21.701  -3.569  -2.919
  587    HG2  GLU  94           HG1      GLU  94  20.237  -5.042  -1.120
  588    HG3  GLU  94           HG2      GLU  94  19.237  -5.078  -2.579
  589    HE2  GLU  94           HE       GLU  94  22.078  -6.565  -4.303
  590    H    ASP  95           H        ASP  95  19.794  -0.356  -2.285
  591    HA   ASP  95           HA       ASP  95  22.409   0.762  -2.858
  592    HB2  ASP  95           HB1      ASP  95  19.705   1.170  -3.787
  593    HB3  ASP  95           HB2      ASP  95  20.427   2.712  -3.307
  594    HD2  ASP  95           HD       ASP  95  22.599   2.712  -5.983
  595    H    ALA  96           H        ALA  96  19.637   1.480  -0.767
  596    HA   ALA  96           HA       ALA  96  20.839   3.781   0.422
  597    HB1  ALA  96           HB1      ALA  96  18.620   2.162   1.638
  598    HB2  ALA  96           HB2      ALA  96  18.942   3.889   1.804
  599    HB3  ALA  96           HB3      ALA  96  18.355   3.244   0.270
  600    H    THR  97           H        THR  97  22.250   3.897   2.043
  601    HA   THR  97           HA       THR  97  23.632   3.317   3.757
  602    HB   THR  97           HB       THR  97  21.779   1.054   4.459
  603    HG1  THR  97           HG1      THR  97  20.276   2.436   5.070
  604   HG21  THR  97          HG21      THR  97  22.426   1.625   6.739
  605   HG22  THR  97          HG22      THR  97  23.383   2.982   6.145
  606   HG23  THR  97          HG23      THR  97  23.856   1.330   5.752
  607    H    GLU  98           H        GLU  98  25.432   2.575   2.747
  608    HA   GLU  98           HA       GLU  98  25.542  -0.309   2.151
  609    HB2  GLU  98           HB1      GLU  98  26.086   1.869   0.473
  610    HB3  GLU  98           HB2      GLU  98  27.670   1.218   0.923
  611    HG2  GLU  98           HG1      GLU  98  26.829  -1.051   0.238
  612    HG3  GLU  98           HG2      GLU  98  25.409  -0.230  -0.425
  613    HE2  GLU  98           HE       GLU  98  27.161   0.919  -3.173
  614    H    ASN  99           H        ASN  99  26.796  -1.466   3.442
  615    HA   ASN  99           HA       ASN  99  28.851  -0.081   5.023
  616    HB2  ASN  99           HB1      ASN  99  26.823  -1.792   5.819
  617    HB3  ASN  99           HB2      ASN  99  28.251  -2.836   5.797
  618   HD21  ASN  99          HD21      ASN  99  26.507  -1.357   7.898
  619   HD22  ASN  99          HD22      ASN  99  27.687  -0.724   8.989
  620    H    LEU 100           H        LEU 100  30.477  -2.086   5.782
  621    HA   LEU 100           HA       LEU 100  32.299  -3.294   5.159
  622    HB2  LEU 100           HB1      LEU 100  30.200  -4.533   4.013
  623    HB3  LEU 100           HB2      LEU 100  31.135  -4.107   2.569
  624    HG   LEU 100           HG       LEU 100  32.834  -5.325   4.558
  625   HD11  LEU 100          HD11      LEU 100  30.933  -6.497   5.369
  626   HD12  LEU 100          HD12      LEU 100  31.826  -7.609   4.332
  627   HD13  LEU 100          HD13      LEU 100  30.361  -6.831   3.734
  628   HD21  LEU 100          HD21      LEU 100  32.249  -6.776   2.088
  629   HD22  LEU 100          HD22      LEU 100  33.785  -6.186   2.723
  630   HD23  LEU 100          HD23      LEU 100  32.717  -5.093   1.839
  631    H    TYR 101           H        TYR 101  33.882  -3.637   3.227
  632    HA   TYR 101           HA       TYR 101  33.898  -1.624   1.197
  633    HB2  TYR 101           HB1      TYR 101  36.007  -0.516   2.004
  634    HB3  TYR 101           HB2      TYR 101  34.564  -0.146   2.953
  635    HD1  TYR 101           HD1      TYR 101  34.453  -0.618   5.261
  636    HD2  TYR 101           HD2      TYR 101  37.634  -2.224   2.936
  637    HE1  TYR 101           HE1      TYR 101  35.588  -1.339   7.322
  638    HE2  TYR 101           HE2      TYR 101  38.776  -2.951   4.989
  639    HH   TYR 101           HH       TYR 101  37.249  -2.992   8.026
  640    H    PHE 102           H        PHE 102  36.331  -1.531   0.294
  641    HA   PHE 102           HA       PHE 102  37.036  -4.334  -0.168
  642    HB2  PHE 102           HB1      PHE 102  36.953  -1.952  -1.798
  643    HB3  PHE 102           HB2      PHE 102  38.562  -2.673  -1.855
  644    HD1  PHE 102           HD1      PHE 102  38.911  -4.024  -3.664
  645    HD2  PHE 102           HD2      PHE 102  35.069  -3.995  -1.831
  646    HE1  PHE 102           HE1      PHE 102  38.129  -5.705  -5.282
  647    HE2  PHE 102           HE2      PHE 102  34.282  -5.676  -3.447
  648    HZ   PHE 102           HZ       PHE 102  35.813  -6.534  -5.175
  649    H    GLN 103           H        GLN 103  39.175  -5.081  -0.036
  650    HA   GLN 103           HA       GLN 103  40.853  -3.515   1.794
  651    HB2  GLN 103           HB1      GLN 103  41.937  -5.613   2.377
  652    HB3  GLN 103           HB2      GLN 103  40.182  -5.755   2.563
  653    HG2  GLN 103           HG1      GLN 103  39.994  -6.980   0.501
  654    HG3  GLN 103           HG2      GLN 103  41.714  -6.732   0.166
  655   HE21  GLN 103          HE21      GLN 103  43.026  -8.320   0.694
  656   HE22  GLN 103          HE22      GLN 103  42.707  -9.563   1.850
  657    H    SER 104           H        SER 104  43.304  -4.342   1.490
  658    HA   SER 104           HA       SER 104  43.959  -3.679  -1.297
  659    HB2  SER 104           HB1      SER 104  46.142  -3.611   0.682
  660    HB3  SER 104           HB2      SER 104  45.674  -2.412  -0.536
  661    HG   SER 104           HG       SER 104  44.968  -2.587   2.116
  662    H    LEU 105           H        LEU 105  46.490  -4.504  -1.562
  663    HA   LEU 105           HA       LEU 105  46.208  -7.411  -1.531
  664    HB2  LEU 105           HB1      LEU 105  46.853  -5.952  -3.580
  665    HB3  LEU 105           HB2      LEU 105  48.457  -5.918  -2.827
  666    HG   LEU 105           HG       LEU 105  47.089  -8.522  -3.417
  667   HD11  LEU 105          HD11      LEU 105  48.788  -6.906  -5.311
  668   HD12  LEU 105          HD12      LEU 105  47.079  -7.294  -5.508
  669   HD13  LEU 105          HD13      LEU 105  48.286  -8.579  -5.556
  670   HD21  LEU 105          HD21      LEU 105  49.640  -7.653  -2.383
  671   HD22  LEU 105          HD22      LEU 105  49.841  -8.662  -3.816
  672   HD23  LEU 105          HD23      LEU 105  48.935  -9.269  -2.429
  673    H    GLU 106           H        GLU 106  48.168  -4.850  -0.194
  674    HA   GLU 106           HA       GLU 106  49.768  -4.823   1.422
  675    HB2  GLU 106           HB1      GLU 106  48.887  -7.653   2.029
  676    HB3  GLU 106           HB2      GLU 106  49.721  -6.533   3.117
  677    HG2  GLU 106           HG1      GLU 106  47.785  -5.784   3.870
  678    HG3  GLU 106           HG2      GLU 106  47.348  -5.266   2.236
  679    HE2  GLU 106           HE       GLU 106  46.161  -8.967   2.991
  680    H    HIS 107           H        HIS 107  51.586  -6.540   2.386
  681    HA   HIS 107           HA       HIS 107  52.858  -7.775   0.039
  682    HB2  HIS 107           HB1      HIS 107  53.756  -5.472   1.513
  683    HB3  HIS 107           HB2      HIS 107  54.918  -6.788   1.706
  684    HD1  HIS 107           HD1      HIS 107  55.050  -8.057  -0.987
  685    HD2  HIS 107           HD2      HIS 107  54.755  -3.943  -0.492
  686    HE1  HIS 107           HE1      HIS 107  55.948  -7.058  -3.114
  687    HE2  HIS 107           HE2      HIS 107  55.767  -4.544  -2.812
  688    H    HIS 108           H        HIS 108  54.942  -9.005   0.903
  689    HA   HIS 108           HA       HIS 108  54.176 -10.479   3.334
  690    HB2  HIS 108           HB1      HIS 108  54.007 -11.516   0.805
  691    HB3  HIS 108           HB2      HIS 108  55.625 -12.028   1.293
  692    HD1  HIS 108           HD1      HIS 108  52.016 -12.558   2.103
  693    HD2  HIS 108           HD2      HIS 108  55.735 -13.938   3.339
  694    HE1  HIS 108           HE1      HIS 108  51.544 -14.570   3.535
  695    HE2  HIS 108           HE2      HIS 108  53.817 -15.414   4.292
  696    H    HIS 109           H        HIS 109  55.972 -11.619   4.377
  697    HA   HIS 109           HA       HIS 109  58.665 -11.231   3.705
  698    HB2  HIS 109           HB1      HIS 109  57.506  -8.886   4.667
  699    HB3  HIS 109           HB2      HIS 109  58.358  -9.554   6.064
  700    HD1  HIS 109           HD1      HIS 109  59.414  -9.452   2.408
  701    HD2  HIS 109           HD2      HIS 109  60.710  -8.224   6.159
  702    HE1  HIS 109           HE1      HIS 109  61.686  -8.439   2.036
  703    HE2  HIS 109           HE2      HIS 109  62.479  -7.689   4.329
  704    H    HIS 110           H        HIS 110  60.027 -11.335   5.950
  705    HA   HIS 110           HA       HIS 110  60.636 -12.670   7.689
  706    HB2  HIS 110           HB1      HIS 110  58.353 -11.557   8.487
  707    HB3  HIS 110           HB2      HIS 110  57.798 -13.233   8.416
  708    HD1  HIS 110           HD1      HIS 110  61.170 -11.988   9.638
  709    HD2  HIS 110           HD2      HIS 110  57.783 -13.942  11.042
  710    HE1  HIS 110           HE1      HIS 110  61.717 -12.672  11.995
  711    HE2  HIS 110           HE2      HIS 110  59.647 -13.866  12.854
  712    H    HIS 111           H        HIS 111  60.336 -14.932   8.638
  713    HA   HIS 111           HA       HIS 111  59.711 -16.762   6.423
  714    HB2  HIS 111           HB1      HIS 111  61.987 -16.518   8.039
  715    HB3  HIS 111           HB2      HIS 111  61.165 -17.970   8.622
  716    HD1  HIS 111           HD1      HIS 111  60.638 -19.825   6.728
  717    HD2  HIS 111           HD2      HIS 111  63.419 -16.902   5.738
  718    HE1  HIS 111           HE1      HIS 111  61.892 -20.734   4.747
  719    HE2  HIS 111           HE2      HIS 111  63.591 -18.947   4.140
  720    H    HIS 112           H        HIS 112  59.789 -16.975   9.985
  721    HA   HIS 112           HA       HIS 112  57.037 -17.899  10.015
  722    HB2  HIS 112           HB1      HIS 112  59.229 -19.729  10.068
  723    HB3  HIS 112           HB2      HIS 112  58.469 -19.732  11.662
  724    HD1  HIS 112           HD1      HIS 112  57.375 -20.071   8.033
  725    HD2  HIS 112           HD2      HIS 112  56.301 -21.342  11.841
  726    HE1  HIS 112           HE1      HIS 112  55.467 -21.673   7.694
  727    HE2  HIS 112           HE2      HIS 112  54.809 -22.449  10.021
  Start of MODEL   59
    1    H1   MET  18           H        MET  18 -73.245  16.540  20.090
    2    HA   MET  18           HA       MET  18 -72.557  17.927  17.947
    3    HB2  MET  18           HB1      MET  18 -73.221  18.642  20.658
    4    HB3  MET  18           HB2      MET  18 -72.061  19.803  19.993
    5    HG2  MET  18           HG1      MET  18 -73.728  19.706  17.918
    6    HG3  MET  18           HG2      MET  18 -74.858  19.253  19.197
    7    HE1  MET  18           HE1      MET  18 -74.815  23.133  17.877
    8    HE2  MET  18           HE2      MET  18 -73.165  22.596  17.564
    9    HE3  MET  18           HE3      MET  18 -74.527  21.570  17.112
   10    H    LEU  19           H        LEU  19 -70.626  17.570  16.952
   11    HA   LEU  19           HA       LEU  19 -68.324  18.938  18.069
   12    HB2  LEU  19           HB1      LEU  19 -66.833  16.976  17.598
   13    HB3  LEU  19           HB2      LEU  19 -67.921  16.797  18.986
   14    HG   LEU  19           HG       LEU  19 -69.290  15.688  16.803
   15   HD11  LEU  19          HD11      LEU  19 -66.364  15.259  16.655
   16   HD12  LEU  19          HD12      LEU  19 -67.575  15.277  15.375
   17   HD13  LEU  19          HD13      LEU  19 -67.406  13.858  16.409
   18   HD21  LEU  19          HD21      LEU  19 -68.770  13.546  18.065
   19   HD22  LEU  19          HD22      LEU  19 -69.572  14.827  18.974
   20   HD23  LEU  19          HD23      LEU  19 -67.841  14.551  19.178
   21    H    VAL  20           H        VAL  20 -68.355  20.365  16.379
   22    HA   VAL  20           HA       VAL  20 -68.512  19.465  13.644
   23    HB   VAL  20           HB       VAL  20 -67.778  22.219  14.643
   24   HG11  VAL  20          HG11      VAL  20 -68.150  21.024  12.019
   25   HG12  VAL  20          HG12      VAL  20 -69.175  22.438  12.273
   26   HG13  VAL  20          HG13      VAL  20 -67.426  22.569  12.467
   27   HG21  VAL  20          HG21      VAL  20 -70.181  22.751  14.292
   28   HG22  VAL  20          HG22      VAL  20 -70.490  21.028  14.071
   29   HG23  VAL  20          HG23      VAL  20 -69.894  21.626  15.620
   30    H    LEU  21           H        LEU  21 -66.881  19.153  12.234
   31    HA   LEU  21           HA       LEU  21 -64.207  18.952  13.261
   32    HB2  LEU  21           HB1      LEU  21 -65.692  18.030  10.949
   33    HB3  LEU  21           HB2      LEU  21 -64.096  18.653  10.495
   34    HG   LEU  21           HG       LEU  21 -64.614  16.467  12.509
   35   HD11  LEU  21          HD11      LEU  21 -63.989  16.472   9.603
   36   HD12  LEU  21          HD12      LEU  21 -65.013  15.384  10.539
   37   HD13  LEU  21          HD13      LEU  21 -63.259  15.229  10.620
   38   HD21  LEU  21          HD21      LEU  21 -62.627  17.361  13.230
   39   HD22  LEU  21          HD22      LEU  21 -62.166  17.917  11.621
   40   HD23  LEU  21          HD23      LEU  21 -62.050  16.205  12.029
   41    H    ASP  22           H        ASP  22 -62.350  20.011  12.397
   42    HA   ASP  22           HA       ASP  22 -62.661  22.287  10.665
   43    HB2  ASP  22           HB1      ASP  22 -61.530  23.771  12.516
   44    HB3  ASP  22           HB2      ASP  22 -63.286  23.568  12.485
   45    HD2  ASP  22           HD       ASP  22 -63.256  22.260  15.633
   46    H    PHE  23           H        PHE  23 -61.188  20.287   9.971
   47    HA   PHE  23           HA       PHE  23 -58.418  21.030  10.645
   48    HB2  PHE  23           HB1      PHE  23 -59.068  18.777  11.476
   49    HB3  PHE  23           HB2      PHE  23 -59.413  18.298   9.813
   50    HD1  PHE  23           HD1      PHE  23 -57.666  17.817   8.247
   51    HD2  PHE  23           HD2      PHE  23 -56.751  19.154  12.183
   52    HE1  PHE  23           HE1      PHE  23 -55.319  17.152   7.923
   53    HE2  PHE  23           HE2      PHE  23 -54.403  18.492  11.864
   54    HZ   PHE  23           HZ       PHE  23 -53.683  17.491   9.733
   55    H    ASN  24           H        ASN  24 -57.327  21.894   9.018
   56    HA   ASN  24           HA       ASN  24 -57.216  20.848   6.419
   57    HB2  ASN  24           HB1      ASN  24 -58.343  22.711   5.188
   58    HB3  ASN  24           HB2      ASN  24 -59.452  21.678   6.097
   59   HD21  ASN  24          HD21      ASN  24 -58.595  24.811   5.445
   60   HD22  ASN  24          HD22      ASN  24 -59.389  25.593   6.764
   61    H    ASN  25           H        ASN  25 -55.112  21.327   7.713
   62    HA   ASN  25           HA       ASN  25 -53.968  23.735   6.533
   63    HB2  ASN  25           HB1      ASN  25 -54.769  23.884   9.117
   64    HB3  ASN  25           HB2      ASN  25 -53.128  23.257   9.331
   65   HD21  ASN  25          HD21      ASN  25 -54.931  25.804   7.668
   66   HD22  ASN  25          HD22      ASN  25 -53.685  26.996   7.773
   67    H    ILE  26           H        ILE  26 -52.173  23.175   5.508
   68    HA   ILE  26           HA       ILE  26 -50.628  20.881   6.529
   69    HB   ILE  26           HB       ILE  26 -49.893  20.472   4.213
   70   HG12  ILE  26          HG11      ILE  26 -50.484  22.964   3.617
   71   HG13  ILE  26          HG12      ILE  26 -50.601  21.696   2.385
   72   HG21  ILE  26          HG21      ILE  26 -52.161  19.710   3.347
   73   HG22  ILE  26          HG22      ILE  26 -51.667  19.108   4.928
   74   HG23  ILE  26          HG23      ILE  26 -52.836  20.424   4.812
   75   HD11  ILE  26          HD11      ILE  26 -52.870  21.773   2.306
   76   HD12  ILE  26          HD12      ILE  26 -53.024  22.286   3.988
   77   HD13  ILE  26          HD13      ILE  26 -52.534  23.445   2.753
   78    H    ARG  27           H        ARG  27 -48.300  20.925   5.864
   79    HA   ARG  27           HA       ARG  27 -47.238  23.648   5.613
   80    HB2  ARG  27           HB1      ARG  27 -45.521  23.131   7.329
   81    HB3  ARG  27           HB2      ARG  27 -47.165  23.178   7.978
   82    HG2  ARG  27           HG1      ARG  27 -46.494  20.502   7.143
   83    HG3  ARG  27           HG2      ARG  27 -45.289  21.139   8.276
   84    HD2  ARG  27           HD1      ARG  27 -48.134  21.628   8.964
   85    HD3  ARG  27           HD2      ARG  27 -47.566  19.955   9.060
   86    HE   ARG  27           HE       ARG  27 -46.886  22.106  10.823
   87   HH11  ARG  27          HH11      ARG  27 -45.792  19.084   9.486
   88   HH12  ARG  27          HH12      ARG  27 -44.739  18.727  10.814
   89   HH21  ARG  27          HH21      ARG  27 -45.503  21.647  12.579
   90   HH22  ARG  27          HH22      ARG  27 -44.577  20.186  12.574
   91    H    SER  28           H        SER  28 -47.316  22.184   3.437
   92    HA   SER  28           HA       SER  28 -45.239  20.329   3.025
   93    HB2  SER  28           HB1      SER  28 -46.248  22.106   0.816
   94    HB3  SER  28           HB2      SER  28 -45.820  20.387   0.764
   95    HG   SER  28           HG       SER  28 -48.206  21.307   0.971
   96    H    SER  29           H        SER  29 -43.142  20.712   3.224
   97    HA   SER  29           HA       SER  29 -42.107  23.386   2.600
   98    HB2  SER  29           HB1      SER  29 -39.977  22.194   3.704
   99    HB3  SER  29           HB2      SER  29 -41.254  22.942   4.680
  100    HG   SER  29           HG       SER  29 -41.565  21.048   5.506
  101    H    ALA  30           H        ALA  30 -40.041  23.546   1.470
  102    HA   ALA  30           HA       ALA  30 -39.165  21.287  -0.102
  103    HB1  ALA  30           HB1      ALA  30 -39.555  23.262  -2.065
  104    HB2  ALA  30           HB2      ALA  30 -40.359  21.698  -1.925
  105    HB3  ALA  30           HB3      ALA  30 -41.074  23.127  -1.179
  106    H    ASP  31           H        ASP  31 -37.109  21.538   0.652
  107    HA   ASP  31           HA       ASP  31 -35.510  23.581  -0.545
  108    HB2  ASP  31           HB1      ASP  31 -36.481  23.950   2.185
  109    HB3  ASP  31           HB2      ASP  31 -34.715  23.974   2.085
  110    HD2  ASP  31           HD       ASP  31 -36.662  27.099   0.855
  111    H    LEU  32           H        LEU  32 -34.238  21.976  -1.369
  112    HA   LEU  32           HA       LEU  32 -32.679  20.433   0.595
  113    HB2  LEU  32           HB1      LEU  32 -34.490  19.335  -1.142
  114    HB3  LEU  32           HB2      LEU  32 -32.976  19.216  -2.055
  115    HG   LEU  32           HG       LEU  32 -32.177  18.206   0.317
  116   HD11  LEU  32          HD11      LEU  32 -33.831  16.867   1.321
  117   HD12  LEU  32          HD12      LEU  32 -34.976  17.157   0.012
  118   HD13  LEU  32          HD13      LEU  32 -34.567  18.458   1.130
  119   HD21  LEU  32          HD21      LEU  32 -33.580  16.332  -1.510
  120   HD22  LEU  32          HD22      LEU  32 -31.961  16.241  -0.816
  121   HD23  LEU  32          HD23      LEU  32 -32.278  17.319  -2.176
  122    H    HIS  33           H        HIS  33 -30.607  20.960   0.523
  123    HA   HIS  33           HA       HIS  33 -29.332  21.451  -2.059
  124    HB2  HIS  33           HB1      HIS  33 -30.024  23.533  -0.293
  125    HB3  HIS  33           HB2      HIS  33 -28.282  23.306  -0.114
  126    HD1  HIS  33           HD1      HIS  33 -30.356  23.100  -3.292
  127    HD2  HIS  33           HD2      HIS  33 -27.227  25.279  -1.645
  128    HE1  HIS  33           HE1      HIS  33 -29.562  24.628  -5.126
  129    HE2  HIS  33           HE2      HIS  33 -27.650  25.960  -4.120
  130    H    GLY  34           H        GLY  34 -26.874  21.680  -1.730
  131    HA2  GLY  34           HA2      GLY  34 -24.935  21.090  -0.471
  132    HA3  GLY  34           HA3      GLY  34 -25.945  20.080   0.552
  133    HA1  GLY  34           HA1      GLY  34 -25.293  20.964  -1.268
  134    H    ALA  35           H        ALA  35 -25.756  17.970   0.250
  135    HA   ALA  35           HA       ALA  35 -25.192  15.960  -0.662
  136    HB1  ALA  35           HB1      ALA  35 -25.798  15.698  -3.113
  137    HB2  ALA  35           HB2      ALA  35 -27.098  16.180  -2.024
  138    HB3  ALA  35           HB3      ALA  35 -26.322  17.381  -3.056
  139    H    ARG  36           H        ARG  36 -23.094  17.895  -0.410
  140    HA   ARG  36           HA       ARG  36 -21.409  17.290  -2.742
  141    HB2  ARG  36           HB1      ARG  36 -19.913  19.097  -1.766
  142    HB3  ARG  36           HB2      ARG  36 -21.474  19.630  -2.407
  143    HG2  ARG  36           HG1      ARG  36 -22.326  20.143  -0.343
  144    HG3  ARG  36           HG2      ARG  36 -21.277  18.981   0.489
  145    HD2  ARG  36           HD1      ARG  36 -19.853  21.166  -0.888
  146    HD3  ARG  36           HD2      ARG  36 -20.882  21.668   0.461
  147    HE   ARG  36           HE       ARG  36 -18.429  20.180   0.618
  148   HH11  ARG  36          HH11      ARG  36 -21.441  20.908   2.206
  149   HH12  ARG  36          HH12      ARG  36 -20.848  20.529   3.789
  150   HH21  ARG  36          HH21      ARG  36 -17.638  19.678   2.698
  151   HH22  ARG  36          HH22      ARG  36 -18.684  19.830   4.068
  152    H    LYS  37           H        LYS  37 -19.306  16.484  -2.453
  153    HA   LYS  37           HA       LYS  37 -18.355  15.766   0.167
  154    HB2  LYS  37           HB1      LYS  37 -20.098  13.985  -0.757
  155    HB3  LYS  37           HB2      LYS  37 -18.674  13.421  -1.648
  156    HG2  LYS  37           HG1      LYS  37 -18.006  12.297   0.135
  157    HG3  LYS  37           HG2      LYS  37 -17.867  13.823   1.026
  158    HD2  LYS  37           HD1      LYS  37 -20.488  13.537   1.262
  159    HD3  LYS  37           HD2      LYS  37 -20.082  11.831   1.009
  160    HE2  LYS  37           HE1      LYS  37 -19.036  11.628   3.015
  161    HE3  LYS  37           HE2      LYS  37 -18.404  13.280   2.958
  162    HZ1  LYS  37           HZ1      LYS  37 -20.224  12.681   4.664
  163    HZ2  LYS  37           HZ2      LYS  37 -21.287  12.832   3.357
  164    HZ3  LYS  37           HZ3      LYS  37 -20.336  14.149   3.829
  165    H    GLY  38           H        GLY  38 -16.408  16.702  -0.198
  166    HA2  GLY  38           HA2      GLY  38 -14.940  15.953  -2.633
  167    HA3  GLY  38           HA3      GLY  38 -14.575  17.329  -1.602
  168    HA1  GLY  38           HA1      GLY  38 -15.184  15.341  -2.048
  169    H    SER  39           H        SER  39 -14.632  13.776  -1.596
  170    HA   SER  39           HA       SER  39 -11.997  13.645  -0.497
  171    HB2  SER  39           HB1      SER  39 -14.173  13.781   1.348
  172    HB3  SER  39           HB2      SER  39 -13.513  12.137   1.394
  173    HG   SER  39           HG       SER  39 -11.391  13.254   1.551
  174    H    GLN  40           H        GLN  40 -11.092  11.916  -1.381
  175    HA   GLN  40           HA       GLN  40 -12.831   9.710  -2.249
  176    HB2  GLN  40           HB1      GLN  40 -10.457  11.029  -3.399
  177    HB3  GLN  40           HB2      GLN  40 -10.463   9.262  -3.517
  178    HG2  GLN  40           HG1      GLN  40 -11.481   9.843  -5.488
  179    HG3  GLN  40           HG2      GLN  40 -12.874   9.593  -4.426
  180   HE21  GLN  40          HE21      GLN  40 -14.091  10.930  -5.831
  181   HE22  GLN  40          HE22      GLN  40 -13.953  12.651  -5.758
  182    H    CYS  41           H        CYS  41  -9.519  10.253  -1.042
  183    HA   CYS  41           HA       CYS  41  -9.814   7.913   0.684
  184    HB2  CYS  41           HB1      CYS  41  -7.494   7.161   0.006
  185    HB3  CYS  41           HB2      CYS  41  -8.762   6.906  -1.193
  186    H    LEU  42           H        LEU  42  -8.428   7.900   2.489
  187    HA   LEU  42           HA       LEU  42  -7.325  10.541   3.126
  188    HB2  LEU  42           HB1      LEU  42  -8.661   8.418   4.641
  189    HB3  LEU  42           HB2      LEU  42  -7.226   9.080   5.444
  190    HG   LEU  42           HG       LEU  42  -8.974  11.172   4.442
  191   HD11  LEU  42          HD11      LEU  42 -10.515  10.533   6.561
  192   HD12  LEU  42          HD12      LEU  42 -10.164   8.926   5.924
  193   HD13  LEU  42          HD13      LEU  42 -10.922  10.139   4.891
  194   HD21  LEU  42          HD21      LEU  42  -7.047  11.057   6.249
  195   HD22  LEU  42          HD22      LEU  42  -8.403  10.705   7.321
  196   HD23  LEU  42          HD23      LEU  42  -8.381  12.203   6.389
  197    H    SER  43           H        SER  43  -6.463   7.193   2.732
  198    HA   SER  43           HA       SER  43  -3.655   7.897   2.768
  199    HB2  SER  43           HB1      SER  43  -4.900   6.709   5.065
  200    HB3  SER  43           HB2      SER  43  -3.788   5.535   4.340
  201    HG   SER  43           HG       SER  43  -3.182   8.173   5.184
  202    H    ASP  44           H        ASP  44  -2.348   5.720   2.435
  203    HA   ASP  44           HA       ASP  44  -3.146   4.688  -0.058
  204    HB2  ASP  44           HB1      ASP  44  -1.220   3.269   0.063
  205    HB3  ASP  44           HB2      ASP  44  -0.789   4.815   0.804
  206    HD2  ASP  44           HD       ASP  44  -0.308   1.653   2.933
  207    H    THR  45           H        THR  45  -3.685   3.602   3.208
  208    HA   THR  45           HA       THR  45  -4.340   0.928   2.755
  209    HB   THR  45           HB       THR  45  -5.745   1.113   4.821
  210    HG1  THR  45           HG1      THR  45  -6.288   3.031   5.538
  211   HG21  THR  45          HG21      THR  45  -3.174   0.838   4.718
  212   HG22  THR  45          HG22      THR  45  -3.918   1.261   6.260
  213   HG23  THR  45          HG23      THR  45  -3.131   2.505   5.290
  214    H    ASP  46           H        ASP  46  -6.094   3.830   2.056
  215    HA   ASP  46           HA       ASP  46  -8.668   2.590   1.814
  216    HB2  ASP  46           HB1      ASP  46  -8.190   5.059   2.277
  217    HB3  ASP  46           HB2      ASP  46  -7.832   5.198   0.550
  218    HD2  ASP  46           HD       ASP  46 -11.153   5.286  -0.270
  219    H    CYS  47           H        CYS  47  -5.936   3.098  -0.267
  220    HA   CYS  47           HA       CYS  47  -7.257   2.772  -2.752
  221    HB2  CYS  47           HB1      CYS  47  -4.638   3.295  -1.869
  222    HB3  CYS  47           HB2      CYS  47  -4.535   1.802  -2.803
  223    H    ASN  48           H        ASN  48  -6.193   0.831  -4.184
  224    HA   ASN  48           HA       ASN  48  -7.421  -1.544  -3.093
  225    HB2  ASN  48           HB1      ASN  48  -6.160  -0.881  -5.757
  226    HB3  ASN  48           HB2      ASN  48  -6.725  -2.510  -5.358
  227   HD21  ASN  48          HD21      ASN  48  -8.286  -2.490  -6.959
  228   HD22  ASN  48          HD22      ASN  48  -9.730  -1.549  -6.831
  229    H    THR  49           H        THR  49  -4.312  -1.171  -4.789
  230    HA   THR  49           HA       THR  49  -2.721  -2.159  -2.676
  231    HB   THR  49           HB       THR  49  -3.793  -4.287  -3.065
  232    HG1  THR  49           HG1      THR  49  -1.837  -5.021  -2.750
  233   HG21  THR  49          HG21      THR  49  -3.559  -3.489  -5.852
  234   HG22  THR  49          HG22      THR  49  -4.637  -4.666  -5.102
  235   HG23  THR  49          HG23      THR  49  -3.007  -5.140  -5.576
  236    H    ARG  50           H        ARG  50  -0.484  -2.435  -3.283
  237    HA   ARG  50           HA       ARG  50   1.398  -1.725  -4.346
  238    HB2  ARG  50           HB1      ARG  50  -0.287  -2.486  -6.741
  239    HB3  ARG  50           HB2      ARG  50   1.432  -2.073  -6.835
  240    HG2  ARG  50           HG1      ARG  50   2.116  -4.035  -5.922
  241    HG3  ARG  50           HG2      ARG  50   0.671  -4.182  -4.907
  242    HD2  ARG  50           HD1      ARG  50   0.393  -5.893  -6.468
  243    HD3  ARG  50           HD2      ARG  50  -0.590  -4.573  -7.117
  244    HE   ARG  50           HE       ARG  50   1.804  -4.202  -8.324
  245   HH11  ARG  50          HH11      ARG  50  -0.320  -6.942  -7.998
  246   HH12  ARG  50          HH12      ARG  50   0.144  -7.647  -9.510
  247   HH21  ARG  50          HH21      ARG  50   2.423  -5.122 -10.318
  248   HH22  ARG  50          HH22      ARG  50   1.706  -6.611 -10.829
  249    H    LYS  51           H        LYS  51  -0.765   0.218  -3.769
  250    HA   LYS  51           HA       LYS  51   0.335   2.417  -5.297
  251    HB2  LYS  51           HB1      LYS  51  -2.492   1.468  -5.581
  252    HB3  LYS  51           HB2      LYS  51  -2.148   3.204  -5.673
  253    HG2  LYS  51           HG1      LYS  51  -1.793   2.874  -7.846
  254    HG3  LYS  51           HG2      LYS  51  -0.265   2.122  -7.354
  255    HD2  LYS  51           HD1      LYS  51  -1.145  -0.053  -7.488
  256    HD3  LYS  51           HD2      LYS  51  -2.815   0.540  -7.494
  257    HE2  LYS  51           HE1      LYS  51  -1.944   1.769  -9.709
  258    HE3  LYS  51           HE2      LYS  51  -0.846   0.382  -9.706
  259    HZ1  LYS  51           HZ1      LYS  51  -2.949  -1.000  -9.390
  260    HZ2  LYS  51           HZ2      LYS  51  -2.674  -0.337 -10.921
  261    HZ3  LYS  51           HZ3      LYS  51  -3.794   0.383  -9.877
  262    H    PHE  52           H        PHE  52  -0.628   4.543  -4.517
  263    HA   PHE  52           HA       PHE  52  -1.446   4.361  -1.698
  264    HB2  PHE  52           HB1      PHE  52   0.099   6.042  -1.025
  265    HB3  PHE  52           HB2      PHE  52   1.018   4.860  -1.959
  266    HD1  PHE  52           HD1      PHE  52   0.204   8.293  -1.610
  267    HD2  PHE  52           HD2      PHE  52   1.409   5.360  -4.450
  268    HE1  PHE  52           HE1      PHE  52   1.019  10.074  -3.100
  269    HE2  PHE  52           HE2      PHE  52   2.226   7.136  -5.943
  270    HZ   PHE  52           HZ       PHE  52   2.032   9.496  -5.269
  271    H    CYS  53           H        CYS  53  -1.951   6.784  -0.955
  272    HA   CYS  53           HA       CYS  53  -3.837   7.830  -2.957
  273    HB2  CYS  53           HB1      CYS  53  -4.938   7.008  -0.958
  274    HB3  CYS  53           HB2      CYS  53  -3.891   7.995   0.062
  275    H    LEU  54           H        LEU  54  -2.740   9.393  -4.022
  276    HA   LEU  54           HA       LEU  54  -0.940  11.192  -2.702
  277    HB2  LEU  54           HB1      LEU  54  -0.528  10.560  -4.995
  278    HB3  LEU  54           HB2      LEU  54  -2.115  11.187  -5.476
  279    HG   LEU  54           HG       LEU  54  -1.173  13.465  -4.619
  280   HD11  LEU  54          HD11      LEU  54   0.983  13.607  -4.105
  281   HD12  LEU  54          HD12      LEU  54   1.456  12.729  -5.558
  282   HD13  LEU  54          HD13      LEU  54   1.022  11.843  -4.097
  283   HD21  LEU  54          HD21      LEU  54   0.144  12.604  -7.134
  284   HD22  LEU  54          HD22      LEU  54  -0.835  14.032  -6.797
  285   HD23  LEU  54          HD23      LEU  54  -1.612  12.467  -7.040
  286    H    GLN  55           H        GLN  55  -1.260  13.280  -2.083
  287    HA   GLN  55           HA       GLN  55  -3.953  14.406  -2.452
  288    HB2  GLN  55           HB1      GLN  55  -3.638  15.414  -0.123
  289    HB3  GLN  55           HB2      GLN  55  -4.013  13.687  -0.215
  290    HG2  GLN  55           HG1      GLN  55  -1.637  13.149   0.083
  291    HG3  GLN  55           HG2      GLN  55  -1.282  14.877   0.212
  292   HE21  GLN  55          HE21      GLN  55  -2.936  12.186   1.727
  293   HE22  GLN  55          HE22      GLN  55  -2.987  12.864   3.315
  294    HA   PRO  56           HA       PRO  56  -0.903  17.466  -3.978
  295    HB2  PRO  56           HB1      PRO  56  -2.560  18.463  -5.918
  296    HB3  PRO  56           HB2      PRO  56  -1.568  17.021  -6.131
  297    HG2  PRO  56           HG1      PRO  56  -4.464  17.246  -5.383
  298    HG3  PRO  56           HG2      PRO  56  -3.677  16.152  -6.581
  299    HD2  PRO  56           HD1      PRO  56  -4.416  15.324  -4.103
  300    HD3  PRO  56           HD2      PRO  56  -2.987  14.689  -4.938
  301    H    ARG  57           H        ARG  57  -0.848  19.711  -3.733
  302    HA   ARG  57           HA       ARG  57  -2.757  20.767  -1.841
  303    HB2  ARG  57           HB1      ARG  57  -1.288  22.754  -1.817
  304    HB3  ARG  57           HB2      ARG  57  -0.405  21.251  -1.510
  305    HG2  ARG  57           HG1      ARG  57   0.424  21.219  -3.790
  306    HG3  ARG  57           HG2      ARG  57  -0.511  22.678  -4.159
  307    HD2  ARG  57           HD1      ARG  57   1.264  22.911  -1.817
  308    HD3  ARG  57           HD2      ARG  57   2.088  22.666  -3.363
  309    HE   ARG  57           HE       ARG  57   0.684  25.019  -2.509
  310   HH11  ARG  57          HH11      ARG  57   1.736  23.171  -5.267
  311   HH12  ARG  57          HH12      ARG  57   1.736  24.531  -6.341
  312   HH21  ARG  57          HH21      ARG  57   0.681  26.816  -3.913
  313   HH22  ARG  57          HH22      ARG  57   1.136  26.603  -5.570
  314    H    ASP  58           H        ASP  58  -2.105  21.012  -5.238
  315    HA   ASP  58           HA       ASP  58  -3.814  23.348  -5.557
  316    HB2  ASP  58           HB1      ASP  58  -1.604  22.508  -6.919
  317    HB3  ASP  58           HB2      ASP  58  -2.900  21.922  -7.969
  318    HD2  ASP  58           HD       ASP  58  -3.657  25.089  -9.057
  319    H    GLU  59           H        GLU  59  -3.984  19.912  -5.773
  320    HA   GLU  59           HA       GLU  59  -6.697  20.131  -6.903
  321    HB2  GLU  59           HB1      GLU  59  -4.452  18.540  -7.752
  322    HB3  GLU  59           HB2      GLU  59  -5.784  17.485  -7.250
  323    HG2  GLU  59           HG1      GLU  59  -7.257  18.377  -8.847
  324    HG3  GLU  59           HG2      GLU  59  -6.203  19.767  -9.149
  325    HE2  GLU  59           HE       GLU  59  -4.398  18.060 -11.519
  326    H    LYS  60           H        LYS  60  -7.842  17.846  -6.395
  327    HA   LYS  60           HA       LYS  60  -7.972  17.761  -3.493
  328    HB2  LYS  60           HB1      LYS  60  -9.735  16.998  -5.746
  329    HB3  LYS  60           HB2      LYS  60  -9.846  15.980  -4.300
  330    HG2  LYS  60           HG1      LYS  60 -10.502  17.796  -2.936
  331    HG3  LYS  60           HG2      LYS  60 -10.068  18.973  -4.189
  332    HD2  LYS  60           HD1      LYS  60 -12.019  16.982  -5.092
  333    HD3  LYS  60           HD2      LYS  60 -12.587  17.979  -3.741
  334    HE2  LYS  60           HE1      LYS  60 -12.776  19.819  -5.016
  335    HE3  LYS  60           HE2      LYS  60 -11.219  19.521  -5.804
  336    HZ1  LYS  60           HZ1      LYS  60 -13.873  18.450  -6.540
  337    HZ2  LYS  60           HZ2      LYS  60 -12.447  17.729  -7.092
  338    HZ3  LYS  60           HZ3      LYS  60 -12.793  19.335  -7.494
  339    HA   PRO  61           HA       PRO  61  -5.875  13.958  -2.866
  340    HB2  PRO  61           HB1      PRO  61  -7.407  12.744  -0.949
  341    HB3  PRO  61           HB2      PRO  61  -6.390  14.149  -0.635
  342    HG2  PRO  61           HG1      PRO  61  -9.332  14.021  -1.207
  343    HG3  PRO  61           HG2      PRO  61  -8.456  14.965   0.054
  344    HD2  PRO  61           HD1      PRO  61  -9.349  16.080  -2.255
  345    HD3  PRO  61           HD2      PRO  61  -7.862  16.608  -1.449
  346    H    PHE  62           H        PHE  62  -5.750  12.121  -3.990
  347    HA   PHE  62           HA       PHE  62  -8.094  10.469  -4.417
  348    HB2  PHE  62           HB1      PHE  62  -7.656  10.362  -6.904
  349    HB3  PHE  62           HB2      PHE  62  -8.343  11.880  -6.322
  350    HD1  PHE  62           HD1      PHE  62  -5.019  10.343  -7.020
  351    HD2  PHE  62           HD2      PHE  62  -7.405  13.869  -6.992
  352    HE1  PHE  62           HE1      PHE  62  -3.172  11.598  -8.053
  353    HE2  PHE  62           HE2      PHE  62  -5.561  15.129  -8.025
  354    HZ   PHE  62           HZ       PHE  62  -3.442  13.994  -8.558
  355    H    CYS  63           H        CYS  63  -7.397   8.511  -5.867
  356    HA   CYS  63           HA       CYS  63  -4.933   7.486  -4.677
  357    HB2  CYS  63           HB1      CYS  63  -7.481   6.352  -5.523
  358    HB3  CYS  63           HB2      CYS  63  -6.112   5.434  -6.152
  359    H    ALA  64           H        ALA  64  -3.117   7.659  -5.797
  360    HA   ALA  64           HA       ALA  64  -3.253   7.538  -8.739
  361    HB1  ALA  64           HB1      ALA  64  -0.970   8.707  -8.559
  362    HB2  ALA  64           HB2      ALA  64  -2.422   9.655  -8.232
  363    HB3  ALA  64           HB3      ALA  64  -1.442   9.055  -6.895
  364    H    THR  65           H        THR  65  -1.014   6.840  -9.663
  365    HA   THR  65           HA       THR  65  -0.557   4.166  -8.729
  366    HB   THR  65           HB       THR  65   1.424   5.064 -10.636
  367    HG1  THR  65           HG1      THR  65  -0.245   5.447 -12.309
  368   HG21  THR  65          HG21      THR  65  -0.906   3.226 -11.131
  369   HG22  THR  65          HG22      THR  65   0.489   2.732 -10.172
  370   HG23  THR  65          HG23      THR  65   0.697   3.188 -11.863
  371    H    CYS  66           H        CYS  66   1.261   3.310  -7.777
  372    HA   CYS  66           HA       CYS  66   2.711   4.933  -6.009
  373    HB2  CYS  66           HB1      CYS  66   2.459   2.150  -6.584
  374    HB3  CYS  66           HB2      CYS  66   4.179   2.539  -6.524
  375    H    ARG  67           H        ARG  67   5.142   5.022  -5.931
  376    HA   ARG  67           HA       ARG  67   6.123   5.882  -8.555
  377    HB2  ARG  67           HB1      ARG  67   7.331   6.401  -5.831
  378    HB3  ARG  67           HB2      ARG  67   7.772   7.178  -7.358
  379    HG2  ARG  67           HG1      ARG  67   5.167   7.817  -7.296
  380    HG3  ARG  67           HG2      ARG  67   5.493   7.698  -5.559
  381    HD2  ARG  67           HD1      ARG  67   7.172   9.367  -5.643
  382    HD3  ARG  67           HD2      ARG  67   7.247   9.290  -7.409
  383    HE   ARG  67           HE       ARG  67   5.383  10.791  -5.823
  384   HH11  ARG  67          HH11      ARG  67   5.929   9.259  -8.901
  385   HH12  ARG  67          HH12      ARG  67   4.798  10.261  -9.748
  386   HH21  ARG  67          HH21      ARG  67   3.890  12.116  -6.926
  387   HH22  ARG  67          HH22      ARG  67   3.639  11.886  -8.623
  388    H    GLY  68           H        GLY  68   8.007   5.108  -9.453
  389    HA2  GLY  68           HA2      GLY  68   8.869   2.509  -8.465
  390    HA3  GLY  68           HA3      GLY  68   9.296   3.235 -10.008
  391    HA1  GLY  68           HA1      GLY  68   8.931   3.196  -7.914
  392    H    LEU  69           H        LEU  69  11.363   2.134  -9.011
  393    HA   LEU  69           HA       LEU  69  12.782   3.525  -6.998
  394    HB2  LEU  69           HB1      LEU  69  13.622   1.628  -9.181
  395    HB3  LEU  69           HB2      LEU  69  14.783   2.342  -8.047
  396    HG   LEU  69           HG       LEU  69  12.470   0.548  -7.311
  397   HD11  LEU  69          HD11      LEU  69  15.432   0.010  -7.205
  398   HD12  LEU  69          HD12      LEU  69  14.360  -0.560  -8.483
  399   HD13  LEU  69          HD13      LEU  69  14.126  -1.113  -6.825
  400   HD21  LEU  69          HD21      LEU  69  14.094   2.372  -5.760
  401   HD22  LEU  69          HD22      LEU  69  14.262   0.709  -5.198
  402   HD23  LEU  69          HD23      LEU  69  12.665   1.452  -5.288
  403    H    ARG  70           H        ARG  70  12.384   4.033 -10.408
  404    HA   ARG  70           HA       ARG  70  14.565   5.973 -10.495
  405    HB2  ARG  70           HB1      ARG  70  12.682   5.066 -12.688
  406    HB3  ARG  70           HB2      ARG  70  14.118   6.080 -12.895
  407    HG2  ARG  70           HG1      ARG  70  15.265   3.972 -11.706
  408    HG3  ARG  70           HG2      ARG  70  13.902   3.164 -12.498
  409    HD2  ARG  70           HD1      ARG  70  14.891   4.896 -14.444
  410    HD3  ARG  70           HD2      ARG  70  16.331   4.249 -13.646
  411    HE   ARG  70           HE       ARG  70  14.563   2.838 -15.380
  412   HH11  ARG  70          HH11      ARG  70  16.672   2.476 -12.633
  413   HH12  ARG  70          HH12      ARG  70  16.990   0.800 -12.935
  414   HH21  ARG  70          HH21      ARG  70  14.974   0.631 -15.787
  415   HH22  ARG  70          HH22      ARG  70  16.025  -0.248 -14.729
  416    H    ARG  71           H        ARG  71  11.727   6.162  -9.188
  417    HA   ARG  71           HA       ARG  71  10.898   8.679 -10.457
  418    HB2  ARG  71           HB1      ARG  71   9.486   6.560  -8.914
  419    HB3  ARG  71           HB2      ARG  71   8.910   8.222  -8.730
  420    HG2  ARG  71           HG1      ARG  71   9.246   6.855 -11.398
  421    HG3  ARG  71           HG2      ARG  71   7.731   6.893 -10.480
  422    HD2  ARG  71           HD1      ARG  71   7.858   9.398 -10.499
  423    HD3  ARG  71           HD2      ARG  71   9.250   9.252 -11.580
  424    HE   ARG  71           HE       ARG  71   7.283   7.798 -12.799
  425   HH11  ARG  71          HH11      ARG  71   7.598  11.075 -11.666
  426   HH12  ARG  71          HH12      ARG  71   6.527  11.728 -12.860
  427   HH21  ARG  71          HH21      ARG  71   5.871   8.648 -14.376
  428   HH22  ARG  71          HH22      ARG  71   5.544  10.347 -14.400
  429    H    ARG  72           H        ARG  72  10.440  10.520  -9.163
  430    HA   ARG  72           HA       ARG  72  12.213  10.741  -6.872
  431    HB2  ARG  72           HB1      ARG  72  10.489  12.886  -8.127
  432    HB3  ARG  72           HB2      ARG  72  11.867  13.117  -7.040
  433    HG2  ARG  72           HG1      ARG  72  12.799  11.600  -9.239
  434    HG3  ARG  72           HG2      ARG  72  11.843  12.946  -9.880
  435    HD2  ARG  72           HD1      ARG  72  13.270  14.233  -7.966
  436    HD3  ARG  72           HD2      ARG  72  14.412  12.968  -8.438
  437    HE   ARG  72           HE       ARG  72  13.502  14.058 -10.795
  438   HH11  ARG  72          HH11      ARG  72  15.145  15.206  -7.950
  439   HH12  ARG  72          HH12      ARG  72  15.997  16.460  -8.789
  440   HH21  ARG  72          HH21      ARG  72  14.618  15.705 -11.911
  441   HH22  ARG  72          HH22      ARG  72  15.695  16.744 -11.042
  442    H    CYS  73           H        CYS  73  11.587  11.310  -4.798
  443    HA   CYS  73           HA       CYS  73   8.705  11.341  -4.235
  444    HB2  CYS  73           HB1      CYS  73   9.173   9.944  -2.194
  445    HB3  CYS  73           HB2      CYS  73   9.330   9.095  -3.732
  446    H    GLN  74           H        GLN  74   8.340  11.974  -1.853
  447    HA   GLN  74           HA       GLN  74  10.241  14.112  -1.148
  448    HB2  GLN  74           HB1      GLN  74   7.277  14.086  -1.352
  449    HB3  GLN  74           HB2      GLN  74   7.980  15.004  -0.011
  450    HG2  GLN  74           HG1      GLN  74   9.172  15.466  -2.678
  451    HG3  GLN  74           HG2      GLN  74   7.518  16.043  -2.433
  452   HE21  GLN  74          HE21      GLN  74  10.614  16.006  -0.695
  453   HE22  GLN  74          HE22      GLN  74  10.520  17.641  -0.146
  454    H    ARG  75           H        ARG  75   8.142  11.557  -0.002
  455    HA   ARG  75           HA       ARG  75   9.472  11.725   2.617
  456    HB2  ARG  75           HB1      ARG  75   6.554  11.100   2.105
  457    HB3  ARG  75           HB2      ARG  75   7.359  10.994   3.678
  458    HG2  ARG  75           HG1      ARG  75   7.308  13.217   4.020
  459    HG3  ARG  75           HG2      ARG  75   7.618  13.583   2.315
  460    HD2  ARG  75           HD1      ARG  75   5.142  12.549   2.093
  461    HD3  ARG  75           HD2      ARG  75   5.055  13.200   3.737
  462    HE   ARG  75           HE       ARG  75   5.145  14.698   1.291
  463   HH11  ARG  75          HH11      ARG  75   5.844  14.761   4.702
  464   HH12  ARG  75          HH12      ARG  75   5.737  16.487   4.824
  465   HH21  ARG  75          HH21      ARG  75   5.003  16.970   1.439
  466   HH22  ARG  75          HH22      ARG  75   5.259  17.741   2.968
  467    H    ASP  76           H        ASP  76   9.251   9.631   3.858
  468    HA   ASP  76           HA       ASP  76  10.156   7.488   2.186
  469    HB2  ASP  76           HB1      ASP  76   9.465   7.268   5.118
  470    HB3  ASP  76           HB2      ASP  76  10.638   6.321   4.194
  471    HD2  ASP  76           HD       ASP  76  11.875   9.563   5.911
  472    H    ALA  77           H        ALA  77   7.169   8.339   3.767
  473    HA   ALA  77           HA       ALA  77   5.967   5.743   3.399
  474    HB1  ALA  77           HB1      ALA  77   4.092   7.900   3.872
  475    HB2  ALA  77           HB2      ALA  77   4.448   6.476   4.852
  476    HB3  ALA  77           HB3      ALA  77   5.435   7.928   5.017
  477    H    MET  78           H        MET  78   6.162   8.746   1.652
  478    HA   MET  78           HA       MET  78   3.953   8.601  -0.005
  479    HB2  MET  78           HB1      MET  78   6.663   9.799  -0.203
  480    HB3  MET  78           HB2      MET  78   5.760   9.626  -1.714
  481    HG2  MET  78           HG1      MET  78   4.440  10.878   0.662
  482    HG3  MET  78           HG2      MET  78   5.573  11.811  -0.320
  483    HE1  MET  78           HE1      MET  78   4.256  11.305  -3.813
  484    HE2  MET  78           HE2      MET  78   4.380  12.911  -3.094
  485    HE3  MET  78           HE3      MET  78   5.600  11.688  -2.736
  486    H    CYS  79           H        CYS  79   7.047   6.931  -0.262
  487    HA   CYS  79           HA       CYS  79   6.372   5.728  -2.798
  488    HB2  CYS  79           HB1      CYS  79   8.719   5.855  -1.027
  489    HB3  CYS  79           HB2      CYS  79   8.522   4.309  -1.855
  490    H    CYS  80           H        CYS  80   6.238   3.418  -3.129
  491    HA   CYS  80           HA       CYS  80   4.351   2.158  -1.522
  492    HB2  CYS  80           HB1      CYS  80   6.049   1.426  -3.800
  493    HB3  CYS  80           HB2      CYS  80   5.642   0.061  -2.759
  494    HA   PRO  81           HA       PRO  81   6.478   0.312   1.841
  495    HB2  PRO  81           HB1      PRO  81   5.253  -2.126   2.052
  496    HB3  PRO  81           HB2      PRO  81   4.473  -0.607   2.483
  497    HG2  PRO  81           HG1      PRO  81   4.277  -2.189  -0.057
  498    HG3  PRO  81           HG2      PRO  81   2.965  -1.417   0.910
  499    HD2  PRO  81           HD1      PRO  81   3.963  -0.305  -1.357
  500    HD3  PRO  81           HD2      PRO  81   3.394   0.662   0.013
  501    H    GLY  82           H        GLY  82   8.531  -0.347   1.791
  502    HA2  GLY  82           HA2      GLY  82   9.794  -2.545   1.636
  503    HA3  GLY  82           HA3      GLY  82   9.251  -2.550  -0.036
  504    HA1  GLY  82           HA1      GLY  82   9.840  -1.681   1.812
  505    H    THR  83           H        THR  83   9.616   0.497   0.050
  506    HA   THR  83           HA       THR  83  12.548   0.484  -0.275
  507    HB   THR  83           HB       THR  83  11.999   2.404  -1.974
  508    HG1  THR  83           HG1      THR  83   9.949   1.591  -3.091
  509   HG21  THR  83          HG21      THR  83  12.353  -0.435  -2.214
  510   HG22  THR  83          HG22      THR  83  12.911   0.849  -3.285
  511   HG23  THR  83          HG23      THR  83  11.308   0.149  -3.507
  512    H    LEU  84           H        LEU  84  13.418   2.816  -0.319
  513    HA   LEU  84           HA       LEU  84  12.039   4.416   1.735
  514    HB2  LEU  84           HB1      LEU  84  14.848   3.463   1.576
  515    HB3  LEU  84           HB2      LEU  84  14.578   5.107   2.179
  516    HG   LEU  84           HG       LEU  84  12.800   3.323   3.530
  517   HD11  LEU  84          HD11      LEU  84  14.478   1.954   4.705
  518   HD12  LEU  84          HD12      LEU  84  15.703   2.509   3.564
  519   HD13  LEU  84          HD13      LEU  84  14.341   1.542   2.997
  520   HD21  LEU  84          HD21      LEU  84  14.159   5.597   4.074
  521   HD22  LEU  84          HD22      LEU  84  15.137   4.414   4.944
  522   HD23  LEU  84          HD23      LEU  84  13.416   4.569   5.299
  523    H    CYS  85           H        CYS  85  12.672   6.719   1.742
  524    HA   CYS  85           HA       CYS  85  13.030   7.664  -1.015
  525    HB2  CYS  85           HB1      CYS  85  10.980   8.295   0.369
  526    HB3  CYS  85           HB2      CYS  85  12.067   9.296   1.334
  527    H    VAL  86           H        VAL  86  15.134   7.993  -1.417
  528    HA   VAL  86           HA       VAL  86  16.651   9.628   0.511
  529    HB   VAL  86           HB       VAL  86  17.841   7.553  -1.330
  530   HG11  VAL  86          HG11      VAL  86  19.727   7.895   0.458
  531   HG12  VAL  86          HG12      VAL  86  19.562   9.012  -0.898
  532   HG13  VAL  86          HG13      VAL  86  18.934   9.453   0.690
  533   HG21  VAL  86          HG21      VAL  86  16.424   6.501   0.379
  534   HG22  VAL  86          HG22      VAL  86  18.133   6.152   0.637
  535   HG23  VAL  86          HG23      VAL  86  17.319   7.356   1.635
  536    H    ASN  87           H        ASN  87  17.596  11.426  -0.254
  537    HA   ASN  87           HA       ASN  87  18.083  13.142  -1.667
  538    HB2  ASN  87           HB1      ASN  87  19.696  11.257  -2.399
  539    HB3  ASN  87           HB2      ASN  87  18.632  11.094  -3.803
  540   HD21  ASN  87          HD21      ASN  87  20.406  11.695  -5.119
  541   HD22  ASN  87          HD22      ASN  87  20.862  13.354  -5.283
  542    H    ASP  88           H        ASP  88  15.358  12.360  -1.547
  543    HA   ASP  88           HA       ASP  88  13.369  12.798  -2.560
  544    HB2  ASP  88           HB1      ASP  88  15.045  14.800  -3.371
  545    HB3  ASP  88           HB2      ASP  88  14.509  14.139  -4.921
  546    HD2  ASP  88           HD       ASP  88  11.749  15.823  -2.612
  547    H    VAL  89           H        VAL  89  14.981  10.425  -3.282
  548    HA   VAL  89           HA       VAL  89  13.507   9.729  -5.717
  549    HB   VAL  89           HB       VAL  89  16.438   9.112  -5.320
  550   HG11  VAL  89          HG11      VAL  89  15.463   7.285  -6.456
  551   HG12  VAL  89          HG12      VAL  89  14.469   8.343  -7.460
  552   HG13  VAL  89          HG13      VAL  89  16.217   8.282  -7.700
  553   HG21  VAL  89          HG21      VAL  89  16.581  11.258  -6.048
  554   HG22  VAL  89          HG22      VAL  89  16.375  10.473  -7.613
  555   HG23  VAL  89          HG23      VAL  89  14.993  11.222  -6.814
  556    H    CYS  90           H        CYS  90  12.754   7.659  -5.776
  557    HA   CYS  90           HA       CYS  90  12.682   6.212  -3.317
  558    HB2  CYS  90           HB1      CYS  90  11.012   6.372  -5.436
  559    HB3  CYS  90           HB2      CYS  90  11.834   4.856  -5.813
  560    H    THR  91           H        THR  91  14.261   4.966  -2.589
  561    HA   THR  91           HA       THR  91  15.848   3.421  -4.535
  562    HB   THR  91           HB       THR  91  17.159   5.235  -3.440
  563    HG1  THR  91           HG1      THR  91  18.021   2.666  -2.577
  564   HG21  THR  91          HG21      THR  91  16.643   3.631  -0.932
  565   HG22  THR  91          HG22      THR  91  16.031   5.250  -1.273
  566   HG23  THR  91          HG23      THR  91  17.763   4.987  -1.074
  567    H    THR  92           H        THR  92  16.722   1.390  -3.730
  568    HA   THR  92           HA       THR  92  14.754  -0.140  -2.367
  569    HB   THR  92           HB       THR  92  16.915  -1.779  -2.334
  570    HG1  THR  92           HG1      THR  92  18.092  -1.310  -4.268
  571   HG21  THR  92          HG21      THR  92  16.071  -2.068  -4.921
  572   HG22  THR  92          HG22      THR  92  14.708  -1.230  -4.178
  573   HG23  THR  92          HG23      THR  92  15.272  -2.761  -3.510
  574    H    MET  93           H        MET  93  14.793  -1.078  -0.335
  575    HA   MET  93           HA       MET  93  15.870   0.403   1.766
  576    HB2  MET  93           HB1      MET  93  13.938  -1.075   2.022
  577    HB3  MET  93           HB2      MET  93  14.976  -2.485   1.764
  578    HG2  MET  93           HG1      MET  93  15.666  -2.521   3.884
  579    HG3  MET  93           HG2      MET  93  15.936  -0.777   3.905
  580    HE1  MET  93           HE1      MET  93  13.723  -0.518   6.895
  581    HE2  MET  93           HE2      MET  93  14.840  -1.869   6.700
  582    HE3  MET  93           HE3      MET  93  15.288  -0.263   6.124
  583    H    GLU  94           H        GLU  94  17.016  -2.613   0.288
  584    HA   GLU  94           HA       GLU  94  19.131  -3.168   1.992
  585    HB2  GLU  94           HB1      GLU  94  18.527  -3.763  -0.868
  586    HB3  GLU  94           HB2      GLU  94  20.172  -4.068  -0.287
  587    HG2  GLU  94           HG1      GLU  94  19.560  -5.954   0.693
  588    HG3  GLU  94           HG2      GLU  94  18.263  -5.130   1.571
  589    HE2  GLU  94           HE       GLU  94  17.117  -6.449  -1.990
  590    H    ASP  95           H        ASP  95  18.844  -0.747  -0.484
  591    HA   ASP  95           HA       ASP  95  21.681  -0.152  -0.498
  592    HB2  ASP  95           HB1      ASP  95  19.279   0.803  -1.993
  593    HB3  ASP  95           HB2      ASP  95  20.671   1.888  -1.882
  594    HD2  ASP  95           HD       ASP  95  22.651  -0.530  -3.654
  595    H    ALA  96           H        ALA  96  18.696   1.239   0.764
  596    HA   ALA  96           HA       ALA  96  19.992   3.581   1.810
  597    HB1  ALA  96           HB1      ALA  96  17.249   2.508   1.732
  598    HB2  ALA  96           HB2      ALA  96  17.635   3.533   3.113
  599    HB3  ALA  96           HB3      ALA  96  17.836   4.151   1.474
  600    H    THR  97           H        THR  97  21.522   3.154   3.313
  601    HA   THR  97           HA       THR  97  20.613   2.074   5.856
  602    HB   THR  97           HB       THR  97  23.191   0.991   4.765
  603    HG1  THR  97           HG1      THR  97  22.077  -0.174   3.403
  604   HG21  THR  97          HG21      THR  97  21.850  -0.865   6.375
  605   HG22  THR  97          HG22      THR  97  21.612   0.695   7.161
  606   HG23  THR  97          HG23      THR  97  23.243   0.121   6.818
  607    H    GLU  98           H        GLU  98  21.063   3.745   7.145
  608    HA   GLU  98           HA       GLU  98  23.279   5.504   6.677
  609    HB2  GLU  98           HB1      GLU  98  21.226   5.277   8.876
  610    HB3  GLU  98           HB2      GLU  98  22.544   6.457   8.933
  611    HG2  GLU  98           HG1      GLU  98  21.036   7.800   7.953
  612    HG3  GLU  98           HG2      GLU  98  21.584   6.979   6.485
  613    HE2  GLU  98           HE       GLU  98  18.616   5.037   6.401
  614    H    ASN  99           H        ASN  99  25.223   4.504   6.905
  615    HA   ASN  99           HA       ASN  99  25.790   2.711   9.068
  616    HB2  ASN  99           HB1      ASN  99  27.898   4.048   7.387
  617    HB3  ASN  99           HB2      ASN  99  27.903   2.427   8.093
  618   HD21  ASN  99          HD21      ASN  99  27.298   0.767   6.876
  619   HD22  ASN  99          HD22      ASN  99  26.550   0.886   5.324
  620    H    LEU 100           H        LEU 100  27.468   3.052  10.670
  621    HA   LEU 100           HA       LEU 100  27.482   5.830  11.624
  622    HB2  LEU 100           HB1      LEU 100  27.821   3.182  13.024
  623    HB3  LEU 100           HB2      LEU 100  28.218   4.727  13.796
  624    HG   LEU 100           HG       LEU 100  25.533   4.720  12.685
  625   HD11  LEU 100          HD11      LEU 100  25.876   2.893  15.023
  626   HD12  LEU 100          HD12      LEU 100  25.994   2.262  13.380
  627   HD13  LEU 100          HD13      LEU 100  24.513   3.056  13.914
  628   HD21  LEU 100          HD21      LEU 100  26.515   6.345  14.305
  629   HD22  LEU 100          HD22      LEU 100  26.504   5.064  15.517
  630   HD23  LEU 100          HD23      LEU 100  24.986   5.638  14.824
  631    H    TYR 101           H        TYR 101  29.430   6.673  12.595
  632    HA   TYR 101           HA       TYR 101  31.829   5.664  11.240
  633    HB2  TYR 101           HB1      TYR 101  30.942   8.105  11.040
  634    HB3  TYR 101           HB2      TYR 101  31.659   8.316  12.639
  635    HD1  TYR 101           HD1      TYR 101  32.766   6.616   9.493
  636    HD2  TYR 101           HD2      TYR 101  33.682   9.407  12.571
  637    HE1  TYR 101           HE1      TYR 101  34.972   7.003   8.476
  638    HE2  TYR 101           HE2      TYR 101  35.891   9.803  11.562
  639    HH   TYR 101           HH       TYR 101  37.398   7.940   9.648
  640    H    PHE 102           H        PHE 102  33.872   5.704  12.402
  641    HA   PHE 102           HA       PHE 102  33.514   5.173  15.277
  642    HB2  PHE 102           HB1      PHE 102  35.180   3.819  13.181
  643    HB3  PHE 102           HB2      PHE 102  35.721   3.803  14.861
  644    HD1  PHE 102           HD1      PHE 102  32.495   3.270  13.053
  645    HD2  PHE 102           HD2      PHE 102  35.205   1.917  16.043
  646    HE1  PHE 102           HE1      PHE 102  31.009   1.368  13.534
  647    HE2  PHE 102           HE2      PHE 102  33.724   0.014  16.528
  648    HZ   PHE 102           HZ       PHE 102  31.623  -0.263  15.272
  649    H    GLN 103           H        GLN 103  34.329   6.754  16.471
  650    HA   GLN 103           HA       GLN 103  36.905   7.929  15.675
  651    HB2  GLN 103           HB1      GLN 103  34.492   9.278  15.611
  652    HB3  GLN 103           HB2      GLN 103  35.182   9.750  17.171
  653    HG2  GLN 103           HG1      GLN 103  37.300  10.347  15.944
  654    HG3  GLN 103           HG2      GLN 103  36.388  10.118  14.445
  655   HE21  GLN 103          HE21      GLN 103  36.739  12.064  17.312
  656   HE22  GLN 103          HE22      GLN 103  35.826  13.417  16.749
  657    H    SER 104           H        SER 104  38.041   8.997  17.506
  658    HA   SER 104           HA       SER 104  37.357   7.821  20.110
  659    HB2  SER 104           HB1      SER 104  40.181   7.903  19.971
  660    HB3  SER 104           HB2      SER 104  39.142   6.468  20.030
  661    HG   SER 104           HG       SER 104  39.210   6.298  17.860
  662    H    LEU 105           H        LEU 105  37.564   9.172  21.798
  663    HA   LEU 105           HA       LEU 105  39.317  11.462  21.702
  664    HB2  LEU 105           HB1      LEU 105  36.851  11.858  20.646
  665    HB3  LEU 105           HB2      LEU 105  36.552  12.241  22.350
  666    HG   LEU 105           HG       LEU 105  38.616  13.806  22.093
  667   HD11  LEU 105          HD11      LEU 105  38.831  14.731  19.830
  668   HD12  LEU 105          HD12      LEU 105  37.749  13.478  19.224
  669   HD13  LEU 105          HD13      LEU 105  39.315  13.037  19.905
  670   HD21  LEU 105          HD21      LEU 105  36.776  15.334  20.712
  671   HD22  LEU 105          HD22      LEU 105  36.885  15.158  22.463
  672   HD23  LEU 105          HD23      LEU 105  35.786  14.132  21.539
  673    H    GLU 106           H        GLU 106  40.160  11.699  23.660
  674    HA   GLU 106           HA       GLU 106  38.512  11.064  26.006
  675    HB2  GLU 106           HB1      GLU 106  40.128   9.191  25.339
  676    HB3  GLU 106           HB2      GLU 106  41.418  10.294  25.844
  677    HG2  GLU 106           HG1      GLU 106  40.764  10.254  28.083
  678    HG3  GLU 106           HG2      GLU 106  39.161   9.619  27.688
  679    HE2  GLU 106           HE       GLU 106  41.939   7.075  28.537
  680    H    HIS 107           H        HIS 107  41.638  12.428  24.976
  681    HA   HIS 107           HA       HIS 107  42.803  14.258  25.662
  682    HB2  HIS 107           HB1      HIS 107  40.016  15.020  25.590
  683    HB3  HIS 107           HB2      HIS 107  40.862  15.909  26.860
  684    HD1  HIS 107           HD1      HIS 107  43.575  16.378  25.525
  685    HD2  HIS 107           HD2      HIS 107  39.929  16.889  23.600
  686    HE1  HIS 107           HE1      HIS 107  44.031  17.969  23.631
  687    HE2  HIS 107           HE2      HIS 107  41.801  18.282  22.455
  688    H    HIS 108           H        HIS 108  43.021  15.839  27.686
  689    HA   HIS 108           HA       HIS 108  42.324  14.638  30.206
  690    HB2  HIS 108           HB1      HIS 108  45.034  14.314  29.015
  691    HB3  HIS 108           HB2      HIS 108  44.947  14.682  30.741
  692    HD1  HIS 108           HD1      HIS 108  42.869  12.999  31.885
  693    HD2  HIS 108           HD2      HIS 108  45.221  11.630  28.744
  694    HE1  HIS 108           HE1      HIS 108  42.728  10.490  31.982
  695    HE2  HIS 108           HE2      HIS 108  44.164   9.653  30.063
  696    H    HIS 109           H        HIS 109  43.709  15.852  32.005
  697    HA   HIS 109           HA       HIS 109  44.169  18.635  31.255
  698    HB2  HIS 109           HB1      HIS 109  41.822  17.684  32.653
  699    HB3  HIS 109           HB2      HIS 109  42.746  18.792  33.673
  700    HD1  HIS 109           HD1      HIS 109  43.543  21.061  32.121
  701    HD2  HIS 109           HD2      HIS 109  40.008  19.076  31.212
  702    HE1  HIS 109           HE1      HIS 109  42.161  22.711  30.821
  703    HE2  HIS 109           HE2      HIS 109  40.000  21.501  30.265
  704    H    HIS 110           H        HIS 110  45.655  19.679  32.519
  705    HA   HIS 110           HA       HIS 110  46.821  18.112  34.728
  706    HB2  HIS 110           HB1      HIS 110  48.328  20.034  32.946
  707    HB3  HIS 110           HB2      HIS 110  49.004  18.910  34.128
  708    HD1  HIS 110           HD1      HIS 110  48.608  16.276  33.520
  709    HD2  HIS 110           HD2      HIS 110  48.229  19.014  30.419
  710    HE1  HIS 110           HE1      HIS 110  48.807  14.929  31.406
  711    HE2  HIS 110           HE2      HIS 110  48.574  16.603  29.509
  712    H    HIS 111           H        HIS 111  44.777  19.807  35.311
  713    HA   HIS 111           HA       HIS 111  46.090  22.199  36.416
  714    HB2  HIS 111           HB1      HIS 111  43.306  21.649  35.464
  715    HB3  HIS 111           HB2      HIS 111  43.550  22.858  36.730
  716    HD1  HIS 111           HD1      HIS 111  42.850  23.060  33.450
  717    HD2  HIS 111           HD2      HIS 111  46.153  24.413  35.576
  718    HE1  HIS 111           HE1      HIS 111  43.844  24.897  32.051
  719    HE2  HIS 111           HE2      HIS 111  45.863  25.725  33.348
  720    H    HIS 112           H        HIS 112  43.244  20.230  37.277
  721    HA   HIS 112           HA       HIS 112  43.813  20.600  40.090
  722    HB2  HIS 112           HB1      HIS 112  41.487  20.531  38.876
  723    HB3  HIS 112           HB2      HIS 112  41.664  18.783  39.058
  724    HD1  HIS 112           HD1      HIS 112  39.513  20.595  40.549
  725    HD2  HIS 112           HD2      HIS 112  43.033  19.102  42.174
  726    HE1  HIS 112           HE1      HIS 112  39.134  20.537  43.035
  727    HE2  HIS 112           HE2      HIS 112  41.285  19.625  44.029
  Start of MODEL   60
    1    H1   MET  18           H        MET  18 -41.990 -27.615  38.105
    2    HA   MET  18           HA       MET  18 -41.996 -29.282  36.550
    3    HB2  MET  18           HB1      MET  18 -44.157 -30.476  36.075
    4    HB3  MET  18           HB2      MET  18 -43.675 -30.454  37.779
    5    HG2  MET  18           HG1      MET  18 -45.231 -28.571  38.173
    6    HG3  MET  18           HG2      MET  18 -45.749 -28.697  36.490
    7    HE1  MET  18           HE1      MET  18 -48.486 -31.153  36.527
    8    HE2  MET  18           HE2      MET  18 -48.160 -29.425  36.386
    9    HE3  MET  18           HE3      MET  18 -47.176 -30.584  35.492
   10    H    LEU  19           H        LEU  19 -44.452 -26.788  36.249
   11    HA   LEU  19           HA       LEU  19 -43.928 -26.717  33.352
   12    HB2  LEU  19           HB1      LEU  19 -46.456 -26.840  34.836
   13    HB3  LEU  19           HB2      LEU  19 -46.389 -25.551  33.622
   14    HG   LEU  19           HG       LEU  19 -45.782 -28.428  32.979
   15   HD11  LEU  19          HD11      LEU  19 -48.380 -27.186  32.254
   16   HD12  LEU  19          HD12      LEU  19 -48.171 -27.782  33.900
   17   HD13  LEU  19          HD13      LEU  19 -47.971 -28.878  32.534
   18   HD21  LEU  19          HD21      LEU  19 -45.244 -27.617  30.988
   19   HD22  LEU  19          HD22      LEU  19 -45.574 -25.978  31.551
   20   HD23  LEU  19          HD23      LEU  19 -46.864 -26.939  30.827
   21    H    VAL  20           H        VAL  20 -42.734 -24.976  32.955
   22    HA   VAL  20           HA       VAL  20 -43.107 -22.562  34.569
   23    HB   VAL  20           HB       VAL  20 -40.958 -23.198  32.542
   24   HG11  VAL  20          HG11      VAL  20 -41.716 -20.763  33.905
   25   HG12  VAL  20          HG12      VAL  20 -40.059 -21.234  34.290
   26   HG13  VAL  20          HG13      VAL  20 -40.546 -21.011  32.609
   27   HG21  VAL  20          HG21      VAL  20 -39.604 -23.193  34.792
   28   HG22  VAL  20          HG22      VAL  20 -41.169 -23.615  35.486
   29   HG23  VAL  20          HG23      VAL  20 -40.446 -24.644  34.250
   30    H    LEU  21           H        LEU  21 -44.133 -20.825  33.819
   31    HA   LEU  21           HA       LEU  21 -45.238 -20.855  31.157
   32    HB2  LEU  21           HB1      LEU  21 -45.585 -19.257  33.628
   33    HB3  LEU  21           HB2      LEU  21 -45.925 -18.434  32.096
   34    HG   LEU  21           HG       LEU  21 -47.946 -19.366  33.140
   35   HD11  LEU  21          HD11      LEU  21 -47.203 -20.766  30.575
   36   HD12  LEU  21          HD12      LEU  21 -47.777 -19.102  30.695
   37   HD13  LEU  21          HD13      LEU  21 -48.832 -20.435  31.165
   38   HD21  LEU  21          HD21      LEU  21 -46.609 -21.373  34.069
   39   HD22  LEU  21          HD22      LEU  21 -46.936 -22.112  32.501
   40   HD23  LEU  21          HD23      LEU  21 -48.273 -21.627  33.545
   41    H    ASP  22           H        ASP  22 -44.852 -19.367  29.515
   42    HA   ASP  22           HA       ASP  22 -42.921 -17.268  29.796
   43    HB2  ASP  22           HB1      ASP  22 -41.978 -19.874  29.099
   44    HB3  ASP  22           HB2      ASP  22 -41.833 -18.833  27.677
   45    HD2  ASP  22           HD       ASP  22 -39.403 -16.854  29.188
   46    H    PHE  23           H        PHE  23 -42.912 -15.851  28.046
   47    HA   PHE  23           HA       PHE  23 -44.165 -16.444  25.562
   48    HB2  PHE  23           HB1      PHE  23 -46.142 -15.068  25.740
   49    HB3  PHE  23           HB2      PHE  23 -46.168 -16.274  27.029
   50    HD1  PHE  23           HD1      PHE  23 -45.733 -12.715  26.276
   51    HD2  PHE  23           HD2      PHE  23 -45.968 -15.661  29.340
   52    HE1  PHE  23           HE1      PHE  23 -46.006 -10.940  27.958
   53    HE2  PHE  23           HE2      PHE  23 -46.241 -13.890  31.027
   54    HZ   PHE  23           HZ       PHE  23 -46.261 -11.526  30.336
   55    H    ASN  24           H        ASN  24 -43.801 -14.859  24.030
   56    HA   ASN  24           HA       ASN  24 -42.551 -12.365  24.940
   57    HB2  ASN  24           HB1      ASN  24 -40.673 -12.577  23.558
   58    HB3  ASN  24           HB2      ASN  24 -40.863 -14.192  24.250
   59   HD21  ASN  24          HD21      ASN  24 -40.708 -12.366  21.406
   60   HD22  ASN  24          HD22      ASN  24 -41.048 -13.635  20.284
   61    H    ASN  25           H        ASN  25 -42.729 -10.612  23.499
   62    HA   ASN  25           HA       ASN  25 -44.024 -10.882  20.960
   63    HB2  ASN  25           HB1      ASN  25 -45.954  -9.315  21.736
   64    HB3  ASN  25           HB2      ASN  25 -46.075 -11.051  22.049
   65   HD21  ASN  25          HD21      ASN  25 -45.849 -11.830  24.139
   66   HD22  ASN  25          HD22      ASN  25 -45.948 -10.798  25.522
   67    H    ILE  26           H        ILE  26 -41.804  -9.815  20.865
   68    HA   ILE  26           HA       ILE  26 -42.157  -6.897  21.070
   69    HB   ILE  26           HB       ILE  26 -39.544  -8.366  21.429
   70   HG12  ILE  26          HG11      ILE  26 -40.999  -8.811  23.320
   71   HG13  ILE  26          HG12      ILE  26 -39.722  -7.682  23.802
   72   HG21  ILE  26          HG21      ILE  26 -38.827  -6.329  20.748
   73   HG22  ILE  26          HG22      ILE  26 -40.321  -5.523  21.222
   74   HG23  ILE  26          HG23      ILE  26 -39.115  -5.929  22.442
   75   HD11  ILE  26          HD11      ILE  26 -41.882  -6.112  22.921
   76   HD12  ILE  26          HD12      ILE  26 -42.543  -7.358  23.981
   77   HD13  ILE  26          HD13      ILE  26 -41.260  -6.296  24.561
   78    H    ARG  27           H        ARG  27 -41.901  -5.809  19.230
   79    HA   ARG  27           HA       ARG  27 -40.427  -7.098  17.030
   80    HB2  ARG  27           HB1      ARG  27 -43.136  -5.803  17.025
   81    HB3  ARG  27           HB2      ARG  27 -42.144  -5.789  15.559
   82    HG2  ARG  27           HG1      ARG  27 -42.938  -7.794  15.055
   83    HG3  ARG  27           HG2      ARG  27 -42.085  -8.431  16.472
   84    HD2  ARG  27           HD1      ARG  27 -44.212  -7.494  17.747
   85    HD3  ARG  27           HD2      ARG  27 -44.950  -7.691  16.151
   86    HE   ARG  27           HE       ARG  27 -43.696 -10.070  16.608
   87   HH11  ARG  27          HH11      ARG  27 -46.055  -8.165  18.317
   88   HH12  ARG  27          HH12      ARG  27 -46.827  -9.536  19.045
   89   HH21  ARG  27          HH21      ARG  27 -44.703 -11.883  17.559
   90   HH22  ARG  27          HH22      ARG  27 -46.056 -11.650  18.614
   91    H    SER  28           H        SER  28 -38.581  -5.913  17.139
   92    HA   SER  28           HA       SER  28 -38.786  -2.992  17.217
   93    HB2  SER  28           HB1      SER  28 -37.119  -4.636  18.582
   94    HB3  SER  28           HB2      SER  28 -36.116  -4.273  17.166
   95    HG   SER  28           HG       SER  28 -35.678  -2.495  18.192
   96    H    SER  29           H        SER  29 -36.911  -1.927  15.868
   97    HA   SER  29           HA       SER  29 -36.305  -3.168  13.358
   98    HB2  SER  29           HB1      SER  29 -37.759  -2.135  11.922
   99    HB3  SER  29           HB2      SER  29 -38.799  -2.194  13.357
  100    HG   SER  29           HG       SER  29 -38.654  -0.095  12.323
  101    H    ALA  30           H        ALA  30 -35.396  -1.379  11.803
  102    HA   ALA  30           HA       ALA  30 -34.352   0.997  12.934
  103    HB1  ALA  30           HB1      ALA  30 -32.557   0.264  14.010
  104    HB2  ALA  30           HB2      ALA  30 -32.884  -1.394  13.505
  105    HB3  ALA  30           HB3      ALA  30 -31.920  -0.333  12.477
  106    H    ASP  31           H        ASP  31 -33.494   2.320  11.386
  107    HA   ASP  31           HA       ASP  31 -32.541   1.308   8.870
  108    HB2  ASP  31           HB1      ASP  31 -35.331   2.024   9.166
  109    HB3  ASP  31           HB2      ASP  31 -34.534   3.082   7.996
  110    HD2  ASP  31           HD       ASP  31 -33.736   0.213   5.991
  111    H    LEU  32           H        LEU  32 -30.784   2.531   8.686
  112    HA   LEU  32           HA       LEU  32 -31.067   5.412   8.550
  113    HB2  LEU  32           HB1      LEU  32 -29.184   5.807  10.117
  114    HB3  LEU  32           HB2      LEU  32 -30.645   5.167  10.889
  115    HG   LEU  32           HG       LEU  32 -29.048   2.935  10.269
  116   HD11  LEU  32          HD11      LEU  32 -26.944   3.396  11.303
  117   HD12  LEU  32          HD12      LEU  32 -27.439   5.042  11.699
  118   HD13  LEU  32          HD13      LEU  32 -27.190   4.577  10.016
  119   HD21  LEU  32          HD21      LEU  32 -30.578   3.157  12.158
  120   HD22  LEU  32          HD22      LEU  32 -29.513   4.360  12.887
  121   HD23  LEU  32          HD23      LEU  32 -28.963   2.694  12.697
  122    H    HIS  33           H        HIS  33 -29.924   6.119   6.879
  123    HA   HIS  33           HA       HIS  33 -27.408   4.786   6.186
  124    HB2  HIS  33           HB1      HIS  33 -29.551   4.067   4.809
  125    HB3  HIS  33           HB2      HIS  33 -29.238   5.583   3.961
  126    HD1  HIS  33           HD1      HIS  33 -27.462   5.575   2.200
  127    HD2  HIS  33           HD2      HIS  33 -27.311   2.202   4.620
  128    HE1  HIS  33           HE1      HIS  33 -25.762   4.060   1.135
  129    HE2  HIS  33           HE2      HIS  33 -25.667   1.999   2.614
  130    H    GLY  34           H        GLY  34 -25.909   6.319   6.305
  131    HA2  GLY  34           HA2      GLY  34 -26.306   8.807   4.842
  132    HA3  GLY  34           HA3      GLY  34 -26.042   8.961   6.573
  133    HA1  GLY  34           HA1      GLY  34 -25.912   8.038   4.662
  134    H    ALA  35           H        ALA  35 -24.609   8.148   3.507
  135    HA   ALA  35           HA       ALA  35 -21.976   8.681   4.604
  136    HB1  ALA  35           HB1      ALA  35 -22.561   6.150   4.776
  137    HB2  ALA  35           HB2      ALA  35 -22.237   6.148   3.042
  138    HB3  ALA  35           HB3      ALA  35 -20.979   6.646   4.173
  139    H    ARG  36           H        ARG  36 -22.842  10.475   3.079
  140    HA   ARG  36           HA       ARG  36 -21.802   9.909   0.384
  141    HB2  ARG  36           HB1      ARG  36 -24.287  11.408   1.188
  142    HB3  ARG  36           HB2      ARG  36 -23.485  11.720  -0.359
  143    HG2  ARG  36           HG1      ARG  36 -23.661   9.151  -0.699
  144    HG3  ARG  36           HG2      ARG  36 -24.896   9.257   0.567
  145    HD2  ARG  36           HD1      ARG  36 -26.160  10.877  -0.747
  146    HD3  ARG  36           HD2      ARG  36 -24.899  10.859  -1.989
  147    HE   ARG  36           HE       ARG  36 -26.021   8.266  -1.460
  148   HH11  ARG  36          HH11      ARG  36 -26.364  11.218  -3.273
  149   HH12  ARG  36          HH12      ARG  36 -27.288  10.485  -4.541
  150   HH21  ARG  36          HH21      ARG  36 -27.236   7.289  -3.123
  151   HH22  ARG  36          HH22      ARG  36 -27.785   8.250  -4.455
  152    H    LYS  37           H        LYS  37 -21.428  12.126  -0.787
  153    HA   LYS  37           HA       LYS  37 -20.037  13.924  -0.939
  154    HB2  LYS  37           HB1      LYS  37 -21.404  14.556   1.685
  155    HB3  LYS  37           HB2      LYS  37 -20.403  15.702   0.781
  156    HG2  LYS  37           HG1      LYS  37 -22.143  14.933  -1.151
  157    HG3  LYS  37           HG2      LYS  37 -23.157  14.811   0.296
  158    HD2  LYS  37           HD1      LYS  37 -21.909  17.199   0.725
  159    HD3  LYS  37           HD2      LYS  37 -22.058  17.183  -1.041
  160    HE2  LYS  37           HE1      LYS  37 -24.532  16.267  -0.088
  161    HE3  LYS  37           HE2      LYS  37 -24.086  17.616   0.965
  162    HZ1  LYS  37           HZ1      LYS  37 -24.872  18.910  -0.644
  163    HZ2  LYS  37           HZ2      LYS  37 -24.918  17.652  -1.773
  164    HZ3  LYS  37           HZ3      LYS  37 -23.486  18.520  -1.532
  165    H    GLY  38           H        GLY  38 -18.092  12.743  -0.773
  166    HA2  GLY  38           HA2      GLY  38 -16.579  13.386   1.638
  167    HA3  GLY  38           HA3      GLY  38 -16.713  11.683   1.225
  168    HA1  GLY  38           HA1      GLY  38 -16.677  13.776   0.854
  169    H    SER  39           H        SER  39 -14.360  11.781   1.113
  170    HA   SER  39           HA       SER  39 -13.296  13.163  -1.238
  171    HB2  SER  39           HB1      SER  39 -11.708  11.587   0.798
  172    HB3  SER  39           HB2      SER  39 -11.129  12.842  -0.312
  173    HG   SER  39           HG       SER  39 -11.722  13.284   2.098
  174    H    GLN  40           H        GLN  40 -11.231  11.649  -2.023
  175    HA   GLN  40           HA       GLN  40 -12.544   9.490  -3.406
  176    HB2  GLN  40           HB1      GLN  40 -10.173  11.099  -3.755
  177    HB3  GLN  40           HB2      GLN  40  -9.785   9.380  -3.935
  178    HG2  GLN  40           HG1      GLN  40 -12.166  10.477  -5.361
  179    HG3  GLN  40           HG2      GLN  40 -10.547  10.817  -5.986
  180   HE21  GLN  40          HE21      GLN  40  -9.883   9.456  -7.468
  181   HE22  GLN  40          HE22      GLN  40 -10.314   7.789  -7.596
  182    H    CYS  41           H        CYS  41 -10.406   9.852  -0.695
  183    HA   CYS  41           HA       CYS  41 -10.738   7.082   0.003
  184    HB2  CYS  41           HB1      CYS  41  -8.400   6.474   0.055
  185    HB3  CYS  41           HB2      CYS  41  -8.828   6.984  -1.578
  186    H    LEU  42           H        LEU  42 -10.486   6.730   2.171
  187    HA   LEU  42           HA       LEU  42 -10.276   9.079   3.833
  188    HB2  LEU  42           HB1      LEU  42 -11.539   6.575   4.007
  189    HB3  LEU  42           HB2      LEU  42 -10.331   6.607   5.305
  190    HG   LEU  42           HG       LEU  42 -12.535   8.629   4.898
  191   HD11  LEU  42          HD11      LEU  42 -12.237   6.226   6.648
  192   HD12  LEU  42          HD12      LEU  42 -13.628   6.765   5.709
  193   HD13  LEU  42          HD13      LEU  42 -13.186   7.607   7.194
  194   HD21  LEU  42          HD21      LEU  42 -10.743   9.777   5.897
  195   HD22  LEU  42          HD22      LEU  42 -10.320   8.401   6.915
  196   HD23  LEU  42          HD23      LEU  42 -11.797   9.312   7.232
  197    H    SER  43           H        SER  43  -8.254   6.426   2.896
  198    HA   SER  43           HA       SER  43  -5.968   7.646   4.130
  199    HB2  SER  43           HB1      SER  43  -7.215   6.159   5.911
  200    HB3  SER  43           HB2      SER  43  -6.440   4.828   5.034
  201    HG   SER  43           HG       SER  43  -5.232   5.790   6.854
  202    H    ASP  44           H        ASP  44  -4.011   6.029   3.874
  203    HA   ASP  44           HA       ASP  44  -3.776   5.509   1.101
  204    HB2  ASP  44           HB1      ASP  44  -1.550   4.962   1.520
  205    HB3  ASP  44           HB2      ASP  44  -1.935   6.071   2.843
  206    HD2  ASP  44           HD       ASP  44  -0.972   2.375   3.711
  207    H    THR  45           H        THR  45  -4.686   3.561   3.828
  208    HA   THR  45           HA       THR  45  -4.274   1.024   2.587
  209    HB   THR  45           HB       THR  45  -6.305   1.351   4.749
  210    HG1  THR  45           HG1      THR  45  -4.794   2.648   5.638
  211   HG21  THR  45          HG21      THR  45  -5.517  -0.740   5.474
  212   HG22  THR  45          HG22      THR  45  -4.001  -0.574   4.586
  213   HG23  THR  45          HG23      THR  45  -5.508  -0.853   3.714
  214    H    ASP  46           H        ASP  46  -6.801   3.386   2.524
  215    HA   ASP  46           HA       ASP  46  -8.930   1.689   1.729
  216    HB2  ASP  46           HB1      ASP  46  -8.420   4.620   1.790
  217    HB3  ASP  46           HB2      ASP  46  -9.690   4.049   0.700
  218    HD2  ASP  46           HD       ASP  46 -11.868   3.618   3.295
  219    H    CYS  47           H        CYS  47  -6.277   3.149   0.044
  220    HA   CYS  47           HA       CYS  47  -7.440   2.737  -2.576
  221    HB2  CYS  47           HB1      CYS  47  -5.793   4.612  -1.841
  222    HB3  CYS  47           HB2      CYS  47  -4.548   3.380  -2.068
  223    H    ASN  48           H        ASN  48  -7.772   0.527  -2.741
  224    HA   ASN  48           HA       ASN  48  -7.231  -1.590  -3.388
  225    HB2  ASN  48           HB1      ASN  48  -4.951  -0.010  -4.149
  226    HB3  ASN  48           HB2      ASN  48  -4.404  -1.586  -3.564
  227   HD21  ASN  48          HD21      ASN  48  -4.634  -3.334  -4.817
  228   HD22  ASN  48          HD22      ASN  48  -5.415  -3.344  -6.358
  229    H    THR  49           H        THR  49  -4.236  -0.766  -1.664
  230    HA   THR  49           HA       THR  49  -4.908  -1.856   0.819
  231    HB   THR  49           HB       THR  49  -5.117  -4.012  -0.175
  232    HG1  THR  49           HG1      THR  49  -3.904  -4.898   1.318
  233   HG21  THR  49          HG21      THR  49  -3.439  -5.031  -1.580
  234   HG22  THR  49          HG22      THR  49  -2.377  -3.636  -1.387
  235   HG23  THR  49          HG23      THR  49  -3.894  -3.473  -2.271
  236    H    ARG  50           H        ARG  50  -2.320  -1.548  -1.577
  237    HA   ARG  50           HA       ARG  50  -0.639  -0.345   0.507
  238    HB2  ARG  50           HB1      ARG  50   1.346  -1.471  -0.455
  239    HB3  ARG  50           HB2      ARG  50   0.182  -2.604   0.246
  240    HG2  ARG  50           HG1      ARG  50  -0.690  -2.590  -2.301
  241    HG3  ARG  50           HG2      ARG  50   1.034  -2.260  -2.552
  242    HD2  ARG  50           HD1      ARG  50   1.611  -4.244  -1.211
  243    HD3  ARG  50           HD2      ARG  50  -0.113  -4.574  -0.993
  244    HE   ARG  50           HE       ARG  50   0.431  -4.401  -3.740
  245   HH11  ARG  50          HH11      ARG  50   1.074  -6.458  -1.005
  246   HH12  ARG  50          HH12      ARG  50   1.204  -7.901  -1.956
  247   HH21  ARG  50          HH21      ARG  50   0.601  -6.294  -5.002
  248   HH22  ARG  50          HH22      ARG  50   0.936  -7.806  -4.230
  249    H    LYS  51           H        LYS  51  -2.138   1.158  -1.189
  250    HA   LYS  51           HA       LYS  51  -0.207   2.119  -3.195
  251    HB2  LYS  51           HB1      LYS  51  -2.908   1.424  -3.487
  252    HB3  LYS  51           HB2      LYS  51  -2.872   3.195  -3.522
  253    HG2  LYS  51           HG1      LYS  51  -2.208   3.152  -5.632
  254    HG3  LYS  51           HG2      LYS  51  -0.750   2.267  -5.149
  255    HD2  LYS  51           HD1      LYS  51  -2.480   0.228  -5.109
  256    HD3  LYS  51           HD2      LYS  51  -3.290   1.257  -6.303
  257    HE2  LYS  51           HE1      LYS  51  -1.642   1.010  -7.860
  258    HE3  LYS  51           HE2      LYS  51  -0.372   0.881  -6.633
  259    HZ1  LYS  51           HZ1      LYS  51  -2.228  -1.321  -6.615
  260    HZ2  LYS  51           HZ2      LYS  51  -0.537  -1.331  -6.583
  261    HZ3  LYS  51           HZ3      LYS  51  -1.355  -1.185  -8.057
  262    H    PHE  52           H        PHE  52  -0.262   4.484  -3.590
  263    HA   PHE  52           HA       PHE  52  -0.446   5.898  -1.031
  264    HB2  PHE  52           HB1      PHE  52   1.703   6.190  -1.902
  265    HB3  PHE  52           HB2      PHE  52   1.110   6.360  -3.556
  266    HD1  PHE  52           HD1      PHE  52   1.339   8.082  -0.297
  267    HD2  PHE  52           HD2      PHE  52   0.550   8.459  -4.462
  268    HE1  PHE  52           HE1      PHE  52   1.386  10.533  -0.080
  269    HE2  PHE  52           HE2      PHE  52   0.597  10.911  -4.253
  270    HZ   PHE  52           HZ       PHE  52   1.016  11.950  -2.060
  271    H    CYS  53           H        CYS  53  -1.655   7.730  -0.746
  272    HA   CYS  53           HA       CYS  53  -3.552   8.356  -2.908
  273    HB2  CYS  53           HB1      CYS  53  -3.867   7.904  -0.054
  274    HB3  CYS  53           HB2      CYS  53  -4.541   9.461  -0.539
  275    H    LEU  54           H        LEU  54  -3.414  10.286  -3.836
  276    HA   LEU  54           HA       LEU  54  -1.771  12.347  -2.547
  277    HB2  LEU  54           HB1      LEU  54  -1.508  11.386  -5.006
  278    HB3  LEU  54           HB2      LEU  54  -2.745  12.608  -5.345
  279    HG   LEU  54           HG       LEU  54  -0.363  13.520  -3.840
  280   HD11  LEU  54          HD11      LEU  54   1.097  12.670  -5.293
  281   HD12  LEU  54          HD12      LEU  54   0.436  13.820  -6.455
  282   HD13  LEU  54          HD13      LEU  54  -0.174  12.166  -6.407
  283   HD21  LEU  54          HD21      LEU  54  -1.929  15.187  -4.319
  284   HD22  LEU  54          HD22      LEU  54  -2.200  14.593  -5.957
  285   HD23  LEU  54          HD23      LEU  54  -0.685  15.400  -5.550
  286    H    GLN  55           H        GLN  55  -2.546  14.348  -2.068
  287    HA   GLN  55           HA       GLN  55  -5.316  14.976  -2.804
  288    HB2  GLN  55           HB1      GLN  55  -5.622  15.901  -0.464
  289    HB3  GLN  55           HB2      GLN  55  -5.578  14.137  -0.604
  290    HG2  GLN  55           HG1      GLN  55  -3.627  13.937   0.528
  291    HG3  GLN  55           HG2      GLN  55  -3.007  15.485  -0.064
  292   HE21  GLN  55          HE21      GLN  55  -3.033  14.420   2.640
  293   HE22  GLN  55          HE22      GLN  55  -3.892  15.567   3.604
  294    HA   PRO  56           HA       PRO  56  -2.624  18.560  -3.750
  295    HB2  PRO  56           HB1      PRO  56  -4.077  19.343  -5.937
  296    HB3  PRO  56           HB2      PRO  56  -2.833  18.096  -5.991
  297    HG2  PRO  56           HG1      PRO  56  -5.808  17.804  -5.749
  298    HG3  PRO  56           HG2      PRO  56  -4.656  16.905  -6.805
  299    HD2  PRO  56           HD1      PRO  56  -5.646  15.868  -4.500
  300    HD3  PRO  56           HD2      PRO  56  -4.011  15.515  -5.084
  301    H    ARG  57           H        ARG  57  -2.965  20.732  -3.359
  302    HA   ARG  57           HA       ARG  57  -5.380  21.382  -1.910
  303    HB2  ARG  57           HB1      ARG  57  -4.266  23.492  -1.388
  304    HB3  ARG  57           HB2      ARG  57  -3.202  22.116  -1.061
  305    HG2  ARG  57           HG1      ARG  57  -2.562  22.757  -3.658
  306    HG3  ARG  57           HG2      ARG  57  -2.863  24.335  -2.911
  307    HD2  ARG  57           HD1      ARG  57  -1.359  23.493  -0.990
  308    HD3  ARG  57           HD2      ARG  57  -0.852  22.248  -2.139
  309    HE   ARG  57           HE       ARG  57  -0.651  24.827  -3.301
  310   HH11  ARG  57          HH11      ARG  57   0.901  22.694  -1.030
  311   HH12  ARG  57          HH12      ARG  57   2.474  23.383  -1.258
  312   HH21  ARG  57          HH21      ARG  57   1.415  25.743  -3.610
  313   HH22  ARG  57          HH22      ARG  57   2.765  25.118  -2.726
  314    H    ASP  58           H        ASP  58  -4.010  21.981  -5.042
  315    HA   ASP  58           HA       ASP  58  -5.929  24.086  -5.646
  316    HB2  ASP  58           HB1      ASP  58  -3.547  22.914  -7.047
  317    HB3  ASP  58           HB2      ASP  58  -4.750  23.818  -7.979
  318    HD2  ASP  58           HD       ASP  58  -3.461  26.231  -5.203
  319    H    GLU  59           H        GLU  59  -5.525  20.689  -6.065
  320    HA   GLU  59           HA       GLU  59  -7.907  20.635  -7.801
  321    HB2  GLU  59           HB1      GLU  59  -5.316  19.453  -8.181
  322    HB3  GLU  59           HB2      GLU  59  -6.532  18.175  -8.036
  323    HG2  GLU  59           HG1      GLU  59  -7.492  20.277  -9.754
  324    HG3  GLU  59           HG2      GLU  59  -5.915  19.688 -10.299
  325    HE2  GLU  59           HE       GLU  59  -7.289  16.800 -11.516
  326    H    LYS  60           H        LYS  60  -8.760  18.164  -7.698
  327    HA   LYS  60           HA       LYS  60  -9.605  17.846  -4.946
  328    HB2  LYS  60           HB1      LYS  60 -11.091  16.064  -5.901
  329    HB3  LYS  60           HB2      LYS  60 -11.328  17.675  -6.598
  330    HG2  LYS  60           HG1      LYS  60 -10.604  17.062  -8.650
  331    HG3  LYS  60           HG2      LYS  60  -9.417  15.917  -8.000
  332    HD2  LYS  60           HD1      LYS  60 -11.601  14.603  -7.268
  333    HD3  LYS  60           HD2      LYS  60 -12.301  15.518  -8.615
  334    HE2  LYS  60           HE1      LYS  60 -10.157  14.677  -9.898
  335    HE3  LYS  60           HE2      LYS  60 -10.175  13.426  -8.644
  336    HZ1  LYS  60           HZ1      LYS  60 -12.152  12.569  -9.390
  337    HZ2  LYS  60           HZ2      LYS  60 -11.455  13.061 -10.850
  338    HZ3  LYS  60           HZ3      LYS  60 -12.648  14.012 -10.121
  339    HA   PRO  61           HA       PRO  61  -6.971  14.516  -3.830
  340    HB2  PRO  61           HB1      PRO  61  -8.618  13.045  -2.208
  341    HB3  PRO  61           HB2      PRO  61  -7.935  14.604  -1.746
  342    HG2  PRO  61           HG1      PRO  61 -10.643  13.970  -2.871
  343    HG3  PRO  61           HG2      PRO  61 -10.205  15.046  -1.492
  344    HD2  PRO  61           HD1      PRO  61 -10.808  16.000  -3.961
  345    HD3  PRO  61           HD2      PRO  61  -9.619  16.774  -2.901
  346    H    PHE  62           H        PHE  62  -6.333  12.636  -4.710
  347    HA   PHE  62           HA       PHE  62  -8.258  10.675  -5.625
  348    HB2  PHE  62           HB1      PHE  62  -7.144  10.596  -7.918
  349    HB3  PHE  62           HB2      PHE  62  -8.234  11.950  -7.615
  350    HD1  PHE  62           HD1      PHE  62  -7.551  14.040  -8.255
  351    HD2  PHE  62           HD2      PHE  62  -4.612  11.139  -7.228
  352    HE1  PHE  62           HE1      PHE  62  -5.775  15.636  -8.848
  353    HE2  PHE  62           HE2      PHE  62  -2.830  12.730  -7.817
  354    HZ   PHE  62           HZ       PHE  62  -3.411  14.982  -8.627
  355    H    CYS  63           H        CYS  63  -7.148   8.701  -6.476
  356    HA   CYS  63           HA       CYS  63  -5.026   7.976  -4.702
  357    HB2  CYS  63           HB1      CYS  63  -6.730   6.613  -6.712
  358    HB3  CYS  63           HB2      CYS  63  -5.153   5.881  -6.404
  359    H    ALA  64           H        ALA  64  -2.899   7.497  -5.162
  360    HA   ALA  64           HA       ALA  64  -1.935   8.078  -7.875
  361    HB1  ALA  64           HB1      ALA  64  -1.057   9.382  -5.329
  362    HB2  ALA  64           HB2      ALA  64   0.060   9.215  -6.685
  363    HB3  ALA  64           HB3      ALA  64  -1.443  10.115  -6.886
  364    H    THR  65           H        THR  65  -1.096   6.201  -8.516
  365    HA   THR  65           HA       THR  65  -0.136   4.173  -6.825
  366    HB   THR  65           HB       THR  65   0.837   4.434  -9.651
  367    HG1  THR  65           HG1      THR  65  -1.181   4.611 -10.261
  368   HG21  THR  65          HG21      THR  65   1.524   2.370  -9.123
  369   HG22  THR  65          HG22      THR  65  -0.174   1.898  -9.189
  370   HG23  THR  65          HG23      THR  65   0.559   2.343  -7.648
  371    H    CYS  66           H        CYS  66   1.933   3.504  -6.285
  372    HA   CYS  66           HA       CYS  66   3.817   5.444  -5.668
  373    HB2  CYS  66           HB1      CYS  66   5.288   3.675  -5.057
  374    HB3  CYS  66           HB2      CYS  66   3.653   3.124  -4.693
  375    H    ARG  67           H        ARG  67   6.211   5.209  -6.438
  376    HA   ARG  67           HA       ARG  67   6.208   5.227  -9.386
  377    HB2  ARG  67           HB1      ARG  67   7.642   7.015  -7.418
  378    HB3  ARG  67           HB2      ARG  67   8.115   6.899  -9.121
  379    HG2  ARG  67           HG1      ARG  67   5.265   7.369  -8.824
  380    HG3  ARG  67           HG2      ARG  67   6.243   8.623  -8.045
  381    HD2  ARG  67           HD1      ARG  67   7.350   9.178 -10.051
  382    HD3  ARG  67           HD2      ARG  67   6.814   7.688 -10.840
  383    HE   ARG  67           HE       ARG  67   4.889   8.755 -11.437
  384   HH11  ARG  67          HH11      ARG  67   6.348  10.485  -8.792
  385   HH12  ARG  67          HH12      ARG  67   5.209  11.790  -8.847
  386   HH21  ARG  67          HH21      ARG  67   3.383  10.467 -11.518
  387   HH22  ARG  67          HH22      ARG  67   3.523  11.779 -10.396
  388    H    GLY  68           H        GLY  68   8.623   5.130 -10.189
  389    HA2  GLY  68           HA2      GLY  68   9.608   2.574  -9.363
  390    HA3  GLY  68           HA3      GLY  68  10.329   3.626 -10.571
  391    HA1  GLY  68           HA1      GLY  68   9.447   3.132  -8.701
  392    H    LEU  69           H        LEU  69  12.290   2.679  -9.459
  393    HA   LEU  69           HA       LEU  69  12.946   3.677  -6.850
  394    HB2  LEU  69           HB1      LEU  69  14.480   2.223  -8.992
  395    HB3  LEU  69           HB2      LEU  69  15.269   2.830  -7.526
  396    HG   LEU  69           HG       LEU  69  13.053   0.785  -7.630
  397   HD11  LEU  69          HD11      LEU  69  14.646  -0.843  -7.174
  398   HD12  LEU  69          HD12      LEU  69  15.854   0.339  -6.669
  399   HD13  LEU  69          HD13      LEU  69  15.441   0.176  -8.376
  400   HD21  LEU  69          HD21      LEU  69  14.375   0.863  -5.129
  401   HD22  LEU  69          HD22      LEU  69  12.686   1.224  -5.487
  402   HD23  LEU  69          HD23      LEU  69  13.891   2.512  -5.528
  403    H    ARG  70           H        ARG  70  14.389   4.253 -10.066
  404    HA   ARG  70           HA       ARG  70  16.028   6.375  -9.342
  405    HB2  ARG  70           HB1      ARG  70  14.853   5.367 -11.875
  406    HB3  ARG  70           HB2      ARG  70  15.458   7.031 -11.891
  407    HG2  ARG  70           HG1      ARG  70  17.527   5.740 -10.683
  408    HG3  ARG  70           HG2      ARG  70  16.926   4.500 -11.795
  409    HD2  ARG  70           HD1      ARG  70  17.470   5.698 -13.668
  410    HD3  ARG  70           HD2      ARG  70  17.237   7.253 -12.857
  411    HE   ARG  70           HE       ARG  70  19.492   5.821 -11.837
  412   HH11  ARG  70          HH11      ARG  70  18.390   7.893 -14.409
  413   HH12  ARG  70          HH12      ARG  70  19.966   8.523 -14.753
  414   HH21  ARG  70          HH21      ARG  70  21.573   6.645 -12.280
  415   HH22  ARG  70          HH22      ARG  70  21.776   7.813 -13.542
  416    H    ARG  71           H        ARG  71  12.607   6.279  -9.841
  417    HA   ARG  71           HA       ARG  71  12.075   8.954 -10.437
  418    HB2  ARG  71           HB1      ARG  71  10.585   6.636  -9.477
  419    HB3  ARG  71           HB2      ARG  71   9.965   8.160  -8.823
  420    HG2  ARG  71           HG1      ARG  71   8.816   7.495 -10.889
  421    HG3  ARG  71           HG2      ARG  71   9.658   9.045 -11.047
  422    HD2  ARG  71           HD1      ARG  71  11.441   8.063 -12.290
  423    HD3  ARG  71           HD2      ARG  71  10.872   6.431 -11.912
  424    HE   ARG  71           HE       ARG  71   9.414   6.580 -13.663
  425   HH11  ARG  71          HH11      ARG  71  10.455   9.786 -12.791
  426   HH12  ARG  71          HH12      ARG  71   9.669  10.547 -14.135
  427   HH21  ARG  71          HH21      ARG  71   8.376   7.570 -15.436
  428   HH22  ARG  71          HH22      ARG  71   8.486   9.286 -15.639
  429    H    ARG  72           H        ARG  72  11.909  10.787  -9.254
  430    HA   ARG  72           HA       ARG  72  13.225  10.910  -6.740
  431    HB2  ARG  72           HB1      ARG  72  11.504  12.999  -8.096
  432    HB3  ARG  72           HB2      ARG  72  12.642  13.284  -6.771
  433    HG2  ARG  72           HG1      ARG  72  13.666  12.044  -9.283
  434    HG3  ARG  72           HG2      ARG  72  13.303  13.778  -9.262
  435    HD2  ARG  72           HD1      ARG  72  15.274  14.157  -8.296
  436    HD3  ARG  72           HD2      ARG  72  14.717  13.238  -6.891
  437    HE   ARG  72           HE       ARG  72  15.610  11.433  -8.841
  438   HH11  ARG  72          HH11      ARG  72  16.855  13.864  -6.682
  439   HH12  ARG  72          HH12      ARG  72  18.411  13.119  -6.531
  440   HH21  ARG  72          HH21      ARG  72  17.656  10.442  -8.649
  441   HH22  ARG  72          HH22      ARG  72  18.866  11.173  -7.650
  442    H    CYS  73           H        CYS  73  12.352  11.599  -4.717
  443    HA   CYS  73           HA       CYS  73   9.486  11.542  -4.333
  444    HB2  CYS  73           HB1      CYS  73   9.448   9.704  -2.769
  445    HB3  CYS  73           HB2      CYS  73  10.121   9.141  -4.300
  446    H    GLN  74           H        GLN  74   8.897  11.995  -2.051
  447    HA   GLN  74           HA       GLN  74  10.993  13.596  -0.738
  448    HB2  GLN  74           HB1      GLN  74   8.045  14.072  -1.094
  449    HB3  GLN  74           HB2      GLN  74   8.929  14.834   0.237
  450    HG2  GLN  74           HG1      GLN  74   8.857  16.418  -1.513
  451    HG3  GLN  74           HG2      GLN  74  10.506  15.774  -1.469
  452   HE21  GLN  74          HE21      GLN  74  11.109  16.036  -3.536
  453   HE22  GLN  74          HE22      GLN  74  10.327  15.301  -4.889
  454    H    ARG  75           H        ARG  75   8.579  11.146  -0.383
  455    HA   ARG  75           HA       ARG  75   9.456  10.726   2.382
  456    HB2  ARG  75           HB1      ARG  75   7.046  10.105   2.933
  457    HB3  ARG  75           HB2      ARG  75   7.407  11.827   2.753
  458    HG2  ARG  75           HG1      ARG  75   6.428  11.886   0.564
  459    HG3  ARG  75           HG2      ARG  75   6.228  10.126   0.571
  460    HD2  ARG  75           HD1      ARG  75   4.118  10.673   1.210
  461    HD3  ARG  75           HD2      ARG  75   4.883  10.703   2.806
  462    HE   ARG  75           HE       ARG  75   4.564  12.966   2.882
  463   HH11  ARG  75          HH11      ARG  75   4.187  11.874  -0.402
  464   HH12  ARG  75          HH12      ARG  75   3.621  13.404  -0.985
  465   HH21  ARG  75          HH21      ARG  75   3.820  14.987   2.126
  466   HH22  ARG  75          HH22      ARG  75   3.414  15.175   0.454
  467    H    ASP  76           H        ASP  76   8.954   8.544   3.183
  468    HA   ASP  76           HA       ASP  76   9.499   6.586   1.140
  469    HB2  ASP  76           HB1      ASP  76   8.897   5.872   3.993
  470    HB3  ASP  76           HB2      ASP  76  10.040   5.125   2.870
  471    HD2  ASP  76           HD       ASP  76  12.564   7.322   3.723
  472    H    ALA  77           H        ALA  77   6.739   7.723   2.867
  473    HA   ALA  77           HA       ALA  77   5.089   5.440   2.654
  474    HB1  ALA  77           HB1      ALA  77   4.208   8.321   2.737
  475    HB2  ALA  77           HB2      ALA  77   3.260   6.902   3.183
  476    HB3  ALA  77           HB3      ALA  77   4.656   7.371   4.154
  477    H    MET  78           H        MET  78   5.503   8.281   0.566
  478    HA   MET  78           HA       MET  78   3.524   7.597  -1.316
  479    HB2  MET  78           HB1      MET  78   4.449   9.278  -2.713
  480    HB3  MET  78           HB2      MET  78   4.657   9.841  -1.049
  481    HG2  MET  78           HG1      MET  78   6.778  10.239  -1.602
  482    HG3  MET  78           HG2      MET  78   6.992   8.489  -1.503
  483    HE1  MET  78           HE1      MET  78   4.882  10.361  -4.336
  484    HE2  MET  78           HE2      MET  78   6.132  11.482  -3.798
  485    HE3  MET  78           HE3      MET  78   6.205  10.791  -5.420
  486    H    CYS  79           H        CYS  79   6.740   6.441  -0.807
  487    HA   CYS  79           HA       CYS  79   6.967   5.274  -3.452
  488    HB2  CYS  79           HB1      CYS  79   8.883   6.219  -1.980
  489    HB3  CYS  79           HB2      CYS  79   8.790   4.670  -1.139
  490    H    CYS  80           H        CYS  80   6.826   3.115  -3.952
  491    HA   CYS  80           HA       CYS  80   4.981   1.531  -2.649
  492    HB2  CYS  80           HB1      CYS  80   6.972   1.162  -4.771
  493    HB3  CYS  80           HB2      CYS  80   6.610  -0.321  -3.884
  494    HA   PRO  81           HA       PRO  81   6.922  -0.387   0.785
  495    HB2  PRO  81           HB1      PRO  81   5.948  -2.944   0.668
  496    HB3  PRO  81           HB2      PRO  81   4.969  -1.550   1.122
  497    HG2  PRO  81           HG1      PRO  81   5.216  -2.917  -1.536
  498    HG3  PRO  81           HG2      PRO  81   3.734  -2.365  -0.673
  499    HD2  PRO  81           HD1      PRO  81   4.842  -0.970  -2.719
  500    HD3  PRO  81           HD2      PRO  81   4.031  -0.183  -1.354
  501    H    GLY  82           H        GLY  82   8.766  -1.460   1.345
  502    HA2  GLY  82           HA2      GLY  82  10.352  -3.248   1.055
  503    HA3  GLY  82           HA3      GLY  82   9.981  -3.240  -0.663
  504    HA1  GLY  82           HA1      GLY  82  10.303  -2.390   1.259
  505    H    THR  83           H        THR  83  10.063  -0.171  -0.433
  506    HA   THR  83           HA       THR  83  13.000   0.049  -0.575
  507    HB   THR  83           HB       THR  83  12.603   1.958  -2.155
  508    HG1  THR  83           HG1      THR  83  10.373   1.676  -3.179
  509   HG21  THR  83          HG21      THR  83  11.504   0.191  -3.926
  510   HG22  THR  83          HG22      THR  83  12.132  -0.888  -2.680
  511   HG23  THR  83          HG23      THR  83  13.211   0.251  -3.487
  512    H    LEU  84           H        LEU  84  13.685   2.458  -0.372
  513    HA   LEU  84           HA       LEU  84  12.100   3.825   1.682
  514    HB2  LEU  84           HB1      LEU  84  14.104   2.333   2.509
  515    HB3  LEU  84           HB2      LEU  84  15.064   3.725   1.976
  516    HG   LEU  84           HG       LEU  84  13.474   5.098   3.498
  517   HD11  LEU  84          HD11      LEU  84  13.237   2.464   4.915
  518   HD12  LEU  84          HD12      LEU  84  11.985   3.052   3.823
  519   HD13  LEU  84          HD13      LEU  84  12.409   3.983   5.259
  520   HD21  LEU  84          HD21      LEU  84  15.168   5.162   4.978
  521   HD22  LEU  84          HD22      LEU  84  15.981   4.137   3.795
  522   HD23  LEU  84          HD23      LEU  84  15.188   3.411   5.194
  523    H    CYS  85           H        CYS  85  12.012   5.984   1.448
  524    HA   CYS  85           HA       CYS  85  13.079   7.174  -0.912
  525    HB2  CYS  85           HB1      CYS  85  10.898   7.757   0.300
  526    HB3  CYS  85           HB2      CYS  85  11.903   8.672   1.425
  527    H    VAL  86           H        VAL  86  15.177   7.608  -1.102
  528    HA   VAL  86           HA       VAL  86  16.479   9.126   1.049
  529    HB   VAL  86           HB       VAL  86  17.735   6.792  -0.402
  530   HG11  VAL  86          HG11      VAL  86  19.684   7.209   1.016
  531   HG12  VAL  86          HG12      VAL  86  19.335   8.594  -0.020
  532   HG13  VAL  86          HG13      VAL  86  18.892   8.635   1.687
  533   HG21  VAL  86          HG21      VAL  86  16.302   7.033   2.115
  534   HG22  VAL  86          HG22      VAL  86  16.776   5.590   1.218
  535   HG23  VAL  86          HG23      VAL  86  17.920   6.360   2.318
  536    H    ASN  87           H        ASN  87  17.926  10.675   0.383
  537    HA   ASN  87           HA       ASN  87  18.849  12.228  -0.997
  538    HB2  ASN  87           HB1      ASN  87  19.784   9.794  -1.841
  539    HB3  ASN  87           HB2      ASN  87  19.096  10.452  -3.331
  540   HD21  ASN  87          HD21      ASN  87  21.680  10.576  -1.126
  541   HD22  ASN  87          HD22      ASN  87  22.569  11.853  -1.876
  542    H    ASP  88           H        ASP  88  15.966  11.850  -1.020
  543    HA   ASP  88           HA       ASP  88  14.147  12.701  -2.087
  544    HB2  ASP  88           HB1      ASP  88  16.011  13.899  -4.138
  545    HB3  ASP  88           HB2      ASP  88  14.432  14.495  -3.610
  546    HD2  ASP  88           HD       ASP  88  15.941  15.591  -0.530
  547    H    VAL  89           H        VAL  89  15.446  10.133  -2.893
  548    HA   VAL  89           HA       VAL  89  13.852   9.713  -5.294
  549    HB   VAL  89           HB       VAL  89  16.006  10.228  -6.257
  550   HG11  VAL  89          HG11      VAL  89  17.985   8.801  -5.720
  551   HG12  VAL  89          HG12      VAL  89  17.470   9.855  -4.402
  552   HG13  VAL  89          HG13      VAL  89  17.072   8.137  -4.367
  553   HG21  VAL  89          HG21      VAL  89  15.473   7.259  -6.273
  554   HG22  VAL  89          HG22      VAL  89  14.723   8.460  -7.325
  555   HG23  VAL  89          HG23      VAL  89  16.450   8.129  -7.456
  556    H    CYS  90           H        CYS  90  13.083   7.638  -5.508
  557    HA   CYS  90           HA       CYS  90  12.854   6.069  -3.202
  558    HB2  CYS  90           HB1      CYS  90  12.212   5.676  -6.097
  559    HB3  CYS  90           HB2      CYS  90  12.148   4.278  -5.021
  560    H    THR  91           H        THR  91  14.566   5.166  -2.243
  561    HA   THR  91           HA       THR  91  16.452   3.642  -3.919
  562    HB   THR  91           HB       THR  91  16.952   4.940  -1.233
  563    HG1  THR  91           HG1      THR  91  18.020   5.518  -3.815
  564   HG21  THR  91          HG21      THR  91  18.187   2.833  -1.481
  565   HG22  THR  91          HG22      THR  91  19.271   4.223  -1.527
  566   HG23  THR  91          HG23      THR  91  18.835   3.395  -3.021
  567    H    THR  92           H        THR  92  16.228   1.519  -3.755
  568    HA   THR  92           HA       THR  92  14.569   0.159  -2.022
  569    HB   THR  92           HB       THR  92  16.986  -1.338  -2.821
  570    HG1  THR  92           HG1      THR  92  16.773  -1.016  -4.949
  571   HG21  THR  92          HG21      THR  92  14.824  -2.501  -4.009
  572   HG22  THR  92          HG22      THR  92  14.081  -1.709  -2.619
  573   HG23  THR  92          HG23      THR  92  15.391  -2.864  -2.379
  574    H    MET  93           H        MET  93  14.802  -0.901  -0.081
  575    HA   MET  93           HA       MET  93  16.476   0.189   1.851
  576    HB2  MET  93           HB1      MET  93  14.965  -2.421   1.734
  577    HB3  MET  93           HB2      MET  93  15.887  -1.929   3.163
  578    HG2  MET  93           HG1      MET  93  14.525   0.087   3.378
  579    HG3  MET  93           HG2      MET  93  13.620  -0.379   1.936
  580    HE1  MET  93           HE1      MET  93  12.710  -1.241   6.120
  581    HE2  MET  93           HE2      MET  93  13.723  -0.032   5.332
  582    HE3  MET  93           HE3      MET  93  11.976  -0.012   5.088
  583    H    GLU  94           H        GLU  94  16.936  -2.605  -0.232
  584    HA   GLU  94           HA       GLU  94  19.179  -3.702   1.059
  585    HB2  GLU  94           HB1      GLU  94  18.062  -3.854  -1.719
  586    HB3  GLU  94           HB2      GLU  94  19.659  -4.540  -1.381
  587    HG2  GLU  94           HG1      GLU  94  18.826  -6.185   0.007
  588    HG3  GLU  94           HG2      GLU  94  17.345  -5.279   0.347
  589    HE2  GLU  94           HE       GLU  94  17.475  -7.489  -2.941
  590    H    ASP  95           H        ASP  95  18.834  -1.079  -1.232
  591    HA   ASP  95           HA       ASP  95  21.636  -0.852  -1.792
  592    HB2  ASP  95           HB1      ASP  95  19.867  -0.102  -3.373
  593    HB3  ASP  95           HB2      ASP  95  19.437   1.178  -2.231
  594    HD2  ASP  95           HD       ASP  95  22.852   1.572  -4.219
  595    H    ALA  96           H        ALA  96  19.335   0.863   0.286
  596    HA   ALA  96           HA       ALA  96  21.072   2.845   1.233
  597    HB1  ALA  96           HB1      ALA  96  19.250   2.090   3.297
  598    HB2  ALA  96           HB2      ALA  96  19.216   3.508   2.247
  599    HB3  ALA  96           HB3      ALA  96  18.425   2.015   1.739
  600    H    THR  97           H        THR  97  22.550   2.931   2.846
  601    HA   THR  97           HA       THR  97  22.944   0.537   4.505
  602    HB   THR  97           HB       THR  97  25.179   2.020   3.106
  603    HG1  THR  97           HG1      THR  97  23.805  -0.380   2.564
  604   HG21  THR  97          HG21      THR  97  26.354   1.225   4.857
  605   HG22  THR  97          HG22      THR  97  26.226  -0.320   4.018
  606   HG23  THR  97          HG23      THR  97  25.093   0.080   5.310
  607    H    GLU  98           H        GLU  98  24.572   3.681   4.051
  608    HA   GLU  98           HA       GLU  98  23.612   4.819   6.449
  609    HB2  GLU  98           HB1      GLU  98  25.752   2.963   6.770
  610    HB3  GLU  98           HB2      GLU  98  26.383   4.588   7.077
  611    HG2  GLU  98           HG1      GLU  98  25.305   4.782   9.021
  612    HG3  GLU  98           HG2      GLU  98  23.816   4.091   8.360
  613    HE2  GLU  98           HE       GLU  98  25.768   1.854  10.733
  614    H    ASN  99           H        ASN  99  23.391   6.720   5.385
  615    HA   ASN  99           HA       ASN  99  23.931   8.668   4.336
  616    HB2  ASN  99           HB1      ASN  99  26.469   8.105   5.878
  617    HB3  ASN  99           HB2      ASN  99  26.211   9.605   4.978
  618   HD21  ASN  99          HD21      ASN  99  26.629   9.403   7.772
  619   HD22  ASN  99          HD22      ASN  99  25.211   9.999   8.559
  620    H    LEU 100           H        LEU 100  23.955   6.783   2.515
  621    HA   LEU 100           HA       LEU 100  24.758   6.126   0.492
  622    HB2  LEU 100           HB1      LEU 100  25.147   8.861   0.715
  623    HB3  LEU 100           HB2      LEU 100  26.718   8.249   0.168
  624    HG   LEU 100           HG       LEU 100  25.259   7.011  -1.634
  625   HD11  LEU 100          HD11      LEU 100  23.550   9.377  -1.654
  626   HD12  LEU 100          HD12      LEU 100  23.244   8.290  -0.299
  627   HD13  LEU 100          HD13      LEU 100  23.153   7.684  -1.953
  628   HD21  LEU 100          HD21      LEU 100  26.122   8.500  -3.081
  629   HD22  LEU 100          HD22      LEU 100  26.899   9.167  -1.645
  630   HD23  LEU 100          HD23      LEU 100  25.404   9.880  -2.251
  631    H    TYR 101           H        TYR 101  27.074   6.063  -0.792
  632    HA   TYR 101           HA       TYR 101  28.822   4.591   1.047
  633    HB2  TYR 101           HB1      TYR 101  27.967   4.223  -1.715
  634    HB3  TYR 101           HB2      TYR 101  29.723   4.133  -1.548
  635    HD1  TYR 101           HD1      TYR 101  30.404   2.747   0.738
  636    HD2  TYR 101           HD2      TYR 101  26.935   2.157  -1.654
  637    HE1  TYR 101           HE1      TYR 101  30.238   0.435   1.560
  638    HE2  TYR 101           HE2      TYR 101  26.758  -0.157  -0.837
  639    HH   TYR 101           HH       TYR 101  27.719  -1.761   0.370
  640    H    PHE 102           H        PHE 102  30.891   5.165   1.408
  641    HA   PHE 102           HA       PHE 102  31.854   7.597   0.060
  642    HB2  PHE 102           HB1      PHE 102  32.029   6.597   2.847
  643    HB3  PHE 102           HB2      PHE 102  33.470   7.398   2.219
  644    HD1  PHE 102           HD1      PHE 102  33.665   9.671   2.459
  645    HD2  PHE 102           HD2      PHE 102  29.782   7.930   2.371
  646    HE1  PHE 102           HE1      PHE 102  32.670  11.875   2.911
  647    HE2  PHE 102           HE2      PHE 102  28.781  10.131   2.822
  648    HZ   PHE 102           HZ       PHE 102  30.225  12.108   3.092
  649    H    GLN 103           H        GLN 103  33.097   6.958  -1.603
  650    HA   GLN 103           HA       GLN 103  35.168   4.932  -1.067
  651    HB2  GLN 103           HB1      GLN 103  33.240   5.095  -3.140
  652    HB3  GLN 103           HB2      GLN 103  34.823   5.399  -3.872
  653    HG2  GLN 103           HG1      GLN 103  34.945   3.170  -2.038
  654    HG3  GLN 103           HG2      GLN 103  33.694   2.931  -3.267
  655   HE21  GLN 103          HE21      GLN 103  37.070   3.151  -2.634
  656   HE22  GLN 103          HE22      GLN 103  37.616   2.726  -4.216
  657    H    SER 104           H        SER 104  36.867   6.171  -0.431
  658    HA   SER 104           HA       SER 104  38.167   7.752  -2.470
  659    HB2  SER 104           HB1      SER 104  38.016   9.235   0.086
  660    HB3  SER 104           HB2      SER 104  37.954   9.831  -1.582
  661    HG   SER 104           HG       SER 104  35.954  10.076  -0.436
  662    H    LEU 105           H        LEU 105  40.201   8.865  -1.235
  663    HA   LEU 105           HA       LEU 105  41.341   6.898   0.616
  664    HB2  LEU 105           HB1      LEU 105  42.271   7.581  -2.109
  665    HB3  LEU 105           HB2      LEU 105  43.519   7.475  -0.855
  666    HG   LEU 105           HG       LEU 105  41.914   5.167  -0.596
  667   HD11  LEU 105          HD11      LEU 105  42.610   4.326  -3.014
  668   HD12  LEU 105          HD12      LEU 105  42.332   6.023  -3.403
  669   HD13  LEU 105          HD13      LEU 105  41.040   5.059  -2.689
  670   HD21  LEU 105          HD21      LEU 105  44.707   5.839  -1.381
  671   HD22  LEU 105          HD22      LEU 105  44.136   4.187  -1.615
  672   HD23  LEU 105          HD23      LEU 105  44.111   4.909  -0.005
  673    H    GLU 106           H        GLU 106  41.803   8.020   2.387
  674    HA   GLU 106           HA       GLU 106  42.460  10.834   2.248
  675    HB2  GLU 106           HB1      GLU 106  41.446   9.012   4.230
  676    HB3  GLU 106           HB2      GLU 106  42.848   9.878   4.876
  677    HG2  GLU 106           HG1      GLU 106  41.835  11.996   4.508
  678    HG3  GLU 106           HG2      GLU 106  40.526  11.265   3.569
  679    HE2  GLU 106           HE       GLU 106  40.239  11.314   7.490
  680    H    HIS 107           H        HIS 107  44.409  11.772   2.706
  681    HA   HIS 107           HA       HIS 107  46.725   9.996   2.599
  682    HB2  HIS 107           HB1      HIS 107  46.196  12.845   1.923
  683    HB3  HIS 107           HB2      HIS 107  47.828  12.438   2.462
  684    HD1  HIS 107           HD1      HIS 107  45.492  10.572   0.102
  685    HD2  HIS 107           HD2      HIS 107  49.313  12.201   0.220
  686    HE1  HIS 107           HE1      HIS 107  46.541   9.988  -2.108
  687    HE2  HIS 107           HE2      HIS 107  48.876  10.983  -2.038
  688    H    HIS 108           H        HIS 108  48.699  10.883   3.867
  689    HA   HIS 108           HA       HIS 108  47.876  11.781   6.540
  690    HB2  HIS 108           HB1      HIS 108  49.047   9.208   5.793
  691    HB3  HIS 108           HB2      HIS 108  49.979  10.046   7.038
  692    HD1  HIS 108           HD1      HIS 108  46.243  10.346   6.897
  693    HD2  HIS 108           HD2      HIS 108  49.158   8.360   9.091
  694    HE1  HIS 108           HE1      HIS 108  45.041   9.364   8.875
  695    HE2  HIS 108           HE2      HIS 108  46.823   8.149  10.218
  696    H    HIS 109           H        HIS 109  49.098  13.374   7.328
  697    HA   HIS 109           HA       HIS 109  51.142  14.560   5.784
  698    HB2  HIS 109           HB1      HIS 109  50.337  14.962   8.674
  699    HB3  HIS 109           HB2      HIS 109  51.517  15.972   7.834
  700    HD1  HIS 109           HD1      HIS 109  50.518  17.196   5.587
  701    HD2  HIS 109           HD2      HIS 109  47.783  15.869   8.419
  702    HE1  HIS 109           HE1      HIS 109  48.389  18.442   5.101
  703    HE2  HIS 109           HE2      HIS 109  46.715  17.631   6.830
  704    H    HIS 110           H        HIS 110  53.115  13.782   5.486
  705    HA   HIS 110           HA       HIS 110  54.322  12.051   7.499
  706    HB2  HIS 110           HB1      HIS 110  56.063  11.656   5.758
  707    HB3  HIS 110           HB2      HIS 110  54.431  11.230   5.238
  708    HD1  HIS 110           HD1      HIS 110  53.309  12.728   3.431
  709    HD2  HIS 110           HD2      HIS 110  57.238  13.748   4.320
  710    HE1  HIS 110           HE1      HIS 110  54.034  14.282   1.592
  711    HE2  HIS 110           HE2      HIS 110  56.435  14.907   2.133
  712    H    HIS 111           H        HIS 111  54.844  15.155   5.924
  713    HA   HIS 111           HA       HIS 111  56.172  16.929   6.439
  714    HB2  HIS 111           HB1      HIS 111  55.226  16.014   8.836
  715    HB3  HIS 111           HB2      HIS 111  56.971  15.956   9.103
  716    HD1  HIS 111           HD1      HIS 111  54.620  18.540   7.568
  717    HD2  HIS 111           HD2      HIS 111  57.816  18.260  10.207
  718    HE1  HIS 111           HE1      HIS 111  55.058  20.891   8.346
  719    HE2  HIS 111           HE2      HIS 111  57.012  20.721   9.959
  720    H    HIS 112           H        HIS 112  58.479  17.452   7.427
  721    HA   HIS 112           HA       HIS 112  60.303  15.702   6.024
  722    HB2  HIS 112           HB1      HIS 112  60.446  18.196   5.899
  723    HB3  HIS 112           HB2      HIS 112  60.917  18.209   7.601
  724    HD1  HIS 112           HD1      HIS 112  62.246  15.718   5.100
  725    HD2  HIS 112           HD2      HIS 112  63.518  19.041   7.244
  726    HE1  HIS 112           HE1      HIS 112  64.733  15.830   4.751
  727    HE2  HIS 112           HE2      HIS 112  65.512  17.862   6.061
  Start of MODEL   61
    1    H1   MET  18           H        MET  18 -51.255  22.372 -49.355
    2    HA   MET  18           HA       MET  18 -49.810  20.788 -50.981
    3    HB2  MET  18           HB1      MET  18 -49.124  21.700 -48.184
    4    HB3  MET  18           HB2      MET  18 -47.951  20.921 -49.257
    5    HG2  MET  18           HG1      MET  18 -47.753  22.733 -50.617
    6    HG3  MET  18           HG2      MET  18 -49.419  23.248 -50.338
    7    HE1  MET  18           HE1      MET  18 -46.936  24.760 -50.708
    8    HE2  MET  18           HE2      MET  18 -47.491  26.148 -49.770
    9    HE3  MET  18           HE3      MET  18 -46.011  25.306 -49.309
   10    H    LEU  19           H        LEU  19 -50.899  19.881 -47.731
   11    HA   LEU  19           HA       LEU  19 -51.130  17.865 -46.707
   12    HB2  LEU  19           HB1      LEU  19 -51.988  17.508 -49.304
   13    HB3  LEU  19           HB2      LEU  19 -50.811  16.202 -49.081
   14    HG   LEU  19           HG       LEU  19 -52.880  16.546 -46.979
   15   HD11  LEU  19          HD11      LEU  19 -54.587  15.460 -48.194
   16   HD12  LEU  19          HD12      LEU  19 -53.517  15.142 -49.560
   17   HD13  LEU  19          HD13      LEU  19 -54.035  16.791 -49.212
   18   HD21  LEU  19          HD21      LEU  19 -51.843  14.667 -46.384
   19   HD22  LEU  19          HD22      LEU  19 -51.024  14.534 -47.941
   20   HD23  LEU  19          HD23      LEU  19 -52.658  13.898 -47.747
   21    H    VAL  20           H        VAL  20 -49.291  17.664 -45.531
   22    HA   VAL  20           HA       VAL  20 -46.917  16.534 -46.844
   23    HB   VAL  20           HB       VAL  20 -46.600  18.633 -45.566
   24   HG11  VAL  20          HG11      VAL  20 -48.329  17.596 -43.763
   25   HG12  VAL  20          HG12      VAL  20 -46.789  17.276 -42.964
   26   HG13  VAL  20          HG13      VAL  20 -47.221  18.924 -43.422
   27   HG21  VAL  20          HG21      VAL  20 -45.167  16.437 -44.115
   28   HG22  VAL  20          HG22      VAL  20 -44.863  16.746 -45.824
   29   HG23  VAL  20          HG23      VAL  20 -44.560  18.010 -44.632
   30    H    LEU  21           H        LEU  21 -45.963  14.657 -46.129
   31    HA   LEU  21           HA       LEU  21 -47.678  12.906 -44.557
   32    HB2  LEU  21           HB1      LEU  21 -45.247  12.464 -46.276
   33    HB3  LEU  21           HB2      LEU  21 -45.897  11.196 -45.224
   34    HG   LEU  21           HG       LEU  21 -48.049  12.182 -46.778
   35   HD11  LEU  21          HD11      LEU  21 -45.485  11.873 -48.272
   36   HD12  LEU  21          HD12      LEU  21 -46.782  13.047 -48.493
   37   HD13  LEU  21          HD13      LEU  21 -47.002  11.380 -49.023
   38   HD21  LEU  21          HD21      LEU  21 -47.885   9.940 -45.881
   39   HD22  LEU  21          HD22      LEU  21 -46.474   9.612 -46.887
   40   HD23  LEU  21          HD23      LEU  21 -48.049   9.872 -47.636
   41    H    ASP  22           H        ASP  22 -47.353  12.508 -42.476
   42    HA   ASP  22           HA       ASP  22 -44.891  13.441 -41.218
   43    HB2  ASP  22           HB1      ASP  22 -46.073  13.136 -39.099
   44    HB3  ASP  22           HB2      ASP  22 -47.039  14.103 -40.220
   45    HD2  ASP  22           HD       ASP  22 -48.325  10.411 -39.492
   46    H    PHE  23           H        PHE  23 -43.842  12.091 -39.572
   47    HA   PHE  23           HA       PHE  23 -44.139   9.209 -40.028
   48    HB2  PHE  23           HB1      PHE  23 -41.620  10.844 -40.294
   49    HB3  PHE  23           HB2      PHE  23 -41.561   9.120 -39.921
   50    HD1  PHE  23           HD1      PHE  23 -41.575   7.550 -41.617
   51    HD2  PHE  23           HD2      PHE  23 -42.968  11.492 -42.416
   52    HE1  PHE  23           HE1      PHE  23 -41.760   6.997 -44.007
   53    HE2  PHE  23           HE2      PHE  23 -43.156  10.945 -44.806
   54    HZ   PHE  23           HZ       PHE  23 -42.553   8.695 -45.605
   55    H    ASN  24           H        ASN  24 -45.135  10.609 -37.853
   56    HA   ASN  24           HA       ASN  24 -45.213  10.547 -35.581
   57    HB2  ASN  24           HB1      ASN  24 -43.021   8.473 -35.669
   58    HB3  ASN  24           HB2      ASN  24 -44.304   8.660 -34.467
   59   HD21  ASN  24          HD21      ASN  24 -43.348   7.057 -37.242
   60   HD22  ASN  24          HD22      ASN  24 -44.861   6.335 -37.660
   61    H    ASN  25           H        ASN  25 -43.717  10.675 -33.543
   62    HA   ASN  25           HA       ASN  25 -41.087  11.675 -33.852
   63    HB2  ASN  25           HB1      ASN  25 -42.995  13.543 -34.547
   64    HB3  ASN  25           HB2      ASN  25 -42.674  13.927 -32.852
   65   HD21  ASN  25          HD21      ASN  25 -42.002  15.294 -35.427
   66   HD22  ASN  25          HD22      ASN  25 -40.303  15.594 -35.331
   67    H    ILE  26           H        ILE  26 -40.186  12.476 -31.802
   68    HA   ILE  26           HA       ILE  26 -41.785  11.871 -29.430
   69    HB   ILE  26           HB       ILE  26 -40.015  10.504 -28.441
   70   HG12  ILE  26          HG11      ILE  26 -38.615   9.896 -30.923
   71   HG13  ILE  26          HG12      ILE  26 -38.422  11.591 -30.447
   72   HG21  ILE  26          HG21      ILE  26 -40.974   9.497 -31.116
   73   HG22  ILE  26          HG22      ILE  26 -40.325   8.490 -29.823
   74   HG23  ILE  26          HG23      ILE  26 -41.830   9.376 -29.579
   75   HD11  ILE  26          HD11      ILE  26 -37.773  10.717 -28.151
   76   HD12  ILE  26          HD12      ILE  26 -37.622   9.140 -28.926
   77   HD13  ILE  26          HD13      ILE  26 -36.618  10.486 -29.463
   78    H    ARG  27           H        ARG  27 -40.996  12.809 -27.498
   79    HA   ARG  27           HA       ARG  27 -38.596  14.308 -27.363
   80    HB2  ARG  27           HB1      ARG  27 -40.916  15.622 -28.508
   81    HB3  ARG  27           HB2      ARG  27 -40.373  16.438 -27.034
   82    HG2  ARG  27           HG1      ARG  27 -38.003  16.043 -28.319
   83    HG3  ARG  27           HG2      ARG  27 -39.117  16.297 -29.673
   84    HD2  ARG  27           HD1      ARG  27 -38.752  18.487 -29.298
   85    HD3  ARG  27           HD2      ARG  27 -39.905  18.265 -27.975
   86    HE   ARG  27           HE       ARG  27 -37.455  17.619 -26.913
   87   HH11  ARG  27          HH11      ARG  27 -38.874  20.403 -28.450
   88   HH12  ARG  27          HH12      ARG  27 -37.896  21.541 -27.586
   89   HH21  ARG  27          HH21      ARG  27 -36.161  19.109 -25.769
   90   HH22  ARG  27          HH22      ARG  27 -36.352  20.805 -26.062
   91    H    SER  28           H        SER  28 -38.729  15.889 -25.396
   92    HA   SER  28           HA       SER  28 -38.956  16.091 -23.142
   93    HB2  SER  28           HB1      SER  28 -41.516  16.083 -24.181
   94    HB3  SER  28           HB2      SER  28 -41.595  14.832 -22.927
   95    HG   SER  28           HG       SER  28 -40.734  17.514 -22.583
   96    H    SER  29           H        SER  29 -40.041  14.631 -21.157
   97    HA   SER  29           HA       SER  29 -39.569  12.847 -19.821
   98    HB2  SER  29           HB1      SER  29 -39.794  11.084 -22.255
   99    HB3  SER  29           HB2      SER  29 -40.321  10.764 -20.594
  100    HG   SER  29           HG       SER  29 -42.188  11.507 -21.165
  101    H    ALA  30           H        ALA  30 -37.369  13.580 -19.573
  102    HA   ALA  30           HA       ALA  30 -35.473  11.568 -20.484
  103    HB1  ALA  30           HB1      ALA  30 -34.216  14.145 -20.728
  104    HB2  ALA  30           HB2      ALA  30 -34.336  12.838 -21.907
  105    HB3  ALA  30           HB3      ALA  30 -35.625  14.035 -21.784
  106    H    ASP  31           H        ASP  31 -33.820  11.202 -19.061
  107    HA   ASP  31           HA       ASP  31 -33.081  13.039 -17.011
  108    HB2  ASP  31           HB1      ASP  31 -35.382  11.715 -16.405
  109    HB3  ASP  31           HB2      ASP  31 -34.173  10.609 -15.740
  110    HD2  ASP  31           HD       ASP  31 -33.103  13.076 -13.427
  111    H    LEU  32           H        LEU  32 -31.012  12.659 -16.579
  112    HA   LEU  32           HA       LEU  32 -29.993   9.974 -16.303
  113    HB2  LEU  32           HB1      LEU  32 -28.108  10.557 -17.981
  114    HB3  LEU  32           HB2      LEU  32 -29.664   9.957 -18.581
  115    HG   LEU  32           HG       LEU  32 -28.582  11.886 -19.846
  116   HD11  LEU  32          HD11      LEU  32 -30.613  12.353 -20.659
  117   HD12  LEU  32          HD12      LEU  32 -31.235  12.860 -19.090
  118   HD13  LEU  32          HD13      LEU  32 -31.180  11.147 -19.505
  119   HD21  LEU  32          HD21      LEU  32 -28.688  14.056 -18.990
  120   HD22  LEU  32          HD22      LEU  32 -28.062  13.096 -17.649
  121   HD23  LEU  32          HD23      LEU  32 -29.758  13.583 -17.670
  122    H    HIS  33           H        HIS  33 -30.263  12.409 -14.695
  123    HA   HIS  33           HA       HIS  33 -27.421  12.772 -14.016
  124    HB2  HIS  33           HB1      HIS  33 -27.867  15.080 -13.372
  125    HB3  HIS  33           HB2      HIS  33 -28.293  14.819 -15.066
  126    HD1  HIS  33           HD1      HIS  33 -29.651  16.125 -11.971
  127    HD2  HIS  33           HD2      HIS  33 -31.193  14.471 -15.456
  128    HE1  HIS  33           HE1      HIS  33 -32.078  16.778 -12.008
  129    HE2  HIS  33           HE2      HIS  33 -33.023  15.768 -14.139
  130    H    GLY  34           H        GLY  34 -26.892  12.722 -11.862
  131    HA2  GLY  34           HA2      GLY  34 -28.981  12.705  -9.844
  132    HA3  GLY  34           HA3      GLY  34 -28.153  11.171 -10.074
  133    HA1  GLY  34           HA1      GLY  34 -28.378  13.285 -10.126
  134    H    ALA  35           H        ALA  35 -28.128  14.102  -8.442
  135    HA   ALA  35           HA       ALA  35 -26.706  15.052  -6.941
  136    HB1  ALA  35           HB1      ALA  35 -25.681  13.624  -5.525
  137    HB2  ALA  35           HB2      ALA  35 -26.580  12.414  -6.443
  138    HB3  ALA  35           HB3      ALA  35 -24.887  12.733  -6.825
  139    H    ARG  36           H        ARG  36 -24.296  15.560  -6.541
  140    HA   ARG  36           HA       ARG  36 -22.517  15.299  -8.770
  141    HB2  ARG  36           HB1      ARG  36 -22.353  17.805  -9.135
  142    HB3  ARG  36           HB2      ARG  36 -23.793  17.010  -9.789
  143    HG2  ARG  36           HG1      ARG  36 -25.051  17.731  -7.761
  144    HG3  ARG  36           HG2      ARG  36 -23.619  18.652  -7.274
  145    HD2  ARG  36           HD1      ARG  36 -24.324  19.217 -10.027
  146    HD3  ARG  36           HD2      ARG  36 -25.688  19.510  -8.938
  147    HE   ARG  36           HE       ARG  36 -23.248  20.646  -7.967
  148   HH11  ARG  36          HH11      ARG  36 -25.929  21.130 -10.135
  149   HH12  ARG  36          HH12      ARG  36 -25.799  22.858 -10.119
  150   HH21  ARG  36          HH21      ARG  36 -23.066  22.919  -7.939
  151   HH22  ARG  36          HH22      ARG  36 -24.169  23.874  -8.871
  152    H    LYS  37           H        LYS  37 -21.914  14.454  -6.394
  153    HA   LYS  37           HA       LYS  37 -19.702  16.055  -5.589
  154    HB2  LYS  37           HB1      LYS  37 -20.470  16.274  -3.181
  155    HB3  LYS  37           HB2      LYS  37 -21.239  17.361  -4.348
  156    HG2  LYS  37           HG1      LYS  37 -23.242  16.076  -4.370
  157    HG3  LYS  37           HG2      LYS  37 -22.475  14.772  -3.447
  158    HD2  LYS  37           HD1      LYS  37 -22.067  16.797  -1.733
  159    HD3  LYS  37           HD2      LYS  37 -23.541  17.376  -2.526
  160    HE2  LYS  37           HE1      LYS  37 -24.567  15.115  -2.062
  161    HE3  LYS  37           HE2      LYS  37 -23.144  14.769  -1.068
  162    HZ1  LYS  37           HZ1      LYS  37 -24.460  15.621   0.533
  163    HZ2  LYS  37           HZ2      LYS  37 -25.380  16.553  -0.538
  164    HZ3  LYS  37           HZ3      LYS  37 -23.859  17.096  -0.036
  165    H    GLY  38           H        GLY  38 -18.249  14.930  -4.271
  166    HA2  GLY  38           HA2      GLY  38 -18.393  12.851  -2.649
  167    HA3  GLY  38           HA3      GLY  38 -18.750  12.052  -4.173
  168    HA1  GLY  38           HA1      GLY  38 -17.924  13.552  -2.912
  169    H    SER  39           H        SER  39 -16.464  11.818  -2.263
  170    HA   SER  39           HA       SER  39 -14.273  12.531  -4.097
  171    HB2  SER  39           HB1      SER  39 -13.368  11.699  -1.474
  172    HB3  SER  39           HB2      SER  39 -13.100  13.234  -2.320
  173    HG   SER  39           HG       SER  39 -14.250  13.728  -0.506
  174    H    GLN  40           H        GLN  40 -12.328  10.977  -3.792
  175    HA   GLN  40           HA       GLN  40 -13.355   8.278  -4.232
  176    HB2  GLN  40           HB1      GLN  40 -11.416   9.824  -5.512
  177    HB3  GLN  40           HB2      GLN  40 -10.497   8.600  -4.621
  178    HG2  GLN  40           HG1      GLN  40 -10.880   7.188  -6.281
  179    HG3  GLN  40           HG2      GLN  40 -12.587   7.198  -5.810
  180   HE21  GLN  40          HE21      GLN  40 -10.724   7.394  -8.387
  181   HE22  GLN  40          HE22      GLN  40 -11.641   8.464  -9.386
  182    H    CYS  41           H        CYS  41 -10.509   9.706  -2.616
  183    HA   CYS  41           HA       CYS  41 -10.838   7.713  -0.476
  184    HB2  CYS  41           HB1      CYS  41  -8.313   7.652  -0.335
  185    HB3  CYS  41           HB2      CYS  41  -9.019   6.867  -1.747
  186    H    LEU  42           H        LEU  42 -10.236   8.368   1.596
  187    HA   LEU  42           HA       LEU  42 -10.025  11.278   1.916
  188    HB2  LEU  42           HB1      LEU  42 -11.520   9.221   3.240
  189    HB3  LEU  42           HB2      LEU  42 -10.451  10.019   4.407
  190    HG   LEU  42           HG       LEU  42 -12.660  11.036   4.407
  191   HD11  LEU  42          HD11      LEU  42 -10.528  12.379   4.730
  192   HD12  LEU  42          HD12      LEU  42 -11.985  13.285   4.327
  193   HD13  LEU  42          HD13      LEU  42 -10.776  12.965   3.085
  194   HD21  LEU  42          HD21      LEU  42 -12.153  11.879   1.563
  195   HD22  LEU  42          HD22      LEU  42 -13.625  12.080   2.514
  196   HD23  LEU  42          HD23      LEU  42 -13.125  10.470   1.992
  197    H    SER  43           H        SER  43  -8.384   8.286   2.526
  198    HA   SER  43           HA       SER  43  -6.044   9.764   3.430
  199    HB2  SER  43           HB1      SER  43  -7.406   9.047   5.469
  200    HB3  SER  43           HB2      SER  43  -6.995   7.381   5.023
  201    HG   SER  43           HG       SER  43  -5.504   9.157   6.345
  202    H    ASP  44           H        ASP  44  -4.132   8.218   3.664
  203    HA   ASP  44           HA       ASP  44  -3.717   6.891   1.239
  204    HB2  ASP  44           HB1      ASP  44  -1.668   5.964   2.325
  205    HB3  ASP  44           HB2      ASP  44  -1.841   7.714   2.511
  206    HD2  ASP  44           HD       ASP  44  -2.465   7.399   5.953
  207    H    THR  45           H        THR  45  -4.953   5.756   4.295
  208    HA   THR  45           HA       THR  45  -4.667   2.970   3.741
  209    HB   THR  45           HB       THR  45  -6.584   2.914   5.582
  210    HG1  THR  45           HG1      THR  45  -7.099   4.892   6.133
  211   HG21  THR  45          HG21      THR  45  -3.927   3.903   6.530
  212   HG22  THR  45          HG22      THR  45  -4.024   2.372   5.660
  213   HG23  THR  45          HG23      THR  45  -4.926   2.594   7.158
  214    H    ASP  46           H        ASP  46  -7.012   5.390   2.944
  215    HA   ASP  46           HA       ASP  46  -9.211   3.669   2.433
  216    HB2  ASP  46           HB1      ASP  46  -8.854   6.388   2.542
  217    HB3  ASP  46           HB2      ASP  46  -9.063   6.113   0.808
  218    HD2  ASP  46           HD       ASP  46 -12.357   4.920   1.328
  219    H    CYS  47           H        CYS  47  -6.404   4.600   0.604
  220    HA   CYS  47           HA       CYS  47  -7.246   4.033  -1.990
  221    HB2  CYS  47           HB1      CYS  47  -4.672   4.248  -0.573
  222    HB3  CYS  47           HB2      CYS  47  -4.629   3.218  -2.006
  223    H    ASN  48           H        ASN  48  -5.115   1.858  -0.148
  224    HA   ASN  48           HA       ASN  48  -6.802  -0.415  -0.487
  225    HB2  ASN  48           HB1      ASN  48  -5.325   0.222  -2.739
  226    HB3  ASN  48           HB2      ASN  48  -4.323  -0.993  -1.931
  227   HD21  ASN  48          HD21      ASN  48  -5.376  -3.020  -1.327
  228   HD22  ASN  48          HD22      ASN  48  -6.622  -3.643  -2.349
  229    H    THR  49           H        THR  49  -3.281   0.167  -0.451
  230    HA   THR  49           HA       THR  49  -2.883  -0.379   2.258
  231    HB   THR  49           HB       THR  49  -3.581  -2.629   1.932
  232    HG1  THR  49           HG1      THR  49  -1.616  -2.385   3.126
  233   HG21  THR  49          HG21      THR  49  -3.399  -2.657  -0.532
  234   HG22  THR  49          HG22      THR  49  -2.691  -4.091   0.211
  235   HG23  THR  49          HG23      THR  49  -1.648  -2.798  -0.382
  236    H    ARG  50           H        ARG  50  -1.562  -0.783  -0.996
  237    HA   ARG  50           HA       ARG  50   1.035   0.178   0.012
  238    HB2  ARG  50           HB1      ARG  50   2.112  -0.975  -1.804
  239    HB3  ARG  50           HB2      ARG  50   1.059  -2.115  -0.953
  240    HG2  ARG  50           HG1      ARG  50  -0.627  -1.192  -2.879
  241    HG3  ARG  50           HG2      ARG  50   0.935  -1.142  -3.712
  242    HD2  ARG  50           HD1      ARG  50  -0.311  -3.536  -2.342
  243    HD3  ARG  50           HD2      ARG  50  -0.103  -3.290  -4.082
  244    HE   ARG  50           HE       ARG  50   2.426  -3.131  -3.150
  245   HH11  ARG  50          HH11      ARG  50  -0.125  -5.461  -2.729
  246   HH12  ARG  50          HH12      ARG  50   0.955  -6.804  -2.542
  247   HH21  ARG  50          HH21      ARG  50   3.859  -4.890  -2.904
  248   HH22  ARG  50          HH22      ARG  50   3.220  -6.476  -2.641
  249    H    LYS  51           H        LYS  51  -1.239   1.829  -0.739
  250    HA   LYS  51           HA       LYS  51   0.100   3.433  -2.788
  251    HB2  LYS  51           HB1      LYS  51  -2.601   2.212  -2.976
  252    HB3  LYS  51           HB2      LYS  51  -2.453   3.894  -3.511
  253    HG2  LYS  51           HG1      LYS  51  -1.997   2.891  -5.487
  254    HG3  LYS  51           HG2      LYS  51  -0.360   2.884  -4.807
  255    HD2  LYS  51           HD1      LYS  51  -0.371   0.629  -4.407
  256    HD3  LYS  51           HD2      LYS  51  -2.126   0.582  -4.166
  257    HE2  LYS  51           HE1      LYS  51  -1.261   1.321  -6.890
  258    HE3  LYS  51           HE2      LYS  51  -0.856  -0.327  -6.384
  259    HZ1  LYS  51           HZ1      LYS  51  -3.344   0.683  -7.209
  260    HZ2  LYS  51           HZ2      LYS  51  -3.488   0.162  -5.606
  261    HZ3  LYS  51           HZ3      LYS  51  -2.938  -0.907  -6.797
  262    H    PHE  52           H        PHE  52  -0.470   5.673  -2.748
  263    HA   PHE  52           HA       PHE  52  -1.601   6.513  -0.162
  264    HB2  PHE  52           HB1      PHE  52  -0.264   8.598  -0.466
  265    HB3  PHE  52           HB2      PHE  52   0.719   7.139  -0.324
  266    HD1  PHE  52           HD1      PHE  52  -0.553   9.646  -2.703
  267    HD2  PHE  52           HD2      PHE  52   2.132   6.404  -2.076
  268    HE1  PHE  52           HE1      PHE  52   0.580  10.180  -4.821
  269    HE2  PHE  52           HE2      PHE  52   3.270   6.933  -4.192
  270    HZ   PHE  52           HZ       PHE  52   2.495   8.824  -5.568
  271    H    CYS  53           H        CYS  53  -3.023   8.265  -0.086
  272    HA   CYS  53           HA       CYS  53  -4.572   8.636  -2.511
  273    HB2  CYS  53           HB1      CYS  53  -5.705   8.190  -0.371
  274    HB3  CYS  53           HB2      CYS  53  -5.034   9.682   0.291
  275    H    LEU  54           H        LEU  54  -3.331   9.945  -3.829
  276    HA   LEU  54           HA       LEU  54  -2.068  12.328  -2.955
  277    HB2  LEU  54           HB1      LEU  54  -1.382  11.089  -4.962
  278    HB3  LEU  54           HB2      LEU  54  -2.921  11.515  -5.730
  279    HG   LEU  54           HG       LEU  54  -2.111  13.971  -5.317
  280   HD11  LEU  54          HD11      LEU  54   0.109  14.352  -5.002
  281   HD12  LEU  54          HD12      LEU  54   0.592  12.820  -5.730
  282   HD13  LEU  54          HD13      LEU  54  -0.049  12.851  -4.087
  283   HD21  LEU  54          HD21      LEU  54  -2.240  13.744  -7.528
  284   HD22  LEU  54          HD22      LEU  54  -1.740  12.053  -7.461
  285   HD23  LEU  54          HD23      LEU  54  -0.524  13.333  -7.493
  286    H    GLN  55           H        GLN  55  -2.873  14.294  -2.613
  287    HA   GLN  55           HA       GLN  55  -5.531  14.928  -3.714
  288    HB2  GLN  55           HB1      GLN  55  -4.454  15.816  -1.028
  289    HB3  GLN  55           HB2      GLN  55  -6.066  16.142  -1.683
  290    HG2  GLN  55           HG1      GLN  55  -6.325  13.579  -1.766
  291    HG3  GLN  55           HG2      GLN  55  -4.941  13.566  -0.663
  292   HE21  GLN  55          HE21      GLN  55  -7.469  12.587   0.007
  293   HE22  GLN  55          HE22      GLN  55  -8.122  13.571   1.268
  294    HA   PRO  56           HA       PRO  56  -2.641  18.109  -5.299
  295    HB2  PRO  56           HB1      PRO  56  -3.998  18.473  -7.650
  296    HB3  PRO  56           HB2      PRO  56  -2.817  17.190  -7.398
  297    HG2  PRO  56           HG1      PRO  56  -5.807  17.087  -7.202
  298    HG3  PRO  56           HG2      PRO  56  -4.676  15.934  -8.005
  299    HD2  PRO  56           HD1      PRO  56  -5.774  15.454  -5.569
  300    HD3  PRO  56           HD2      PRO  56  -4.145  14.914  -6.007
  301    H    ARG  57           H        ARG  57  -2.893  20.335  -5.444
  302    HA   ARG  57           HA       ARG  57  -5.287  21.386  -4.211
  303    HB2  ARG  57           HB1      ARG  57  -2.607  22.097  -4.190
  304    HB3  ARG  57           HB2      ARG  57  -3.368  23.359  -5.170
  305    HG2  ARG  57           HG1      ARG  57  -5.111  23.293  -3.130
  306    HG3  ARG  57           HG2      ARG  57  -3.636  22.780  -2.292
  307    HD2  ARG  57           HD1      ARG  57  -2.835  24.861  -2.282
  308    HD3  ARG  57           HD2      ARG  57  -3.057  24.989  -4.032
  309    HE   ARG  57           HE       ARG  57  -5.562  25.320  -2.913
  310   HH11  ARG  57          HH11      ARG  57  -2.471  26.916  -2.784
  311   HH12  ARG  57          HH12      ARG  57  -3.146  28.484  -2.489
  312   HH21  ARG  57          HH21      ARG  57  -6.463  27.379  -2.526
  313   HH22  ARG  57          HH22      ARG  57  -5.417  28.747  -2.341
  314    H    ASP  58           H        ASP  58  -3.903  21.178  -7.379
  315    HA   ASP  58           HA       ASP  58  -5.710  23.181  -8.474
  316    HB2  ASP  58           HB1      ASP  58  -3.382  21.613  -9.513
  317    HB3  ASP  58           HB2      ASP  58  -4.555  22.258 -10.669
  318    HD2  ASP  58           HD       ASP  58  -3.388  25.468 -10.301
  319    H    GLU  59           H        GLU  59  -5.493  19.764  -8.079
  320    HA   GLU  59           HA       GLU  59  -7.906  19.437  -9.740
  321    HB2  GLU  59           HB1      GLU  59  -5.372  18.064  -9.871
  322    HB3  GLU  59           HB2      GLU  59  -6.669  16.921  -9.492
  323    HG2  GLU  59           HG1      GLU  59  -6.867  16.815 -11.728
  324    HG3  GLU  59           HG2      GLU  59  -7.843  18.271 -11.485
  325    HE2  GLU  59           HE       GLU  59  -4.478  18.571 -13.466
  326    H    LYS  60           H        LYS  60  -8.850  17.085  -9.092
  327    HA   LYS  60           HA       LYS  60  -9.600  17.392  -6.304
  328    HB2  LYS  60           HB1      LYS  60 -10.670  15.927  -8.669
  329    HB3  LYS  60           HB2      LYS  60 -11.044  15.279  -7.064
  330    HG2  LYS  60           HG1      LYS  60 -12.048  17.394  -6.404
  331    HG3  LYS  60           HG2      LYS  60 -11.632  18.088  -7.980
  332    HD2  LYS  60           HD1      LYS  60 -13.627  17.400  -8.709
  333    HD3  LYS  60           HD2      LYS  60 -12.999  15.747  -8.599
  334    HE2  LYS  60           HE1      LYS  60 -13.682  15.983  -6.065
  335    HE3  LYS  60           HE2      LYS  60 -14.751  17.240  -6.702
  336    HZ1  LYS  60           HZ1      LYS  60 -16.145  15.697  -7.418
  337    HZ2  LYS  60           HZ2      LYS  60 -15.188  14.505  -6.697
  338    HZ3  LYS  60           HZ3      LYS  60 -14.933  14.929  -8.314
  339    HA   PRO  61           HA       PRO  61  -7.213  14.125  -4.610
  340    HB2  PRO  61           HB1      PRO  61  -8.959  12.963  -2.849
  341    HB3  PRO  61           HB2      PRO  61  -8.233  14.548  -2.595
  342    HG2  PRO  61           HG1      PRO  61 -10.929  13.849  -3.707
  343    HG3  PRO  61           HG2      PRO  61 -10.489  15.100  -2.484
  344    HD2  PRO  61           HD1      PRO  61 -10.984  15.704  -5.084
  345    HD3  PRO  61           HD2      PRO  61  -9.796  16.583  -4.108
  346    H    PHE  62           H        PHE  62  -6.741  11.953  -4.818
  347    HA   PHE  62           HA       PHE  62  -8.636   9.975  -5.548
  348    HB2  PHE  62           HB1      PHE  62  -7.718   9.525  -7.844
  349    HB3  PHE  62           HB2      PHE  62  -8.672  11.003  -7.707
  350    HD1  PHE  62           HD1      PHE  62  -7.837  12.992  -8.521
  351    HD2  PHE  62           HD2      PHE  62  -5.138   9.841  -7.573
  352    HE1  PHE  62           HE1      PHE  62  -5.979  14.309  -9.452
  353    HE2  PHE  62           HE2      PHE  62  -3.276  11.153  -8.502
  354    HZ   PHE  62           HZ       PHE  62  -3.694  13.390  -9.443
  355    H    CYS  63           H        CYS  63  -7.345   7.977  -6.514
  356    HA   CYS  63           HA       CYS  63  -5.082   7.596  -4.700
  357    HB2  CYS  63           HB1      CYS  63  -7.088   6.014  -4.790
  358    HB3  CYS  63           HB2      CYS  63  -6.452   5.470  -6.344
  359    H    ALA  64           H        ALA  64  -3.059   7.590  -5.411
  360    HA   ALA  64           HA       ALA  64  -2.578   7.101  -8.279
  361    HB1  ALA  64           HB1      ALA  64  -0.436   8.619  -7.408
  362    HB2  ALA  64           HB2      ALA  64  -1.802   9.186  -8.371
  363    HB3  ALA  64           HB3      ALA  64  -1.830   9.355  -6.616
  364    H    THR  65           H        THR  65  -1.369   5.376  -8.671
  365    HA   THR  65           HA       THR  65  -0.313   3.676  -6.774
  366    HB   THR  65           HB       THR  65  -0.602   2.837  -8.978
  367    HG1  THR  65           HG1      THR  65   1.118   1.791  -8.076
  368   HG21  THR  65          HG21      THR  65   0.752   3.647 -10.890
  369   HG22  THR  65          HG22      THR  65   1.386   4.933  -9.861
  370   HG23  THR  65          HG23      THR  65  -0.334   4.880 -10.249
  371    H    CYS  66           H        CYS  66   1.938   3.115  -6.317
  372    HA   CYS  66           HA       CYS  66   3.397   5.229  -5.263
  373    HB2  CYS  66           HB1      CYS  66   5.232   3.641  -4.973
  374    HB3  CYS  66           HB2      CYS  66   3.689   2.900  -4.546
  375    H    ARG  67           H        ARG  67   5.828   5.545  -5.873
  376    HA   ARG  67           HA       ARG  67   5.885   6.246  -8.728
  377    HB2  ARG  67           HB1      ARG  67   7.650   7.366  -6.547
  378    HB3  ARG  67           HB2      ARG  67   7.415   8.001  -8.182
  379    HG2  ARG  67           HG1      ARG  67   4.863   7.896  -6.962
  380    HG3  ARG  67           HG2      ARG  67   5.986   8.624  -5.801
  381    HD2  ARG  67           HD1      ARG  67   6.698  10.265  -7.453
  382    HD3  ARG  67           HD2      ARG  67   5.667   9.499  -8.669
  383    HE   ARG  67           HE       ARG  67   4.839  11.300  -6.588
  384   HH11  ARG  67          HH11      ARG  67   3.832   8.767  -8.753
  385   HH12  ARG  67          HH12      ARG  67   2.163   9.235  -8.734
  386   HH21  ARG  67          HH21      ARG  67   2.646  11.928  -6.556
  387   HH22  ARG  67          HH22      ARG  67   1.491  11.034  -7.485
  388    H    GLY  68           H        GLY  68   8.183   6.325  -9.648
  389    HA2  GLY  68           HA2      GLY  68   9.282   3.696  -9.459
  390    HA3  GLY  68           HA3      GLY  68   9.913   5.018 -10.429
  391    HA1  GLY  68           HA1      GLY  68   9.146   4.087  -8.678
  392    H    LEU  69           H        LEU  69  12.027   4.256  -9.804
  393    HA   LEU  69           HA       LEU  69  12.790   4.519  -7.021
  394    HB2  LEU  69           HB1      LEU  69  14.139   3.623  -9.536
  395    HB3  LEU  69           HB2      LEU  69  15.122   4.097  -8.140
  396    HG   LEU  69           HG       LEU  69  13.059   1.895  -8.164
  397   HD11  LEU  69          HD11      LEU  69  15.085   1.398  -9.481
  398   HD12  LEU  69          HD12      LEU  69  14.932   0.379  -8.049
  399   HD13  LEU  69          HD13      LEU  69  16.067   1.729  -8.053
  400   HD21  LEU  69          HD21      LEU  69  13.174   2.855  -5.979
  401   HD22  LEU  69          HD22      LEU  69  14.936   2.884  -6.024
  402   HD23  LEU  69          HD23      LEU  69  14.080   1.343  -5.956
  403    H    ARG  70           H        ARG  70  13.926   5.966 -10.081
  404    HA   ARG  70           HA       ARG  70  15.513   7.954  -8.954
  405    HB2  ARG  70           HB1      ARG  70  14.202   7.517 -11.582
  406    HB3  ARG  70           HB2      ARG  70  14.726   9.168 -11.223
  407    HG2  ARG  70           HG1      ARG  70  16.837   7.383 -10.520
  408    HG3  ARG  70           HG2      ARG  70  16.279   7.005 -12.157
  409    HD2  ARG  70           HD1      ARG  70  16.757   9.153 -12.961
  410    HD3  ARG  70           HD2      ARG  70  16.802   9.837 -11.331
  411    HE   ARG  70           HE       ARG  70  18.967   8.617 -12.737
  412   HH11  ARG  70          HH11      ARG  70  17.640   9.196  -9.571
  413   HH12  ARG  70          HH12      ARG  70  19.169   9.091  -8.766
  414   HH21  ARG  70          HH21      ARG  70  20.989   8.477 -11.689
  415   HH22  ARG  70          HH22      ARG  70  21.074   8.682  -9.972
  416    H    ARG  71           H        ARG  71  12.076   7.740  -9.247
  417    HA   ARG  71           HA       ARG  71  11.313  10.407  -9.172
  418    HB2  ARG  71           HB1      ARG  71  10.093   7.843  -8.260
  419    HB3  ARG  71           HB2      ARG  71   9.356   9.354  -7.707
  420    HG2  ARG  71           HG1      ARG  71   9.921   8.926 -10.620
  421    HG3  ARG  71           HG2      ARG  71   8.474   8.241  -9.860
  422    HD2  ARG  71           HD1      ARG  71   7.717  10.426  -9.172
  423    HD3  ARG  71           HD2      ARG  71   9.231  11.155  -9.727
  424    HE   ARG  71           HE       ARG  71   8.000   9.837 -11.883
  425   HH11  ARG  71          HH11      ARG  71   7.589  12.628  -9.845
  426   HH12  ARG  71          HH12      ARG  71   6.749  13.547 -11.050
  427   HH21  ARG  71          HH21      ARG  71   6.897  11.037 -13.480
  428   HH22  ARG  71          HH22      ARG  71   6.356  12.641 -13.117
  429    H    ARG  72           H        ARG  72  10.948  11.893  -7.550
  430    HA   ARG  72           HA       ARG  72  12.598  11.613  -5.210
  431    HB2  ARG  72           HB1      ARG  72  10.683  13.851  -5.911
  432    HB3  ARG  72           HB2      ARG  72  12.013  13.912  -4.746
  433    HG2  ARG  72           HG1      ARG  72  13.169  13.121  -7.182
  434    HG3  ARG  72           HG2      ARG  72  12.047  14.439  -7.559
  435    HD2  ARG  72           HD1      ARG  72  13.956  14.669  -5.248
  436    HD3  ARG  72           HD2      ARG  72  14.482  15.014  -6.901
  437    HE   ARG  72           HE       ARG  72  12.094  16.418  -6.279
  438   HH11  ARG  72          HH11      ARG  72  15.533  16.427  -5.744
  439   HH12  ARG  72          HH12      ARG  72  15.622  18.139  -5.494
  440   HH21  ARG  72          HH21      ARG  72  12.196  18.674  -5.952
  441   HH22  ARG  72          HH22      ARG  72  13.723  19.416  -5.611
  442    H    CYS  73           H        CYS  73  11.911  11.706  -3.046
  443    HA   CYS  73           HA       CYS  73   9.064  11.414  -2.493
  444    HB2  CYS  73           HB1      CYS  73   9.356   9.375  -1.198
  445    HB3  CYS  73           HB2      CYS  73   9.861   9.115  -2.868
  446    H    GLN  74           H        GLN  74   8.558  11.589  -0.203
  447    HA   GLN  74           HA       GLN  74  10.639  13.063   1.273
  448    HB2  GLN  74           HB1      GLN  74   7.736  13.568   0.862
  449    HB3  GLN  74           HB2      GLN  74   8.408  13.952   2.456
  450    HG2  GLN  74           HG1      GLN  74   9.844  15.578   1.614
  451    HG3  GLN  74           HG2      GLN  74   9.716  14.958  -0.038
  452   HE21  GLN  74          HE21      GLN  74   7.736  16.384   2.529
  453   HE22  GLN  74          HE22      GLN  74   6.726  17.309   1.475
  454    H    ARG  75           H        ARG  75   8.281  10.527   1.347
  455    HA   ARG  75           HA       ARG  75   9.120   9.877   4.095
  456    HB2  ARG  75           HB1      ARG  75   6.565  10.600   3.342
  457    HB3  ARG  75           HB2      ARG  75   6.499   8.832   3.323
  458    HG2  ARG  75           HG1      ARG  75   7.835   9.853   5.696
  459    HG3  ARG  75           HG2      ARG  75   6.175  10.453   5.527
  460    HD2  ARG  75           HD1      ARG  75   5.788   7.850   4.915
  461    HD3  ARG  75           HD2      ARG  75   7.161   7.715   6.022
  462    HE   ARG  75           HE       ARG  75   4.472   8.339   6.715
  463   HH11  ARG  75          HH11      ARG  75   7.788   8.946   7.582
  464   HH12  ARG  75          HH12      ARG  75   7.427   9.290   9.242
  465   HH21  ARG  75          HH21      ARG  75   3.984   8.789   8.897
  466   HH22  ARG  75          HH22      ARG  75   5.263   9.198   9.989
  467    H    ASP  76           H        ASP  76   8.644   7.501   4.603
  468    HA   ASP  76           HA       ASP  76   9.939   5.915   2.576
  469    HB2  ASP  76           HB1      ASP  76  10.613   5.530   4.841
  470    HB3  ASP  76           HB2      ASP  76   8.939   5.275   5.353
  471    HD2  ASP  76           HD       ASP  76   9.400   1.928   4.877
  472    H    ALA  77           H        ALA  77   6.806   5.790   4.263
  473    HA   ALA  77           HA       ALA  77   5.756   3.617   2.823
  474    HB1  ALA  77           HB1      ALA  77   4.915   4.738   4.994
  475    HB2  ALA  77           HB2      ALA  77   4.016   5.796   3.906
  476    HB3  ALA  77           HB3      ALA  77   3.737   4.055   3.872
  477    H    MET  78           H        MET  78   6.099   6.967   2.023
  478    HA   MET  78           HA       MET  78   4.096   7.312   0.128
  479    HB2  MET  78           HB1      MET  78   6.711   8.552   0.718
  480    HB3  MET  78           HB2      MET  78   6.134   8.762  -0.943
  481    HG2  MET  78           HG1      MET  78   3.895   9.457   0.252
  482    HG3  MET  78           HG2      MET  78   4.986   9.780   1.603
  483    HE1  MET  78           HE1      MET  78   5.040  10.034  -2.204
  484    HE2  MET  78           HE2      MET  78   3.751  11.210  -1.947
  485    HE3  MET  78           HE3      MET  78   5.325  11.742  -2.538
  486    H    CYS  79           H        CYS  79   7.027   5.472  -0.034
  487    HA   CYS  79           HA       CYS  79   6.669   5.057  -2.921
  488    HB2  CYS  79           HB1      CYS  79   8.933   5.713  -1.711
  489    HB3  CYS  79           HB2      CYS  79   9.018   3.974  -1.423
  490    H    CYS  80           H        CYS  80   6.737   2.913  -3.779
  491    HA   CYS  80           HA       CYS  80   5.057   1.091  -2.565
  492    HB2  CYS  80           HB1      CYS  80   6.876   1.096  -4.866
  493    HB3  CYS  80           HB2      CYS  80   6.638  -0.506  -4.164
  494    HA   PRO  81           HA       PRO  81   7.341  -1.177   0.416
  495    HB2  PRO  81           HB1      PRO  81   6.439  -3.735   0.035
  496    HB3  PRO  81           HB2      PRO  81   5.459  -2.454   0.748
  497    HG2  PRO  81           HG1      PRO  81   5.521  -3.449  -2.081
  498    HG3  PRO  81           HG2      PRO  81   4.101  -3.076  -1.034
  499    HD2  PRO  81           HD1      PRO  81   4.990  -1.378  -2.957
  500    HD3  PRO  81           HD2      PRO  81   4.273  -0.814  -1.438
  501    H    GLY  82           H        GLY  82   9.316  -2.087   0.623
  502    HA2  GLY  82           HA2      GLY  82  10.885  -3.837  -0.037
  503    HA3  GLY  82           HA3      GLY  82  10.400  -3.550  -1.701
  504    HA1  GLY  82           HA1      GLY  82  10.828  -3.030   0.316
  505    H    THR  83           H        THR  83  10.419  -0.566  -0.962
  506    HA   THR  83           HA       THR  83  13.334  -0.217  -1.237
  507    HB   THR  83           HB       THR  83  12.524   2.058  -2.303
  508    HG1  THR  83           HG1      THR  83  10.360   0.311  -2.934
  509   HG21  THR  83          HG21      THR  83  12.090   0.310  -4.442
  510   HG22  THR  83          HG22      THR  83  13.176  -0.551  -3.352
  511   HG23  THR  83          HG23      THR  83  13.618   1.044  -3.961
  512    H    LEU  84           H        LEU  84  13.968   2.146  -0.669
  513    HA   LEU  84           HA       LEU  84  12.489   3.078   1.688
  514    HB2  LEU  84           HB1      LEU  84  15.450   2.514   1.522
  515    HB3  LEU  84           HB2      LEU  84  14.702   3.481   2.805
  516    HG   LEU  84           HG       LEU  84  13.981   0.606   2.263
  517   HD11  LEU  84          HD11      LEU  84  15.959   1.742   4.233
  518   HD12  LEU  84          HD12      LEU  84  16.319   0.694   2.862
  519   HD13  LEU  84          HD13      LEU  84  15.379   0.077   4.220
  520   HD21  LEU  84          HD21      LEU  84  13.092   2.685   4.133
  521   HD22  LEU  84          HD22      LEU  84  13.459   1.128   4.876
  522   HD23  LEU  84          HD23      LEU  84  12.270   1.227   3.577
  523    H    CYS  85           H        CYS  85  12.472   5.266   1.994
  524    HA   CYS  85           HA       CYS  85  13.169   6.896  -0.252
  525    HB2  CYS  85           HB1      CYS  85  11.176   7.172   1.355
  526    HB3  CYS  85           HB2      CYS  85  12.333   7.927   2.452
  527    H    VAL  86           H        VAL  86  15.285   7.229  -0.608
  528    HA   VAL  86           HA       VAL  86  16.844   8.430   1.581
  529    HB   VAL  86           HB       VAL  86  17.896   6.428  -0.423
  530   HG11  VAL  86          HG11      VAL  86  19.230   8.124   1.658
  531   HG12  VAL  86          HG12      VAL  86  19.936   6.594   1.136
  532   HG13  VAL  86          HG13      VAL  86  19.670   7.889  -0.033
  533   HG21  VAL  86          HG21      VAL  86  17.014   4.973   1.046
  534   HG22  VAL  86          HG22      VAL  86  18.413   5.395   2.033
  535   HG23  VAL  86          HG23      VAL  86  16.863   6.188   2.316
  536    H    ASN  87           H        ASN  87  18.207  10.093   1.022
  537    HA   ASN  87           HA       ASN  87  18.950  11.886  -0.164
  538    HB2  ASN  87           HB1      ASN  87  19.978   9.826  -1.423
  539    HB3  ASN  87           HB2      ASN  87  18.832  10.275  -2.691
  540   HD21  ASN  87          HD21      ASN  87  21.024  10.493  -3.763
  541   HD22  ASN  87          HD22      ASN  87  21.744  12.062  -3.721
  542    H    ASP  88           H        ASP  88  16.092  11.484   0.127
  543    HA   ASP  88           HA       ASP  88  14.151  12.472  -0.531
  544    HB2  ASP  88           HB1      ASP  88  16.176  14.268  -1.223
  545    HB3  ASP  88           HB2      ASP  88  15.170  14.148  -2.672
  546    HD2  ASP  88           HD       ASP  88  12.358  15.322  -0.757
  547    H    VAL  89           H        VAL  89  15.335  10.129  -1.967
  548    HA   VAL  89           HA       VAL  89  13.442  10.129  -4.179
  549    HB   VAL  89           HB       VAL  89  15.195   9.070  -5.682
  550   HG11  VAL  89          HG11      VAL  89  16.119  11.281  -6.372
  551   HG12  VAL  89          HG12      VAL  89  14.367  11.267  -6.156
  552   HG13  VAL  89          HG13      VAL  89  15.404  11.978  -4.919
  553   HG21  VAL  89          HG21      VAL  89  17.059  10.364  -3.694
  554   HG22  VAL  89          HG22      VAL  89  16.872   8.631  -3.958
  555   HG23  VAL  89          HG23      VAL  89  17.528   9.652  -5.238
  556    H    CYS  90           H        CYS  90  12.938   8.006  -4.959
  557    HA   CYS  90           HA       CYS  90  12.869   6.052  -2.897
  558    HB2  CYS  90           HB1      CYS  90  12.043   6.085  -5.792
  559    HB3  CYS  90           HB2      CYS  90  11.973   4.594  -4.851
  560    H    THR  91           H        THR  91  14.686   5.058  -2.284
  561    HA   THR  91           HA       THR  91  16.503   4.046  -4.369
  562    HB   THR  91           HB       THR  91  17.079   4.592  -1.450
  563    HG1  THR  91           HG1      THR  91  18.238   5.893  -3.685
  564   HG21  THR  91          HG21      THR  91  19.421   4.126  -2.054
  565   HG22  THR  91          HG22      THR  91  18.900   3.656  -3.672
  566   HG23  THR  91          HG23      THR  91  18.391   2.711  -2.272
  567    H    THR  92           H        THR  92  17.151   1.916  -4.363
  568    HA   THR  92           HA       THR  92  15.336   0.039  -3.214
  569    HB   THR  92           HB       THR  92  17.364  -1.538  -4.067
  570    HG1  THR  92           HG1      THR  92  18.772  -0.309  -5.060
  571   HG21  THR  92          HG21      THR  92  16.070  -1.947  -5.962
  572   HG22  THR  92          HG22      THR  92  15.557  -0.265  -6.094
  573   HG23  THR  92          HG23      THR  92  14.901  -1.288  -4.817
  574    H    MET  93           H        MET  93  15.902  -1.731  -1.805
  575    HA   MET  93           HA       MET  93  17.382  -0.871   0.473
  576    HB2  MET  93           HB1      MET  93  15.326  -2.401   0.405
  577    HB3  MET  93           HB2      MET  93  16.458  -3.692  -0.028
  578    HG2  MET  93           HG1      MET  93  17.734  -3.197   2.060
  579    HG3  MET  93           HG2      MET  93  16.453  -2.064   2.499
  580    HE1  MET  93           HE1      MET  93  16.974  -3.490   4.519
  581    HE2  MET  93           HE2      MET  93  15.639  -4.516   5.046
  582    HE3  MET  93           HE3      MET  93  17.102  -5.243   4.379
  583    H    GLU  94           H        GLU  94  18.101  -2.801  -2.318
  584    HA   GLU  94           HA       GLU  94  20.356  -4.172  -1.280
  585    HB2  GLU  94           HB1      GLU  94  19.188  -3.674  -3.967
  586    HB3  GLU  94           HB2      GLU  94  20.899  -4.121  -3.907
  587    HG2  GLU  94           HG1      GLU  94  20.293  -6.245  -3.802
  588    HG3  GLU  94           HG2      GLU  94  19.617  -5.915  -2.200
  589    HE2  GLU  94           HE       GLU  94  17.149  -6.432  -5.232
  590    H    ASP  95           H        ASP  95  19.930  -1.085  -2.922
  591    HA   ASP  95           HA       ASP  95  22.755  -0.567  -3.104
  592    HB2  ASP  95           HB1      ASP  95  20.579   0.392  -4.439
  593    HB3  ASP  95           HB2      ASP  95  20.899   1.715  -3.310
  594    HD2  ASP  95           HD       ASP  95  23.984   2.419  -4.831
  595    H    ALA  96           H        ALA  96  20.108   0.378  -0.981
  596    HA   ALA  96           HA       ALA  96  21.606   2.283   0.514
  597    HB1  ALA  96           HB1      ALA  96  19.158   0.809   1.457
  598    HB2  ALA  96           HB2      ALA  96  19.740   2.392   1.973
  599    HB3  ALA  96           HB3      ALA  96  19.097   2.177   0.344
  600    H    THR  97           H        THR  97  23.551   1.085   0.946
  601    HA   THR  97           HA       THR  97  23.454  -0.253   3.492
  602    HB   THR  97           HB       THR  97  24.609  -1.815   1.180
  603    HG1  THR  97           HG1      THR  97  22.644  -2.491   0.824
  604   HG21  THR  97          HG21      THR  97  25.601  -2.926   2.848
  605   HG22  THR  97          HG22      THR  97  23.996  -3.504   3.297
  606   HG23  THR  97          HG23      THR  97  24.664  -2.067   4.070
  607    H    GLU  98           H        GLU  98  24.940   1.009   4.440
  608    HA   GLU  98           HA       GLU  98  27.178   2.130   3.129
  609    HB2  GLU  98           HB1      GLU  98  25.909   2.528   5.535
  610    HB3  GLU  98           HB2      GLU  98  27.445   1.799   6.030
  611    HG2  GLU  98           HG1      GLU  98  28.482   3.733   5.772
  612    HG3  GLU  98           HG2      GLU  98  28.002   3.771   4.069
  613    HE2  GLU  98           HE       GLU  98  25.208   5.808   4.836
  614    H    ASN  99           H        ASN  99  29.373   1.617   3.258
  615    HA   ASN  99           HA       ASN  99  29.923  -1.208   3.446
  616    HB2  ASN  99           HB1      ASN  99  31.549   1.206   2.653
  617    HB3  ASN  99           HB2      ASN  99  32.295  -0.384   2.848
  618   HD21  ASN  99          HD21      ASN  99  32.045   1.218   0.451
  619   HD22  ASN  99          HD22      ASN  99  31.179   0.255  -0.692
  620    H    LEU 100           H        LEU 100  30.772  -2.251   5.128
  621    HA   LEU 100           HA       LEU 100  32.092  -0.678   7.239
  622    HB2  LEU 100           HB1      LEU 100  30.045  -2.874   7.506
  623    HB3  LEU 100           HB2      LEU 100  31.120  -2.402   8.835
  624    HG   LEU 100           HG       LEU 100  29.687  -0.141   7.678
  625   HD11  LEU 100          HD11      LEU 100  27.499  -0.687   8.415
  626   HD12  LEU 100          HD12      LEU 100  28.044  -2.208   9.121
  627   HD13  LEU 100          HD13      LEU 100  28.032  -2.003   7.369
  628   HD21  LEU 100          HD21      LEU 100  29.278   0.353  10.011
  629   HD22  LEU 100          HD22      LEU 100  30.966  -0.105   9.783
  630   HD23  LEU 100          HD23      LEU 100  29.825  -1.258  10.476
  631    H    TYR 101           H        TYR 101  33.446  -2.069   8.698
  632    HA   TYR 101           HA       TYR 101  34.497  -4.467   7.399
  633    HB2  TYR 101           HB1      TYR 101  35.772  -1.988   7.172
  634    HB3  TYR 101           HB2      TYR 101  36.666  -2.838   8.435
  635    HD1  TYR 101           HD1      TYR 101  37.833  -4.946   7.957
  636    HD2  TYR 101           HD2      TYR 101  35.860  -2.764   4.883
  637    HE1  TYR 101           HE1      TYR 101  39.053  -6.244   6.260
  638    HE2  TYR 101           HE2      TYR 101  37.073  -4.057   3.179
  639    HH   TYR 101           HH       TYR 101  38.731  -6.890   3.853
  640    H    PHE 102           H        PHE 102  35.371  -5.962   8.792
  641    HA   PHE 102           HA       PHE 102  35.683  -5.263  11.605
  642    HB2  PHE 102           HB1      PHE 102  33.681  -7.233  10.522
  643    HB3  PHE 102           HB2      PHE 102  34.355  -7.430  12.142
  644    HD1  PHE 102           HD1      PHE 102  33.584  -6.168  13.963
  645    HD2  PHE 102           HD2      PHE 102  32.426  -5.109  10.007
  646    HE1  PHE 102           HE1      PHE 102  31.932  -4.587  14.873
  647    HE2  PHE 102           HE2      PHE 102  30.774  -3.526  10.910
  648    HZ   PHE 102           HZ       PHE 102  30.526  -3.263  13.346
  649    H    GLN 103           H        GLN 103  37.813  -5.693  10.151
  650    HA   GLN 103           HA       GLN 103  38.674  -8.393  10.919
  651    HB2  GLN 103           HB1      GLN 103  38.322  -7.512   8.270
  652    HB3  GLN 103           HB2      GLN 103  40.070  -7.507   8.556
  653    HG2  GLN 103           HG1      GLN 103  39.424  -9.903   9.621
  654    HG3  GLN 103           HG2      GLN 103  38.194  -9.762   8.357
  655   HE21  GLN 103          HE21      GLN 103  38.774  -9.908   6.238
  656   HE22  GLN 103          HE22      GLN 103  40.368 -10.310   5.709
  657    H    SER 104           H        SER 104  40.981  -8.607  11.234
  658    HA   SER 104           HA       SER 104  42.545  -6.166  11.399
  659    HB2  SER 104           HB1      SER 104  41.152  -6.632  13.598
  660    HB3  SER 104           HB2      SER 104  42.445  -7.807  13.900
  661    HG   SER 104           HG       SER 104  43.051  -5.148  13.183
  662    H    LEU 105           H        LEU 105  42.552  -9.547  12.545
  663    HA   LEU 105           HA       LEU 105  44.068 -11.225  12.322
  664    HB2  LEU 105           HB1      LEU 105  44.242  -9.688   9.835
  665    HB3  LEU 105           HB2      LEU 105  45.711 -10.605  10.216
  666    HG   LEU 105           HG       LEU 105  44.125 -11.792   8.714
  667   HD11  LEU 105          HD11      LEU 105  45.730 -12.814  10.562
  668   HD12  LEU 105          HD12      LEU 105  44.682 -13.824   9.567
  669   HD13  LEU 105          HD13      LEU 105  44.196 -13.397  11.207
  670   HD21  LEU 105          HD21      LEU 105  42.365 -12.387  11.028
  671   HD22  LEU 105          HD22      LEU 105  41.999 -12.354   9.302
  672   HD23  LEU 105          HD23      LEU 105  42.144 -10.844  10.203
  673    H    GLU 106           H        GLU 106  46.554 -11.635  12.086
  674    HA   GLU 106           HA       GLU 106  48.330  -9.523  12.753
  675    HB2  GLU 106           HB1      GLU 106  46.815 -10.529  14.908
  676    HB3  GLU 106           HB2      GLU 106  48.439 -11.215  15.081
  677    HG2  GLU 106           HG1      GLU 106  49.365  -8.902  14.857
  678    HG3  GLU 106           HG2      GLU 106  47.700  -8.305  14.925
  679    HE2  GLU 106           HE       GLU 106  48.765  -8.173  18.309
  680    H    HIS 107           H        HIS 107  50.484 -10.478  13.590
  681    HA   HIS 107           HA       HIS 107  50.910 -13.199  12.587
  682    HB2  HIS 107           HB1      HIS 107  51.716 -10.814  11.237
  683    HB3  HIS 107           HB2      HIS 107  53.166 -11.631  11.828
  684    HD1  HIS 107           HD1      HIS 107  52.481 -14.549  11.405
  685    HD2  HIS 107           HD2      HIS 107  51.616 -11.583   8.627
  686    HE1  HIS 107           HE1      HIS 107  52.277 -15.734   9.196
  687    HE2  HIS 107           HE2      HIS 107  51.749 -13.924   7.498
  688    H    HIS 108           H        HIS 108  52.769 -14.243  13.423
  689    HA   HIS 108           HA       HIS 108  54.369 -12.886  15.420
  690    HB2  HIS 108           HB1      HIS 108  52.144 -14.687  16.102
  691    HB3  HIS 108           HB2      HIS 108  53.675 -15.103  16.878
  692    HD1  HIS 108           HD1      HIS 108  54.874 -12.886  18.082
  693    HD2  HIS 108           HD2      HIS 108  50.757 -12.846  17.531
  694    HE1  HIS 108           HE1      HIS 108  53.998 -11.155  19.683
  695    HE2  HIS 108           HE2      HIS 108  51.482 -11.130  19.345
  696    H    HIS 109           H        HIS 109  56.375 -13.503  15.003
  697    HA   HIS 109           HA       HIS 109  57.049 -16.297  14.764
  698    HB2  HIS 109           HB1      HIS 109  56.367 -15.455  12.431
  699    HB3  HIS 109           HB2      HIS 109  57.862 -14.515  12.474
  700    HD1  HIS 109           HD1      HIS 109  56.593 -17.953  11.972
  701    HD2  HIS 109           HD2      HIS 109  60.259 -16.053  12.431
  702    HE1  HIS 109           HE1      HIS 109  58.317 -19.637  11.254
  703    HE2  HIS 109           HE2      HIS 109  60.558 -18.476  11.533
  704    H    HIS 110           H        HIS 110  58.220 -15.802  16.666
  705    HA   HIS 110           HA       HIS 110  60.822 -14.587  16.115
  706    HB2  HIS 110           HB1      HIS 110  58.936 -13.772  18.324
  707    HB3  HIS 110           HB2      HIS 110  60.677 -13.495  18.434
  708    HD1  HIS 110           HD1      HIS 110  61.484 -12.361  15.843
  709    HD2  HIS 110           HD2      HIS 110  57.824 -11.423  17.570
  710    HE1  HIS 110           HE1      HIS 110  60.792 -10.177  14.806
  711    HE2  HIS 110           HE2      HIS 110  58.554  -9.603  15.859
  712    H    HIS 111           H        HIS 111  62.434 -15.110  17.800
  713    HA   HIS 111           HA       HIS 111  61.792 -17.616  19.207
  714    HB2  HIS 111           HB1      HIS 111  63.361 -17.548  17.010
  715    HB3  HIS 111           HB2      HIS 111  64.575 -17.240  18.257
  716    HD1  HIS 111           HD1      HIS 111  62.985 -19.151  20.369
  717    HD2  HIS 111           HD2      HIS 111  64.418 -20.136  16.594
  718    HE1  HIS 111           HE1      HIS 111  63.285 -21.648  20.393
  719    HE2  HIS 111           HE2      HIS 111  64.161 -22.251  18.087
  720    H    HIS 112           H        HIS 112  62.018 -17.389  21.323
  721    HA   HIS 112           HA       HIS 112  63.962 -15.419  22.332
  722    HB2  HIS 112           HB1      HIS 112  61.195 -15.944  22.986
  723    HB3  HIS 112           HB2      HIS 112  62.212 -16.128  24.418
  724    HD1  HIS 112           HD1      HIS 112  60.153 -13.703  23.404
  725    HD2  HIS 112           HD2      HIS 112  64.272 -13.638  23.950
  726    HE1  HIS 112           HE1      HIS 112  60.747 -11.285  23.759
  727    HE2  HIS 112           HE2      HIS 112  63.263 -11.244  24.092
  Start of MODEL   62
    1    H1   MET  18           H        MET  18 -66.167  14.463  23.791
    2    HA   MET  18           HA       MET  18 -63.566  13.081  23.686
    3    HB2  MET  18           HB1      MET  18 -64.528  11.773  21.775
    4    HB3  MET  18           HB2      MET  18 -65.279  11.446  23.343
    5    HG2  MET  18           HG1      MET  18 -66.689  13.574  22.023
    6    HG3  MET  18           HG2      MET  18 -66.538  12.180  20.949
    7    HE1  MET  18           HE1      MET  18 -69.662  13.108  22.280
    8    HE2  MET  18           HE2      MET  18 -68.973  12.318  20.862
    9    HE3  MET  18           HE3      MET  18 -70.040  11.418  21.942
   10    H    LEU  19           H        LEU  19 -63.759  15.838  23.343
   11    HA   LEU  19           HA       LEU  19 -63.898  16.471  20.541
   12    HB2  LEU  19           HB1      LEU  19 -62.821  18.116  22.836
   13    HB3  LEU  19           HB2      LEU  19 -63.223  18.705  21.214
   14    HG   LEU  19           HG       LEU  19 -65.379  17.433  22.828
   15   HD11  LEU  19          HD11      LEU  19 -64.876  18.824  24.537
   16   HD12  LEU  19          HD12      LEU  19 -65.730  19.991  23.528
   17   HD13  LEU  19          HD13      LEU  19 -63.968  19.936  23.513
   18   HD21  LEU  19          HD21      LEU  19 -65.251  19.713  20.859
   19   HD22  LEU  19          HD22      LEU  19 -66.717  19.154  21.663
   20   HD23  LEU  19          HD23      LEU  19 -65.856  18.086  20.554
   21    H    VAL  20           H        VAL  20 -62.363  15.508  19.327
   22    HA   VAL  20           HA       VAL  20 -59.670  15.135  20.200
   23    HB   VAL  20           HB       VAL  20 -59.222  14.381  17.912
   24   HG11  VAL  20          HG11      VAL  20 -60.596  12.442  17.940
   25   HG12  VAL  20          HG12      VAL  20 -60.337  12.912  19.621
   26   HG13  VAL  20          HG13      VAL  20 -61.870  13.278  18.828
   27   HG21  VAL  20          HG21      VAL  20 -60.362  15.271  16.225
   28   HG22  VAL  20          HG22      VAL  20 -61.767  14.338  16.738
   29   HG23  VAL  20          HG23      VAL  20 -61.537  15.982  17.332
   30    H    LEU  21           H        LEU  21 -57.830  16.247  19.659
   31    HA   LEU  21           HA       LEU  21 -58.140  19.021  19.042
   32    HB2  LEU  21           HB1      LEU  21 -56.050  17.251  20.012
   33    HB3  LEU  21           HB2      LEU  21 -55.438  18.420  18.829
   34    HG   LEU  21           HG       LEU  21 -56.681  20.160  20.337
   35   HD11  LEU  21          HD11      LEU  21 -56.020  18.850  22.736
   36   HD12  LEU  21          HD12      LEU  21 -57.031  17.738  21.814
   37   HD13  LEU  21          HD13      LEU  21 -57.614  19.362  22.180
   38   HD21  LEU  21          HD21      LEU  21 -54.088  19.408  20.011
   39   HD22  LEU  21          HD22      LEU  21 -54.297  19.204  21.751
   40   HD23  LEU  21          HD23      LEU  21 -54.625  20.766  21.000
   41    H    ASP  22           H        ASP  22 -58.393  19.810  17.070
   42    HA   ASP  22           HA       ASP  22 -57.405  18.294  14.771
   43    HB2  ASP  22           HB1      ASP  22 -58.971  19.409  13.451
   44    HB3  ASP  22           HB2      ASP  22 -59.811  19.239  14.999
   45    HD2  ASP  22           HD       ASP  22 -59.359  22.710  15.655
   46    H    PHE  23           H        PHE  23 -55.999  19.136  13.260
   47    HA   PHE  23           HA       PHE  23 -54.314  21.302  14.221
   48    HB2  PHE  23           HB1      PHE  23 -54.061  19.231  12.050
   49    HB3  PHE  23           HB2      PHE  23 -52.976  20.623  12.099
   50    HD1  PHE  23           HD1      PHE  23 -54.077  17.653  13.995
   51    HD2  PHE  23           HD2      PHE  23 -51.174  20.742  13.613
   52    HE1  PHE  23           HE1      PHE  23 -52.641  16.501  15.626
   53    HE2  PHE  23           HE2      PHE  23 -49.732  19.594  15.243
   54    HZ   PHE  23           HZ       PHE  23 -50.464  17.470  16.252
   55    H    ASN  24           H        ASN  24 -53.570  22.989  12.722
   56    HA   ASN  24           HA       ASN  24 -55.079  23.591  10.375
   57    HB2  ASN  24           HB1      ASN  24 -56.326  24.318  12.740
   58    HB3  ASN  24           HB2      ASN  24 -55.514  25.804  12.234
   59   HD21  ASN  24          HD21      ASN  24 -57.277  26.945  11.624
   60   HD22  ASN  24          HD22      ASN  24 -58.296  26.511  10.299
   61    H    ASN  25           H        ASN  25 -54.046  25.067   9.110
   62    HA   ASN  25           HA       ASN  25 -52.483  26.575   8.410
   63    HB2  ASN  25           HB1      ASN  25 -51.611  27.069  11.246
   64    HB3  ASN  25           HB2      ASN  25 -51.636  28.188   9.879
   65   HD21  ASN  25          HD21      ASN  25 -53.966  28.408   8.933
   66   HD22  ASN  25          HD22      ASN  25 -55.184  28.748  10.110
   67    H    ILE  26           H        ILE  26 -51.139  25.033  11.337
   68    HA   ILE  26           HA       ILE  26 -49.217  23.869  11.696
   69    HB   ILE  26           HB       ILE  26 -49.565  23.086   8.798
   70   HG12  ILE  26          HG11      ILE  26 -50.339  21.503  11.249
   71   HG13  ILE  26          HG12      ILE  26 -51.467  22.606  10.443
   72   HG21  ILE  26          HG21      ILE  26 -47.575  22.117   9.028
   73   HG22  ILE  26          HG22      ILE  26 -47.526  22.469  10.756
   74   HG23  ILE  26          HG23      ILE  26 -48.337  21.015  10.175
   75   HD11  ILE  26          HD11      ILE  26 -51.725  21.261   8.631
   76   HD12  ILE  26          HD12      ILE  26 -50.110  20.567   8.774
   77   HD13  ILE  26          HD13      ILE  26 -51.395  20.040   9.860
   78    H    ARG  27           H        ARG  27 -48.029  25.840  11.972
   79    HA   ARG  27           HA       ARG  27 -46.523  26.855   9.708
   80    HB2  ARG  27           HB1      ARG  27 -46.466  27.659  12.627
   81    HB3  ARG  27           HB2      ARG  27 -45.669  28.519  11.301
   82    HG2  ARG  27           HG1      ARG  27 -47.499  29.772  11.164
   83    HG3  ARG  27           HG2      ARG  27 -48.292  28.350  10.466
   84    HD2  ARG  27           HD1      ARG  27 -49.744  28.599  12.174
   85    HD3  ARG  27           HD2      ARG  27 -48.481  27.785  13.109
   86    HE   ARG  27           HE       ARG  27 -47.935  30.523  13.136
   87   HH11  ARG  27          HH11      ARG  27 -50.345  28.302  14.310
   88   HH12  ARG  27          HH12      ARG  27 -50.760  29.274  15.684
   89   HH21  ARG  27          HH21      ARG  27 -48.472  31.811  14.941
   90   HH22  ARG  27          HH22      ARG  27 -49.693  31.269  16.041
   91    H    SER  28           H        SER  28 -45.656  25.692  12.970
   92    HA   SER  28           HA       SER  28 -43.826  24.594  13.757
   93    HB2  SER  28           HB1      SER  28 -44.578  23.293  11.364
   94    HB3  SER  28           HB2      SER  28 -42.812  23.436  11.319
   95    HG   SER  28           HG       SER  28 -44.116  21.631  12.593
   96    H    SER  29           H        SER  29 -41.344  24.086  12.942
   97    HA   SER  29           HA       SER  29 -40.275  26.506  11.691
   98    HB2  SER  29           HB1      SER  29 -38.465  26.199  13.698
   99    HB3  SER  29           HB2      SER  29 -39.836  27.321  13.764
  100    HG   SER  29           HG       SER  29 -40.193  24.661  14.589
  101    H    ALA  30           H        ALA  30 -38.906  25.916  10.157
  102    HA   ALA  30           HA       ALA  30 -37.500  23.343  10.429
  103    HB1  ALA  30           HB1      ALA  30 -37.562  23.071   8.125
  104    HB2  ALA  30           HB2      ALA  30 -39.132  23.794   8.483
  105    HB3  ALA  30           HB3      ALA  30 -37.830  24.790   7.829
  106    H    ASP  31           H        ASP  31 -35.349  23.329  10.578
  107    HA   ASP  31           HA       ASP  31 -33.791  25.559   9.530
  108    HB2  ASP  31           HB1      ASP  31 -32.480  25.628  11.716
  109    HB3  ASP  31           HB2      ASP  31 -34.090  26.358  11.738
  110    HD2  ASP  31           HD       ASP  31 -33.369  23.444  14.199
  111    H    LEU  32           H        LEU  32 -32.394  24.577   8.230
  112    HA   LEU  32           HA       LEU  32 -31.163  22.058   9.135
  113    HB2  LEU  32           HB1      LEU  32 -32.203  22.976   6.538
  114    HB3  LEU  32           HB2      LEU  32 -30.626  22.169   6.469
  115    HG   LEU  32           HG       LEU  32 -32.443  20.605   6.037
  116   HD11  LEU  32          HD11      LEU  32 -31.734  18.872   7.481
  117   HD12  LEU  32          HD12      LEU  32 -31.280  20.014   8.746
  118   HD13  LEU  32          HD13      LEU  32 -30.342  19.932   7.256
  119   HD21  LEU  32          HD21      LEU  32 -33.382  20.857   8.859
  120   HD22  LEU  32          HD22      LEU  32 -34.222  20.216   7.445
  121   HD23  LEU  32          HD23      LEU  32 -34.007  21.957   7.630
  122    H    HIS  33           H        HIS  33 -28.965  21.840   9.106
  123    HA   HIS  33           HA       HIS  33 -27.424  24.259   9.122
  124    HB2  HIS  33           HB1      HIS  33 -27.079  21.485   9.954
  125    HB3  HIS  33           HB2      HIS  33 -25.621  22.146   9.207
  126    HD1  HIS  33           HD1      HIS  33 -27.861  22.627  12.178
  127    HD2  HIS  33           HD2      HIS  33 -24.266  24.073  10.681
  128    HE1  HIS  33           HE1      HIS  33 -26.835  23.948  14.054
  129    HE2  HIS  33           HE2      HIS  33 -24.637  24.832  13.142
  130    H    GLY  34           H        GLY  34 -27.573  21.377   7.055
  131    HA2  GLY  34           HA2      GLY  34 -27.227  21.359   4.731
  132    HA3  GLY  34           HA3      GLY  34 -26.500  22.956   4.850
  133    HA1  GLY  34           HA1      GLY  34 -26.894  20.951   5.438
  134    H    ALA  35           H        ALA  35 -25.874  19.645   6.025
  135    HA   ALA  35           HA       ALA  35 -23.014  20.113   5.897
  136    HB1  ALA  35           HB1      ALA  35 -23.017  17.625   6.631
  137    HB2  ALA  35           HB2      ALA  35 -23.547  18.864   7.770
  138    HB3  ALA  35           HB3      ALA  35 -24.738  17.890   6.909
  139    H    ARG  36           H        ARG  36 -22.397  20.247   3.781
  140    HA   ARG  36           HA       ARG  36 -22.708  17.792   2.197
  141    HB2  ARG  36           HB1      ARG  36 -22.817  19.293   0.149
  142    HB3  ARG  36           HB2      ARG  36 -24.261  19.249   1.171
  143    HG2  ARG  36           HG1      ARG  36 -24.172  21.433   1.565
  144    HG3  ARG  36           HG2      ARG  36 -22.455  21.349   1.994
  145    HD2  ARG  36           HD1      ARG  36 -21.852  21.375  -0.393
  146    HD3  ARG  36           HD2      ARG  36 -23.568  21.479  -0.806
  147    HE   ARG  36           HE       ARG  36 -23.481  23.716  -0.379
  148   HH11  ARG  36          HH11      ARG  36 -20.813  22.172   1.240
  149   HH12  ARG  36          HH12      ARG  36 -20.105  23.661   1.773
  150   HH21  ARG  36          HH21      ARG  36 -22.560  25.683   0.317
  151   HH22  ARG  36          HH22      ARG  36 -21.101  25.658   1.248
  152    H    LYS  37           H        LYS  37 -20.579  17.297   2.977
  153    HA   LYS  37           HA       LYS  37 -18.531  17.954   1.189
  154    HB2  LYS  37           HB1      LYS  37 -18.897  20.048   2.876
  155    HB3  LYS  37           HB2      LYS  37 -17.710  19.101   3.786
  156    HG2  LYS  37           HG1      LYS  37 -16.306  19.054   1.679
  157    HG3  LYS  37           HG2      LYS  37 -17.423  20.270   1.034
  158    HD2  LYS  37           HD1      LYS  37 -16.787  21.256   3.543
  159    HD3  LYS  37           HD2      LYS  37 -15.262  20.567   2.958
  160    HE2  LYS  37           HE1      LYS  37 -15.167  22.741   2.143
  161    HE3  LYS  37           HE2      LYS  37 -15.805  21.831   0.766
  162    HZ1  LYS  37           HZ1      LYS  37 -17.714  23.006   2.654
  163    HZ2  LYS  37           HZ2      LYS  37 -17.869  22.742   0.991
  164    HZ3  LYS  37           HZ3      LYS  37 -16.935  24.034   1.558
  165    H    GLY  38           H        GLY  38 -17.732  15.947   1.152
  166    HA2  GLY  38           HA2      GLY  38 -16.718  14.841   3.683
  167    HA3  GLY  38           HA3      GLY  38 -17.727  13.843   2.647
  168    HA1  GLY  38           HA1      GLY  38 -16.344  15.392   3.103
  169    H    SER  39           H        SER  39 -14.726  14.027   3.555
  170    HA   SER  39           HA       SER  39 -13.267  14.214   1.111
  171    HB2  SER  39           HB1      SER  39 -12.200  14.661   3.277
  172    HB3  SER  39           HB2      SER  39 -12.477  12.979   3.761
  173    HG   SER  39           HG       SER  39 -10.392  13.903   2.507
  174    H    GLN  40           H        GLN  40 -12.344  12.570  -0.124
  175    HA   GLN  40           HA       GLN  40 -13.931  10.228  -0.414
  176    HB2  GLN  40           HB1      GLN  40 -11.915  11.608  -1.902
  177    HB3  GLN  40           HB2      GLN  40 -11.466   9.900  -1.784
  178    HG2  GLN  40           HG1      GLN  40 -14.270  10.186  -2.414
  179    HG3  GLN  40           HG2      GLN  40 -13.255  11.050  -3.575
  180   HE21  GLN  40          HE21      GLN  40 -12.014   9.928  -4.995
  181   HE22  GLN  40          HE22      GLN  40 -12.035   8.205  -5.138
  182    H    CYS  41           H        CYS  41 -10.564  10.742   0.627
  183    HA   CYS  41           HA       CYS  41 -10.708   8.158   2.031
  184    HB2  CYS  41           HB1      CYS  41  -8.392   7.715   1.500
  185    HB3  CYS  41           HB2      CYS  41  -9.286   7.997   0.006
  186    H    LEU  42           H        LEU  42  -9.863   8.080   4.072
  187    HA   LEU  42           HA       LEU  42  -9.270  10.656   5.300
  188    HB2  LEU  42           HB1      LEU  42 -10.589   8.275   6.115
  189    HB3  LEU  42           HB2      LEU  42  -9.182   8.508   7.169
  190    HG   LEU  42           HG       LEU  42 -10.007  10.768   7.728
  191   HD11  LEU  42          HD11      LEU  42 -11.268  11.351   5.805
  192   HD12  LEU  42          HD12      LEU  42 -12.401  11.258   7.152
  193   HD13  LEU  42          HD13      LEU  42 -12.314   9.943   5.981
  194   HD21  LEU  42          HD21      LEU  42 -10.589   8.652   9.012
  195   HD22  LEU  42          HD22      LEU  42 -12.167   8.737   8.227
  196   HD23  LEU  42          HD23      LEU  42 -11.630  10.052   9.274
  197    H    SER  43           H        SER  43  -7.699   7.710   4.386
  198    HA   SER  43           HA       SER  43  -5.123   8.840   5.027
  199    HB2  SER  43           HB1      SER  43  -6.199   6.420   6.483
  200    HB3  SER  43           HB2      SER  43  -4.461   6.709   6.297
  201    HG   SER  43           HG       SER  43  -6.339   8.090   7.822
  202    H    ASP  44           H        ASP  44  -3.346   7.569   4.156
  203    HA   ASP  44           HA       ASP  44  -3.803   6.658   1.570
  204    HB2  ASP  44           HB1      ASP  44  -1.464   5.771   3.264
  205    HB3  ASP  44           HB2      ASP  44  -1.513   6.019   1.514
  206    HD2  ASP  44           HD       ASP  44  -1.025   9.434   1.823
  207    H    THR  45           H        THR  45  -4.005   4.982   4.592
  208    HA   THR  45           HA       THR  45  -3.774   2.334   3.577
  209    HB   THR  45           HB       THR  45  -5.102   1.827   5.786
  210    HG1  THR  45           HG1      THR  45  -5.596   3.548   6.897
  211   HG21  THR  45          HG21      THR  45  -2.881   2.438   7.060
  212   HG22  THR  45          HG22      THR  45  -2.295   2.777   5.431
  213   HG23  THR  45          HG23      THR  45  -2.896   1.169   5.835
  214    H    ASP  46           H        ASP  46  -6.339   4.645   3.705
  215    HA   ASP  46           HA       ASP  46  -8.527   2.850   3.524
  216    HB2  ASP  46           HB1      ASP  46  -8.646   5.282   4.195
  217    HB3  ASP  46           HB2      ASP  46  -8.429   5.687   2.488
  218    HD2  ASP  46           HD       ASP  46 -11.659   4.612   1.685
  219    H    CYS  47           H        CYS  47  -6.284   4.141   1.210
  220    HA   CYS  47           HA       CYS  47  -7.705   3.849  -1.162
  221    HB2  CYS  47           HB1      CYS  47  -4.793   3.697  -0.454
  222    HB3  CYS  47           HB2      CYS  47  -5.312   3.312  -2.095
  223    H    ASN  48           H        ASN  48  -5.174   1.550  -0.179
  224    HA   ASN  48           HA       ASN  48  -6.921  -0.714  -0.504
  225    HB2  ASN  48           HB1      ASN  48  -6.414  -0.228  -2.848
  226    HB3  ASN  48           HB2      ASN  48  -4.683  -0.261  -2.490
  227   HD21  ASN  48          HD21      ASN  48  -4.342  -1.912  -3.983
  228   HD22  ASN  48          HD22      ASN  48  -4.799  -3.546  -3.656
  229    H    THR  49           H        THR  49  -3.422  -0.308  -0.999
  230    HA   THR  49           HA       THR  49  -2.619  -1.014   1.591
  231    HB   THR  49           HB       THR  49  -3.546  -3.195   1.231
  232    HG1  THR  49           HG1      THR  49  -1.709  -3.639   2.238
  233   HG21  THR  49          HG21      THR  49  -1.868  -3.423  -1.267
  234   HG22  THR  49          HG22      THR  49  -3.588  -3.033  -1.268
  235   HG23  THR  49          HG23      THR  49  -3.037  -4.590  -0.651
  236    H    ARG  50           H        ARG  50  -1.875  -1.339  -1.854
  237    HA   ARG  50           HA       ARG  50   0.921  -0.633  -1.258
  238    HB2  ARG  50           HB1      ARG  50   1.388  -1.531  -3.568
  239    HB3  ARG  50           HB2      ARG  50   0.857  -2.731  -2.379
  240    HG2  ARG  50           HG1      ARG  50  -1.337  -2.821  -3.308
  241    HG3  ARG  50           HG2      ARG  50  -0.998  -1.434  -4.358
  242    HD2  ARG  50           HD1      ARG  50  -0.845  -3.382  -5.722
  243    HD3  ARG  50           HD2      ARG  50   0.804  -2.804  -5.440
  244    HE   ARG  50           HE       ARG  50   1.257  -4.733  -4.284
  245   HH11  ARG  50          HH11      ARG  50  -2.185  -4.419  -4.709
  246   HH12  ARG  50          HH12      ARG  50  -2.534  -6.013  -4.124
  247   HH21  ARG  50          HH21      ARG  50   0.810  -6.832  -3.511
  248   HH22  ARG  50          HH22      ARG  50  -0.829  -7.384  -3.442
  249    H    LYS  51           H        LYS  51  -1.414   1.185  -1.528
  250    HA   LYS  51           HA       LYS  51  -0.214   2.980  -3.494
  251    HB2  LYS  51           HB1      LYS  51  -3.107   2.111  -3.475
  252    HB3  LYS  51           HB2      LYS  51  -2.561   3.601  -4.264
  253    HG2  LYS  51           HG1      LYS  51  -1.311   2.445  -5.872
  254    HG3  LYS  51           HG2      LYS  51  -1.351   0.942  -4.934
  255    HD2  LYS  51           HD1      LYS  51  -3.021   0.361  -6.328
  256    HD3  LYS  51           HD2      LYS  51  -4.007   1.409  -5.296
  257    HE2  LYS  51           HE1      LYS  51  -3.676   3.287  -6.792
  258    HE3  LYS  51           HE2      LYS  51  -2.564   2.328  -7.779
  259    HZ1  LYS  51           HZ1      LYS  51  -4.242   1.304  -8.819
  260    HZ2  LYS  51           HZ2      LYS  51  -5.189   2.592  -8.267
  261    HZ3  LYS  51           HZ3      LYS  51  -5.167   1.131  -7.413
  262    H    PHE  52           H        PHE  52  -0.763   5.209  -3.177
  263    HA   PHE  52           HA       PHE  52  -1.785   5.768  -0.470
  264    HB2  PHE  52           HB1      PHE  52  -0.258   7.604  -0.282
  265    HB3  PHE  52           HB2      PHE  52   0.666   6.191  -0.799
  266    HD1  PHE  52           HD1      PHE  52   1.255   5.943  -3.243
  267    HD2  PHE  52           HD2      PHE  52  -0.243   9.562  -1.577
  268    HE1  PHE  52           HE1      PHE  52   2.129   7.190  -5.175
  269    HE2  PHE  52           HE2      PHE  52   0.628  10.815  -3.508
  270    HZ   PHE  52           HZ       PHE  52   1.816   9.629  -5.310
  271    H    CYS  53           H        CYS  53  -2.555   8.104  -0.257
  272    HA   CYS  53           HA       CYS  53  -4.345   8.652  -2.511
  273    HB2  CYS  53           HB1      CYS  53  -4.716   8.595   0.279
  274    HB3  CYS  53           HB2      CYS  53  -4.822  10.295  -0.183
  275    H    LEU  54           H        LEU  54  -3.189   9.872  -3.931
  276    HA   LEU  54           HA       LEU  54  -1.496  12.027  -3.078
  277    HB2  LEU  54           HB1      LEU  54  -1.100  10.648  -5.122
  278    HB3  LEU  54           HB2      LEU  54  -2.524  11.417  -5.844
  279    HG   LEU  54           HG       LEU  54  -0.617  13.387  -4.907
  280   HD11  LEU  54          HD11      LEU  54   0.333  11.308  -6.867
  281   HD12  LEU  54          HD12      LEU  54   1.084  11.776  -5.342
  282   HD13  LEU  54          HD13      LEU  54   1.060  12.906  -6.695
  283   HD21  LEU  54          HD21      LEU  54  -1.101  13.140  -7.771
  284   HD22  LEU  54          HD22      LEU  54  -1.419  14.487  -6.678
  285   HD23  LEU  54          HD23      LEU  54  -2.581  13.166  -6.813
  286    H    GLN  55           H        GLN  55  -2.093  14.036  -2.627
  287    HA   GLN  55           HA       GLN  55  -4.751  14.937  -3.510
  288    HB2  GLN  55           HB1      GLN  55  -4.688  14.915  -1.144
  289    HB3  GLN  55           HB2      GLN  55  -3.080  15.654  -1.109
  290    HG2  GLN  55           HG1      GLN  55  -3.901  17.721  -1.150
  291    HG3  GLN  55           HG2      GLN  55  -5.018  17.327  -2.466
  292   HE21  GLN  55          HE21      GLN  55  -6.857  18.217  -1.744
  293   HE22  GLN  55          HE22      GLN  55  -7.646  17.785  -0.270
  294    HA   PRO  56           HA       PRO  56  -1.924  17.507  -6.033
  295    HB2  PRO  56           HB1      PRO  56  -3.680  17.768  -8.119
  296    HB3  PRO  56           HB2      PRO  56  -2.615  16.378  -7.911
  297    HG2  PRO  56           HG1      PRO  56  -5.499  16.694  -7.151
  298    HG3  PRO  56           HG2      PRO  56  -4.683  15.315  -7.979
  299    HD2  PRO  56           HD1      PRO  56  -5.310  15.272  -5.340
  300    HD3  PRO  56           HD2      PRO  56  -3.869  14.476  -5.993
  301    H    ARG  57           H        ARG  57  -1.972  19.714  -6.460
  302    HA   ARG  57           HA       ARG  57  -3.931  21.210  -4.951
  303    HB2  ARG  57           HB1      ARG  57  -1.244  21.640  -5.966
  304    HB3  ARG  57           HB2      ARG  57  -2.295  23.025  -6.298
  305    HG2  ARG  57           HG1      ARG  57  -2.957  22.889  -3.821
  306    HG3  ARG  57           HG2      ARG  57  -1.529  21.854  -3.651
  307    HD2  ARG  57           HD1      ARG  57  -0.068  23.566  -3.958
  308    HD3  ARG  57           HD2      ARG  57  -1.123  24.380  -5.121
  309    HE   ARG  57           HE       ARG  57  -2.215  24.499  -2.502
  310   HH11  ARG  57          HH11      ARG  57   0.235  25.887  -4.550
  311   HH12  ARG  57          HH12      ARG  57   0.265  27.402  -3.709
  312   HH21  ARG  57          HH21      ARG  57  -2.185  26.489  -1.387
  313   HH22  ARG  57          HH22      ARG  57  -1.112  27.742  -1.910
  314    H    ASP  58           H        ASP  58  -3.062  20.694  -8.317
  315    HA   ASP  58           HA       ASP  58  -4.930  22.675  -9.283
  316    HB2  ASP  58           HB1      ASP  58  -2.860  22.273 -10.517
  317    HB3  ASP  58           HB2      ASP  58  -3.315  20.581 -10.754
  318    HD2  ASP  58           HD       ASP  58  -5.474  21.356 -13.340
  319    H    GLU  59           H        GLU  59  -4.954  19.313  -8.524
  320    HA   GLU  59           HA       GLU  59  -7.647  19.081  -9.700
  321    HB2  GLU  59           HB1      GLU  59  -5.327  17.435 -10.073
  322    HB3  GLU  59           HB2      GLU  59  -6.589  16.491  -9.267
  323    HG2  GLU  59           HG1      GLU  59  -8.154  16.940 -11.031
  324    HG3  GLU  59           HG2      GLU  59  -7.016  18.055 -11.800
  325    HE2  GLU  59           HE       GLU  59  -5.552  15.499 -13.529
  326    H    LYS  60           H        LYS  60  -8.695  16.964  -8.582
  327    HA   LYS  60           HA       LYS  60  -8.911  17.701  -5.781
  328    HB2  LYS  60           HB1      LYS  60 -10.554  16.226  -7.747
  329    HB3  LYS  60           HB2      LYS  60 -10.651  15.639  -6.078
  330    HG2  LYS  60           HG1      LYS  60 -12.141  17.223  -5.659
  331    HG3  LYS  60           HG2      LYS  60 -10.861  18.423  -5.908
  332    HD2  LYS  60           HD1      LYS  60 -12.195  19.200  -7.545
  333    HD3  LYS  60           HD2      LYS  60 -11.542  17.840  -8.477
  334    HE2  LYS  60           HE1      LYS  60 -13.578  16.949  -8.647
  335    HE3  LYS  60           HE2      LYS  60 -13.685  16.866  -6.882
  336    HZ1  LYS  60           HZ1      LYS  60 -14.191  19.457  -7.316
  337    HZ2  LYS  60           HZ2      LYS  60 -15.389  18.269  -7.184
  338    HZ3  LYS  60           HZ3      LYS  60 -14.862  18.774  -8.711
  339    HA   PRO  61           HA       PRO  61  -6.626  14.377  -4.053
  340    HB2  PRO  61           HB1      PRO  61  -8.151  13.669  -1.890
  341    HB3  PRO  61           HB2      PRO  61  -7.224  15.166  -1.979
  342    HG2  PRO  61           HG1      PRO  61 -10.132  14.694  -2.535
  343    HG3  PRO  61           HG2      PRO  61  -9.354  16.014  -1.586
  344    HD2  PRO  61           HD1      PRO  61 -10.231  16.361  -4.131
  345    HD3  PRO  61           HD2      PRO  61  -8.802  17.191  -3.489
  346    H    PHE  62           H        PHE  62  -6.371  12.235  -4.360
  347    HA   PHE  62           HA       PHE  62  -8.503  10.355  -4.293
  348    HB2  PHE  62           HB1      PHE  62  -8.665   9.738  -6.588
  349    HB3  PHE  62           HB2      PHE  62  -8.871  11.489  -6.521
  350    HD1  PHE  62           HD1      PHE  62  -7.313   8.944  -8.268
  351    HD2  PHE  62           HD2      PHE  62  -6.547  12.826  -6.698
  352    HE1  PHE  62           HE1      PHE  62  -5.491   9.239  -9.895
  353    HE2  PHE  62           HE2      PHE  62  -4.723  13.127  -8.323
  354    HZ   PHE  62           HZ       PHE  62  -4.194  11.332  -9.924
  355    H    CYS  63           H        CYS  63  -7.676   8.178  -5.314
  356    HA   CYS  63           HA       CYS  63  -5.089   7.693  -4.100
  357    HB2  CYS  63           HB1      CYS  63  -7.169   5.871  -5.325
  358    HB3  CYS  63           HB2      CYS  63  -5.626   5.287  -4.700
  359    H    ALA  64           H        ALA  64  -3.221   7.352  -5.142
  360    HA   ALA  64           HA       ALA  64  -3.290   6.952  -8.056
  361    HB1  ALA  64           HB1      ALA  64  -1.634   8.572  -8.451
  362    HB2  ALA  64           HB2      ALA  64  -2.786   9.345  -7.360
  363    HB3  ALA  64           HB3      ALA  64  -1.258   8.726  -6.734
  364    H    THR  65           H        THR  65  -1.349   5.986  -8.941
  365    HA   THR  65           HA       THR  65  -0.387   3.848  -7.319
  366    HB   THR  65           HB       THR  65   1.188   4.281  -9.718
  367    HG1  THR  65           HG1      THR  65  -1.625   4.031 -10.090
  368   HG21  THR  65          HG21      THR  65   0.324   2.160  -8.250
  369   HG22  THR  65          HG22      THR  65   0.962   2.044  -9.890
  370   HG23  THR  65          HG23      THR  65  -0.780   2.100  -9.623
  371    H    CYS  66           H        CYS  66   1.847   3.370  -6.855
  372    HA   CYS  66           HA       CYS  66   3.208   5.503  -5.627
  373    HB2  CYS  66           HB1      CYS  66   4.912   3.933  -5.077
  374    HB3  CYS  66           HB2      CYS  66   3.375   3.069  -5.004
  375    H    ARG  67           H        ARG  67   5.672   5.799  -6.098
  376    HA   ARG  67           HA       ARG  67   5.889   6.517  -8.939
  377    HB2  ARG  67           HB1      ARG  67   7.260   7.595  -6.471
  378    HB3  ARG  67           HB2      ARG  67   7.739   8.035  -8.117
  379    HG2  ARG  67           HG1      ARG  67   5.095   8.560  -8.249
  380    HG3  ARG  67           HG2      ARG  67   5.409   8.886  -6.536
  381    HD2  ARG  67           HD1      ARG  67   7.533  10.138  -7.678
  382    HD3  ARG  67           HD2      ARG  67   6.303  10.340  -8.934
  383    HE   ARG  67           HE       ARG  67   5.248  11.019  -6.394
  384   HH11  ARG  67          HH11      ARG  67   7.377  12.185  -8.891
  385   HH12  ARG  67          HH12      ARG  67   7.117  13.856  -8.512
  386   HH21  ARG  67          HH21      ARG  67   4.899  13.216  -5.887
  387   HH22  ARG  67          HH22      ARG  67   5.708  14.441  -6.803
  388    H    GLY  68           H        GLY  68   8.297   6.605  -9.672
  389    HA2  GLY  68           HA2      GLY  68   9.288   3.910  -9.480
  390    HA3  GLY  68           HA3      GLY  68   9.972   5.209 -10.447
  391    HA1  GLY  68           HA1      GLY  68   9.138   4.312  -8.709
  392    H    LEU  69           H        LEU  69  12.052   4.408  -9.756
  393    HA   LEU  69           HA       LEU  69  12.745   4.685  -6.956
  394    HB2  LEU  69           HB1      LEU  69  14.140   3.731  -9.423
  395    HB3  LEU  69           HB2      LEU  69  15.097   4.201  -8.009
  396    HG   LEU  69           HG       LEU  69  12.985   2.046  -8.052
  397   HD11  LEU  69          HD11      LEU  69  15.225   1.693  -9.285
  398   HD12  LEU  69          HD12      LEU  69  14.675   0.465  -8.146
  399   HD13  LEU  69          HD13      LEU  69  15.920   1.619  -7.665
  400   HD21  LEU  69          HD21      LEU  69  13.961   1.496  -5.819
  401   HD22  LEU  69          HD22      LEU  69  13.079   3.021  -5.874
  402   HD23  LEU  69          HD23      LEU  69  14.843   3.021  -5.891
  403    H    ARG  70           H        ARG  70  14.012   6.065  -9.996
  404    HA   ARG  70           HA       ARG  70  15.602   8.034  -8.844
  405    HB2  ARG  70           HB1      ARG  70  14.123   8.182 -11.482
  406    HB3  ARG  70           HB2      ARG  70  15.529   9.151 -11.018
  407    HG2  ARG  70           HG1      ARG  70  16.100   6.340 -10.720
  408    HG3  ARG  70           HG2      ARG  70  15.535   6.710 -12.358
  409    HD2  ARG  70           HD1      ARG  70  17.682   8.323 -10.982
  410    HD3  ARG  70           HD2      ARG  70  18.035   6.886 -11.952
  411    HE   ARG  70           HE       ARG  70  16.476   8.504 -13.548
  412   HH11  ARG  70          HH11      ARG  70  19.545   8.737 -11.923
  413   HH12  ARG  70          HH12      ARG  70  20.227   9.824 -13.087
  414   HH21  ARG  70          HH21      ARG  70  17.361   9.935 -15.087
  415   HH22  ARG  70          HH22      ARG  70  18.983  10.506 -14.886
  416    H    ARG  71           H        ARG  71  12.172   7.893  -9.251
  417    HA   ARG  71           HA       ARG  71  11.476  10.583  -9.225
  418    HB2  ARG  71           HB1      ARG  71  10.172   8.036  -8.659
  419    HB3  ARG  71           HB2      ARG  71   9.533   9.358  -7.672
  420    HG2  ARG  71           HG1      ARG  71   8.264   9.049  -9.752
  421    HG3  ARG  71           HG2      ARG  71   9.020  10.648  -9.648
  422    HD2  ARG  71           HD1      ARG  71  10.749  10.036 -11.173
  423    HD3  ARG  71           HD2      ARG  71  10.280   8.332 -11.100
  424    HE   ARG  71           HE       ARG  71   8.050   9.509 -12.049
  425   HH11  ARG  71          HH11      ARG  71  11.398   9.682 -12.986
  426   HH12  ARG  71          HH12      ARG  71  11.051   9.973 -14.658
  427   HH21  ARG  71          HH21      ARG  71   7.580   9.892 -14.248
  428   HH22  ARG  71          HH22      ARG  71   8.878  10.093 -15.375
  429    H    ARG  72           H        ARG  72  11.007  12.062  -7.601
  430    HA   ARG  72           HA       ARG  72  12.593  11.787  -5.216
  431    HB2  ARG  72           HB1      ARG  72  10.749  13.992  -6.163
  432    HB3  ARG  72           HB2      ARG  72  11.774  14.088  -4.723
  433    HG2  ARG  72           HG1      ARG  72  13.400  13.316  -6.938
  434    HG3  ARG  72           HG2      ARG  72  12.438  14.733  -7.389
  435    HD2  ARG  72           HD1      ARG  72  14.104  14.517  -4.870
  436    HD3  ARG  72           HD2      ARG  72  14.625  15.306  -6.366
  437    HE   ARG  72           HE       ARG  72  12.303  16.565  -5.808
  438   HH11  ARG  72          HH11      ARG  72  15.153  15.888  -3.926
  439   HH12  ARG  72          HH12      ARG  72  14.996  17.304  -2.939
  440   HH21  ARG  72          HH21      ARG  72  12.087  18.432  -4.516
  441   HH22  ARG  72          HH22      ARG  72  13.251  18.750  -3.275
  442    H    CYS  73           H        CYS  73  11.831  11.906  -3.068
  443    HA   CYS  73           HA       CYS  73   8.975  11.583  -2.600
  444    HB2  CYS  73           HB1      CYS  73   9.235   9.534  -1.311
  445    HB3  CYS  73           HB2      CYS  73   9.794   9.288  -2.966
  446    H    GLN  74           H        GLN  74   8.456  11.605  -0.258
  447    HA   GLN  74           HA       GLN  74  10.463  13.146   1.252
  448    HB2  GLN  74           HB1      GLN  74   8.695  14.425   2.268
  449    HB3  GLN  74           HB2      GLN  74   8.507  14.492   0.508
  450    HG2  GLN  74           HG1      GLN  74   6.725  12.875   0.570
  451    HG3  GLN  74           HG2      GLN  74   6.966  12.638   2.307
  452   HE21  GLN  74          HE21      GLN  74   4.540  13.398   1.054
  453   HE22  GLN  74          HE22      GLN  74   4.115  14.966   1.640
  454    H    ARG  75           H        ARG  75   8.012  10.654   1.326
  455    HA   ARG  75           HA       ARG  75   8.902   9.933   4.042
  456    HB2  ARG  75           HB1      ARG  75   6.391  10.720   3.432
  457    HB3  ARG  75           HB2      ARG  75   6.252   8.983   3.131
  458    HG2  ARG  75           HG1      ARG  75   7.579   9.136   5.566
  459    HG3  ARG  75           HG2      ARG  75   6.356  10.414   5.638
  460    HD2  ARG  75           HD1      ARG  75   4.735   8.599   4.727
  461    HD3  ARG  75           HD2      ARG  75   5.980   7.466   5.272
  462    HE   ARG  75           HE       ARG  75   4.130   8.870   6.909
  463   HH11  ARG  75          HH11      ARG  75   7.388   7.645   6.824
  464   HH12  ARG  75          HH12      ARG  75   7.503   7.465   8.543
  465   HH21  ARG  75          HH21      ARG  75   4.270   8.637   9.173
  466   HH22  ARG  75          HH22      ARG  75   5.730   8.028   9.878
  467    H    ASP  76           H        ASP  76   8.388   7.540   4.506
  468    HA   ASP  76           HA       ASP  76   9.726   5.988   2.481
  469    HB2  ASP  76           HB1      ASP  76  10.360   5.531   4.731
  470    HB3  ASP  76           HB2      ASP  76   8.676   5.330   5.232
  471    HD2  ASP  76           HD       ASP  76  10.179   2.341   3.084
  472    H    ALA  77           H        ALA  77   6.601   5.673   4.175
  473    HA   ALA  77           HA       ALA  77   5.573   3.591   2.638
  474    HB1  ALA  77           HB1      ALA  77   3.898   5.789   3.825
  475    HB2  ALA  77           HB2      ALA  77   3.460   4.100   3.567
  476    HB3  ALA  77           HB3      ALA  77   4.649   4.524   4.797
  477    H    MET  78           H        MET  78   5.911   6.959   1.908
  478    HA   MET  78           HA       MET  78   3.947   7.318  -0.027
  479    HB2  MET  78           HB1      MET  78   6.592   8.551   0.559
  480    HB3  MET  78           HB2      MET  78   5.882   8.870  -1.031
  481    HG2  MET  78           HG1      MET  78   4.329   9.297   1.509
  482    HG3  MET  78           HG2      MET  78   5.401  10.531   0.840
  483    HE1  MET  78           HE1      MET  78   4.304  10.392  -2.749
  484    HE2  MET  78           HE2      MET  78   4.110  11.975  -1.996
  485    HE3  MET  78           HE3      MET  78   5.483  10.956  -1.565
  486    H    CYS  79           H        CYS  79   6.902   5.518  -0.148
  487    HA   CYS  79           HA       CYS  79   6.698   5.213  -3.056
  488    HB2  CYS  79           HB1      CYS  79   8.892   5.709  -1.691
  489    HB3  CYS  79           HB2      CYS  79   8.872   3.965  -1.418
  490    H    CYS  80           H        CYS  80   6.810   3.082  -4.002
  491    HA   CYS  80           HA       CYS  80   4.924   1.302  -3.060
  492    HB2  CYS  80           HB1      CYS  80   6.997   1.298  -5.134
  493    HB3  CYS  80           HB2      CYS  80   6.612  -0.314  -4.527
  494    HA   PRO  81           HA       PRO  81   6.745  -1.171   0.072
  495    HB2  PRO  81           HB1      PRO  81   5.786  -3.669  -0.510
  496    HB3  PRO  81           HB2      PRO  81   4.786  -2.369   0.135
  497    HG2  PRO  81           HG1      PRO  81   5.137  -3.268  -2.704
  498    HG3  PRO  81           HG2      PRO  81   3.620  -2.867  -1.814
  499    HD2  PRO  81           HD1      PRO  81   4.798  -1.148  -3.553
  500    HD3  PRO  81           HD2      PRO  81   3.934  -0.602  -2.107
  501    H    GLY  82           H        GLY  82   8.860  -1.590   0.176
  502    HA2  GLY  82           HA2      GLY  82  10.494  -3.419  -0.152
  503    HA3  GLY  82           HA3      GLY  82  10.007  -3.421  -1.841
  504    HA1  GLY  82           HA1      GLY  82  10.396  -2.571   0.068
  505    H    THR  83           H        THR  83  10.230  -0.348  -0.346
  506    HA   THR  83           HA       THR  83  12.971   0.055  -1.294
  507    HB   THR  83           HB       THR  83  11.858   2.406  -2.086
  508    HG1  THR  83           HG1      THR  83   9.926   0.361  -2.376
  509   HG21  THR  83          HG21      THR  83  12.674  -0.091  -3.441
  510   HG22  THR  83          HG22      THR  83  13.254   1.560  -3.659
  511   HG23  THR  83          HG23      THR  83  11.741   1.051  -4.408
  512    H    LEU  84           H        LEU  84  13.667   2.401  -0.725
  513    HA   LEU  84           HA       LEU  84  12.458   3.286   1.792
  514    HB2  LEU  84           HB1      LEU  84  15.366   2.601   1.362
  515    HB3  LEU  84           HB2      LEU  84  14.779   3.575   2.721
  516    HG   LEU  84           HG       LEU  84  13.997   0.712   2.174
  517   HD11  LEU  84          HD11      LEU  84  15.536   1.406   4.578
  518   HD12  LEU  84          HD12      LEU  84  16.418   1.533   3.057
  519   HD13  LEU  84          HD13      LEU  84  15.658   0.008   3.512
  520   HD21  LEU  84          HD21      LEU  84  12.245   1.916   3.323
  521   HD22  LEU  84          HD22      LEU  84  13.406   2.559   4.486
  522   HD23  LEU  84          HD23      LEU  84  13.055   0.830   4.454
  523    H    CYS  85           H        CYS  85  12.272   5.433   1.925
  524    HA   CYS  85           HA       CYS  85  13.050   7.081  -0.261
  525    HB2  CYS  85           HB1      CYS  85  11.026   7.338   1.316
  526    HB3  CYS  85           HB2      CYS  85  12.162   8.108   2.426
  527    H    VAL  86           H        VAL  86  15.187   7.377  -0.561
  528    HA   VAL  86           HA       VAL  86  16.689   8.600   1.656
  529    HB   VAL  86           HB       VAL  86  17.778   6.581  -0.310
  530   HG11  VAL  86          HG11      VAL  86  19.428   8.283   0.201
  531   HG12  VAL  86          HG12      VAL  86  19.142   8.072   1.930
  532   HG13  VAL  86          HG13      VAL  86  19.860   6.765   0.987
  533   HG21  VAL  86          HG21      VAL  86  16.332   5.705   1.556
  534   HG22  VAL  86          HG22      VAL  86  17.979   5.076   1.517
  535   HG23  VAL  86          HG23      VAL  86  17.541   6.326   2.681
  536    H    ASN  87           H        ASN  87  18.076  10.255   1.121
  537    HA   ASN  87           HA       ASN  87  18.851  12.042  -0.054
  538    HB2  ASN  87           HB1      ASN  87  19.951  10.036  -1.263
  539    HB3  ASN  87           HB2      ASN  87  18.769  10.347  -2.540
  540   HD21  ASN  87          HD21      ASN  87  19.953  11.171  -4.136
  541   HD22  ASN  87          HD22      ASN  87  20.965  12.566  -4.006
  542    H    ASP  88           H        ASP  88  15.985  11.653   0.185
  543    HA   ASP  88           HA       ASP  88  14.061  12.651  -0.507
  544    HB2  ASP  88           HB1      ASP  88  15.592  14.240  -2.549
  545    HB3  ASP  88           HB2      ASP  88  14.193  14.721  -1.578
  546    HD2  ASP  88           HD       ASP  88  17.764  15.416  -0.169
  547    H    VAL  89           H        VAL  89  15.260  10.297  -1.917
  548    HA   VAL  89           HA       VAL  89  13.403  10.300  -4.161
  549    HB   VAL  89           HB       VAL  89  15.175   9.229  -5.632
  550   HG11  VAL  89          HG11      VAL  89  16.127  11.434  -6.306
  551   HG12  VAL  89          HG12      VAL  89  14.372  11.430  -6.126
  552   HG13  VAL  89          HG13      VAL  89  15.388  12.136  -4.868
  553   HG21  VAL  89          HG21      VAL  89  17.020  10.519  -3.623
  554   HG22  VAL  89          HG22      VAL  89  16.816   8.785  -3.869
  555   HG23  VAL  89          HG23      VAL  89  17.502   9.782  -5.151
  556    H    CYS  90           H        CYS  90  12.879   8.184  -4.926
  557    HA   CYS  90           HA       CYS  90  12.756   6.239  -2.870
  558    HB2  CYS  90           HB1      CYS  90  11.979   6.324  -5.766
  559    HB3  CYS  90           HB2      CYS  90  11.972   4.778  -4.913
  560    H    THR  91           H        THR  91  14.549   5.244  -2.189
  561    HA   THR  91           HA       THR  91  16.410   4.182  -4.210
  562    HB   THR  91           HB       THR  91  16.968   4.778  -1.297
  563    HG1  THR  91           HG1      THR  91  16.697   6.557  -2.997
  564   HG21  THR  91          HG21      THR  91  18.290   3.056  -3.061
  565   HG22  THR  91          HG22      THR  91  18.894   3.673  -1.523
  566   HG23  THR  91          HG23      THR  91  19.267   4.523  -3.023
  567    H    THR  92           H        THR  92  16.507   2.052  -4.451
  568    HA   THR  92           HA       THR  92  14.859   0.255  -3.103
  569    HB   THR  92           HB       THR  92  17.400  -0.783  -4.259
  570    HG1  THR  92           HG1      THR  92  16.844  -0.210  -6.308
  571   HG21  THR  92          HG21      THR  92  16.082  -2.591  -4.021
  572   HG22  THR  92          HG22      THR  92  15.295  -2.016  -5.491
  573   HG23  THR  92          HG23      THR  92  14.613  -1.623  -3.913
  574    H    MET  93           H        MET  93  15.374  -1.482  -1.658
  575    HA   MET  93           HA       MET  93  16.876  -0.678   0.587
  576    HB2  MET  93           HB1      MET  93  14.901  -2.296   0.493
  577    HB3  MET  93           HB2      MET  93  16.076  -3.520  -0.013
  578    HG2  MET  93           HG1      MET  93  16.883  -3.793   2.055
  579    HG3  MET  93           HG2      MET  93  16.891  -2.057   2.370
  580    HE1  MET  93           HE1      MET  93  15.713  -4.003   5.040
  581    HE2  MET  93           HE2      MET  93  16.534  -2.501   4.614
  582    HE3  MET  93           HE3      MET  93  14.927  -2.453   5.343
  583    H    GLU  94           H        GLU  94  17.625  -2.721  -2.166
  584    HA   GLU  94           HA       GLU  94  19.935  -3.964  -1.215
  585    HB2  GLU  94           HB1      GLU  94  18.992  -3.182  -3.961
  586    HB3  GLU  94           HB2      GLU  94  20.585  -3.921  -3.727
  587    HG2  GLU  94           HG1      GLU  94  19.714  -5.951  -3.068
  588    HG3  GLU  94           HG2      GLU  94  18.171  -5.239  -2.576
  589    HE2  GLU  94           HE       GLU  94  17.946  -5.014  -6.390
  590    H    ASP  95           H        ASP  95  19.436  -0.756  -2.546
  591    HA   ASP  95           HA       ASP  95  22.249  -0.153  -2.690
  592    HB2  ASP  95           HB1      ASP  95  20.601   0.867  -4.239
  593    HB3  ASP  95           HB2      ASP  95  19.871   1.709  -2.865
  594    HD2  ASP  95           HD       ASP  95  23.017   3.279  -4.531
  595    H    ALA  96           H        ALA  96  19.565   0.596  -0.519
  596    HA   ALA  96           HA       ALA  96  21.168   2.261   1.193
  597    HB1  ALA  96           HB1      ALA  96  18.482   1.057   1.825
  598    HB2  ALA  96           HB2      ALA  96  19.224   2.489   2.542
  599    HB3  ALA  96           HB3      ALA  96  18.693   2.519   0.860
  600    H    THR  97           H        THR  97  22.898   0.712   1.571
  601    HA   THR  97           HA       THR  97  22.309  -0.959   3.897
  602    HB   THR  97           HB       THR  97  24.143  -2.542   2.654
  603    HG1  THR  97           HG1      THR  97  24.091  -2.119   0.588
  604   HG21  THR  97          HG21      THR  97  21.254  -2.603   3.122
  605   HG22  THR  97          HG22      THR  97  22.479  -3.832   3.437
  606   HG23  THR  97          HG23      THR  97  21.790  -3.667   1.822
  607    H    GLU  98           H        GLU  98  23.401   0.622   5.115
  608    HA   GLU  98           HA       GLU  98  26.262   0.266   5.179
  609    HB2  GLU  98           HB1      GLU  98  25.398   2.304   3.592
  610    HB3  GLU  98           HB2      GLU  98  25.571   3.131   5.147
  611    HG2  GLU  98           HG1      GLU  98  27.840   2.878   5.210
  612    HG3  GLU  98           HG2      GLU  98  27.804   1.403   4.230
  613    HE2  GLU  98           HE       GLU  98  27.264   3.662   1.368
  614    H    ASN  99           H        ASN  99  27.220   1.025   7.123
  615    HA   ASN  99           HA       ASN  99  25.430   0.973   9.359
  616    HB2  ASN  99           HB1      ASN  99  27.848   0.022   9.162
  617    HB3  ASN  99           HB2      ASN  99  28.343   1.670   9.569
  618   HD21  ASN  99          HD21      ASN  99  26.248  -0.951  10.678
  619   HD22  ASN  99          HD22      ASN  99  26.430  -0.619  12.364
  620    H    LEU 100           H        LEU 100  24.774   2.609  10.658
  621    HA   LEU 100           HA       LEU 100  24.736   5.237   9.677
  622    HB2  LEU 100           HB1      LEU 100  23.710   3.787  11.955
  623    HB3  LEU 100           HB2      LEU 100  24.300   5.387  12.437
  624    HG   LEU 100           HG       LEU 100  22.638   5.522  10.062
  625   HD11  LEU 100          HD11      LEU 100  21.302   3.786  10.741
  626   HD12  LEU 100          HD12      LEU 100  20.544   5.137  11.582
  627   HD13  LEU 100          HD13      LEU 100  21.631   4.056  12.453
  628   HD21  LEU 100          HD21      LEU 100  23.285   7.432  11.454
  629   HD22  LEU 100          HD22      LEU 100  22.397   6.741  12.812
  630   HD23  LEU 100          HD23      LEU 100  21.532   7.256  11.362
  631    H    TYR 101           H        TYR 101  25.668   7.160  10.572
  632    HA   TYR 101           HA       TYR 101  28.442   6.997  10.971
  633    HB2  TYR 101           HB1      TYR 101  26.396   9.174  11.210
  634    HB3  TYR 101           HB2      TYR 101  28.029   9.463  11.817
  635    HD1  TYR 101           HD1      TYR 101  29.650  10.281  10.381
  636    HD2  TYR 101           HD2      TYR 101  26.295   8.240   8.745
  637    HE1  TYR 101           HE1      TYR 101  30.428  10.833   8.113
  638    HE2  TYR 101           HE2      TYR 101  27.064   8.785   6.473
  639    HH   TYR 101           HH       TYR 101  28.927  11.031   5.652
  640    H    PHE 102           H        PHE 102  29.544   8.094  12.893
  641    HA   PHE 102           HA       PHE 102  28.278   7.223  15.406
  642    HB2  PHE 102           HB1      PHE 102  30.427   6.462  16.234
  643    HB3  PHE 102           HB2      PHE 102  30.058   5.649  14.711
  644    HD1  PHE 102           HD1      PHE 102  32.311   7.922  16.406
  645    HD2  PHE 102           HD2      PHE 102  31.225   6.273  12.635
  646    HE1  PHE 102           HE1      PHE 102  34.463   8.659  15.467
  647    HE2  PHE 102           HE2      PHE 102  33.376   7.007  11.691
  648    HZ   PHE 102           HZ       PHE 102  34.998   8.201  13.107
  649    H    GLN 103           H        GLN 103  29.395   8.231  17.353
  650    HA   GLN 103           HA       GLN 103  29.889  10.095  18.558
  651    HB2  GLN 103           HB1      GLN 103  31.852   9.887  16.679
  652    HB3  GLN 103           HB2      GLN 103  31.237  11.516  16.359
  653    HG2  GLN 103           HG1      GLN 103  31.528  11.215  19.177
  654    HG3  GLN 103           HG2      GLN 103  33.016  10.675  18.388
  655   HE21  GLN 103          HE21      GLN 103  31.598  13.259  19.728
  656   HE22  GLN 103          HE22      GLN 103  32.399  14.531  18.878
  657    H    SER 104           H        SER 104  29.925  12.698  18.242
  658    HA   SER 104           HA       SER 104  28.097  13.781  16.373
  659    HB2  SER 104           HB1      SER 104  26.325  14.377  18.147
  660    HB3  SER 104           HB2      SER 104  26.324  12.722  17.514
  661    HG   SER 104           HG       SER 104  27.002  11.972  19.393
  662    H    LEU 105           H        LEU 105  27.803  16.050  16.629
  663    HA   LEU 105           HA       LEU 105  30.022  17.352  17.837
  664    HB2  LEU 105           HB1      LEU 105  27.543  18.274  16.418
  665    HB3  LEU 105           HB2      LEU 105  28.607  19.438  17.225
  666    HG   LEU 105           HG       LEU 105  30.117  17.691  15.487
  667   HD11  LEU 105          HD11      LEU 105  29.233  18.415  13.366
  668   HD12  LEU 105          HD12      LEU 105  27.965  19.340  14.170
  669   HD13  LEU 105          HD13      LEU 105  27.971  17.579  14.271
  670   HD21  LEU 105          HD21      LEU 105  30.767  19.920  14.533
  671   HD22  LEU 105          HD22      LEU 105  31.035  19.739  16.267
  672   HD23  LEU 105          HD23      LEU 105  29.648  20.658  15.680
  673    H    GLU 106           H        GLU 106  30.250  17.944  19.881
  674    HA   GLU 106           HA       GLU 106  28.089  17.772  21.745
  675    HB2  GLU 106           HB1      GLU 106  30.959  17.980  21.835
  676    HB3  GLU 106           HB2      GLU 106  30.234  19.154  22.944
  677    HG2  GLU 106           HG1      GLU 106  29.426  17.571  24.342
  678    HG3  GLU 106           HG2      GLU 106  29.134  16.417  23.032
  679    HE2  GLU 106           HE       GLU 106  32.255  15.829  25.153
  680    H    HIS 107           H        HIS 107  26.701  19.302  22.331
  681    HA   HIS 107           HA       HIS 107  27.358  22.104  21.693
  682    HB2  HIS 107           HB1      HIS 107  24.691  20.680  21.596
  683    HB3  HIS 107           HB2      HIS 107  24.867  22.434  21.482
  684    HD1  HIS 107           HD1      HIS 107  25.248  19.324  19.499
  685    HD2  HIS 107           HD2      HIS 107  26.041  23.381  19.078
  686    HE1  HIS 107           HE1      HIS 107  25.701  19.670  17.049
  687    HE2  HIS 107           HE2      HIS 107  26.185  22.150  16.791
  688    H    HIS 108           H        HIS 108  24.802  20.529  23.602
  689    HA   HIS 108           HA       HIS 108  24.106  20.816  25.749
  690    HB2  HIS 108           HB1      HIS 108  26.796  20.417  25.916
  691    HB3  HIS 108           HB2      HIS 108  26.637  21.982  26.718
  692    HD1  HIS 108           HD1      HIS 108  26.775  21.481  29.143
  693    HD2  HIS 108           HD2      HIS 108  24.253  18.850  27.149
  694    HE1  HIS 108           HE1      HIS 108  25.741  20.051  30.936
  695    HE2  HIS 108           HE2      HIS 108  24.200  18.442  29.718
  696    H    HIS 109           H        HIS 109  24.024  22.545  27.587
  697    HA   HIS 109           HA       HIS 109  24.422  25.268  26.773
  698    HB2  HIS 109           HB1      HIS 109  22.055  24.075  25.922
  699    HB3  HIS 109           HB2      HIS 109  21.588  24.969  27.372
  700    HD1  HIS 109           HD1      HIS 109  21.949  27.575  27.339
  701    HD2  HIS 109           HD2      HIS 109  22.596  25.659  23.709
  702    HE1  HIS 109           HE1      HIS 109  21.968  29.401  25.609
  703    HE2  HIS 109           HE2      HIS 109  22.364  28.230  23.389
  704    H    HIS 110           H        HIS 110  23.287  26.775  28.435
  705    HA   HIS 110           HA       HIS 110  23.153  25.516  31.078
  706    HB2  HIS 110           HB1      HIS 110  24.646  27.115  32.073
  707    HB3  HIS 110           HB2      HIS 110  25.475  26.362  30.707
  708    HD1  HIS 110           HD1      HIS 110  24.475  29.624  32.026
  709    HD2  HIS 110           HD2      HIS 110  25.632  28.057  28.356
  710    HE1  HIS 110           HE1      HIS 110  25.084  31.610  30.609
  711    HE2  HIS 110           HE2      HIS 110  25.792  30.653  28.366
  712    H    HIS 111           H        HIS 111  22.523  27.298  32.755
  713    HA   HIS 111           HA       HIS 111  20.520  29.083  31.540
  714    HB2  HIS 111           HB1      HIS 111  20.053  26.831  33.217
  715    HB3  HIS 111           HB2      HIS 111  19.673  28.280  34.152
  716    HD1  HIS 111           HD1      HIS 111  18.201  26.032  31.761
  717    HD2  HIS 111           HD2      HIS 111  17.792  30.061  32.687
  718    HE1  HIS 111           HE1      HIS 111  16.002  26.732  30.762
  719    HE2  HIS 111           HE2      HIS 111  15.751  29.194  31.326
  720    H    HIS 112           H        HIS 112  19.960  30.953  32.808
  721    HA   HIS 112           HA       HIS 112  22.254  31.967  34.281
  722    HB2  HIS 112           HB1      HIS 112  20.004  33.120  32.779
  723    HB3  HIS 112           HB2      HIS 112  20.411  34.004  34.253
  724    HD1  HIS 112           HD1      HIS 112  22.714  35.178  34.361
  725    HD2  HIS 112           HD2      HIS 112  21.939  33.277  30.750
  726    HE1  HIS 112           HE1      HIS 112  24.463  36.027  32.765
  727    HE2  HIS 112           HE2      HIS 112  23.989  34.865  30.557
  Start of MODEL   63
    1    H1   MET  18           H        MET  18 -54.270  45.445  28.875
    2    HA   MET  18           HA       MET  18 -52.873  46.364  30.825
    3    HB2  MET  18           HB1      MET  18 -52.804  43.517  31.188
    4    HB3  MET  18           HB2      MET  18 -51.156  44.120  30.958
    5    HG2  MET  18           HG1      MET  18 -51.501  45.754  32.765
    6    HG3  MET  18           HG2      MET  18 -53.126  45.106  33.007
    7    HE1  MET  18           HE1      MET  18 -49.622  44.123  35.235
    8    HE2  MET  18           HE2      MET  18 -50.297  45.571  34.488
    9    HE3  MET  18           HE3      MET  18 -51.130  44.807  35.843
   10    H    LEU  19           H        LEU  19 -52.479  44.343  28.012
   11    HA   LEU  19           HA       LEU  19 -50.089  45.896  27.265
   12    HB2  LEU  19           HB1      LEU  19 -50.858  43.194  26.169
   13    HB3  LEU  19           HB2      LEU  19 -49.317  44.050  25.985
   14    HG   LEU  19           HG       LEU  19 -49.330  43.790  28.646
   15   HD11  LEU  19          HD11      LEU  19 -51.577  42.552  28.364
   16   HD12  LEU  19          HD12      LEU  19 -50.356  41.868  29.435
   17   HD13  LEU  19          HD13      LEU  19 -50.582  41.203  27.818
   18   HD21  LEU  19          HD21      LEU  19 -47.762  42.927  26.727
   19   HD22  LEU  19          HD22      LEU  19 -48.533  41.381  27.085
   20   HD23  LEU  19          HD23      LEU  19 -47.661  42.247  28.351
   21    H    VAL  20           H        VAL  20 -49.937  46.713  25.175
   22    HA   VAL  20           HA       VAL  20 -52.506  46.905  23.760
   23    HB   VAL  20           HB       VAL  20 -51.537  48.891  22.645
   24   HG11  VAL  20          HG11      VAL  20 -52.377  48.633  25.333
   25   HG12  VAL  20          HG12      VAL  20 -51.084  49.834  25.296
   26   HG13  VAL  20          HG13      VAL  20 -52.509  50.039  24.276
   27   HG21  VAL  20          HG21      VAL  20 -49.218  48.418  24.517
   28   HG22  VAL  20          HG22      VAL  20 -49.185  48.295  22.759
   29   HG23  VAL  20          HG23      VAL  20 -49.453  49.858  23.528
   30    H    LEU  21           H        LEU  21 -52.700  46.398  21.618
   31    HA   LEU  21           HA       LEU  21 -50.876  44.513  20.539
   32    HB2  LEU  21           HB1      LEU  21 -52.295  44.699  18.483
   33    HB3  LEU  21           HB2      LEU  21 -53.166  44.299  19.974
   34    HG   LEU  21           HG       LEU  21 -53.133  47.159  19.456
   35   HD11  LEU  21          HD11      LEU  21 -54.527  45.408  17.439
   36   HD12  LEU  21          HD12      LEU  21 -53.067  46.345  17.122
   37   HD13  LEU  21          HD13      LEU  21 -54.571  47.170  17.529
   38   HD21  LEU  21          HD21      LEU  21 -55.676  46.594  19.576
   39   HD22  LEU  21          HD22      LEU  21 -54.676  46.478  21.024
   40   HD23  LEU  21          HD23      LEU  21 -55.103  45.020  20.126
   41    H    ASP  22           H        ASP  22 -49.148  44.782  19.283
   42    HA   ASP  22           HA       ASP  22 -48.816  47.312  17.832
   43    HB2  ASP  22           HB1      ASP  22 -46.605  47.656  18.593
   44    HB3  ASP  22           HB2      ASP  22 -47.545  47.283  20.044
   45    HD2  ASP  22           HD       ASP  22 -46.015  44.086  20.272
   46    H    PHE  23           H        PHE  23 -47.973  47.114  15.829
   47    HA   PHE  23           HA       PHE  23 -47.916  44.612  14.569
   48    HB2  PHE  23           HB1      PHE  23 -47.786  47.300  13.781
   49    HB3  PHE  23           HB2      PHE  23 -46.296  46.571  13.178
   50    HD1  PHE  23           HD1      PHE  23 -49.973  46.348  13.065
   51    HD2  PHE  23           HD2      PHE  23 -46.292  45.055  11.362
   52    HE1  PHE  23           HE1      PHE  23 -51.198  45.374  11.166
   53    HE2  PHE  23           HE2      PHE  23 -47.510  44.079   9.460
   54    HZ   PHE  23           HZ       PHE  23 -49.966  44.238   9.360
   55    H    ASN  24           H        ASN  24 -46.522  43.063  15.143
   56    HA   ASN  24           HA       ASN  24 -43.808  43.688  15.916
   57    HB2  ASN  24           HB1      ASN  24 -45.615  41.603  16.453
   58    HB3  ASN  24           HB2      ASN  24 -44.306  40.867  15.522
   59   HD21  ASN  24          HD21      ASN  24 -45.306  41.669  18.555
   60   HD22  ASN  24          HD22      ASN  24 -43.783  41.645  19.372
   61    H    ASN  25           H        ASN  25 -41.931  42.940  14.867
   62    HA   ASN  25           HA       ASN  25 -42.121  42.961  11.997
   63    HB2  ASN  25           HB1      ASN  25 -40.148  43.595  13.915
   64    HB3  ASN  25           HB2      ASN  25 -39.492  42.265  12.952
   65   HD21  ASN  25          HD21      ASN  25 -38.916  42.599  10.861
   66   HD22  ASN  25          HD22      ASN  25 -38.943  44.147  10.094
   67    H    ILE  26           H        ILE  26 -41.052  41.337  10.636
   68    HA   ILE  26           HA       ILE  26 -41.037  38.642  11.805
   69    HB   ILE  26           HB       ILE  26 -42.093  37.819   9.656
   70   HG12  ILE  26          HG11      ILE  26 -43.432  40.434   9.319
   71   HG13  ILE  26          HG12      ILE  26 -41.745  40.370   8.783
   72   HG21  ILE  26          HG21      ILE  26 -43.561  39.424  11.715
   73   HG22  ILE  26          HG22      ILE  26 -44.428  38.605  10.417
   74   HG23  ILE  26          HG23      ILE  26 -43.442  37.673  11.543
   75   HD11  ILE  26          HD11      ILE  26 -43.026  39.859   6.888
   76   HD12  ILE  26          HD12      ILE  26 -42.380  38.316   7.450
   77   HD13  ILE  26          HD13      ILE  26 -44.057  38.745   7.785
   78    H    ARG  27           H        ARG  27 -38.688  39.264  11.695
   79    HA   ARG  27           HA       ARG  27 -37.398  39.485   9.172
   80    HB2  ARG  27           HB1      ARG  27 -36.487  38.989  11.988
   81    HB3  ARG  27           HB2      ARG  27 -35.351  38.788  10.644
   82    HG2  ARG  27           HG1      ARG  27 -36.852  41.299  10.538
   83    HG3  ARG  27           HG2      ARG  27 -35.833  41.122  11.976
   84    HD2  ARG  27           HD1      ARG  27 -33.872  41.052  10.766
   85    HD3  ARG  27           HD2      ARG  27 -34.678  40.430   9.320
   86    HE   ARG  27           HE       ARG  27 -35.694  42.939   9.605
   87   HH11  ARG  27          HH11      ARG  27 -32.480  41.615   9.406
   88   HH12  ARG  27          HH12      ARG  27 -31.804  43.026   8.663
   89   HH21  ARG  27          HH21      ARG  27 -34.816  44.803   8.628
   90   HH22  ARG  27          HH22      ARG  27 -33.133  44.840   8.222
   91    H    SER  28           H        SER  28 -36.588  37.966   7.838
   92    HA   SER  28           HA       SER  28 -37.115  35.164   8.540
   93    HB2  SER  28           HB1      SER  28 -36.679  36.495   5.848
   94    HB3  SER  28           HB2      SER  28 -36.920  34.755   6.083
   95    HG   SER  28           HG       SER  28 -38.948  35.386   7.156
   96    H    SER  29           H        SER  29 -35.453  33.977   9.171
   97    HA   SER  29           HA       SER  29 -32.738  34.861   8.664
   98    HB2  SER  29           HB1      SER  29 -33.448  34.015  10.904
   99    HB3  SER  29           HB2      SER  29 -33.692  32.418  10.177
  100    HG   SER  29           HG       SER  29 -31.613  32.092  10.190
  101    H    ALA  30           H        ALA  30 -32.342  34.507   6.504
  102    HA   ALA  30           HA       ALA  30 -32.101  31.685   5.727
  103    HB1  ALA  30           HB1      ALA  30 -34.176  32.763   4.753
  104    HB2  ALA  30           HB2      ALA  30 -33.086  33.770   3.799
  105    HB3  ALA  30           HB3      ALA  30 -33.067  32.017   3.602
  106    H    ASP  31           H        ASP  31 -30.874  31.668   3.468
  107    HA   ASP  31           HA       ASP  31 -28.881  31.956   2.411
  108    HB2  ASP  31           HB1      ASP  31 -29.985  34.303   2.204
  109    HB3  ASP  31           HB2      ASP  31 -28.790  34.787   3.416
  110    HD2  ASP  31           HD       ASP  31 -26.258  33.787   0.947
  111    H    LEU  32           H        LEU  32 -28.402  30.593   4.521
  112    HA   LEU  32           HA       LEU  32 -26.550  31.923   6.318
  113    HB2  LEU  32           HB1      LEU  32 -27.644  29.122   6.140
  114    HB3  LEU  32           HB2      LEU  32 -26.353  29.567   7.269
  115    HG   LEU  32           HG       LEU  32 -28.868  31.153   7.340
  116   HD11  LEU  32          HD11      LEU  32 -30.172  29.395   7.710
  117   HD12  LEU  32          HD12      LEU  32 -29.239  29.086   9.174
  118   HD13  LEU  32          HD13      LEU  32 -28.797  28.292   7.663
  119   HD21  LEU  32          HD21      LEU  32 -28.201  30.670   9.876
  120   HD22  LEU  32          HD22      LEU  32 -27.472  31.967   8.930
  121   HD23  LEU  32          HD23      LEU  32 -26.621  30.434   9.129
  122    H    HIS  33           H        HIS  33 -24.499  30.539   6.840
  123    HA   HIS  33           HA       HIS  33 -22.866  30.603   4.515
  124    HB2  HIS  33           HB1      HIS  33 -21.054  29.957   5.953
  125    HB3  HIS  33           HB2      HIS  33 -22.065  31.110   6.830
  126    HD1  HIS  33           HD1      HIS  33 -23.488  30.196   8.814
  127    HD2  HIS  33           HD2      HIS  33 -20.947  27.404   7.080
  128    HE1  HIS  33           HE1      HIS  33 -23.400  28.273  10.431
  129    HE2  HIS  33           HE2      HIS  33 -21.848  26.566   9.372
  130    H    GLY  34           H        GLY  34 -21.516  28.786   3.765
  131    HA2  GLY  34           HA2      GLY  34 -22.416  26.099   4.296
  132    HA3  GLY  34           HA3      GLY  34 -22.906  26.699   2.719
  133    HA1  GLY  34           HA1      GLY  34 -21.706  26.596   4.470
  134    H    ALA  35           H        ALA  35 -20.251  25.647   4.696
  135    HA   ALA  35           HA       ALA  35 -18.183  26.251   2.825
  136    HB1  ALA  35           HB1      ALA  35 -18.205  24.303   5.128
  137    HB2  ALA  35           HB2      ALA  35 -16.775  24.833   4.242
  138    HB3  ALA  35           HB3      ALA  35 -17.701  25.992   5.195
  139    H    ARG  36           H        ARG  36 -16.831  24.585   1.780
  140    HA   ARG  36           HA       ARG  36 -18.486  22.779   0.272
  141    HB2  ARG  36           HB1      ARG  36 -15.492  23.223   0.219
  142    HB3  ARG  36           HB2      ARG  36 -16.409  22.270  -0.957
  143    HG2  ARG  36           HG1      ARG  36 -17.277  24.099  -2.001
  144    HG3  ARG  36           HG2      ARG  36 -17.239  25.082  -0.529
  145    HD2  ARG  36           HD1      ARG  36 -14.724  24.214  -1.949
  146    HD3  ARG  36           HD2      ARG  36 -15.592  25.697  -2.369
  147    HE   ARG  36           HE       ARG  36 -15.193  25.795   0.361
  148   HH11  ARG  36          HH11      ARG  36 -13.220  25.634  -2.503
  149   HH12  ARG  36          HH12      ARG  36 -11.893  26.493  -1.796
  150   HH21  ARG  36          HH21      ARG  36 -13.452  26.927   1.305
  151   HH22  ARG  36          HH22      ARG  36 -12.026  27.229   0.371
  152    H    LYS  37           H        LYS  37 -16.223  22.555   2.912
  153    HA   LYS  37           HA       LYS  37 -15.767  20.851   4.356
  154    HB2  LYS  37           HB1      LYS  37 -17.646  19.066   2.820
  155    HB3  LYS  37           HB2      LYS  37 -17.222  19.008   4.539
  156    HG2  LYS  37           HG1      LYS  37 -18.332  21.472   4.399
  157    HG3  LYS  37           HG2      LYS  37 -19.248  20.616   3.144
  158    HD2  LYS  37           HD1      LYS  37 -19.454  18.748   4.979
  159    HD3  LYS  37           HD2      LYS  37 -19.111  20.092   6.081
  160    HE2  LYS  37           HE1      LYS  37 -21.094  20.859   4.114
  161    HE3  LYS  37           HE2      LYS  37 -21.583  19.395   4.981
  162    HZ1  LYS  37           HZ1      LYS  37 -22.374  21.007   6.368
  163    HZ2  LYS  37           HZ2      LYS  37 -21.130  22.099   6.022
  164    HZ3  LYS  37           HZ3      LYS  37 -20.839  20.783   7.046
  165    H    GLY  38           H        GLY  38 -16.463  19.099   1.324
  166    HA2  GLY  38           HA2      GLY  38 -15.000  18.040  -0.130
  167    HA3  GLY  38           HA3      GLY  38 -13.657  18.657   0.822
  168    HA1  GLY  38           HA1      GLY  38 -15.553  17.753   0.494
  169    H    SER  39           H        SER  39 -12.473  17.124   1.721
  170    HA   SER  39           HA       SER  39 -11.817  15.125   2.589
  171    HB2  SER  39           HB1      SER  39 -14.488  15.628   3.849
  172    HB3  SER  39           HB2      SER  39 -13.712  14.054   4.102
  173    HG   SER  39           HG       SER  39 -12.366  14.960   5.427
  174    H    GLN  40           H        GLN  40 -11.710  14.166   0.489
  175    HA   GLN  40           HA       GLN  40 -13.949  12.680  -0.532
  176    HB2  GLN  40           HB1      GLN  40 -12.023  13.797  -1.855
  177    HB3  GLN  40           HB2      GLN  40 -11.112  12.333  -1.452
  178    HG2  GLN  40           HG1      GLN  40 -13.788  12.285  -2.837
  179    HG3  GLN  40           HG2      GLN  40 -12.240  12.332  -3.692
  180   HE21  GLN  40          HE21      GLN  40 -10.639  10.622  -2.794
  181   HE22  GLN  40          HE22      GLN  40 -11.291   9.031  -2.632
  182    H    CYS  41           H        CYS  41 -11.025  11.979   1.279
  183    HA   CYS  41           HA       CYS  41 -12.063   9.287   1.799
  184    HB2  CYS  41           HB1      CYS  41  -9.954   8.236   1.446
  185    HB3  CYS  41           HB2      CYS  41 -10.293   9.206   0.012
  186    H    LEU  42           H        LEU  42 -11.393   8.369   3.787
  187    HA   LEU  42           HA       LEU  42 -10.815  10.361   5.813
  188    HB2  LEU  42           HB1      LEU  42 -12.143   7.804   5.690
  189    HB3  LEU  42           HB2      LEU  42 -10.939   7.817   6.990
  190    HG   LEU  42           HG       LEU  42 -13.148   9.850   6.692
  191   HD11  LEU  42          HD11      LEU  42 -13.433   8.227   8.998
  192   HD12  LEU  42          HD12      LEU  42 -13.269   7.165   7.600
  193   HD13  LEU  42          HD13      LEU  42 -14.531   8.398   7.629
  194   HD21  LEU  42          HD21      LEU  42 -12.531  10.553   8.904
  195   HD22  LEU  42          HD22      LEU  42 -11.099  10.603   7.874
  196   HD23  LEU  42          HD23      LEU  42 -11.318   9.278   9.018
  197    H    SER  43           H        SER  43  -9.199   7.788   4.148
  198    HA   SER  43           HA       SER  43  -6.648   8.579   5.056
  199    HB2  SER  43           HB1      SER  43  -8.044   6.549   6.653
  200    HB3  SER  43           HB2      SER  43  -6.454   6.021   6.076
  201    HG   SER  43           HG       SER  43  -7.073   7.856   7.990
  202    H    ASP  44           H        ASP  44  -5.013   6.638   4.552
  203    HA   ASP  44           HA       ASP  44  -5.163   6.195   1.792
  204    HB2  ASP  44           HB1      ASP  44  -3.532   4.484   3.667
  205    HB3  ASP  44           HB2      ASP  44  -3.155   4.965   2.008
  206    HD2  ASP  44           HD       ASP  44  -1.649   7.129   4.744
  207    H    THR  45           H        THR  45  -6.400   4.381   4.467
  208    HA   THR  45           HA       THR  45  -6.630   1.839   3.336
  209    HB   THR  45           HB       THR  45  -8.723   1.696   4.877
  210    HG1  THR  45           HG1      THR  45  -7.554   4.013   6.016
  211   HG21  THR  45          HG21      THR  45  -6.931   2.039   6.896
  212   HG22  THR  45          HG22      THR  45  -5.858   1.850   5.508
  213   HG23  THR  45          HG23      THR  45  -7.037   0.596   5.889
  214    H    ASP  46           H        ASP  46  -8.411   4.746   2.737
  215    HA   ASP  46           HA       ASP  46 -10.744   3.577   1.626
  216    HB2  ASP  46           HB1      ASP  46 -10.460   5.975   2.426
  217    HB3  ASP  46           HB2      ASP  46  -9.605   6.279   0.909
  218    HD2  ASP  46           HD       ASP  46 -12.527   6.338  -0.915
  219    H    CYS  47           H        CYS  47  -7.571   4.268   0.379
  220    HA   CYS  47           HA       CYS  47  -8.205   4.158  -2.381
  221    HB2  CYS  47           HB1      CYS  47  -5.835   4.390  -0.736
  222    HB3  CYS  47           HB2      CYS  47  -5.557   3.270  -2.071
  223    H    ASN  48           H        ASN  48  -6.769   2.369  -3.662
  224    HA   ASN  48           HA       ASN  48  -8.229   0.028  -3.618
  225    HB2  ASN  48           HB1      ASN  48  -5.428   0.579  -4.614
  226    HB3  ASN  48           HB2      ASN  48  -6.251  -0.962  -4.880
  227   HD21  ASN  48          HD21      ASN  48  -5.339   1.057  -6.795
  228   HD22  ASN  48          HD22      ASN  48  -6.734   1.495  -7.716
  229    H    THR  49           H        THR  49  -4.780   0.032  -2.755
  230    HA   THR  49           HA       THR  49  -5.251  -1.268  -0.236
  231    HB   THR  49           HB       THR  49  -3.975  -2.862  -2.466
  232    HG1  THR  49           HG1      THR  49  -5.762  -4.229  -2.154
  233   HG21  THR  49          HG21      THR  49  -4.271  -3.418   0.483
  234   HG22  THR  49          HG22      THR  49  -2.778  -3.320  -0.451
  235   HG23  THR  49          HG23      THR  49  -3.894  -4.662  -0.709
  236    H    ARG  50           H        ARG  50  -2.579  -1.499  -2.577
  237    HA   ARG  50           HA       ARG  50  -0.776  -0.420  -0.545
  238    HB2  ARG  50           HB1      ARG  50   1.025  -1.160  -2.091
  239    HB3  ARG  50           HB2      ARG  50  -0.047  -2.472  -1.579
  240    HG2  ARG  50           HG1      ARG  50  -0.855  -1.145  -4.073
  241    HG3  ARG  50           HG2      ARG  50   0.697  -1.997  -4.141
  242    HD2  ARG  50           HD1      ARG  50  -1.714  -3.330  -2.944
  243    HD3  ARG  50           HD2      ARG  50  -1.482  -3.286  -4.697
  244    HE   ARG  50           HE       ARG  50   0.889  -4.222  -3.790
  245   HH11  ARG  50          HH11      ARG  50  -2.421  -5.159  -3.254
  246   HH12  ARG  50          HH12      ARG  50  -2.044  -6.833  -3.011
  247   HH21  ARG  50          HH21      ARG  50   1.397  -6.422  -3.472
  248   HH22  ARG  50          HH22      ARG  50   0.128  -7.550  -3.134
  249    H    LYS  51           H        LYS  51  -2.297   1.588  -1.282
  250    HA   LYS  51           HA       LYS  51  -0.497   3.265  -2.850
  251    HB2  LYS  51           HB1      LYS  51  -3.371   2.696  -3.521
  252    HB3  LYS  51           HB2      LYS  51  -2.643   4.254  -3.943
  253    HG2  LYS  51           HG1      LYS  51  -1.748   3.379  -5.766
  254    HG3  LYS  51           HG2      LYS  51  -0.880   2.188  -4.783
  255    HD2  LYS  51           HD1      LYS  51  -2.573   0.586  -4.984
  256    HD3  LYS  51           HD2      LYS  51  -3.774   1.797  -5.466
  257    HE2  LYS  51           HE1      LYS  51  -3.059   1.863  -7.645
  258    HE3  LYS  51           HE2      LYS  51  -1.398   1.431  -7.213
  259    HZ1  LYS  51           HZ1      LYS  51  -1.889  -0.612  -7.874
  260    HZ2  LYS  51           HZ2      LYS  51  -3.538  -0.262  -8.012
  261    HZ3  LYS  51           HZ3      LYS  51  -2.902  -0.761  -6.526
  262    H    PHE  52           H        PHE  52  -1.060   5.595  -2.650
  263    HA   PHE  52           HA       PHE  52  -2.156   6.123   0.029
  264    HB2  PHE  52           HB1      PHE  52  -0.857   8.298  -0.178
  265    HB3  PHE  52           HB2      PHE  52   0.106   6.826  -0.037
  266    HD1  PHE  52           HD1      PHE  52  -1.390   8.960  -2.708
  267    HD2  PHE  52           HD2      PHE  52   1.887   6.550  -1.453
  268    HE1  PHE  52           HE1      PHE  52  -0.186   9.524  -4.778
  269    HE2  PHE  52           HE2      PHE  52   3.096   7.112  -3.522
  270    HZ   PHE  52           HZ       PHE  52   2.060   8.601  -5.187
  271    H    CYS  53           H        CYS  53  -3.398   8.067   0.349
  272    HA   CYS  53           HA       CYS  53  -5.245   8.521  -1.822
  273    HB2  CYS  53           HB1      CYS  53  -5.630   8.380   0.815
  274    HB3  CYS  53           HB2      CYS  53  -5.374  10.121   0.689
  275    H    LEU  54           H        LEU  54  -4.197   9.678  -3.404
  276    HA   LEU  54           HA       LEU  54  -2.748  12.092  -2.765
  277    HB2  LEU  54           HB1      LEU  54  -2.488  10.308  -4.749
  278    HB3  LEU  54           HB2      LEU  54  -3.530  11.492  -5.555
  279    HG   LEU  54           HG       LEU  54  -1.169  11.865  -6.065
  280   HD11  LEU  54          HD11      LEU  54  -1.064  14.262  -5.352
  281   HD12  LEU  54          HD12      LEU  54  -2.516  13.975  -4.392
  282   HD13  LEU  54          HD13      LEU  54  -2.567  13.789  -6.145
  283   HD21  LEU  54          HD21      LEU  54   0.434  11.743  -4.535
  284   HD22  LEU  54          HD22      LEU  54  -0.791  11.262  -3.360
  285   HD23  LEU  54          HD23      LEU  54  -0.355  12.963  -3.534
  286    H    GLN  55           H        GLN  55  -3.739  13.946  -2.366
  287    HA   GLN  55           HA       GLN  55  -6.124  14.638  -3.937
  288    HB2  GLN  55           HB1      GLN  55  -6.695  15.922  -1.648
  289    HB3  GLN  55           HB2      GLN  55  -7.267  14.285  -2.007
  290    HG2  GLN  55           HG1      GLN  55  -6.365  14.494   0.270
  291    HG3  GLN  55           HG2      GLN  55  -5.484  13.319  -0.716
  292   HE21  GLN  55          HE21      GLN  55  -5.391  16.595   0.549
  293   HE22  GLN  55          HE22      GLN  55  -3.672  16.756   0.521
  294    HA   PRO  56           HA       PRO  56  -3.040  17.997  -4.377
  295    HB2  PRO  56           HB1      PRO  56  -3.773  18.622  -6.941
  296    HB3  PRO  56           HB2      PRO  56  -2.648  17.325  -6.539
  297    HG2  PRO  56           HG1      PRO  56  -5.587  17.182  -7.124
  298    HG3  PRO  56           HG2      PRO  56  -4.249  16.137  -7.734
  299    HD2  PRO  56           HD1      PRO  56  -5.908  15.371  -5.726
  300    HD3  PRO  56           HD2      PRO  56  -4.202  14.896  -5.793
  301    H    ARG  57           H        ARG  57  -3.327  20.224  -4.337
  302    HA   ARG  57           HA       ARG  57  -5.986  21.111  -3.639
  303    HB2  ARG  57           HB1      ARG  57  -3.863  21.799  -2.440
  304    HB3  ARG  57           HB2      ARG  57  -3.495  22.799  -3.852
  305    HG2  ARG  57           HG1      ARG  57  -5.360  24.202  -3.491
  306    HG3  ARG  57           HG2      ARG  57  -6.054  23.079  -2.309
  307    HD2  ARG  57           HD1      ARG  57  -3.340  24.013  -1.655
  308    HD3  ARG  57           HD2      ARG  57  -4.574  25.279  -1.685
  309    HE   ARG  57           HE       ARG  57  -4.293  23.200   0.260
  310   HH11  ARG  57          HH11      ARG  57  -6.571  25.310  -1.315
  311   HH12  ARG  57          HH12      ARG  57  -7.706  25.275  -0.008
  312   HH21  ARG  57          HH21      ARG  57  -5.780  23.146   1.988
  313   HH22  ARG  57          HH22      ARG  57  -7.255  24.044   1.871
  314    H    ASP  58           H        ASP  58  -3.851  21.277  -6.363
  315    HA   ASP  58           HA       ASP  58  -5.404  23.374  -7.655
  316    HB2  ASP  58           HB1      ASP  58  -2.850  21.929  -8.282
  317    HB3  ASP  58           HB2      ASP  58  -3.717  22.771  -9.573
  318    HD2  ASP  58           HD       ASP  58  -2.820  25.880  -8.372
  319    H    GLU  59           H        GLU  59  -5.164  19.937  -7.589
  320    HA   GLU  59           HA       GLU  59  -7.070  19.778  -9.831
  321    HB2  GLU  59           HB1      GLU  59  -4.753  18.000  -9.115
  322    HB3  GLU  59           HB2      GLU  59  -6.118  17.380 -10.058
  323    HG2  GLU  59           HG1      GLU  59  -5.673  19.452 -11.574
  324    HG3  GLU  59           HG2      GLU  59  -4.079  19.423 -10.806
  325    HE2  GLU  59           HE       GLU  59  -4.600  15.940 -12.496
  326    H    LYS  60           H        LYS  60  -8.078  17.376  -9.699
  327    HA   LYS  60           HA       LYS  60  -9.528  17.371  -7.190
  328    HB2  LYS  60           HB1      LYS  60  -9.878  16.154  -9.882
  329    HB3  LYS  60           HB2      LYS  60 -10.607  15.304  -8.510
  330    HG2  LYS  60           HG1      LYS  60 -12.290  16.749  -8.390
  331    HG3  LYS  60           HG2      LYS  60 -11.179  18.131  -8.404
  332    HD2  LYS  60           HD1      LYS  60 -10.973  17.788 -10.911
  333    HD3  LYS  60           HD2      LYS  60 -12.336  16.662 -10.765
  334    HE2  LYS  60           HE1      LYS  60 -13.420  18.638 -11.301
  335    HE3  LYS  60           HE2      LYS  60 -13.498  18.636  -9.532
  336    HZ1  LYS  60           HZ1      LYS  60 -12.811  20.787 -10.466
  337    HZ2  LYS  60           HZ2      LYS  60 -11.429  20.061 -11.115
  338    HZ3  LYS  60           HZ3      LYS  60 -11.639  20.130  -9.437
  339    HA   PRO  61           HA       PRO  61  -7.524  13.997  -5.227
  340    HB2  PRO  61           HB1      PRO  61  -9.616  12.631  -4.109
  341    HB3  PRO  61           HB2      PRO  61  -9.055  14.196  -3.526
  342    HG2  PRO  61           HG1      PRO  61 -11.330  13.560  -5.374
  343    HG3  PRO  61           HG2      PRO  61 -11.284  14.690  -3.969
  344    HD2  PRO  61           HD1      PRO  61 -11.106  15.541  -6.540
  345    HD3  PRO  61           HD2      PRO  61 -10.257  16.342  -5.207
  346    H    PHE  62           H        PHE  62  -6.923  11.861  -5.491
  347    HA   PHE  62           HA       PHE  62  -8.472   9.943  -6.897
  348    HB2  PHE  62           HB1      PHE  62  -6.842   9.734  -8.845
  349    HB3  PHE  62           HB2      PHE  62  -7.964  11.095  -8.897
  350    HD1  PHE  62           HD1      PHE  62  -7.135  13.145  -9.489
  351    HD2  PHE  62           HD2      PHE  62  -4.546  10.346  -7.596
  352    HE1  PHE  62           HE1      PHE  62  -5.260  14.719  -9.734
  353    HE2  PHE  62           HE2      PHE  62  -2.668  11.916  -7.837
  354    HZ   PHE  62           HZ       PHE  62  -3.023  14.105  -8.906
  355    H    CYS  63           H        CYS  63  -7.363   7.891  -7.133
  356    HA   CYS  63           HA       CYS  63  -5.402   7.519  -5.028
  357    HB2  CYS  63           HB1      CYS  63  -7.454   6.033  -5.451
  358    HB3  CYS  63           HB2      CYS  63  -6.539   5.366  -6.803
  359    H    ALA  64           H        ALA  64  -3.330   7.821  -5.496
  360    HA   ALA  64           HA       ALA  64  -2.350   7.087  -8.169
  361    HB1  ALA  64           HB1      ALA  64  -1.258   9.015  -8.117
  362    HB2  ALA  64           HB2      ALA  64  -1.879   9.336  -6.497
  363    HB3  ALA  64           HB3      ALA  64  -0.358   8.468  -6.703
  364    H    THR  65           H        THR  65  -0.197   6.107  -8.300
  365    HA   THR  65           HA       THR  65   0.164   4.136  -6.158
  366    HB   THR  65           HB       THR  65  -0.132   3.101  -8.296
  367    HG1  THR  65           HG1      THR  65   1.409   1.793  -7.695
  368   HG21  THR  65          HG21      THR  65   0.417   4.202 -10.155
  369   HG22  THR  65          HG22      THR  65   2.113   3.863  -9.808
  370   HG23  THR  65          HG23      THR  65   1.376   5.359  -9.236
  371    H    CYS  66           H        CYS  66   2.389   3.494  -5.614
  372    HA   CYS  66           HA       CYS  66   3.926   5.591  -4.685
  373    HB2  CYS  66           HB1      CYS  66   5.743   3.941  -4.385
  374    HB3  CYS  66           HB2      CYS  66   4.184   3.341  -3.816
  375    H    ARG  67           H        ARG  67   6.173   6.166  -5.287
  376    HA   ARG  67           HA       ARG  67   6.292   6.740  -8.131
  377    HB2  ARG  67           HB1      ARG  67   7.355   7.907  -5.687
  378    HB3  ARG  67           HB2      ARG  67   8.590   7.769  -6.946
  379    HG2  ARG  67           HG1      ARG  67   7.547   9.935  -7.084
  380    HG3  ARG  67           HG2      ARG  67   7.110   8.971  -8.504
  381    HD2  ARG  67           HD1      ARG  67   4.929   9.079  -8.024
  382    HD3  ARG  67           HD2      ARG  67   5.221   8.581  -6.351
  383    HE   ARG  67           HE       ARG  67   5.996  11.188  -6.397
  384   HH11  ARG  67          HH11      ARG  67   3.089   9.492  -7.285
  385   HH12  ARG  67          HH12      ARG  67   2.044  10.824  -6.916
  386   HH21  ARG  67          HH21      ARG  67   4.631  12.948  -5.906
  387   HH22  ARG  67          HH22      ARG  67   2.922  12.789  -6.132
  388    H    GLY  68           H        GLY  68   8.411   6.529  -9.272
  389    HA2  GLY  68           HA2      GLY  68   9.358   3.817  -8.983
  390    HA3  GLY  68           HA3      GLY  68   9.823   4.960 -10.234
  391    HA1  GLY  68           HA1      GLY  68   9.391   4.314  -8.255
  392    H    LEU  69           H        LEU  69  11.815   3.497  -9.362
  393    HA   LEU  69           HA       LEU  69  13.144   4.412  -7.039
  394    HB2  LEU  69           HB1      LEU  69  14.215   3.057  -9.520
  395    HB3  LEU  69           HB2      LEU  69  15.136   3.312  -8.028
  396    HG   LEU  69           HG       LEU  69  12.712   1.551  -8.375
  397   HD11  LEU  69          HD11      LEU  69  15.146   0.390  -7.304
  398   HD12  LEU  69          HD12      LEU  69  15.370   1.051  -8.923
  399   HD13  LEU  69          HD13      LEU  69  14.117  -0.156  -8.630
  400   HD21  LEU  69          HD21      LEU  69  13.737   0.974  -5.923
  401   HD22  LEU  69          HD22      LEU  69  12.347   2.021  -6.212
  402   HD23  LEU  69          HD23      LEU  69  13.950   2.724  -5.990
  403    H    ARG  70           H        ARG  70  12.949   5.612 -10.284
  404    HA   ARG  70           HA       ARG  70  15.208   7.415  -9.903
  405    HB2  ARG  70           HB1      ARG  70  13.353   7.015 -12.262
  406    HB3  ARG  70           HB2      ARG  70  14.752   8.097 -12.241
  407    HG2  ARG  70           HG1      ARG  70  15.804   5.666 -11.433
  408    HG3  ARG  70           HG2      ARG  70  14.630   5.238 -12.688
  409    HD2  ARG  70           HD1      ARG  70  15.743   6.407 -14.341
  410    HD3  ARG  70           HD2      ARG  70  16.498   7.508 -13.180
  411    HE   ARG  70           HE       ARG  70  17.624   5.121 -12.581
  412   HH11  ARG  70          HH11      ARG  70  17.246   6.923 -15.535
  413   HH12  ARG  70          HH12      ARG  70  18.700   6.309 -16.250
  414   HH21  ARG  70          HH21      ARG  70  19.541   4.306 -13.510
  415   HH22  ARG  70          HH22      ARG  70  20.004   4.820 -15.097
  416    H    ARG  71           H        ARG  71  12.348   7.477  -8.633
  417    HA   ARG  71           HA       ARG  71  11.733  10.273  -9.306
  418    HB2  ARG  71           HB1      ARG  71  10.068   7.993  -8.287
  419    HB3  ARG  71           HB2      ARG  71   9.558   9.663  -7.999
  420    HG2  ARG  71           HG1      ARG  71  10.123   8.492 -10.724
  421    HG3  ARG  71           HG2      ARG  71   8.517   8.648  -9.995
  422    HD2  ARG  71           HD1      ARG  71   9.770  11.181  -9.774
  423    HD3  ARG  71           HD2      ARG  71  10.037  10.600 -11.424
  424    HE   ARG  71           HE       ARG  71   7.326  10.263 -10.619
  425   HH11  ARG  71          HH11      ARG  71   9.633  12.610 -11.754
  426   HH12  ARG  71          HH12      ARG  71   8.433  13.634 -12.471
  427   HH21  ARG  71          HH21      ARG  71   5.737  11.603 -11.559
  428   HH22  ARG  71          HH22      ARG  71   6.218  13.061 -12.359
  429    H    ARG  72           H        ARG  72  11.294  11.764  -7.618
  430    HA   ARG  72           HA       ARG  72  12.978  11.400  -5.323
  431    HB2  ARG  72           HB1      ARG  72  11.102  13.650  -6.092
  432    HB3  ARG  72           HB2      ARG  72  12.230  13.695  -4.728
  433    HG2  ARG  72           HG1      ARG  72  13.562  12.981  -7.207
  434    HG3  ARG  72           HG2      ARG  72  12.737  14.545  -7.304
  435    HD2  ARG  72           HD1      ARG  72  13.890  14.822  -4.893
  436    HD3  ARG  72           HD2      ARG  72  15.046  13.716  -5.649
  437    HE   ARG  72           HE       ARG  72  14.648  15.694  -7.504
  438   HH11  ARG  72          HH11      ARG  72  15.703  15.558  -4.189
  439   HH12  ARG  72          HH12      ARG  72  16.723  16.953  -4.320
  440   HH21  ARG  72          HH21      ARG  72  15.987  17.531  -7.688
  441   HH22  ARG  72          HH22      ARG  72  16.883  18.075  -6.311
  442    H    CYS  73           H        CYS  73  12.300  11.604  -3.115
  443    HA   CYS  73           HA       CYS  73   9.472  11.049  -2.590
  444    HB2  CYS  73           HB1      CYS  73   9.922   9.174  -1.191
  445    HB3  CYS  73           HB2      CYS  73  10.754   8.886  -2.721
  446    H    GLN  74           H        GLN  74   8.751  11.656  -0.532
  447    HA   GLN  74           HA       GLN  74  10.608  13.418   0.921
  448    HB2  GLN  74           HB1      GLN  74   7.670  13.569   0.360
  449    HB3  GLN  74           HB2      GLN  74   8.312  14.333   1.821
  450    HG2  GLN  74           HG1      GLN  74   9.355  15.986   0.689
  451    HG3  GLN  74           HG2      GLN  74   9.733  14.942  -0.688
  452   HE21  GLN  74          HE21      GLN  74   8.321  17.655  -0.176
  453   HE22  GLN  74          HE22      GLN  74   6.932  17.561  -1.201
  454    H    ARG  75           H        ARG  75   8.332  10.789   1.200
  455    HA   ARG  75           HA       ARG  75   9.081  10.510   4.036
  456    HB2  ARG  75           HB1      ARG  75   6.459  10.709   2.823
  457    HB3  ARG  75           HB2      ARG  75   6.643   9.172   3.682
  458    HG2  ARG  75           HG1      ARG  75   7.478  10.543   5.661
  459    HG3  ARG  75           HG2      ARG  75   6.859  11.953   4.785
  460    HD2  ARG  75           HD1      ARG  75   4.776  11.525   5.455
  461    HD3  ARG  75           HD2      ARG  75   4.874   9.891   4.785
  462    HE   ARG  75           HE       ARG  75   6.209  10.113   7.304
  463   HH11  ARG  75          HH11      ARG  75   3.106   9.705   5.779
  464   HH12  ARG  75          HH12      ARG  75   2.397   8.900   7.139
  465   HH21  ARG  75          HH21      ARG  75   5.286   9.054   9.103
  466   HH22  ARG  75          HH22      ARG  75   3.638   8.532   9.029
  467    H    ASP  76           H        ASP  76   9.512   8.448   4.785
  468    HA   ASP  76           HA       ASP  76  10.580   6.613   2.938
  469    HB2  ASP  76           HB1      ASP  76   9.753   5.889   5.748
  470    HB3  ASP  76           HB2      ASP  76  11.101   5.249   4.797
  471    HD2  ASP  76           HD       ASP  76  11.711   8.417   6.983
  472    H    ALA  77           H        ALA  77   7.435   6.891   4.427
  473    HA   ALA  77           HA       ALA  77   6.572   4.265   3.588
  474    HB1  ALA  77           HB1      ALA  77   5.756   5.449   5.658
  475    HB2  ALA  77           HB2      ALA  77   4.827   6.502   4.591
  476    HB3  ALA  77           HB3      ALA  77   4.503   4.768   4.621
  477    H    MET  78           H        MET  78   6.472   7.520   2.364
  478    HA   MET  78           HA       MET  78   4.353   7.403   0.586
  479    HB2  MET  78           HB1      MET  78   6.760   9.014   0.924
  480    HB3  MET  78           HB2      MET  78   6.295   8.845  -0.775
  481    HG2  MET  78           HG1      MET  78   3.928   9.502   0.028
  482    HG3  MET  78           HG2      MET  78   4.761  10.076   1.475
  483    HE1  MET  78           HE1      MET  78   4.944  11.707  -2.759
  484    HE2  MET  78           HE2      MET  78   6.233  10.548  -2.431
  485    HE3  MET  78           HE3      MET  78   4.546  10.068  -2.241
  486    H    CYS  79           H        CYS  79   7.584   6.068   0.309
  487    HA   CYS  79           HA       CYS  79   7.183   5.281  -2.452
  488    HB2  CYS  79           HB1      CYS  79   9.409   5.981  -1.199
  489    HB3  CYS  79           HB2      CYS  79   9.456   4.260  -0.802
  490    H    CYS  80           H        CYS  80   7.178   3.111  -3.186
  491    HA   CYS  80           HA       CYS  80   5.478   1.382  -1.833
  492    HB2  CYS  80           HB1      CYS  80   7.205   1.251  -4.212
  493    HB3  CYS  80           HB2      CYS  80   6.906  -0.315  -3.453
  494    HA   PRO  81           HA       PRO  81   7.863  -0.843   1.100
  495    HB2  PRO  81           HB1      PRO  81   6.886  -3.389   0.851
  496    HB3  PRO  81           HB2      PRO  81   5.974  -2.064   1.570
  497    HG2  PRO  81           HG1      PRO  81   5.867  -3.148  -1.224
  498    HG3  PRO  81           HG2      PRO  81   4.512  -2.710  -0.119
  499    HD2  PRO  81           HD1      PRO  81   5.337  -1.095  -2.140
  500    HD3  PRO  81           HD2      PRO  81   4.712  -0.466  -0.605
  501    H    GLY  82           H        GLY  82   9.828  -1.783   1.233
  502    HA2  GLY  82           HA2      GLY  82  11.335  -3.578   0.563
  503    HA3  GLY  82           HA3      GLY  82  10.752  -3.367  -1.081
  504    HA1  GLY  82           HA1      GLY  82  11.311  -2.753   0.876
  505    H    THR  83           H        THR  83  10.855  -0.351  -0.511
  506    HA   THR  83           HA       THR  83  13.754  -0.064  -0.968
  507    HB   THR  83           HB       THR  83  13.290   1.861  -2.375
  508    HG1  THR  83           HG1      THR  83  10.526   1.285  -1.975
  509   HG21  THR  83          HG21      THR  83  12.379  -0.817  -2.964
  510   HG22  THR  83          HG22      THR  83  13.219   0.335  -4.002
  511   HG23  THR  83          HG23      THR  83  11.461   0.379  -3.878
  512    H    LEU  84           H        LEU  84  14.463   2.303  -0.561
  513    HA   LEU  84           HA       LEU  84  13.130   3.384   1.822
  514    HB2  LEU  84           HB1      LEU  84  15.390   1.912   2.032
  515    HB3  LEU  84           HB2      LEU  84  16.075   3.527   1.784
  516    HG   LEU  84           HG       LEU  84  14.494   4.218   3.731
  517   HD11  LEU  84          HD11      LEU  84  14.484   1.236   3.878
  518   HD12  LEU  84          HD12      LEU  84  13.167   2.378   4.137
  519   HD13  LEU  84          HD13      LEU  84  14.426   2.194   5.358
  520   HD21  LEU  84          HD21      LEU  84  16.261   3.382   5.370
  521   HD22  LEU  84          HD22      LEU  84  16.810   4.402   4.040
  522   HD23  LEU  84          HD23      LEU  84  17.047   2.655   3.969
  523    H    CYS  85           H        CYS  85  13.800   5.619   2.323
  524    HA   CYS  85           HA       CYS  85  14.004   7.155  -0.131
  525    HB2  CYS  85           HB1      CYS  85  13.125   7.653   2.652
  526    HB3  CYS  85           HB2      CYS  85  13.872   9.026   1.831
  527    H    VAL  86           H        VAL  86  16.028   7.331  -0.892
  528    HA   VAL  86           HA       VAL  86  18.135   8.172   0.992
  529    HB   VAL  86           HB       VAL  86  18.471   6.679  -1.614
  530   HG11  VAL  86          HG11      VAL  86  20.548   7.479  -1.573
  531   HG12  VAL  86          HG12      VAL  86  20.311   8.198   0.021
  532   HG13  VAL  86          HG13      VAL  86  20.810   6.512  -0.122
  533   HG21  VAL  86          HG21      VAL  86  17.528   5.256   0.111
  534   HG22  VAL  86          HG22      VAL  86  19.208   4.812  -0.188
  535   HG23  VAL  86          HG23      VAL  86  18.787   5.755   1.242
  536    H    ASN  87           H        ASN  87  18.886  10.163   0.731
  537    HA   ASN  87           HA       ASN  87  19.233  12.242  -0.131
  538    HB2  ASN  87           HB1      ASN  87  19.641  10.714  -2.717
  539    HB3  ASN  87           HB2      ASN  87  20.250  12.331  -2.343
  540   HD21  ASN  87          HD21      ASN  87  21.386  12.240  -0.011
  541   HD22  ASN  87          HD22      ASN  87  22.637  11.051   0.076
  542    H    ASP  88           H        ASP  88  16.552  11.582   0.062
  543    HA   ASP  88           HA       ASP  88  14.489  12.276  -0.600
  544    HB2  ASP  88           HB1      ASP  88  16.282  14.339  -1.290
  545    HB3  ASP  88           HB2      ASP  88  15.208  14.141  -2.681
  546    HD2  ASP  88           HD       ASP  88  13.280  14.969   0.687
  547    H    VAL  89           H        VAL  89  15.935  10.133  -2.061
  548    HA   VAL  89           HA       VAL  89  14.196  10.093  -4.424
  549    HB   VAL  89           HB       VAL  89  17.117   9.318  -4.456
  550   HG11  VAL  89          HG11      VAL  89  16.707   8.952  -6.888
  551   HG12  VAL  89          HG12      VAL  89  15.876   7.802  -5.839
  552   HG13  VAL  89          HG13      VAL  89  14.981   9.131  -6.575
  553   HG21  VAL  89          HG21      VAL  89  15.623  11.722  -5.339
  554   HG22  VAL  89          HG22      VAL  89  17.264  11.574  -4.710
  555   HG23  VAL  89          HG23      VAL  89  16.919  11.140  -6.384
  556    H    CYS  90           H        CYS  90  13.338   8.120  -4.924
  557    HA   CYS  90           HA       CYS  90  13.265   6.154  -2.888
  558    HB2  CYS  90           HB1      CYS  90  12.173   6.394  -5.663
  559    HB3  CYS  90           HB2      CYS  90  12.159   4.812  -4.884
  560    H    THR  91           H        THR  91  15.022   4.990  -2.413
  561    HA   THR  91           HA       THR  91  16.428   3.656  -4.634
  562    HB   THR  91           HB       THR  91  17.643   4.595  -2.028
  563    HG1  THR  91           HG1      THR  91  17.976   5.521  -4.706
  564   HG21  THR  91          HG21      THR  91  18.493   2.643  -3.985
  565   HG22  THR  91          HG22      THR  91  19.210   3.056  -2.427
  566   HG23  THR  91          HG23      THR  91  19.644   3.974  -3.869
  567    H    THR  92           H        THR  92  16.348   1.512  -4.587
  568    HA   THR  92           HA       THR  92  14.941   0.028  -2.715
  569    HB   THR  92           HB       THR  92  16.947  -1.666  -3.830
  570    HG1  THR  92           HG1      THR  92  17.000  -1.040  -5.927
  571   HG21  THR  92          HG21      THR  92  14.265  -1.383  -5.086
  572   HG22  THR  92          HG22      THR  92  14.336  -1.848  -3.386
  573   HG23  THR  92          HG23      THR  92  15.141  -2.837  -4.605
  574    H    MET  93           H        MET  93  15.638  -1.528  -1.146
  575    HA   MET  93           HA       MET  93  17.518  -0.534   0.687
  576    HB2  MET  93           HB1      MET  93  15.684  -2.763   0.505
  577    HB3  MET  93           HB2      MET  93  17.218  -3.272   1.229
  578    HG2  MET  93           HG1      MET  93  16.896  -1.097   2.679
  579    HG3  MET  93           HG2      MET  93  15.204  -1.329   2.232
  580    HE1  MET  93           HE1      MET  93  14.038  -1.774   4.123
  581    HE2  MET  93           HE2      MET  93  14.288  -3.033   5.333
  582    HE3  MET  93           HE3      MET  93  15.274  -1.571   5.364
  583    H    GLU  94           H        GLU  94  17.727  -3.186  -1.660
  584    HA   GLU  94           HA       GLU  94  20.350  -3.985  -0.942
  585    HB2  GLU  94           HB1      GLU  94  18.858  -4.364  -3.551
  586    HB3  GLU  94           HB2      GLU  94  20.332  -5.222  -3.073
  587    HG2  GLU  94           HG1      GLU  94  17.962  -5.359  -1.272
  588    HG3  GLU  94           HG2      GLU  94  17.957  -6.303  -2.770
  589    HE2  GLU  94           HE       GLU  94  20.490  -8.411  -1.597
  590    H    ASP  95           H        ASP  95  19.086  -1.487  -2.984
  591    HA   ASP  95           HA       ASP  95  21.558  -1.036  -4.399
  592    HB2  ASP  95           HB1      ASP  95  18.817   0.033  -4.453
  593    HB3  ASP  95           HB2      ASP  95  20.069   1.242  -4.766
  594    HD2  ASP  95           HD       ASP  95  20.215  -1.772  -7.330
  595    H    ALA  96           H        ALA  96  19.969   0.200  -1.547
  596    HA   ALA  96           HA       ALA  96  21.347   2.592  -1.180
  597    HB1  ALA  96           HB1      ALA  96  19.397   1.854   0.151
  598    HB2  ALA  96           HB2      ALA  96  20.440   0.705   0.990
  599    HB3  ALA  96           HB3      ALA  96  20.733   2.437   1.143
  600    H    THR  97           H        THR  97  22.262  -0.716  -0.356
  601    HA   THR  97           HA       THR  97  25.026  -0.176  -0.470
  602    HB   THR  97           HB       THR  97  24.748   0.975   1.634
  603    HG1  THR  97           HG1      THR  97  25.780  -1.560   2.358
  604   HG21  THR  97          HG21      THR  97  23.242   0.375   3.164
  605   HG22  THR  97          HG22      THR  97  23.997  -1.209   3.344
  606   HG23  THR  97          HG23      THR  97  22.761  -0.955   2.113
  607    H    GLU  98           H        GLU  98  25.910  -2.036  -1.072
  608    HA   GLU  98           HA       GLU  98  24.614  -4.541  -0.222
  609    HB2  GLU  98           HB1      GLU  98  24.671  -3.900  -2.704
  610    HB3  GLU  98           HB2      GLU  98  26.406  -4.242  -2.623
  611    HG2  GLU  98           HG1      GLU  98  25.313  -6.484  -1.478
  612    HG3  GLU  98           HG2      GLU  98  24.142  -6.071  -2.739
  613    HE2  GLU  98           HE       GLU  98  27.327  -7.879  -3.862
  614    H    ASN  99           H        ASN  99  26.387  -3.383   1.532
  615    HA   ASN  99           HA       ASN  99  28.210  -3.849   2.808
  616    HB2  ASN  99           HB1      ASN  99  27.213  -6.285   2.009
  617    HB3  ASN  99           HB2      ASN  99  28.905  -6.388   1.505
  618   HD21  ASN  99          HD21      ASN  99  27.490  -7.826   3.613
  619   HD22  ASN  99          HD22      ASN  99  28.358  -7.507   5.072
  620    H    LEU 100           H        LEU 100  29.651  -2.324   2.138
  621    HA   LEU 100           HA       LEU 100  31.687  -3.230   0.229
  622    HB2  LEU 100           HB1      LEU 100  30.251  -0.580   0.244
  623    HB3  LEU 100           HB2      LEU 100  31.818  -0.814  -0.550
  624    HG   LEU 100           HG       LEU 100  30.413  -2.808  -1.699
  625   HD11  LEU 100          HD11      LEU 100  28.281  -2.527  -0.930
  626   HD12  LEU 100          HD12      LEU 100  28.232  -1.481  -2.348
  627   HD13  LEU 100          HD13      LEU 100  28.457  -0.782  -0.744
  628   HD21  LEU 100          HD21      LEU 100  29.830  -0.561  -3.261
  629   HD22  LEU 100          HD22      LEU 100  31.230  -1.626  -3.392
  630   HD23  LEU 100          HD23      LEU 100  31.318  -0.170  -2.399
  631    H    TYR 101           H        TYR 101  33.776  -2.569   0.662
  632    HA   TYR 101           HA       TYR 101  34.484  -2.124   3.319
  633    HB2  TYR 101           HB1      TYR 101  35.828  -2.412   0.786
  634    HB3  TYR 101           HB2      TYR 101  36.584  -1.118   1.718
  635    HD1  TYR 101           HD1      TYR 101  38.404  -1.751   2.972
  636    HD2  TYR 101           HD2      TYR 101  35.220  -4.526   2.456
  637    HE1  TYR 101           HE1      TYR 101  39.629  -3.398   4.325
  638    HE2  TYR 101           HE2      TYR 101  36.437  -6.182   3.807
  639    HH   TYR 101           HH       TYR 101  39.513  -6.178   4.387
  640    H    PHE 102           H        PHE 102  35.759  -0.255   4.152
  641    HA   PHE 102           HA       PHE 102  35.280   2.329   2.979
  642    HB2  PHE 102           HB1      PHE 102  33.972   3.255   4.810
  643    HB3  PHE 102           HB2      PHE 102  33.118   1.892   4.086
  644    HD1  PHE 102           HD1      PHE 102  34.497   3.242   7.101
  645    HD2  PHE 102           HD2      PHE 102  33.201  -0.355   5.230
  646    HE1  PHE 102           HE1      PHE 102  34.307   2.167   9.306
  647    HE2  PHE 102           HE2      PHE 102  33.009  -1.435   7.432
  648    HZ   PHE 102           HZ       PHE 102  33.560  -0.173   9.474
  649    H    GLN 103           H        GLN 103  37.524   0.673   3.883
  650    HA   GLN 103           HA       GLN 103  39.087   2.676   5.092
  651    HB2  GLN 103           HB1      GLN 103  39.567   1.476   7.250
  652    HB3  GLN 103           HB2      GLN 103  37.959   2.210   7.140
  653    HG2  GLN 103           HG1      GLN 103  36.936   0.263   7.433
  654    HG3  GLN 103           HG2      GLN 103  37.932  -0.518   6.197
  655   HE21  GLN 103          HE21      GLN 103  37.015  -1.009   9.150
  656   HE22  GLN 103          HE22      GLN 103  38.444  -1.651   9.875
  657    H    SER 104           H        SER 104  41.144   2.310   4.554
  658    HA   SER 104           HA       SER 104  42.420  -0.205   4.642
  659    HB2  SER 104           HB1      SER 104  40.963  -0.613   2.661
  660    HB3  SER 104           HB2      SER 104  41.742   0.758   1.853
  661    HG   SER 104           HG       SER 104  43.538  -0.377   1.590
  662    H    LEU 105           H        LEU 105  43.255   2.034   5.733
  663    HA   LEU 105           HA       LEU 105  45.636   2.694   4.184
  664    HB2  LEU 105           HB1      LEU 105  43.451   4.554   4.836
  665    HB3  LEU 105           HB2      LEU 105  45.071   5.130   5.268
  666    HG   LEU 105           HG       LEU 105  44.743   4.061   2.527
  667   HD11  LEU 105          HD11      LEU 105  43.547   6.688   3.399
  668   HD12  LEU 105          HD12      LEU 105  42.678   5.300   2.745
  669   HD13  LEU 105          HD13      LEU 105  43.807   6.191   1.726
  670   HD21  LEU 105          HD21      LEU 105  46.750   5.273   3.814
  671   HD22  LEU 105          HD22      LEU 105  45.945   6.692   3.142
  672   HD23  LEU 105          HD23      LEU 105  46.506   5.406   2.072
  673    H    GLU 106           H        GLU 106  47.164   1.958   5.518
  674    HA   GLU 106           HA       GLU 106  47.451   3.171   8.123
  675    HB2  GLU 106           HB1      GLU 106  46.253   0.590   7.869
  676    HB3  GLU 106           HB2      GLU 106  47.851   0.396   8.605
  677    HG2  GLU 106           HG1      GLU 106  47.277   1.467  10.516
  678    HG3  GLU 106           HG2      GLU 106  46.153   2.554   9.689
  679    HE2  GLU 106           HE       GLU 106  43.600   0.070   9.847
  680    H    HIS 107           H        HIS 107  49.459   3.914   7.856
  681    HA   HIS 107           HA       HIS 107  51.672   2.159   7.804
  682    HB2  HIS 107           HB1      HIS 107  50.692   2.405   5.311
  683    HB3  HIS 107           HB2      HIS 107  51.748   3.822   5.344
  684    HD1  HIS 107           HD1      HIS 107  53.544   2.952   3.791
  685    HD2  HIS 107           HD2      HIS 107  52.800   0.413   6.993
  686    HE1  HIS 107           HE1      HIS 107  55.377   1.232   3.725
  687    HE2  HIS 107           HE2      HIS 107  54.922  -0.321   5.682
  688    H    HIS 108           H        HIS 108  53.588   3.198   8.319
  689    HA   HIS 108           HA       HIS 108  53.520   6.128   8.483
  690    HB2  HIS 108           HB1      HIS 108  54.626   5.961  10.736
  691    HB3  HIS 108           HB2      HIS 108  52.937   5.445  10.699
  692    HD1  HIS 108           HD1      HIS 108  52.453   2.888  10.938
  693    HD2  HIS 108           HD2      HIS 108  56.442   3.953  11.407
  694    HE1  HIS 108           HE1      HIS 108  53.569   0.881  11.964
  695    HE2  HIS 108           HE2      HIS 108  56.006   1.532  12.252
  696    H    HIS 109           H        HIS 109  54.803   4.987   6.456
  697    HA   HIS 109           HA       HIS 109  56.802   4.834   5.380
  698    HB2  HIS 109           HB1      HIS 109  57.886   6.351   7.766
  699    HB3  HIS 109           HB2      HIS 109  58.615   6.248   6.160
  700    HD1  HIS 109           HD1      HIS 109  56.294   6.914   4.344
  701    HD2  HIS 109           HD2      HIS 109  57.046   8.936   7.895
  702    HE1  HIS 109           HE1      HIS 109  55.177   9.154   4.092
  703    HE2  HIS 109           HE2      HIS 109  55.637  10.391   6.262
  704    H    HIS 110           H        HIS 110  59.332   4.350   5.984
  705    HA   HIS 110           HA       HIS 110  59.235   1.703   7.120
  706    HB2  HIS 110           HB1      HIS 110  61.606   1.571   6.461
  707    HB3  HIS 110           HB2      HIS 110  60.574   2.093   5.125
  708    HD1  HIS 110           HD1      HIS 110  63.068   3.502   7.588
  709    HD2  HIS 110           HD2      HIS 110  61.200   4.528   4.022
  710    HE1  HIS 110           HE1      HIS 110  64.219   5.596   6.804
  711    HE2  HIS 110           HE2      HIS 110  63.079   6.223   4.623
  712    H    HIS 111           H        HIS 111  61.257   1.107   8.534
  713    HA   HIS 111           HA       HIS 111  62.086   3.114  10.416
  714    HB2  HIS 111           HB1      HIS 111  59.652   1.945  10.955
  715    HB3  HIS 111           HB2      HIS 111  60.771   0.939  11.883
  716    HD1  HIS 111           HD1      HIS 111  61.541   1.829  14.082
  717    HD2  HIS 111           HD2      HIS 111  59.855   4.781  11.692
  718    HE1  HIS 111           HE1      HIS 111  61.404   3.875  15.537
  719    HE2  HIS 111           HE2      HIS 111  60.374   5.681  14.078
  720    H    HIS 112           H        HIS 112  64.165   2.627  10.606
  721    HA   HIS 112           HA       HIS 112  64.985  -0.189  10.597
  722    HB2  HIS 112           HB1      HIS 112  65.981   1.956   9.209
  723    HB3  HIS 112           HB2      HIS 112  67.090   1.866  10.582
  724    HD1  HIS 112           HD1      HIS 112  66.015  -0.052   7.552
  725    HD2  HIS 112           HD2      HIS 112  68.794  -0.346  10.627
  726    HE1  HIS 112           HE1      HIS 112  67.584  -1.894   6.867
  727    HE2  HIS 112           HE2      HIS 112  69.282  -2.074   8.746
  Start of MODEL   64
    1    H1   MET  18           H        MET  18 -35.335   8.369  47.676
    2    HA   MET  18           HA       MET  18 -34.686   6.835  46.069
    3    HB2  MET  18           HB1      MET  18 -37.086   5.363  47.138
    4    HB3  MET  18           HB2      MET  18 -36.278   4.842  45.651
    5    HG2  MET  18           HG1      MET  18 -34.133   4.719  46.959
    6    HG3  MET  18           HG2      MET  18 -35.100   4.994  48.410
    7    HE1  MET  18           HE1      MET  18 -35.081   1.557  49.478
    8    HE2  MET  18           HE2      MET  18 -33.577   2.059  48.705
    9    HE3  MET  18           HE3      MET  18 -34.518   3.220  49.644
   10    H    LEU  19           H        LEU  19 -34.965   8.444  44.537
   11    HA   LEU  19           HA       LEU  19 -37.600   8.635  43.257
   12    HB2  LEU  19           HB1      LEU  19 -36.593  10.652  42.127
   13    HB3  LEU  19           HB2      LEU  19 -36.814  10.766  43.881
   14    HG   LEU  19           HG       LEU  19 -34.152   9.845  43.054
   15   HD11  LEU  19          HD11      LEU  19 -34.985  12.683  42.485
   16   HD12  LEU  19          HD12      LEU  19 -34.664  11.459  41.259
   17   HD13  LEU  19          HD13      LEU  19 -33.367  12.002  42.323
   18   HD21  LEU  19          HD21      LEU  19 -34.868  10.416  45.373
   19   HD22  LEU  19          HD22      LEU  19 -35.028  12.095  44.857
   20   HD23  LEU  19          HD23      LEU  19 -33.451  11.306  44.814
   21    H    VAL  20           H        VAL  20 -37.937   7.980  41.210
   22    HA   VAL  20           HA       VAL  20 -35.788   6.535  39.886
   23    HB   VAL  20           HB       VAL  20 -37.563   5.817  38.297
   24   HG11  VAL  20          HG11      VAL  20 -36.992   4.769  40.634
   25   HG12  VAL  20          HG12      VAL  20 -38.631   5.291  41.030
   26   HG13  VAL  20          HG13      VAL  20 -38.359   4.176  39.690
   27   HG21  VAL  20          HG21      VAL  20 -39.854   6.365  38.656
   28   HG22  VAL  20          HG22      VAL  20 -39.478   7.220  40.153
   29   HG23  VAL  20          HG23      VAL  20 -38.956   7.882  38.605
   30    H    LEU  21           H        LEU  21 -34.943   7.020  37.894
   31    HA   LEU  21           HA       LEU  21 -34.998   9.763  37.105
   32    HB2  LEU  21           HB1      LEU  21 -33.280   7.603  36.761
   33    HB3  LEU  21           HB2      LEU  21 -33.885   7.952  35.132
   34    HG   LEU  21           HG       LEU  21 -31.799   9.105  35.494
   35   HD11  LEU  21          HD11      LEU  21 -32.501  10.892  34.368
   36   HD12  LEU  21          HD12      LEU  21 -33.470  11.467  35.724
   37   HD13  LEU  21          HD13      LEU  21 -34.136  10.273  34.610
   38   HD21  LEU  21          HD21      LEU  21 -31.829   9.233  37.918
   39   HD22  LEU  21          HD22      LEU  21 -33.166  10.382  37.861
   40   HD23  LEU  21          HD23      LEU  21 -31.584  10.836  37.224
   41    H    ASP  22           H        ASP  22 -36.111  10.745  35.520
   42    HA   ASP  22           HA       ASP  22 -37.156   9.539  33.225
   43    HB2  ASP  22           HB1      ASP  22 -38.685   8.952  35.520
   44    HB3  ASP  22           HB2      ASP  22 -39.593  10.179  34.627
   45    HD2  ASP  22           HD       ASP  22 -39.142   6.613  32.960
   46    H    PHE  23           H        PHE  23 -38.338  11.007  31.897
   47    HA   PHE  23           HA       PHE  23 -38.938  13.654  32.832
   48    HB2  PHE  23           HB1      PHE  23 -36.334  13.080  31.680
   49    HB3  PHE  23           HB2      PHE  23 -37.215  14.263  30.712
   50    HD1  PHE  23           HD1      PHE  23 -38.451  16.129  32.186
   51    HD2  PHE  23           HD2      PHE  23 -35.000  13.927  33.351
   52    HE1  PHE  23           HE1      PHE  23 -37.852  17.913  33.772
   53    HE2  PHE  23           HE2      PHE  23 -34.396  15.706  34.940
   54    HZ   PHE  23           HZ       PHE  23 -35.823  17.702  35.151
   55    H    ASN  24           H        ASN  24 -38.086  11.918  29.833
   56    HA   ASN  24           HA       ASN  24 -40.759  12.467  28.798
   57    HB2  ASN  24           HB1      ASN  24 -38.193  13.487  27.629
   58    HB3  ASN  24           HB2      ASN  24 -39.518  13.042  26.548
   59   HD21  ASN  24          HD21      ASN  24 -38.253  15.424  28.575
   60   HD22  ASN  24          HD22      ASN  24 -39.587  16.521  28.529
   61    H    ASN  25           H        ASN  25 -37.607  11.132  27.787
   62    HA   ASN  25           HA       ASN  25 -37.048   9.191  26.735
   63    HB2  ASN  25           HB1      ASN  25 -39.429   8.178  28.315
   64    HB3  ASN  25           HB2      ASN  25 -38.222   7.152  27.530
   65   HD21  ASN  25          HD21      ASN  25 -35.881   8.333  28.094
   66   HD22  ASN  25          HD22      ASN  25 -35.603   8.357  29.799
   67    H    ILE  26           H        ILE  26 -37.644  10.123  24.680
   68    HA   ILE  26           HA       ILE  26 -39.874   8.667  23.448
   69    HB   ILE  26           HB       ILE  26 -40.499  10.628  22.120
   70   HG12  ILE  26          HG11      ILE  26 -39.546  12.832  23.422
   71   HG13  ILE  26          HG12      ILE  26 -38.137  11.759  23.471
   72   HG21  ILE  26          HG21      ILE  26 -41.490  11.978  23.997
   73   HG22  ILE  26          HG22      ILE  26 -41.810  10.246  24.060
   74   HG23  ILE  26          HG23      ILE  26 -40.583  10.954  25.110
   75   HD11  ILE  26          HD11      ILE  26 -39.425  11.888  20.854
   76   HD12  ILE  26          HD12      ILE  26 -38.748  13.419  21.413
   77   HD13  ILE  26          HD13      ILE  26 -37.720  11.991  21.293
   78    H    ARG  27           H        ARG  27 -39.740   9.053  20.941
   79    HA   ARG  27           HA       ARG  27 -36.985   9.221  20.004
   80    HB2  ARG  27           HB1      ARG  27 -38.589   6.740  20.147
   81    HB3  ARG  27           HB2      ARG  27 -37.766   7.032  18.608
   82    HG2  ARG  27           HG1      ARG  27 -35.849   7.572  20.575
   83    HG3  ARG  27           HG2      ARG  27 -36.688   6.103  21.103
   84    HD2  ARG  27           HD1      ARG  27 -36.214   4.986  19.035
   85    HD3  ARG  27           HD2      ARG  27 -35.596   6.483  18.323
   86    HE   ARG  27           HE       ARG  27 -33.592   6.136  19.389
   87   HH11  ARG  27          HH11      ARG  27 -36.001   4.003  20.715
   88   HH12  ARG  27          HH12      ARG  27 -34.863   3.079  21.639
   89   HH21  ARG  27          HH21      ARG  27 -32.083   4.927  20.599
   90   HH22  ARG  27          HH22      ARG  27 -32.635   3.606  21.572
   91    H    SER  28           H        SER  28 -37.261  10.856  18.605
   92    HA   SER  28           HA       SER  28 -39.132  10.436  16.391
   93    HB2  SER  28           HB1      SER  28 -40.286  12.390  16.650
   94    HB3  SER  28           HB2      SER  28 -39.857  12.130  18.351
   95    HG   SER  28           HG       SER  28 -39.340  14.251  17.634
   96    H    SER  29           H        SER  29 -38.185  10.739  14.485
   97    HA   SER  29           HA       SER  29 -35.940  12.605  14.263
   98    HB2  SER  29           HB1      SER  29 -35.881   9.672  13.527
   99    HB3  SER  29           HB2      SER  29 -34.750  10.849  12.837
  100    HG   SER  29           HG       SER  29 -33.629  10.581  14.583
  101    H    ALA  30           H        ALA  30 -35.925  13.737  12.405
  102    HA   ALA  30           HA       ALA  30 -37.282  12.769  10.040
  103    HB1  ALA  30           HB1      ALA  30 -38.329  15.378  10.411
  104    HB2  ALA  30           HB2      ALA  30 -39.201  13.849  10.298
  105    HB3  ALA  30           HB3      ALA  30 -38.664  14.443  11.869
  106    H    ASP  31           H        ASP  31 -37.335  14.796   8.405
  107    HA   ASP  31           HA       ASP  31 -36.073  16.129   7.062
  108    HB2  ASP  31           HB1      ASP  31 -35.281  16.959   9.818
  109    HB3  ASP  31           HB2      ASP  31 -34.307  17.548   8.464
  110    HD2  ASP  31           HD       ASP  31 -37.001  19.453   7.229
  111    H    LEU  32           H        LEU  32 -34.962  14.653   5.855
  112    HA   LEU  32           HA       LEU  32 -32.317  13.832   6.857
  113    HB2  LEU  32           HB1      LEU  32 -34.013  12.530   4.718
  114    HB3  LEU  32           HB2      LEU  32 -32.445  11.956   5.313
  115    HG   LEU  32           HG       LEU  32 -33.930  12.043   7.612
  116   HD11  LEU  32          HD11      LEU  32 -35.734  11.153   5.368
  117   HD12  LEU  32          HD12      LEU  32 -35.979  12.544   6.422
  118   HD13  LEU  32          HD13      LEU  32 -36.047  10.912   7.086
  119   HD21  LEU  32          HD21      LEU  32 -33.919   9.642   7.481
  120   HD22  LEU  32          HD22      LEU  32 -32.414  10.260   6.800
  121   HD23  LEU  32          HD23      LEU  32 -33.700   9.698   5.731
  122    H    HIS  33           H        HIS  33 -30.521  14.296   5.695
  123    HA   HIS  33           HA       HIS  33 -30.818  15.403   3.003
  124    HB2  HIS  33           HB1      HIS  33 -29.420  17.316   3.485
  125    HB3  HIS  33           HB2      HIS  33 -30.798  17.312   4.590
  126    HD1  HIS  33           HD1      HIS  33 -30.274  16.397   7.076
  127    HD2  HIS  33           HD2      HIS  33 -26.987  17.401   4.741
  128    HE1  HIS  33           HE1      HIS  33 -28.357  16.643   8.684
  129    HE2  HIS  33           HE2      HIS  33 -26.347  17.254   7.258
  130    H    GLY  34           H        GLY  34 -28.865  15.376   1.748
  131    HA2  GLY  34           HA2      GLY  34 -26.460  14.220   2.774
  132    HA3  GLY  34           HA3      GLY  34 -27.405  13.048   1.869
  133    HA1  GLY  34           HA1      GLY  34 -26.742  14.986   2.437
  134    H    ALA  35           H        ALA  35 -25.533  15.985   1.691
  135    HA   ALA  35           HA       ALA  35 -25.830  16.156  -1.197
  136    HB1  ALA  35           HB1      ALA  35 -25.364  18.305  -0.903
  137    HB2  ALA  35           HB2      ALA  35 -25.277  18.007   0.834
  138    HB3  ALA  35           HB3      ALA  35 -23.817  17.912  -0.152
  139    H    ARG  36           H        ARG  36 -23.895  16.303  -2.578
  140    HA   ARG  36           HA       ARG  36 -21.509  14.965  -1.590
  141    HB2  ARG  36           HB1      ARG  36 -23.424  13.388  -2.672
  142    HB3  ARG  36           HB2      ARG  36 -22.523  13.837  -4.127
  143    HG2  ARG  36           HG1      ARG  36 -20.582  12.785  -3.431
  144    HG3  ARG  36           HG2      ARG  36 -21.067  12.820  -1.728
  145    HD2  ARG  36           HD1      ARG  36 -22.553  11.033  -1.971
  146    HD3  ARG  36           HD2      ARG  36 -22.641  11.242  -3.726
  147    HE   ARG  36           HE       ARG  36 -20.057  10.582  -3.353
  148   HH11  ARG  36          HH11      ARG  36 -23.040   9.162  -2.252
  149   HH12  ARG  36          HH12      ARG  36 -22.409   7.549  -2.212
  150   HH21  ARG  36          HH21      ARG  36 -19.216   8.462  -3.305
  151   HH22  ARG  36          HH22      ARG  36 -20.233   7.151  -2.810
  152    H    LYS  37           H        LYS  37 -19.728  15.806  -2.474
  153    HA   LYS  37           HA       LYS  37 -20.058  17.572  -4.802
  154    HB2  LYS  37           HB1      LYS  37 -18.021  17.510  -2.573
  155    HB3  LYS  37           HB2      LYS  37 -17.818  18.498  -4.028
  156    HG2  LYS  37           HG1      LYS  37 -18.932  20.116  -3.002
  157    HG3  LYS  37           HG2      LYS  37 -20.378  19.097  -3.116
  158    HD2  LYS  37           HD1      LYS  37 -18.515  18.493  -0.888
  159    HD3  LYS  37           HD2      LYS  37 -19.408  20.020  -0.789
  160    HE2  LYS  37           HE1      LYS  37 -21.507  18.645  -1.303
  161    HE3  LYS  37           HE2      LYS  37 -20.506  17.228  -0.955
  162    HZ1  LYS  37           HZ1      LYS  37 -20.381  19.312   1.046
  163    HZ2  LYS  37           HZ2      LYS  37 -20.534  17.638   1.233
  164    HZ3  LYS  37           HZ3      LYS  37 -21.897  18.579   0.890
  165    H    GLY  38           H        GLY  38 -17.388  15.641  -3.422
  166    HA2  GLY  38           HA2      GLY  38 -17.044  13.758  -5.355
  167    HA3  GLY  38           HA3      GLY  38 -16.282  15.184  -6.043
  168    HA1  GLY  38           HA1      GLY  38 -17.003  13.925  -4.490
  169    H    SER  39           H        SER  39 -15.621  12.432  -4.466
  170    HA   SER  39           HA       SER  39 -13.017  13.355  -3.653
  171    HB2  SER  39           HB1      SER  39 -13.178  13.245  -1.391
  172    HB3  SER  39           HB2      SER  39 -14.897  13.546  -1.702
  173    HG   SER  39           HG       SER  39 -14.010  11.550  -0.405
  174    H    GLN  40           H        GLN  40 -11.575  11.817  -4.083
  175    HA   GLN  40           HA       GLN  40 -12.499   9.201  -4.892
  176    HB2  GLN  40           HB1      GLN  40  -9.796  10.546  -4.896
  177    HB3  GLN  40           HB2      GLN  40 -10.020   8.855  -5.369
  178    HG2  GLN  40           HG1      GLN  40 -11.303  11.250  -6.684
  179    HG3  GLN  40           HG2      GLN  40  -9.942  10.309  -7.312
  180   HE21  GLN  40          HE21      GLN  40 -12.593  10.813  -8.453
  181   HE22  GLN  40          HE22      GLN  40 -13.283   9.256  -8.746
  182    H    CYS  41           H        CYS  41 -10.157  10.447  -2.512
  183    HA   CYS  41           HA       CYS  41 -10.869   8.310  -0.685
  184    HB2  CYS  41           HB1      CYS  41  -8.464   7.663  -0.358
  185    HB3  CYS  41           HB2      CYS  41  -9.156   7.169  -1.903
  186    H    LEU  42           H        LEU  42 -10.111   8.663   1.467
  187    HA   LEU  42           HA       LEU  42  -9.427  11.480   1.970
  188    HB2  LEU  42           HB1      LEU  42 -11.086   9.460   3.392
  189    HB3  LEU  42           HB2      LEU  42 -10.214  10.651   4.373
  190    HG   LEU  42           HG       LEU  42 -11.681  11.892   2.193
  191   HD11  LEU  42          HD11      LEU  42 -13.444  10.477   2.283
  192   HD12  LEU  42          HD12      LEU  42 -13.854  11.463   3.686
  193   HD13  LEU  42          HD13      LEU  42 -13.051   9.909   3.906
  194   HD21  LEU  42          HD21      LEU  42 -10.650  12.891   4.314
  195   HD22  LEU  42          HD22      LEU  42 -12.076  12.266   5.143
  196   HD23  LEU  42          HD23      LEU  42 -12.257  13.443   3.842
  197    H    SER  43           H        SER  43  -8.412   8.204   2.455
  198    HA   SER  43           HA       SER  43  -5.943   9.183   3.688
  199    HB2  SER  43           HB1      SER  43  -7.943   7.435   4.945
  200    HB3  SER  43           HB2      SER  43  -6.298   6.773   4.973
  201    HG   SER  43           HG       SER  43  -5.994   8.073   6.588
  202    H    ASP  44           H        ASP  44  -4.212   7.496   3.661
  203    HA   ASP  44           HA       ASP  44  -3.909   6.458   1.057
  204    HB2  ASP  44           HB1      ASP  44  -2.337   5.622   3.503
  205    HB3  ASP  44           HB2      ASP  44  -1.811   5.574   1.816
  206    HD2  ASP  44           HD       ASP  44  -1.736   9.067   3.688
  207    H    THR  45           H        THR  45  -5.032   5.054   4.055
  208    HA   THR  45           HA       THR  45  -4.869   2.335   3.271
  209    HB   THR  45           HB       THR  45  -7.028   2.646   5.093
  210    HG1  THR  45           HG1      THR  45  -6.074   3.974   6.657
  211   HG21  THR  45          HG21      THR  45  -5.327   1.683   6.690
  212   HG22  THR  45          HG22      THR  45  -4.146   1.810   5.385
  213   HG23  THR  45          HG23      THR  45  -5.560   0.775   5.197
  214    H    ASP  46           H        ASP  46  -7.150   4.864   2.640
  215    HA   ASP  46           HA       ASP  46  -9.362   3.212   1.948
  216    HB2  ASP  46           HB1      ASP  46  -8.863   5.977   2.208
  217    HB3  ASP  46           HB2      ASP  46  -9.378   5.726   0.535
  218    HD2  ASP  46           HD       ASP  46 -12.606   4.899   1.480
  219    H    CYS  47           H        CYS  47  -6.544   4.348   0.252
  220    HA   CYS  47           HA       CYS  47  -7.486   3.864  -2.385
  221    HB2  CYS  47           HB1      CYS  47  -4.937   4.570  -1.092
  222    HB3  CYS  47           HB2      CYS  47  -4.761   3.618  -2.567
  223    H    ASN  48           H        ASN  48  -6.538   2.212  -3.846
  224    HA   ASN  48           HA       ASN  48  -7.082  -0.376  -2.944
  225    HB2  ASN  48           HB1      ASN  48  -6.612   0.824  -5.396
  226    HB3  ASN  48           HB2      ASN  48  -5.246  -0.285  -5.218
  227   HD21  ASN  48          HD21      ASN  48  -5.932  -1.665  -6.819
  228   HD22  ASN  48          HD22      ASN  48  -7.306  -2.696  -6.641
  229    H    THR  49           H        THR  49  -5.374  -2.207  -3.353
  230    HA   THR  49           HA       THR  49  -3.464  -2.026  -1.296
  231    HB   THR  49           HB       THR  49  -3.094  -4.034  -3.472
  232    HG1  THR  49           HG1      THR  49  -4.933  -5.108  -2.932
  233   HG21  THR  49          HG21      THR  49  -1.959  -5.081  -1.866
  234   HG22  THR  49          HG22      THR  49  -3.372  -5.065  -0.811
  235   HG23  THR  49          HG23      THR  49  -2.252  -3.704  -0.804
  236    H    ARG  50           H        ARG  50  -1.286  -1.672  -1.287
  237    HA   ARG  50           HA       ARG  50   0.716  -0.814  -1.942
  238    HB2  ARG  50           HB1      ARG  50   0.057  -1.907  -4.681
  239    HB3  ARG  50           HB2      ARG  50   1.660  -1.611  -3.992
  240    HG2  ARG  50           HG1      ARG  50   1.250  -3.382  -2.319
  241    HG3  ARG  50           HG2      ARG  50  -0.305  -3.710  -3.100
  242    HD2  ARG  50           HD1      ARG  50   1.839  -3.675  -5.045
  243    HD3  ARG  50           HD2      ARG  50   2.175  -4.822  -3.740
  244    HE   ARG  50           HE       ARG  50  -0.479  -5.157  -4.618
  245   HH11  ARG  50          HH11      ARG  50   2.800  -5.698  -5.653
  246   HH12  ARG  50          HH12      ARG  50   2.395  -7.046  -6.664
  247   HH21  ARG  50          HH21      ARG  50  -1.024  -6.929  -5.945
  248   HH22  ARG  50          HH22      ARG  50   0.220  -7.745  -6.830
  249    H    LYS  51           H        LYS  51  -1.472   0.941  -2.009
  250    HA   LYS  51           HA       LYS  51  -0.482   2.877  -3.950
  251    HB2  LYS  51           HB1      LYS  51  -3.170   1.636  -3.992
  252    HB3  LYS  51           HB2      LYS  51  -3.127   3.396  -4.185
  253    HG2  LYS  51           HG1      LYS  51  -2.563   3.189  -6.314
  254    HG3  LYS  51           HG2      LYS  51  -1.132   2.247  -5.862
  255    HD2  LYS  51           HD1      LYS  51  -2.856   0.288  -5.590
  256    HD3  LYS  51           HD2      LYS  51  -3.851   1.296  -6.655
  257    HE2  LYS  51           HE1      LYS  51  -1.768   1.416  -8.171
  258    HE3  LYS  51           HE2      LYS  51  -1.176   0.052  -7.213
  259    HZ1  LYS  51           HZ1      LYS  51  -3.536  -0.897  -7.785
  260    HZ2  LYS  51           HZ2      LYS  51  -2.248  -1.049  -8.872
  261    HZ3  LYS  51           HZ3      LYS  51  -3.411   0.158  -9.101
  262    H    PHE  52           H        PHE  52  -1.001   5.061  -3.426
  263    HA   PHE  52           HA       PHE  52  -1.929   5.427  -0.654
  264    HB2  PHE  52           HB1      PHE  52  -0.392   7.437  -0.609
  265    HB3  PHE  52           HB2      PHE  52   0.409   5.865  -0.635
  266    HD1  PHE  52           HD1      PHE  52  -0.491   8.771  -2.725
  267    HD2  PHE  52           HD2      PHE  52   1.853   5.233  -2.388
  268    HE1  PHE  52           HE1      PHE  52   0.799   9.440  -4.711
  269    HE2  PHE  52           HE2      PHE  52   3.146   5.897  -4.372
  270    HZ   PHE  52           HZ       PHE  52   2.620   8.003  -5.537
  271    H    CYS  53           H        CYS  53  -2.808   7.598  -0.196
  272    HA   CYS  53           HA       CYS  53  -4.556   8.424  -2.370
  273    HB2  CYS  53           HB1      CYS  53  -5.362   7.978  -0.007
  274    HB3  CYS  53           HB2      CYS  53  -4.531   9.462   0.465
  275    H    LEU  54           H        LEU  54  -3.529   9.747  -3.766
  276    HA   LEU  54           HA       LEU  54  -1.734  11.815  -2.821
  277    HB2  LEU  54           HB1      LEU  54  -1.612  10.361  -5.007
  278    HB3  LEU  54           HB2      LEU  54  -2.677  11.626  -5.644
  279    HG   LEU  54           HG       LEU  54  -0.331  12.021  -6.223
  280   HD11  LEU  54          HD11      LEU  54  -0.194  14.339  -5.440
  281   HD12  LEU  54          HD12      LEU  54  -1.469  14.013  -4.267
  282   HD13  LEU  54          HD13      LEU  54  -1.816  13.925  -5.993
  283   HD21  LEU  54          HD21      LEU  54   1.309  11.676  -4.771
  284   HD22  LEU  54          HD22      LEU  54   0.118  11.235  -3.547
  285   HD23  LEU  54          HD23      LEU  54   0.650  12.910  -3.698
  286    H    GLN  55           H        GLN  55  -2.619  13.573  -1.946
  287    HA   GLN  55           HA       GLN  55  -5.014  14.716  -3.222
  288    HB2  GLN  55           HB1      GLN  55  -5.557  14.162  -0.988
  289    HB3  GLN  55           HB2      GLN  55  -4.027  14.812  -0.378
  290    HG2  GLN  55           HG1      GLN  55  -4.852  16.867  -0.159
  291    HG3  GLN  55           HG2      GLN  55  -5.596  16.819  -1.762
  292   HE21  GLN  55          HE21      GLN  55  -7.652  17.332  -1.564
  293   HE22  GLN  55          HE22      GLN  55  -8.746  16.710  -0.381
  294    HA   PRO  56           HA       PRO  56  -1.706  17.694  -4.296
  295    HB2  PRO  56           HB1      PRO  56  -2.885  18.482  -6.640
  296    HB3  PRO  56           HB2      PRO  56  -1.872  17.046  -6.494
  297    HG2  PRO  56           HG1      PRO  56  -4.861  17.279  -6.432
  298    HG3  PRO  56           HG2      PRO  56  -3.828  16.098  -7.320
  299    HD2  PRO  56           HD1      PRO  56  -5.101  15.479  -5.004
  300    HD3  PRO  56           HD2      PRO  56  -3.522  14.802  -5.438
  301    H    ARG  57           H        ARG  57  -1.679  19.889  -4.019
  302    HA   ARG  57           HA       ARG  57  -4.045  21.082  -2.873
  303    HB2  ARG  57           HB1      ARG  57  -1.299  21.412  -2.533
  304    HB3  ARG  57           HB2      ARG  57  -1.828  22.907  -3.319
  305    HG2  ARG  57           HG1      ARG  57  -3.127  23.564  -1.551
  306    HG3  ARG  57           HG2      ARG  57  -3.391  21.900  -0.999
  307    HD2  ARG  57           HD1      ARG  57  -0.641  22.254  -0.775
  308    HD3  ARG  57           HD2      ARG  57  -1.329  23.797  -0.250
  309    HE   ARG  57           HE       ARG  57  -1.494  21.276   1.119
  310   HH11  ARG  57          HH11      ARG  57  -2.977  24.395   0.679
  311   HH12  ARG  57          HH12      ARG  57  -3.760  24.385   2.225
  312   HH21  ARG  57          HH21      ARG  57  -2.518  21.253   3.156
  313   HH22  ARG  57          HH22      ARG  57  -3.497  22.598   3.634
  314    H    ASP  58           H        ASP  58  -2.400  21.097  -5.909
  315    HA   ASP  58           HA       ASP  58  -3.912  23.432  -6.829
  316    HB2  ASP  58           HB1      ASP  58  -1.436  22.043  -7.718
  317    HB3  ASP  58           HB2      ASP  58  -2.433  22.786  -8.975
  318    HD2  ASP  58           HD       ASP  58  -0.775  25.234  -6.318
  319    H    GLU  59           H        GLU  59  -4.454  20.251  -6.539
  320    HA   GLU  59           HA       GLU  59  -6.356  20.255  -8.747
  321    HB2  GLU  59           HB1      GLU  59  -3.906  18.839  -8.876
  322    HB3  GLU  59           HB2      GLU  59  -5.184  17.641  -8.624
  323    HG2  GLU  59           HG1      GLU  59  -5.530  17.699 -10.814
  324    HG3  GLU  59           HG2      GLU  59  -6.229  19.303 -10.561
  325    HE2  GLU  59           HE       GLU  59  -3.617  20.848 -12.164
  326    H    LYS  60           H        LYS  60  -7.514  17.913  -8.616
  327    HA   LYS  60           HA       LYS  60  -8.680  17.874  -5.965
  328    HB2  LYS  60           HB1      LYS  60 -10.255  16.209  -6.986
  329    HB3  LYS  60           HB2      LYS  60 -10.223  17.786  -7.791
  330    HG2  LYS  60           HG1      LYS  60  -9.335  16.965  -9.707
  331    HG3  LYS  60           HG2      LYS  60  -8.404  15.717  -8.860
  332    HD2  LYS  60           HD1      LYS  60 -10.224  14.261  -8.717
  333    HD3  LYS  60           HD2      LYS  60 -11.396  15.564  -8.981
  334    HE2  LYS  60           HE1      LYS  60 -10.578  15.798 -11.311
  335    HE3  LYS  60           HE2      LYS  60  -9.489  14.432 -11.028
  336    HZ1  LYS  60           HZ1      LYS  60 -12.446  14.295 -10.794
  337    HZ2  LYS  60           HZ2      LYS  60 -11.366  12.999 -10.669
  338    HZ3  LYS  60           HZ3      LYS  60 -11.566  13.794 -12.149
  339    HA   PRO  61           HA       PRO  61  -6.601  14.351  -4.373
  340    HB2  PRO  61           HB1      PRO  61  -8.578  13.185  -2.878
  341    HB3  PRO  61           HB2      PRO  61  -7.771  14.685  -2.423
  342    HG2  PRO  61           HG1      PRO  61 -10.394  14.285  -3.822
  343    HG3  PRO  61           HG2      PRO  61  -9.985  15.394  -2.460
  344    HD2  PRO  61           HD1      PRO  61 -10.197  16.244  -5.029
  345    HD3  PRO  61           HD2      PRO  61  -9.047  16.948  -3.881
  346    H    PHE  62           H        PHE  62  -6.026  12.529  -5.364
  347    HA   PHE  62           HA       PHE  62  -8.088  10.689  -6.316
  348    HB2  PHE  62           HB1      PHE  62  -6.672  10.352  -8.427
  349    HB3  PHE  62           HB2      PHE  62  -7.665  11.808  -8.341
  350    HD1  PHE  62           HD1      PHE  62  -6.708  13.763  -9.041
  351    HD2  PHE  62           HD2      PHE  62  -4.226  10.752  -7.341
  352    HE1  PHE  62           HE1      PHE  62  -4.729  15.168  -9.446
  353    HE2  PHE  62           HE2      PHE  62  -2.244  12.153  -7.743
  354    HZ   PHE  62           HZ       PHE  62  -2.495  14.365  -8.796
  355    H    CYS  63           H        CYS  63  -6.890   8.634  -7.227
  356    HA   CYS  63           HA       CYS  63  -4.959   7.862  -5.157
  357    HB2  CYS  63           HB1      CYS  63  -7.188   6.610  -5.615
  358    HB3  CYS  63           HB2      CYS  63  -6.344   5.946  -7.015
  359    H    ALA  64           H        ALA  64  -2.898   7.496  -5.644
  360    HA   ALA  64           HA       ALA  64  -2.148   7.347  -8.486
  361    HB1  ALA  64           HB1      ALA  64   0.065   7.806  -6.688
  362    HB2  ALA  64           HB2      ALA  64  -0.495   8.770  -8.055
  363    HB3  ALA  64           HB3      ALA  64  -1.210   9.002  -6.459
  364    H    THR  65           H        THR  65  -0.811   5.736  -9.232
  365    HA   THR  65           HA       THR  65  -0.808   3.291  -7.732
  366    HB   THR  65           HB       THR  65   0.439   2.378  -9.713
  367    HG1  THR  65           HG1      THR  65   1.224   3.736 -11.129
  368   HG21  THR  65          HG21      THR  65  -1.670   1.905 -10.280
  369   HG22  THR  65          HG22      THR  65  -1.647   3.366 -11.267
  370   HG23  THR  65          HG23      THR  65  -2.258   3.427  -9.615
  371    H    CYS  66           H        CYS  66   1.278   1.948  -7.716
  372    HA   CYS  66           HA       CYS  66   3.096   3.046  -5.953
  373    HB2  CYS  66           HB1      CYS  66   2.854   0.638  -6.306
  374    HB3  CYS  66           HB2      CYS  66   3.549   0.793  -7.921
  375    H    ARG  67           H        ARG  67   5.120   3.969  -6.114
  376    HA   ARG  67           HA       ARG  67   5.709   5.201  -8.702
  377    HB2  ARG  67           HB1      ARG  67   6.787   5.802  -5.937
  378    HB3  ARG  67           HB2      ARG  67   7.183   6.702  -7.408
  379    HG2  ARG  67           HG1      ARG  67   4.375   6.427  -6.348
  380    HG3  ARG  67           HG2      ARG  67   5.462   7.762  -5.926
  381    HD2  ARG  67           HD1      ARG  67   5.627   8.435  -8.249
  382    HD3  ARG  67           HD2      ARG  67   4.670   7.031  -8.742
  383    HE   ARG  67           HE       ARG  67   2.759   8.138  -8.111
  384   HH11  ARG  67          HH11      ARG  67   5.545   9.822  -6.877
  385   HH12  ARG  67          HH12      ARG  67   4.643  11.210  -6.368
  386   HH21  ARG  67          HH21      ARG  67   1.560   9.961  -7.446
  387   HH22  ARG  67          HH22      ARG  67   2.376  11.288  -6.691
  388    H    GLY  68           H        GLY  68   7.988   5.388  -9.370
  389    HA2  GLY  68           HA2      GLY  68   9.323   2.817  -9.016
  390    HA3  GLY  68           HA3      GLY  68   9.694   4.022 -10.240
  391    HA1  GLY  68           HA1      GLY  68   9.182   3.315  -8.301
  392    H    LEU  69           H        LEU  69  11.896   3.223  -9.373
  393    HA   LEU  69           HA       LEU  69  12.804   4.142  -6.855
  394    HB2  LEU  69           HB1      LEU  69  14.109   3.183  -9.370
  395    HB3  LEU  69           HB2      LEU  69  15.096   3.953  -8.115
  396    HG   LEU  69           HG       LEU  69  13.404   1.484  -7.730
  397   HD11  LEU  69          HD11      LEU  69  15.134   0.625  -8.929
  398   HD12  LEU  69          HD12      LEU  69  15.880   0.625  -7.330
  399   HD13  LEU  69          HD13      LEU  69  16.242   1.919  -8.472
  400   HD21  LEU  69          HD21      LEU  69  15.171   1.567  -5.675
  401   HD22  LEU  69          HD22      LEU  69  13.509   2.149  -5.587
  402   HD23  LEU  69          HD23      LEU  69  14.825   3.282  -5.896
  403    H    ARG  70           H        ARG  70  13.489   5.394 -10.128
  404    HA   ARG  70           HA       ARG  70  14.816   7.709  -9.343
  405    HB2  ARG  70           HB1      ARG  70  13.132   7.156 -11.795
  406    HB3  ARG  70           HB2      ARG  70  14.137   8.599 -11.594
  407    HG2  ARG  70           HG1      ARG  70  15.230   5.791 -11.473
  408    HG3  ARG  70           HG2      ARG  70  15.163   6.764 -12.951
  409    HD2  ARG  70           HD1      ARG  70  16.776   8.244 -12.234
  410    HD3  ARG  70           HD2      ARG  70  16.414   7.955 -10.527
  411    HE   ARG  70           HE       ARG  70  18.003   6.324 -10.523
  412   HH11  ARG  70          HH11      ARG  70  16.973   6.858 -13.806
  413   HH12  ARG  70          HH12      ARG  70  18.140   5.775 -14.487
  414   HH21  ARG  70          HH21      ARG  70  19.546   4.897 -11.408
  415   HH22  ARG  70          HH22      ARG  70  19.603   4.659 -13.122
  416    H    ARG  71           H        ARG  71  11.443   6.952  -9.320
  417    HA   ARG  71           HA       ARG  71  10.296   9.485  -9.429
  418    HB2  ARG  71           HB1      ARG  71   9.476   6.834  -8.745
  419    HB3  ARG  71           HB2      ARG  71   8.866   7.947  -7.512
  420    HG2  ARG  71           HG1      ARG  71   7.198   7.694  -9.218
  421    HG3  ARG  71           HG2      ARG  71   7.872   9.330  -9.307
  422    HD2  ARG  71           HD1      ARG  71   7.855   8.727 -11.537
  423    HD3  ARG  71           HD2      ARG  71   9.495   8.275 -11.051
  424    HE   ARG  71           HE       ARG  71   8.968   6.087 -11.441
  425   HH11  ARG  71          HH11      ARG  71   6.025   7.924 -11.156
  426   HH12  ARG  71          HH12      ARG  71   5.002   6.605 -11.623
  427   HH21  ARG  71          HH21      ARG  71   7.633   4.342 -12.056
  428   HH22  ARG  71          HH22      ARG  71   5.918   4.568 -12.133
  429    H    ARG  72           H        ARG  72  10.102  11.146  -8.039
  430    HA   ARG  72           HA       ARG  72  11.788  11.236  -5.742
  431    HB2  ARG  72           HB1      ARG  72  10.745  13.493  -5.394
  432    HB3  ARG  72           HB2      ARG  72  11.483  13.254  -6.984
  433    HG2  ARG  72           HG1      ARG  72   8.634  12.558  -6.868
  434    HG3  ARG  72           HG2      ARG  72   8.996  14.265  -6.555
  435    HD2  ARG  72           HD1      ARG  72  10.589  13.867  -8.688
  436    HD3  ARG  72           HD2      ARG  72   9.325  12.677  -9.028
  437    HE   ARG  72           HE       ARG  72   8.055  15.063  -8.371
  438   HH11  ARG  72          HH11      ARG  72  10.161  13.824 -10.851
  439   HH12  ARG  72          HH12      ARG  72   9.554  14.884 -12.079
  440   HH21  ARG  72          HH21      ARG  72   7.248  16.465  -9.979
  441   HH22  ARG  72          HH22      ARG  72   7.899  16.387 -11.581
  442    H    CYS  73           H        CYS  73  11.047  11.837  -3.568
  443    HA   CYS  73           HA       CYS  73   8.328  11.129  -2.856
  444    HB2  CYS  73           HB1      CYS  73   9.049   9.446  -1.180
  445    HB3  CYS  73           HB2      CYS  73   9.349   8.938  -2.843
  446    H    GLN  74           H        GLN  74   7.913  11.480  -0.516
  447    HA   GLN  74           HA       GLN  74   9.690  13.577   0.546
  448    HB2  GLN  74           HB1      GLN  74   6.723  13.365   0.366
  449    HB3  GLN  74           HB2      GLN  74   7.407  14.160   1.792
  450    HG2  GLN  74           HG1      GLN  74   8.747  15.591   0.157
  451    HG3  GLN  74           HG2      GLN  74   7.652  14.966  -1.083
  452   HE21  GLN  74          HE21      GLN  74   6.544  16.774  -1.566
  453   HE22  GLN  74          HE22      GLN  74   5.557  17.644  -0.447
  454    H    ARG  75           H        ARG  75   7.980  10.634   1.182
  455    HA   ARG  75           HA       ARG  75   9.241  10.517   3.829
  456    HB2  ARG  75           HB1      ARG  75   7.196   9.422   4.736
  457    HB3  ARG  75           HB2      ARG  75   6.957  11.120   4.290
  458    HG2  ARG  75           HG1      ARG  75   6.276   9.760   1.983
  459    HG3  ARG  75           HG2      ARG  75   5.650   8.734   3.285
  460    HD2  ARG  75           HD1      ARG  75   4.937  11.260   4.123
  461    HD3  ARG  75           HD2      ARG  75   4.751  11.356   2.367
  462    HE   ARG  75           HE       ARG  75   3.486   9.051   2.965
  463   HH11  ARG  75          HH11      ARG  75   3.265  12.279   4.248
  464   HH12  ARG  75          HH12      ARG  75   1.592  12.136   4.672
  465   HH21  ARG  75          HH21      ARG  75   1.283   8.850   3.519
  466   HH22  ARG  75          HH22      ARG  75   0.465  10.185   4.259
  467    H    ASP  76           H        ASP  76   8.974   8.177   4.722
  468    HA   ASP  76           HA       ASP  76  10.211   6.437   2.827
  469    HB2  ASP  76           HB1      ASP  76  10.937   6.270   5.091
  470    HB3  ASP  76           HB2      ASP  76   9.281   6.046   5.672
  471    HD2  ASP  76           HD       ASP  76   9.781   2.673   5.530
  472    H    ALA  77           H        ALA  77   6.972   6.928   3.948
  473    HA   ALA  77           HA       ALA  77   5.994   4.383   2.997
  474    HB1  ALA  77           HB1      ALA  77   4.356   6.779   3.795
  475    HB2  ALA  77           HB2      ALA  77   3.855   5.088   3.748
  476    HB3  ALA  77           HB3      ALA  77   5.024   5.628   4.952
  477    H    MET  78           H        MET  78   6.429   7.579   1.746
  478    HA   MET  78           HA       MET  78   4.525   7.718  -0.255
  479    HB2  MET  78           HB1      MET  78   7.076   8.981   0.340
  480    HB3  MET  78           HB2      MET  78   6.824   8.801  -1.403
  481    HG2  MET  78           HG1      MET  78   4.836  10.078   0.475
  482    HG3  MET  78           HG2      MET  78   6.034  10.961  -0.475
  483    HE1  MET  78           HE1      MET  78   5.095  10.080  -4.092
  484    HE2  MET  78           HE2      MET  78   5.406  11.624  -3.298
  485    HE3  MET  78           HE3      MET  78   6.412  10.223  -2.927
  486    H    CYS  79           H        CYS  79   7.415   5.786  -0.081
  487    HA   CYS  79           HA       CYS  79   7.086   4.937  -2.869
  488    HB2  CYS  79           HB1      CYS  79   9.324   4.384  -0.903
  489    HB3  CYS  79           HB2      CYS  79   9.296   3.869  -2.591
  490    H    CYS  80           H        CYS  80   7.123   2.664  -3.387
  491    HA   CYS  80           HA       CYS  80   5.263   1.140  -2.033
  492    HB2  CYS  80           HB1      CYS  80   7.237   0.688  -4.156
  493    HB3  CYS  80           HB2      CYS  80   6.851  -0.766  -3.234
  494    HA   PRO  81           HA       PRO  81   7.202  -0.722   1.433
  495    HB2  PRO  81           HB1      PRO  81   6.191  -3.267   1.386
  496    HB3  PRO  81           HB2      PRO  81   5.235  -1.848   1.812
  497    HG2  PRO  81           HG1      PRO  81   5.442  -3.281  -0.815
  498    HG3  PRO  81           HG2      PRO  81   3.975  -2.687   0.047
  499    HD2  PRO  81           HD1      PRO  81   5.087  -1.357  -2.041
  500    HD3  PRO  81           HD2      PRO  81   4.298  -0.527  -0.689
  501    H    GLY  82           H        GLY  82   9.315  -1.154   1.521
  502    HA2  GLY  82           HA2      GLY  82  10.808  -3.201   1.421
  503    HA3  GLY  82           HA3      GLY  82  10.395  -3.224  -0.287
  504    HA1  GLY  82           HA1      GLY  82  10.752  -2.341   1.613
  505    H    THR  83           H        THR  83  10.440  -0.150  -0.101
  506    HA   THR  83           HA       THR  83  13.368   0.107  -0.323
  507    HB   THR  83           HB       THR  83  12.864   2.025  -1.896
  508    HG1  THR  83           HG1      THR  83  10.345   0.848  -2.318
  509   HG21  THR  83          HG21      THR  83  13.261  -0.590  -2.412
  510   HG22  THR  83          HG22      THR  83  13.068   0.630  -3.671
  511   HG23  THR  83          HG23      THR  83  11.693  -0.361  -3.185
  512    H    LEU  84           H        LEU  84  14.027   2.527  -0.167
  513    HA   LEU  84           HA       LEU  84  12.539   3.800   2.031
  514    HB2  LEU  84           HB1      LEU  84  15.514   3.391   1.752
  515    HB3  LEU  84           HB2      LEU  84  14.800   4.572   2.864
  516    HG   LEU  84           HG       LEU  84  13.760   1.839   3.157
  517   HD11  LEU  84          HD11      LEU  84  15.710   0.777   3.189
  518   HD12  LEU  84          HD12      LEU  84  16.126   1.731   4.612
  519   HD13  LEU  84          HD13      LEU  84  16.609   2.284   3.009
  520   HD21  LEU  84          HD21      LEU  84  14.998   3.196   5.426
  521   HD22  LEU  84          HD22      LEU  84  13.366   2.555   5.237
  522   HD23  LEU  84          HD23      LEU  84  13.760   4.158   4.615
  523    H    CYS  85           H        CYS  85  12.786   6.103   2.195
  524    HA   CYS  85           HA       CYS  85  13.030   7.350  -0.413
  525    HB2  CYS  85           HB1      CYS  85  11.164   7.810   1.266
  526    HB3  CYS  85           HB2      CYS  85  12.361   8.719   2.191
  527    H    VAL  86           H        VAL  86  15.141   7.575  -0.965
  528    HA   VAL  86           HA       VAL  86  16.910   8.956   0.943
  529    HB   VAL  86           HB       VAL  86  17.652   7.258  -1.443
  530   HG11  VAL  86          HG11      VAL  86  19.964   7.461  -0.382
  531   HG12  VAL  86          HG12      VAL  86  19.346   8.872  -1.243
  532   HG13  VAL  86          HG13      VAL  86  19.301   8.824   0.520
  533   HG21  VAL  86          HG21      VAL  86  17.839   5.490  -0.081
  534   HG22  VAL  86          HG22      VAL  86  18.557   6.446   1.216
  535   HG23  VAL  86          HG23      VAL  86  16.804   6.405   1.016
  536    H    ASN  87           H        ASN  87  17.688  10.919   0.465
  537    HA   ASN  87           HA       ASN  87  17.905  12.929  -0.585
  538    HB2  ASN  87           HB1      ASN  87  19.371  11.193  -1.966
  539    HB3  ASN  87           HB2      ASN  87  18.196  11.575  -3.231
  540   HD21  ASN  87          HD21      ASN  87  19.591  12.657  -4.549
  541   HD22  ASN  87          HD22      ASN  87  20.291  14.185  -4.146
  542    H    ASP  88           H        ASP  88  15.249  12.010  -0.292
  543    HA   ASP  88           HA       ASP  88  13.133  12.553  -0.929
  544    HB2  ASP  88           HB1      ASP  88  14.396  14.411  -2.954
  545    HB3  ASP  88           HB2      ASP  88  12.789  14.536  -2.226
  546    HD2  ASP  88           HD       ASP  88  14.051  15.954   0.685
  547    H    VAL  89           H        VAL  89  14.644  10.416  -2.280
  548    HA   VAL  89           HA       VAL  89  12.815  10.050  -4.516
  549    HB   VAL  89           HB       VAL  89  15.808   9.823  -4.859
  550   HG11  VAL  89          HG11      VAL  89  14.672   8.052  -6.051
  551   HG12  VAL  89          HG12      VAL  89  13.556   9.214  -6.771
  552   HG13  VAL  89          HG13      VAL  89  15.267   9.252  -7.197
  553   HG21  VAL  89          HG21      VAL  89  13.819  11.699  -6.136
  554   HG22  VAL  89          HG22      VAL  89  15.015  12.134  -4.915
  555   HG23  VAL  89          HG23      VAL  89  15.539  11.605  -6.514
  556    H    CYS  90           H        CYS  90  12.278   7.940  -4.878
  557    HA   CYS  90           HA       CYS  90  12.614   6.068  -2.846
  558    HB2  CYS  90           HB1      CYS  90  11.945   5.583  -5.761
  559    HB3  CYS  90           HB2      CYS  90  11.698   4.424  -4.453
  560    H    THR  91           H        THR  91  14.076   4.521  -2.407
  561    HA   THR  91           HA       THR  91  16.078   3.807  -4.413
  562    HB   THR  91           HB       THR  91  16.807   4.812  -1.655
  563    HG1  THR  91           HG1      THR  91  17.579   5.851  -4.187
  564   HG21  THR  91          HG21      THR  91  19.138   4.465  -2.396
  565   HG22  THR  91          HG22      THR  91  18.536   3.698  -3.866
  566   HG23  THR  91          HG23      THR  91  18.234   2.954  -2.297
  567    H    THR  92           H        THR  92  16.661   1.711  -4.330
  568    HA   THR  92           HA       THR  92  15.202  -0.139  -2.839
  569    HB   THR  92           HB       THR  92  17.683  -1.347  -3.502
  570    HG1  THR  92           HG1      THR  92  17.816  -0.692  -5.717
  571   HG21  THR  92          HG21      THR  92  16.365  -2.620  -5.028
  572   HG22  THR  92          HG22      THR  92  15.145  -1.350  -5.129
  573   HG23  THR  92          HG23      THR  92  15.340  -2.268  -3.637
  574    H    MET  93           H        MET  93  15.954  -1.663  -1.220
  575    HA   MET  93           HA       MET  93  17.201  -0.359   0.973
  576    HB2  MET  93           HB1      MET  93  15.948  -2.970   0.437
  577    HB3  MET  93           HB2      MET  93  17.218  -2.999   1.670
  578    HG2  MET  93           HG1      MET  93  16.070  -1.272   2.943
  579    HG3  MET  93           HG2      MET  93  14.824  -1.176   1.696
  580    HE1  MET  93           HE1      MET  93  14.391  -2.185   5.179
  581    HE2  MET  93           HE2      MET  93  15.037  -3.825   5.249
  582    HE3  MET  93           HE3      MET  93  16.075  -2.489   4.751
  583    H    GLU  94           H        GLU  94  18.301  -2.635  -1.458
  584    HA   GLU  94           HA       GLU  94  20.817  -3.149  -0.171
  585    HB2  GLU  94           HB1      GLU  94  19.500  -3.923  -2.723
  586    HB3  GLU  94           HB2      GLU  94  21.268  -3.967  -2.683
  587    HG2  GLU  94           HG1      GLU  94  20.477  -5.222  -0.322
  588    HG3  GLU  94           HG2      GLU  94  19.359  -5.808  -1.561
  589    HE2  GLU  94           HE       GLU  94  23.122  -6.964  -1.707
  590    H    ASP  95           H        ASP  95  19.575  -0.821  -2.417
  591    HA   ASP  95           HA       ASP  95  22.164   0.052  -3.337
  592    HB2  ASP  95           HB1      ASP  95  19.441   0.446  -4.112
  593    HB3  ASP  95           HB2      ASP  95  20.173   2.030  -3.828
  594    HD2  ASP  95           HD       ASP  95  21.740  -0.171  -6.743
  595    H    ALA  96           H        ALA  96  19.744   1.142  -1.013
  596    HA   ALA  96           HA       ALA  96  20.854   3.627  -0.372
  597    HB1  ALA  96           HB1      ALA  96  18.718   2.059   0.531
  598    HB2  ALA  96           HB2      ALA  96  19.706   2.393   1.954
  599    HB3  ALA  96           HB3      ALA  96  19.092   3.725   0.974
  600    H    THR  97           H        THR  97  21.611   0.391   0.783
  601    HA   THR  97           HA       THR  97  23.228   1.079   2.964
  602    HB   THR  97           HB       THR  97  24.230  -1.265   1.584
  603    HG1  THR  97           HG1      THR  97  22.188  -2.412   1.749
  604   HG21  THR  97          HG21      THR  97  23.867  -0.433   4.165
  605   HG22  THR  97          HG22      THR  97  24.246  -2.085   3.677
  606   HG23  THR  97          HG23      THR  97  22.572  -1.615   3.974
  607    H    GLU  98           H        GLU  98  24.322   0.033  -0.271
  608    HA   GLU  98           HA       GLU  98  26.201   0.501  -1.465
  609    HB2  GLU  98           HB1      GLU  98  25.180   2.846  -1.059
  610    HB3  GLU  98           HB2      GLU  98  26.498   3.044   0.107
  611    HG2  GLU  98           HG1      GLU  98  28.156   2.866  -1.561
  612    HG3  GLU  98           HG2      GLU  98  26.992   2.261  -2.746
  613    HE2  GLU  98           HE       GLU  98  27.634   5.979  -2.901
  614    H    ASN  99           H        ASN  99  27.527  -1.108  -0.680
  615    HA   ASN  99           HA       ASN  99  28.925  -0.935   1.786
  616    HB2  ASN  99           HB1      ASN  99  29.138  -2.698  -0.644
  617    HB3  ASN  99           HB2      ASN  99  30.351  -2.791   0.641
  618   HD21  ASN  99          HD21      ASN  99  28.264  -4.693  -0.308
  619   HD22  ASN  99          HD22      ASN  99  27.386  -5.131   1.115
  620    H    LEU 100           H        LEU 100  30.981  -0.282   2.248
  621    HA   LEU 100           HA       LEU 100  32.319   1.297   0.169
  622    HB2  LEU 100           HB1      LEU 100  31.684   1.865   2.807
  623    HB3  LEU 100           HB2      LEU 100  33.417   1.495   2.853
  624    HG   LEU 100           HG       LEU 100  32.916   3.280   0.679
  625   HD11  LEU 100          HD11      LEU 100  32.095   5.217   1.907
  626   HD12  LEU 100          HD12      LEU 100  31.856   4.219   3.341
  627   HD13  LEU 100          HD13      LEU 100  30.896   3.924   1.891
  628   HD21  LEU 100          HD21      LEU 100  34.348   4.747   2.311
  629   HD22  LEU 100          HD22      LEU 100  35.048   3.330   1.528
  630   HD23  LEU 100          HD23      LEU 100  34.501   3.233   3.203
  631    H    TYR 101           H        TYR 101  34.796   1.381   0.498
  632    HA   TYR 101           HA       TYR 101  35.736  -1.388   0.475
  633    HB2  TYR 101           HB1      TYR 101  36.768   1.193  -0.666
  634    HB3  TYR 101           HB2      TYR 101  37.864  -0.172  -0.440
  635    HD1  TYR 101           HD1      TYR 101  37.833  -2.058  -1.891
  636    HD2  TYR 101           HD2      TYR 101  34.819   0.928  -2.218
  637    HE1  TYR 101           HE1      TYR 101  37.098  -3.041  -4.023
  638    HE2  TYR 101           HE2      TYR 101  34.075  -0.049  -4.350
  639    HH   TYR 101           HH       TYR 101  34.719  -3.005  -5.343
  640    H    PHE 102           H        PHE 102  37.796  -1.921   1.472
  641    HA   PHE 102           HA       PHE 102  38.454  -0.220   3.782
  642    HB2  PHE 102           HB1      PHE 102  37.796  -3.140   3.694
  643    HB3  PHE 102           HB2      PHE 102  38.980  -2.572   4.871
  644    HD1  PHE 102           HD1      PHE 102  35.583  -3.175   4.343
  645    HD2  PHE 102           HD2      PHE 102  38.230  -0.449   6.258
  646    HE1  PHE 102           HE1      PHE 102  33.772  -2.488   5.860
  647    HE2  PHE 102           HE2      PHE 102  36.425   0.241   7.780
  648    HZ   PHE 102           HZ       PHE 102  34.192  -0.779   7.583
  649    H    GLN 103           H        GLN 103  40.509   0.380   3.757
  650    HA   GLN 103           HA       GLN 103  42.728   0.482   3.264
  651    HB2  GLN 103           HB1      GLN 103  42.531  -2.536   3.415
  652    HB3  GLN 103           HB2      GLN 103  44.012  -1.574   3.556
  653    HG2  GLN 103           HG1      GLN 103  43.702  -1.657   5.753
  654    HG3  GLN 103           HG2      GLN 103  42.397  -0.492   5.494
  655   HE21  GLN 103          HE21      GLN 103  40.935  -1.109   6.961
  656   HE22  GLN 103          HE22      GLN 103  40.212  -2.677   7.039
  657    H    SER 104           H        SER 104  44.481  -0.858   1.771
  658    HA   SER 104           HA       SER 104  43.212  -1.244  -0.854
  659    HB2  SER 104           HB1      SER 104  44.779   0.983  -0.112
  660    HB3  SER 104           HB2      SER 104  45.811  -0.026  -1.141
  661    HG   SER 104           HG       SER 104  44.498   0.273  -2.809
  662    H    LEU 105           H        LEU 105  45.296  -1.841  -2.409
  663    HA   LEU 105           HA       LEU 105  46.690  -4.043  -1.037
  664    HB2  LEU 105           HB1      LEU 105  45.190  -4.026  -3.636
  665    HB3  LEU 105           HB2      LEU 105  46.527  -5.160  -3.376
  666    HG   LEU 105           HG       LEU 105  45.199  -5.827  -1.236
  667   HD11  LEU 105          HD11      LEU 105  42.751  -5.639  -1.591
  668   HD12  LEU 105          HD12      LEU 105  43.068  -4.531  -2.925
  669   HD13  LEU 105          HD13      LEU 105  43.542  -4.093  -1.284
  670   HD21  LEU 105          HD21      LEU 105  43.839  -6.718  -3.724
  671   HD22  LEU 105          HD22      LEU 105  44.458  -7.664  -2.369
  672   HD23  LEU 105          HD23      LEU 105  45.573  -7.010  -3.571
  673    H    GLU 106           H        GLU 106  48.457  -4.931  -2.683
  674    HA   GLU 106           HA       GLU 106  50.480  -4.560  -3.653
  675    HB2  GLU 106           HB1      GLU 106  48.606  -2.927  -5.057
  676    HB3  GLU 106           HB2      GLU 106  50.126  -2.032  -4.909
  677    HG2  GLU 106           HG1      GLU 106  50.476  -4.828  -5.701
  678    HG3  GLU 106           HG2      GLU 106  49.548  -3.856  -6.850
  679    HE2  GLU 106           HE       GLU 106  52.346  -1.776  -7.456
  680    H    HIS 107           H        HIS 107  51.792  -4.216  -1.923
  681    HA   HIS 107           HA       HIS 107  52.677  -1.500  -1.480
  682    HB2  HIS 107           HB1      HIS 107  50.899  -2.854   0.383
  683    HB3  HIS 107           HB2      HIS 107  52.429  -2.408   1.146
  684    HD1  HIS 107           HD1      HIS 107  53.080   0.284   0.177
  685    HD2  HIS 107           HD2      HIS 107  49.151  -0.855   0.901
  686    HE1  HIS 107           HE1      HIS 107  51.812   2.428   0.524
  687    HE2  HIS 107           HE2      HIS 107  49.409   1.733   0.967
  688    H    HIS 108           H        HIS 108  54.377  -1.660   0.500
  689    HA   HIS 108           HA       HIS 108  56.363  -2.490   1.254
  690    HB2  HIS 108           HB1      HIS 108  54.898  -4.621   1.470
  691    HB3  HIS 108           HB2      HIS 108  55.741  -5.158   0.014
  692    HD1  HIS 108           HD1      HIS 108  56.007  -5.356   3.561
  693    HD2  HIS 108           HD2      HIS 108  58.727  -5.008   0.440
  694    HE1  HIS 108           HE1      HIS 108  58.214  -6.102   4.507
  695    HE2  HIS 108           HE2      HIS 108  59.877  -5.890   2.600
  696    H    HIS 109           H        HIS 109  55.858  -4.372  -1.731
  697    HA   HIS 109           HA       HIS 109  57.054  -4.514  -3.661
  698    HB2  HIS 109           HB1      HIS 109  57.135  -1.676  -2.909
  699    HB3  HIS 109           HB2      HIS 109  58.463  -2.170  -3.963
  700    HD1  HIS 109           HD1      HIS 109  54.970  -1.191  -4.061
  701    HD2  HIS 109           HD2      HIS 109  57.531  -3.421  -6.453
  702    HE1  HIS 109           HE1      HIS 109  53.837  -1.341  -6.301
  703    HE2  HIS 109           HE2      HIS 109  55.401  -2.706  -7.764
  704    H    HIS 110           H        HIS 110  58.537  -6.075  -3.218
  705    HA   HIS 110           HA       HIS 110  61.126  -5.188  -2.126
  706    HB2  HIS 110           HB1      HIS 110  59.612  -7.009  -0.949
  707    HB3  HIS 110           HB2      HIS 110  60.339  -8.072  -2.157
  708    HD1  HIS 110           HD1      HIS 110  62.136  -5.296  -0.314
  709    HD2  HIS 110           HD2      HIS 110  62.112  -9.441  -0.589
  710    HE1  HIS 110           HE1      HIS 110  64.115  -6.070   1.030
  711    HE2  HIS 110           HE2      HIS 110  64.102  -8.603   0.862
  712    H    HIS 111           H        HIS 111  62.979  -6.639  -2.889
  713    HA   HIS 111           HA       HIS 111  64.331  -7.323  -4.586
  714    HB2  HIS 111           HB1      HIS 111  61.862  -8.717  -4.912
  715    HB3  HIS 111           HB2      HIS 111  62.463  -8.285  -6.515
  716    HD1  HIS 111           HD1      HIS 111  64.281  -9.566  -3.420
  717    HD2  HIS 111           HD2      HIS 111  63.814 -10.418  -7.459
  718    HE1  HIS 111           HE1      HIS 111  65.784 -11.531  -3.871
  719    HE2  HIS 111           HE2      HIS 111  65.498 -12.053  -6.341
  720    H    HIS 112           H        HIS 112  65.110  -5.409  -5.352
  721    HA   HIS 112           HA       HIS 112  63.586  -3.696  -7.068
  722    HB2  HIS 112           HB1      HIS 112  66.260  -3.694  -5.829
  723    HB3  HIS 112           HB2      HIS 112  66.178  -2.886  -7.399
  724    HD1  HIS 112           HD1      HIS 112  64.287  -2.779  -4.096
  725    HD2  HIS 112           HD2      HIS 112  65.380  -0.307  -7.251
  726    HE1  HIS 112           HE1      HIS 112  63.504  -0.479  -3.450
  727    HE2  HIS 112           HE2      HIS 112  64.172   1.033  -5.377
  Start of MODEL   65
    1    H1   MET  18           H        MET  18 -53.796 -28.031  -7.101
    2    HA   MET  18           HA       MET  18 -52.454 -28.778  -5.322
    3    HB2  MET  18           HB1      MET  18 -51.524 -29.355  -8.007
    4    HB3  MET  18           HB2      MET  18 -50.187 -29.387  -6.847
    5    HG2  MET  18           HG1      MET  18 -50.906 -31.577  -6.806
    6    HG3  MET  18           HG2      MET  18 -51.756 -30.870  -5.431
    7    HE1  MET  18           HE1      MET  18 -55.207 -31.847  -5.940
    8    HE2  MET  18           HE2      MET  18 -53.837 -32.829  -5.419
    9    HE3  MET  18           HE3      MET  18 -53.936 -31.133  -4.947
   10    H    LEU  19           H        LEU  19 -51.481 -27.686  -3.756
   11    HA   LEU  19           HA       LEU  19 -50.093 -26.279  -2.631
   12    HB2  LEU  19           HB1      LEU  19 -48.435 -27.393  -4.826
   13    HB3  LEU  19           HB2      LEU  19 -47.795 -25.979  -3.973
   14    HG   LEU  19           HG       LEU  19 -48.239 -27.370  -1.829
   15   HD11  LEU  19          HD11      LEU  19 -48.574 -29.607  -1.981
   16   HD12  LEU  19          HD12      LEU  19 -47.740 -29.742  -3.529
   17   HD13  LEU  19          HD13      LEU  19 -49.392 -29.126  -3.468
   18   HD21  LEU  19          HD21      LEU  19 -46.023 -28.540  -2.173
   19   HD22  LEU  19          HD22      LEU  19 -46.027 -26.794  -2.421
   20   HD23  LEU  19          HD23      LEU  19 -46.034 -27.882  -3.809
   21    H    VAL  20           H        VAL  20 -51.257 -24.384  -2.789
   22    HA   VAL  20           HA       VAL  20 -51.126 -22.690  -5.096
   23    HB   VAL  20           HB       VAL  20 -52.108 -22.060  -2.308
   24   HG11  VAL  20          HG11      VAL  20 -53.426 -20.298  -3.578
   25   HG12  VAL  20          HG12      VAL  20 -51.698 -20.002  -3.378
   26   HG13  VAL  20          HG13      VAL  20 -52.321 -20.589  -4.920
   27   HG21  VAL  20          HG21      VAL  20 -53.372 -23.338  -4.682
   28   HG22  VAL  20          HG22      VAL  20 -53.565 -23.703  -2.968
   29   HG23  VAL  20          HG23      VAL  20 -54.355 -22.288  -3.662
   30    H    LEU  21           H        LEU  21 -49.398 -21.537  -5.623
   31    HA   LEU  21           HA       LEU  21 -47.195 -21.061  -3.969
   32    HB2  LEU  21           HB1      LEU  21 -48.155 -19.823  -6.535
   33    HB3  LEU  21           HB2      LEU  21 -46.695 -19.236  -5.718
   34    HG   LEU  21           HG       LEU  21 -45.833 -21.628  -5.866
   35   HD11  LEU  21          HD11      LEU  21 -46.818 -22.943  -7.734
   36   HD12  LEU  21          HD12      LEU  21 -48.169 -21.809  -7.761
   37   HD13  LEU  21          HD13      LEU  21 -47.872 -22.793  -6.327
   38   HD21  LEU  21          HD21      LEU  21 -45.090 -21.326  -8.180
   39   HD22  LEU  21          HD22      LEU  21 -44.985 -19.823  -7.262
   40   HD23  LEU  21          HD23      LEU  21 -46.306 -20.069  -8.405
   41    H    ASP  22           H        ASP  22 -46.840 -19.648  -2.395
   42    HA   ASP  22           HA       ASP  22 -48.728 -17.418  -2.067
   43    HB2  ASP  22           HB1      ASP  22 -47.086 -19.033  -0.136
   44    HB3  ASP  22           HB2      ASP  22 -47.630 -17.411   0.304
   45    HD2  ASP  22           HD       ASP  22 -50.994 -18.451   0.373
   46    H    PHE  23           H        PHE  23 -45.367 -17.961  -1.023
   47    HA   PHE  23           HA       PHE  23 -44.208 -15.994  -2.656
   48    HB2  PHE  23           HB1      PHE  23 -45.742 -14.790  -0.756
   49    HB3  PHE  23           HB2      PHE  23 -44.191 -14.887   0.082
   50    HD1  PHE  23           HD1      PHE  23 -42.233 -13.701  -0.736
   51    HD2  PHE  23           HD2      PHE  23 -46.002 -13.358  -2.682
   52    HE1  PHE  23           HE1      PHE  23 -41.424 -11.715  -1.944
   53    HE2  PHE  23           HE2      PHE  23 -45.199 -11.373  -3.894
   54    HZ   PHE  23           HZ       PHE  23 -42.908 -10.550  -3.526
   55    H    ASN  24           H        ASN  24 -42.112 -16.462  -2.740
   56    HA   ASN  24           HA       ASN  24 -40.972 -18.209  -0.722
   57    HB2  ASN  24           HB1      ASN  24 -40.642 -17.894  -3.499
   58    HB3  ASN  24           HB2      ASN  24 -39.105 -17.403  -2.774
   59   HD21  ASN  24          HD21      ASN  24 -37.778 -19.054  -3.068
   60   HD22  ASN  24          HD22      ASN  24 -38.099 -20.693  -2.621
   61    H    ASN  25           H        ASN  25 -40.200 -17.261   1.052
   62    HA   ASN  25           HA       ASN  25 -39.005 -14.613   0.908
   63    HB2  ASN  25           HB1      ASN  25 -40.557 -15.037   2.728
   64    HB3  ASN  25           HB2      ASN  25 -39.594 -16.421   3.261
   65   HD21  ASN  25          HD21      ASN  25 -38.164 -16.090   4.801
   66   HD22  ASN  25          HD22      ASN  25 -37.526 -14.558   5.282
   67    H    ILE  26           H        ILE  26 -36.891 -14.131   1.526
   68    HA   ILE  26           HA       ILE  26 -35.019 -16.007   2.471
   69    HB   ILE  26           HB       ILE  26 -35.221 -17.045   0.287
   70   HG12  ILE  26          HG11      ILE  26 -32.643 -15.510   0.142
   71   HG13  ILE  26          HG12      ILE  26 -32.941 -16.621   1.489
   72   HG21  ILE  26          HG21      ILE  26 -34.397 -14.393  -0.884
   73   HG22  ILE  26          HG22      ILE  26 -34.747 -15.878  -1.767
   74   HG23  ILE  26          HG23      ILE  26 -36.038 -15.039  -0.908
   75   HD11  ILE  26          HD11      ILE  26 -32.758 -17.285  -1.430
   76   HD12  ILE  26          HD12      ILE  26 -31.732 -17.848  -0.111
   77   HD13  ILE  26          HD13      ILE  26 -33.401 -18.404  -0.229
   78    H    ARG  27           H        ARG  27 -35.595 -13.090   0.589
   79    HA   ARG  27           HA       ARG  27 -33.149 -11.910   1.723
   80    HB2  ARG  27           HB1      ARG  27 -34.747 -11.269  -0.754
   81    HB3  ARG  27           HB2      ARG  27 -33.552 -10.146  -0.088
   82    HG2  ARG  27           HG1      ARG  27 -31.767 -11.442  -0.679
   83    HG3  ARG  27           HG2      ARG  27 -32.702 -12.944  -0.598
   84    HD2  ARG  27           HD1      ARG  27 -33.985 -12.058  -2.636
   85    HD3  ARG  27           HD2      ARG  27 -32.676 -10.876  -2.776
   86    HE   ARG  27           HE       ARG  27 -32.548 -13.686  -3.394
   87   HH11  ARG  27          HH11      ARG  27 -30.730 -10.832  -2.574
   88   HH12  ARG  27          HH12      ARG  27 -29.255 -11.413  -3.274
   89   HH21  ARG  27          HH21      ARG  27 -30.613 -14.460  -4.321
   90   HH22  ARG  27          HH22      ARG  27 -29.190 -13.476  -4.269
   91    H    SER  28           H        SER  28 -36.613 -11.542   1.388
   92    HA   SER  28           HA       SER  28 -38.130 -10.190   2.413
   93    HB2  SER  28           HB1      SER  28 -36.650 -11.149   4.393
   94    HB3  SER  28           HB2      SER  28 -36.158  -9.452   4.536
   95    HG   SER  28           HG       SER  28 -38.091  -8.927   5.229
   96    H    SER  29           H        SER  29 -38.307  -7.866   3.507
   97    HA   SER  29           HA       SER  29 -37.241  -6.050   1.534
   98    HB2  SER  29           HB1      SER  29 -39.410  -6.046   3.503
   99    HB3  SER  29           HB2      SER  29 -38.550  -4.498   3.419
  100    HG   SER  29           HG       SER  29 -40.301  -5.558   1.667
  101    H    ALA  30           H        ALA  30 -36.029  -4.157   2.000
  102    HA   ALA  30           HA       ALA  30 -34.638  -4.120   4.584
  103    HB1  ALA  30           HB1      ALA  30 -33.265  -5.344   2.892
  104    HB2  ALA  30           HB2      ALA  30 -33.184  -3.847   1.960
  105    HB3  ALA  30           HB3      ALA  30 -32.484  -3.919   3.578
  106    H    ASP  31           H        ASP  31 -34.550  -2.369   1.474
  107    HA   ASP  31           HA       ASP  31 -34.713  -0.158   0.967
  108    HB2  ASP  31           HB1      ASP  31 -36.886  -0.682   2.455
  109    HB3  ASP  31           HB2      ASP  31 -36.103   0.503   3.511
  110    HD2  ASP  31           HD       ASP  31 -37.665   1.753   0.109
  111    H    LEU  32           H        LEU  32 -32.344  -0.906   2.134
  112    HA   LEU  32           HA       LEU  32 -31.400   1.598   3.139
  113    HB2  LEU  32           HB1      LEU  32 -32.377  -0.113   5.064
  114    HB3  LEU  32           HB2      LEU  32 -30.640  -0.471   5.053
  115    HG   LEU  32           HG       LEU  32 -31.226   1.189   6.753
  116   HD11  LEU  32          HD11      LEU  32 -29.749   2.861   4.838
  117   HD12  LEU  32          HD12      LEU  32 -29.104   1.239   5.089
  118   HD13  LEU  32          HD13      LEU  32 -29.309   2.328   6.461
  119   HD21  LEU  32          HD21      LEU  32 -32.057   3.359   6.187
  120   HD22  LEU  32          HD22      LEU  32 -33.152   2.159   5.500
  121   HD23  LEU  32          HD23      LEU  32 -31.993   2.992   4.464
  122    H    HIS  33           H        HIS  33 -29.833   1.654   1.617
  123    HA   HIS  33           HA       HIS  33 -27.797  -0.470   1.732
  124    HB2  HIS  33           HB1      HIS  33 -29.428   0.240  -0.485
  125    HB3  HIS  33           HB2      HIS  33 -27.785   0.780  -0.845
  126    HD1  HIS  33           HD1      HIS  33 -26.013  -1.374   0.121
  127    HD2  HIS  33           HD2      HIS  33 -29.687  -2.198  -1.636
  128    HE1  HIS  33           HE1      HIS  33 -25.845  -3.742  -0.710
  129    HE2  HIS  33           HE2      HIS  33 -28.090  -4.246  -1.784
  130    H    GLY  34           H        GLY  34 -28.314   2.815   0.424
  131    HA2  GLY  34           HA2      GLY  34 -25.883   3.686   1.805
  132    HA3  GLY  34           HA3      GLY  34 -25.930   3.858   0.057
  133    HA1  GLY  34           HA1      GLY  34 -26.738   3.711   2.017
  134    H    ALA  35           H        ALA  35 -25.516   6.143   1.077
  135    HA   ALA  35           HA       ALA  35 -27.954   7.618   0.675
  136    HB1  ALA  35           HB1      ALA  35 -26.645   7.566   3.383
  137    HB2  ALA  35           HB2      ALA  35 -27.714   8.867   2.858
  138    HB3  ALA  35           HB3      ALA  35 -28.325   7.217   2.975
  139    H    ARG  36           H        ARG  36 -24.579   7.732   1.761
  140    HA   ARG  36           HA       ARG  36 -23.756   9.494  -0.258
  141    HB2  ARG  36           HB1      ARG  36 -23.257  11.487   1.239
  142    HB3  ARG  36           HB2      ARG  36 -24.949  11.252   0.776
  143    HG2  ARG  36           HG1      ARG  36 -25.626  10.780   2.887
  144    HG3  ARG  36           HG2      ARG  36 -24.089  10.006   3.313
  145    HD2  ARG  36           HD1      ARG  36 -24.142  11.980   4.596
  146    HD3  ARG  36           HD2      ARG  36 -23.068  12.337   3.236
  147    HE   ARG  36           HE       ARG  36 -25.734  13.097   2.637
  148   HH11  ARG  36          HH11      ARG  36 -22.937  14.051   4.479
  149   HH12  ARG  36          HH12      ARG  36 -23.336  15.737   4.458
  150   HH21  ARG  36          HH21      ARG  36 -26.270  15.315   2.602
  151   HH22  ARG  36          HH22      ARG  36 -25.232  16.455   3.391
  152    H    LYS  37           H        LYS  37 -21.509  10.236   0.046
  153    HA   LYS  37           HA       LYS  37 -20.064   8.659   2.069
  154    HB2  LYS  37           HB1      LYS  37 -19.841   8.602  -0.861
  155    HB3  LYS  37           HB2      LYS  37 -18.293   8.789  -0.021
  156    HG2  LYS  37           HG1      LYS  37 -18.724   6.774   1.281
  157    HG3  LYS  37           HG2      LYS  37 -20.290   6.589   0.472
  158    HD2  LYS  37           HD1      LYS  37 -18.963   6.574  -1.725
  159    HD3  LYS  37           HD2      LYS  37 -17.537   6.320  -0.701
  160    HE2  LYS  37           HE1      LYS  37 -18.063   4.175  -0.271
  161    HE3  LYS  37           HE2      LYS  37 -19.779   4.552  -0.062
  162    HZ1  LYS  37           HZ1      LYS  37 -20.225   4.215  -2.257
  163    HZ2  LYS  37           HZ2      LYS  37 -18.952   3.118  -2.067
  164    HZ3  LYS  37           HZ3      LYS  37 -18.667   4.630  -2.772
  165    H    GLY  38           H        GLY  38 -19.724  11.299  -0.304
  166    HA2  GLY  38           HA2      GLY  38 -19.067  13.504   0.273
  167    HA3  GLY  38           HA3      GLY  38 -18.368  12.878   1.759
  168    HA1  GLY  38           HA1      GLY  38 -18.859  12.874  -0.310
  169    H    SER  39           H        SER  39 -16.240  12.406   1.822
  170    HA   SER  39           HA       SER  39 -14.533  13.388  -0.173
  171    HB2  SER  39           HB1      SER  39 -13.354  11.317   1.553
  172    HB3  SER  39           HB2      SER  39 -12.899  13.018   1.346
  173    HG   SER  39           HG       SER  39 -14.818  13.493   2.659
  174    H    GLN  40           H        GLN  40 -12.662  11.892  -1.011
  175    HA   GLN  40           HA       GLN  40 -13.964   9.849  -2.626
  176    HB2  GLN  40           HB1      GLN  40 -11.709  11.643  -2.936
  177    HB3  GLN  40           HB2      GLN  40 -11.264   9.977  -3.340
  178    HG2  GLN  40           HG1      GLN  40 -13.494  10.038  -4.725
  179    HG3  GLN  40           HG2      GLN  40 -13.221  11.785  -4.660
  180   HE21  GLN  40          HE21      GLN  40 -13.233  10.610  -7.066
  181   HE22  GLN  40          HE22      GLN  40 -11.638  10.537  -7.726
  182    H    CYS  41           H        CYS  41 -11.234  10.159  -0.385
  183    HA   CYS  41           HA       CYS  41 -11.469   7.310   0.217
  184    HB2  CYS  41           HB1      CYS  41  -9.130   6.866  -0.031
  185    HB3  CYS  41           HB2      CYS  41  -9.703   7.579  -1.539
  186    H    LEU  42           H        LEU  42 -10.928   6.769   2.304
  187    HA   LEU  42           HA       LEU  42 -10.654   9.008   4.141
  188    HB2  LEU  42           HB1      LEU  42 -11.543   6.184   4.316
  189    HB3  LEU  42           HB2      LEU  42 -10.795   6.880   5.763
  190    HG   LEU  42           HG       LEU  42 -12.543   8.799   5.373
  191   HD11  LEU  42          HD11      LEU  42 -14.536   8.187   4.300
  192   HD12  LEU  42          HD12      LEU  42 -14.059   6.493   4.190
  193   HD13  LEU  42          HD13      LEU  42 -13.255   7.702   3.190
  194   HD21  LEU  42          HD21      LEU  42 -13.366   7.965   7.258
  195   HD22  LEU  42          HD22      LEU  42 -12.402   6.513   6.984
  196   HD23  LEU  42          HD23      LEU  42 -14.066   6.591   6.402
  197    H    SER  43           H        SER  43  -8.860   6.212   3.033
  198    HA   SER  43           HA       SER  43  -6.420   7.313   4.106
  199    HB2  SER  43           HB1      SER  43  -7.096   4.502   4.969
  200    HB3  SER  43           HB2      SER  43  -5.837   5.582   5.593
  201    HG   SER  43           HG       SER  43  -8.423   5.338   6.367
  202    H    ASP  44           H        ASP  44  -4.706   5.251   3.826
  203    HA   ASP  44           HA       ASP  44  -4.484   5.005   1.004
  204    HB2  ASP  44           HB1      ASP  44  -2.488   3.658   1.471
  205    HB3  ASP  44           HB2      ASP  44  -2.511   5.127   2.454
  206    HD2  ASP  44           HD       ASP  44  -3.293   3.160   5.343
  207    H    THR  45           H        THR  45  -5.843   3.014   3.496
  208    HA   THR  45           HA       THR  45  -5.807   0.539   2.126
  209    HB   THR  45           HB       THR  45  -7.664  -0.092   3.703
  210    HG1  THR  45           HG1      THR  45  -8.589   1.966   3.999
  211   HG21  THR  45          HG21      THR  45  -5.091  -0.085   4.171
  212   HG22  THR  45          HG22      THR  45  -6.224  -0.374   5.491
  213   HG23  THR  45          HG23      THR  45  -5.493   1.219   5.287
  214    H    ASP  46           H        ASP  46  -7.830   3.339   1.900
  215    HA   ASP  46           HA       ASP  46 -10.049   2.040   0.643
  216    HB2  ASP  46           HB1      ASP  46  -9.717   4.460   1.836
  217    HB3  ASP  46           HB2      ASP  46  -9.634   4.919   0.130
  218    HD2  ASP  46           HD       ASP  46 -12.971   3.492  -0.236
  219    H    CYS  47           H        CYS  47  -7.040   3.402  -0.425
  220    HA   CYS  47           HA       CYS  47  -7.737   3.732  -3.163
  221    HB2  CYS  47           HB1      CYS  47  -5.440   4.144  -1.499
  222    HB3  CYS  47           HB2      CYS  47  -4.950   3.235  -2.931
  223    H    ASN  48           H        ASN  48  -5.396   1.413  -1.809
  224    HA   ASN  48           HA       ASN  48  -6.636  -0.847  -3.023
  225    HB2  ASN  48           HB1      ASN  48  -5.135   0.654  -4.785
  226    HB3  ASN  48           HB2      ASN  48  -3.985  -0.575  -4.244
  227   HD21  ASN  48          HD21      ASN  48  -3.950  -2.357  -5.389
  228   HD22  ASN  48          HD22      ASN  48  -5.261  -3.008  -6.308
  229    H    THR  49           H        THR  49  -4.597  -2.607  -3.228
  230    HA   THR  49           HA       THR  49  -3.823  -2.941  -0.469
  231    HB   THR  49           HB       THR  49  -3.173  -4.690  -2.850
  232    HG1  THR  49           HG1      THR  49  -4.957  -5.945  -1.969
  233   HG21  THR  49          HG21      THR  49  -2.850  -5.013   0.114
  234   HG22  THR  49          HG22      THR  49  -1.688  -5.335  -1.173
  235   HG23  THR  49          HG23      THR  49  -3.057  -6.420  -0.929
  236    H    ARG  50           H        ARG  50  -2.352  -1.860  -3.409
  237    HA   ARG  50           HA       ARG  50   0.167  -1.455  -1.960
  238    HB2  ARG  50           HB1      ARG  50   0.008  -2.432  -4.821
  239    HB3  ARG  50           HB2      ARG  50   1.477  -2.143  -3.878
  240    HG2  ARG  50           HG1      ARG  50   0.510  -3.917  -2.253
  241    HG3  ARG  50           HG2      ARG  50  -0.509  -4.362  -3.632
  242    HD2  ARG  50           HD1      ARG  50   2.333  -4.025  -4.303
  243    HD3  ARG  50           HD2      ARG  50   2.001  -5.328  -3.154
  244    HE   ARG  50           HE       ARG  50   0.175  -5.768  -5.093
  245   HH11  ARG  50          HH11      ARG  50   3.619  -5.255  -5.143
  246   HH12  ARG  50          HH12      ARG  50   3.874  -6.227  -6.554
  247   HH21  ARG  50          HH21      ARG  50   0.499  -7.050  -6.951
  248   HH22  ARG  50          HH22      ARG  50   2.098  -7.246  -7.583
  249    H    LYS  51           H        LYS  51  -1.727   0.488  -2.233
  250    HA   LYS  51           HA       LYS  51  -0.338   2.396  -3.948
  251    HB2  LYS  51           HB1      LYS  51  -3.311   1.845  -4.091
  252    HB3  LYS  51           HB2      LYS  51  -2.532   3.272  -4.795
  253    HG2  LYS  51           HG1      LYS  51  -1.351   1.989  -6.382
  254    HG3  LYS  51           HG2      LYS  51  -1.728   0.476  -5.537
  255    HD2  LYS  51           HD1      LYS  51  -3.591   0.229  -6.730
  256    HD3  LYS  51           HD2      LYS  51  -4.173   1.809  -6.176
  257    HE2  LYS  51           HE1      LYS  51  -3.256   2.940  -8.010
  258    HE3  LYS  51           HE2      LYS  51  -2.163   1.601  -8.390
  259    HZ1  LYS  51           HZ1      LYS  51  -4.890   2.020  -9.202
  260    HZ2  LYS  51           HZ2      LYS  51  -4.599   0.459  -8.622
  261    HZ3  LYS  51           HZ3      LYS  51  -3.686   1.066  -9.909
  262    H    PHE  52           H        PHE  52  -0.909   4.641  -3.454
  263    HA   PHE  52           HA       PHE  52  -1.999   4.959  -0.737
  264    HB2  PHE  52           HB1      PHE  52  -0.342   6.755  -0.352
  265    HB3  PHE  52           HB2      PHE  52   0.416   5.184  -0.618
  266    HD1  PHE  52           HD1      PHE  52   1.835   4.770  -2.476
  267    HD2  PHE  52           HD2      PHE  52  -0.262   8.459  -2.149
  268    HE1  PHE  52           HE1      PHE  52   3.214   5.710  -4.284
  269    HE2  PHE  52           HE2      PHE  52   1.113   9.405  -3.957
  270    HZ   PHE  52           HZ       PHE  52   2.854   8.030  -5.026
  271    H    CYS  53           H        CYS  53  -3.028   6.960  -0.285
  272    HA   CYS  53           HA       CYS  53  -4.230   8.160  -2.658
  273    HB2  CYS  53           HB1      CYS  53  -5.268   7.383  -0.217
  274    HB3  CYS  53           HB2      CYS  53  -5.153   9.136  -0.057
  275    H    LEU  54           H        LEU  54  -2.966   9.723  -3.484
  276    HA   LEU  54           HA       LEU  54  -1.536  11.552  -1.744
  277    HB2  LEU  54           HB1      LEU  54  -0.415  10.706  -3.726
  278    HB3  LEU  54           HB2      LEU  54  -1.704  11.364  -4.748
  279    HG   LEU  54           HG       LEU  54  -0.704  13.547  -3.301
  280   HD11  LEU  54          HD11      LEU  54   1.678  12.515  -4.655
  281   HD12  LEU  54          HD12      LEU  54   1.255  11.663  -3.171
  282   HD13  LEU  54          HD13      LEU  54   1.525  13.405  -3.141
  283   HD21  LEU  54          HD21      LEU  54  -0.292  14.437  -5.407
  284   HD22  LEU  54          HD22      LEU  54  -1.555  13.246  -5.717
  285   HD23  LEU  54          HD23      LEU  54   0.126  12.869  -6.098
  286    H    GLN  55           H        GLN  55  -2.128  13.582  -1.265
  287    HA   GLN  55           HA       GLN  55  -4.382  14.762  -2.741
  288    HB2  GLN  55           HB1      GLN  55  -3.979  14.944   0.252
  289    HB3  GLN  55           HB2      GLN  55  -5.332  15.604  -0.681
  290    HG2  GLN  55           HG1      GLN  55  -5.804  13.188  -1.384
  291    HG3  GLN  55           HG2      GLN  55  -4.711  12.739  -0.067
  292   HE21  GLN  55          HE21      GLN  55  -6.226  11.778   1.212
  293   HE22  GLN  55          HE22      GLN  55  -7.507  12.640   1.986
  294    HA   PRO  56           HA       PRO  56  -0.905  17.743  -2.820
  295    HB2  PRO  56           HB1      PRO  56  -1.554  18.760  -5.279
  296    HB3  PRO  56           HB2      PRO  56  -0.600  17.296  -5.053
  297    HG2  PRO  56           HG1      PRO  56  -3.533  17.587  -5.607
  298    HG3  PRO  56           HG2      PRO  56  -2.337  16.467  -6.358
  299    HD2  PRO  56           HD1      PRO  56  -4.078  15.675  -4.432
  300    HD3  PRO  56           HD2      PRO  56  -2.444  15.003  -4.580
  301    H    ARG  57           H        ARG  57  -0.905  20.018  -2.663
  302    HA   ARG  57           HA       ARG  57  -3.398  21.122  -1.703
  303    HB2  ARG  57           HB1      ARG  57  -2.001  23.130  -1.186
  304    HB3  ARG  57           HB2      ARG  57  -1.432  21.634  -0.432
  305    HG2  ARG  57           HG1      ARG  57   0.488  21.573  -1.635
  306    HG3  ARG  57           HG2      ARG  57  -0.260  22.320  -3.056
  307    HD2  ARG  57           HD1      ARG  57  -0.231  24.503  -1.970
  308    HD3  ARG  57           HD2      ARG  57   0.438  23.771  -0.506
  309    HE   ARG  57           HE       ARG  57   2.131  23.181  -2.664
  310   HH11  ARG  57          HH11      ARG  57   1.104  25.884  -0.726
  311   HH12  ARG  57          HH12      ARG  57   2.583  26.763  -0.932
  312   HH21  ARG  57          HH21      ARG  57   4.084  24.327  -2.943
  313   HH22  ARG  57          HH22      ARG  57   4.277  25.876  -2.194
  314    H    ASP  58           H        ASP  58  -1.412  21.316  -4.547
  315    HA   ASP  58           HA       ASP  58  -2.852  23.635  -5.567
  316    HB2  ASP  58           HB1      ASP  58  -0.295  23.070  -5.844
  317    HB3  ASP  58           HB2      ASP  58  -0.874  22.081  -7.192
  318    HD2  ASP  58           HD       ASP  58  -0.479  25.046  -8.942
  319    H    GLU  59           H        GLU  59  -2.876  20.195  -5.801
  320    HA   GLU  59           HA       GLU  59  -4.820  20.360  -8.010
  321    HB2  GLU  59           HB1      GLU  59  -2.460  18.803  -7.764
  322    HB3  GLU  59           HB2      GLU  59  -3.836  17.694  -7.663
  323    HG2  GLU  59           HG1      GLU  59  -4.006  17.733  -9.865
  324    HG3  GLU  59           HG2      GLU  59  -4.405  19.454  -9.772
  325    HE2  GLU  59           HE       GLU  59  -0.631  18.525 -10.623
  326    H    LYS  60           H        LYS  60  -6.117  18.089  -7.953
  327    HA   LYS  60           HA       LYS  60  -7.505  18.150  -5.386
  328    HB2  LYS  60           HB1      LYS  60  -9.220  16.767  -6.601
  329    HB3  LYS  60           HB2      LYS  60  -8.949  18.383  -7.271
  330    HG2  LYS  60           HG1      LYS  60  -8.194  17.595  -9.231
  331    HG3  LYS  60           HG2      LYS  60  -7.278  16.290  -8.458
  332    HD2  LYS  60           HD1      LYS  60  -9.744  15.373  -7.983
  333    HD3  LYS  60           HD2      LYS  60 -10.077  16.323  -9.443
  334    HE2  LYS  60           HE1      LYS  60  -7.675  14.597  -9.556
  335    HE3  LYS  60           HE2      LYS  60  -9.232  13.760  -9.476
  336    HZ1  LYS  60           HZ1      LYS  60  -8.296  15.670 -11.533
  337    HZ2  LYS  60           HZ2      LYS  60  -9.931  15.266 -11.364
  338    HZ3  LYS  60           HZ3      LYS  60  -8.798  14.067 -11.741
  339    HA   PRO  61           HA       PRO  61  -6.011  14.285  -3.937
  340    HB2  PRO  61           HB1      PRO  61  -8.209  13.310  -2.626
  341    HB3  PRO  61           HB2      PRO  61  -7.238  14.656  -2.030
  342    HG2  PRO  61           HG1      PRO  61  -9.805  14.702  -3.581
  343    HG3  PRO  61           HG2      PRO  61  -9.333  15.662  -2.128
  344    HD2  PRO  61           HD1      PRO  61  -9.278  16.686  -4.641
  345    HD3  PRO  61           HD2      PRO  61  -8.114  17.157  -3.390
  346    H    PHE  62           H        PHE  62  -5.684  12.359  -4.857
  347    HA   PHE  62           HA       PHE  62  -7.871  10.851  -6.004
  348    HB2  PHE  62           HB1      PHE  62  -7.023  10.696  -8.226
  349    HB3  PHE  62           HB2      PHE  62  -7.090  12.413  -7.823
  350    HD1  PHE  62           HD1      PHE  62  -4.997   9.726  -8.899
  351    HD2  PHE  62           HD2      PHE  62  -4.964  13.573  -7.077
  352    HE1  PHE  62           HE1      PHE  62  -2.617   9.973  -9.472
  353    HE2  PHE  62           HE2      PHE  62  -2.584  13.827  -7.647
  354    HZ   PHE  62           HZ       PHE  62  -1.408  12.026  -8.847
  355    H    CYS  63           H        CYS  63  -6.789   8.812  -7.171
  356    HA   CYS  63           HA       CYS  63  -5.068   7.640  -5.131
  357    HB2  CYS  63           HB1      CYS  63  -7.248   6.607  -6.163
  358    HB3  CYS  63           HB2      CYS  63  -6.164   6.114  -7.465
  359    H    ALA  64           H        ALA  64  -2.955   7.412  -5.402
  360    HA   ALA  64           HA       ALA  64  -1.857   7.640  -8.124
  361    HB1  ALA  64           HB1      ALA  64  -0.618   9.247  -7.206
  362    HB2  ALA  64           HB2      ALA  64  -1.074   8.772  -5.570
  363    HB3  ALA  64           HB3      ALA  64   0.262   7.959  -6.384
  364    H    THR  65           H        THR  65  -0.305   6.192  -8.847
  365    HA   THR  65           HA       THR  65  -0.414   3.576  -7.621
  366    HB   THR  65           HB       THR  65   0.974   2.875  -9.584
  367    HG1  THR  65           HG1      THR  65   1.079   4.545 -11.282
  368   HG21  THR  65          HG21      THR  65  -1.710   4.097  -9.726
  369   HG22  THR  65          HG22      THR  65  -1.181   2.469 -10.148
  370   HG23  THR  65          HG23      THR  65  -0.916   3.802 -11.273
  371    H    CYS  66           H        CYS  66   1.659   2.282  -7.489
  372    HA   CYS  66           HA       CYS  66   3.346   3.322  -5.560
  373    HB2  CYS  66           HB1      CYS  66   2.993   0.871  -6.710
  374    HB3  CYS  66           HB2      CYS  66   4.583   1.315  -7.330
  375    H    ARG  67           H        ARG  67   5.561   3.960  -5.611
  376    HA   ARG  67           HA       ARG  67   6.245   5.420  -8.063
  377    HB2  ARG  67           HB1      ARG  67   7.271   5.729  -5.232
  378    HB3  ARG  67           HB2      ARG  67   7.786   6.708  -6.612
  379    HG2  ARG  67           HG1      ARG  67   4.877   6.575  -5.972
  380    HG3  ARG  67           HG2      ARG  67   5.939   7.559  -4.952
  381    HD2  ARG  67           HD1      ARG  67   6.297   9.109  -6.567
  382    HD3  ARG  67           HD2      ARG  67   6.308   7.895  -7.854
  383    HE   ARG  67           HE       ARG  67   3.696   8.264  -6.774
  384   HH11  ARG  67          HH11      ARG  67   6.043   9.626  -8.955
  385   HH12  ARG  67          HH12      ARG  67   4.860  10.423  -9.939
  386   HH21  ARG  67          HH21      ARG  67   2.128   9.309  -8.061
  387   HH22  ARG  67          HH22      ARG  67   2.634  10.242  -9.429
  388    H    GLY  68           H        GLY  68   7.715   4.557  -9.364
  389    HA2  GLY  68           HA2      GLY  68   9.238   2.273  -8.707
  390    HA3  GLY  68           HA3      GLY  68   9.464   3.282 -10.128
  391    HA1  GLY  68           HA1      GLY  68   9.219   2.867  -8.058
  392    H    LEU  69           H        LEU  69  11.686   2.251  -9.138
  393    HA   LEU  69           HA       LEU  69  12.947   3.671  -7.060
  394    HB2  LEU  69           HB1      LEU  69  14.096   2.176  -9.420
  395    HB3  LEU  69           HB2      LEU  69  15.057   2.799  -8.067
  396    HG   LEU  69           HG       LEU  69  12.961   0.632  -7.950
  397   HD11  LEU  69          HD11      LEU  69  14.748  -0.845  -7.483
  398   HD12  LEU  69          HD12      LEU  69  15.895   0.482  -7.303
  399   HD13  LEU  69          HD13      LEU  69  15.237   0.095  -8.893
  400   HD21  LEU  69          HD21      LEU  69  12.662   1.559  -5.886
  401   HD22  LEU  69          HD22      LEU  69  14.288   2.239  -5.829
  402   HD23  LEU  69          HD23      LEU  69  14.042   0.515  -5.542
  403    H    ARG  70           H        ARG  70  12.405   4.417 -10.394
  404    HA   ARG  70           HA       ARG  70  14.321   6.628 -10.320
  405    HB2  ARG  70           HB1      ARG  70  12.820   5.207 -12.491
  406    HB3  ARG  70           HB2      ARG  70  13.405   6.854 -12.773
  407    HG2  ARG  70           HG1      ARG  70  15.652   5.733 -11.790
  408    HG3  ARG  70           HG2      ARG  70  14.900   4.328 -12.564
  409    HD2  ARG  70           HD1      ARG  70  14.543   6.045 -14.553
  410    HD3  ARG  70           HD2      ARG  70  15.917   6.848 -13.777
  411    HE   ARG  70           HE       ARG  70  17.268   5.216 -14.617
  412   HH11  ARG  70          HH11      ARG  70  14.001   4.015 -14.536
  413   HH12  ARG  70          HH12      ARG  70  14.390   2.527 -15.333
  414   HH21  ARG  70          HH21      ARG  70  17.791   3.261 -15.668
  415   HH22  ARG  70          HH22      ARG  70  16.546   2.099 -15.977
  416    H    ARG  71           H        ARG  71  11.475   6.313  -9.055
  417    HA   ARG  71           HA       ARG  71  10.278   8.750 -10.169
  418    HB2  ARG  71           HB1      ARG  71   9.180   6.520  -8.460
  419    HB3  ARG  71           HB2      ARG  71   8.308   8.041  -8.701
  420    HG2  ARG  71           HG1      ARG  71   9.151   6.135 -10.888
  421    HG3  ARG  71           HG2      ARG  71   7.520   6.300 -10.218
  422    HD2  ARG  71           HD1      ARG  71   7.593   8.734 -10.904
  423    HD3  ARG  71           HD2      ARG  71   9.082   8.346 -11.778
  424    HE   ARG  71           HE       ARG  71   6.992   6.578 -12.520
  425   HH11  ARG  71          HH11      ARG  71   8.144   9.832 -12.965
  426   HH12  ARG  71          HH12      ARG  71   7.413  10.016 -14.525
  427   HH21  ARG  71          HH21      ARG  71   6.025   6.807 -14.572
  428   HH22  ARG  71          HH22      ARG  71   6.207   8.295 -15.438
  429    H    ARG  72           H        ARG  72   9.959  10.565  -8.960
  430    HA   ARG  72           HA       ARG  72  11.613  10.924  -6.664
  431    HB2  ARG  72           HB1      ARG  72   9.497  12.734  -7.857
  432    HB3  ARG  72           HB2      ARG  72  10.681  13.209  -6.629
  433    HG2  ARG  72           HG1      ARG  72  12.278  12.177  -8.607
  434    HG3  ARG  72           HG2      ARG  72  10.978  12.965  -9.517
  435    HD2  ARG  72           HD1      ARG  72  12.278  14.414  -7.236
  436    HD3  ARG  72           HD2      ARG  72  13.089  14.326  -8.806
  437    HE   ARG  72           HE       ARG  72  10.469  15.156  -9.262
  438   HH11  ARG  72          HH11      ARG  72  13.346  16.308  -7.675
  439   HH12  ARG  72          HH12      ARG  72  12.971  17.981  -7.926
  440   HH21  ARG  72          HH21      ARG  72   9.965  17.355  -9.597
  441   HH22  ARG  72          HH22      ARG  72  11.047  18.575  -9.018
  442    H    CYS  73           H        CYS  73  10.912  11.616  -4.558
  443    HA   CYS  73           HA       CYS  73   8.154  10.991  -3.828
  444    HB2  CYS  73           HB1      CYS  73   9.019   9.658  -1.848
  445    HB3  CYS  73           HB2      CYS  73   9.139   8.874  -3.425
  446    H    GLN  74           H        GLN  74   7.779  11.525  -1.451
  447    HA   GLN  74           HA       GLN  74   9.442  13.816  -0.645
  448    HB2  GLN  74           HB1      GLN  74   6.560  13.684  -1.203
  449    HB3  GLN  74           HB2      GLN  74   6.963  14.439   0.347
  450    HG2  GLN  74           HG1      GLN  74   8.546  15.337  -1.981
  451    HG3  GLN  74           HG2      GLN  74   6.832  15.778  -1.972
  452   HE21  GLN  74          HE21      GLN  74   6.144  16.476   0.392
  453   HE22  GLN  74          HE22      GLN  74   7.151  17.701   1.075
  454    H    ARG  75           H        ARG  75   7.187  11.295   0.381
  455    HA   ARG  75           HA       ARG  75   8.270  11.525   3.111
  456    HB2  ARG  75           HB1      ARG  75   5.634  11.593   2.290
  457    HB3  ARG  75           HB2      ARG  75   5.850   9.912   2.802
  458    HG2  ARG  75           HG1      ARG  75   6.816  10.812   4.962
  459    HG3  ARG  75           HG2      ARG  75   6.227  12.399   4.440
  460    HD2  ARG  75           HD1      ARG  75   3.945  11.247   4.130
  461    HD3  ARG  75           HD2      ARG  75   4.641   9.938   5.096
  462    HE   ARG  75           HE       ARG  75   4.961  12.475   6.360
  463   HH11  ARG  75          HH11      ARG  75   2.691   9.903   5.769
  464   HH12  ARG  75          HH12      ARG  75   1.753  10.227   7.189
  465   HH21  ARG  75          HH21      ARG  75   3.734  12.913   8.232
  466   HH22  ARG  75          HH22      ARG  75   2.347  11.941   8.588
  467    H    ASP  76           H        ASP  76   8.661   9.563   4.283
  468    HA   ASP  76           HA       ASP  76  10.058   7.623   2.800
  469    HB2  ASP  76           HB1      ASP  76  10.019   6.329   5.003
  470    HB3  ASP  76           HB2      ASP  76  10.747   7.941   5.038
  471    HD2  ASP  76           HD       ASP  76   7.448   7.314   7.108
  472    H    ALA  77           H        ALA  77   6.888   7.501   4.399
  473    HA   ALA  77           HA       ALA  77   6.333   4.829   3.552
  474    HB1  ALA  77           HB1      ALA  77   4.322   6.875   4.463
  475    HB2  ALA  77           HB2      ALA  77   4.194   5.117   4.537
  476    HB3  ALA  77           HB3      ALA  77   5.348   5.961   5.570
  477    H    MET  78           H        MET  78   5.905   7.981   2.174
  478    HA   MET  78           HA       MET  78   3.825   7.495   0.377
  479    HB2  MET  78           HB1      MET  78   6.030   9.447   0.622
  480    HB3  MET  78           HB2      MET  78   5.385   9.232  -1.012
  481    HG2  MET  78           HG1      MET  78   3.313   9.519   1.037
  482    HG3  MET  78           HG2      MET  78   4.380  10.917   0.886
  483    HE1  MET  78           HE1      MET  78   5.190  11.696  -1.301
  484    HE2  MET  78           HE2      MET  78   4.750  10.844  -2.782
  485    HE3  MET  78           HE3      MET  78   3.974  12.379  -2.383
  486    H    CYS  79           H        CYS  79   7.160   6.527   0.315
  487    HA   CYS  79           HA       CYS  79   7.288   5.909  -2.466
  488    HB2  CYS  79           HB1      CYS  79   9.048   5.847  -0.198
  489    HB3  CYS  79           HB2      CYS  79   9.133   4.296  -1.037
  490    H    CYS  80           H        CYS  80   8.161   3.434  -2.817
  491    HA   CYS  80           HA       CYS  80   5.789   1.857  -2.573
  492    HB2  CYS  80           HB1      CYS  80   8.495   1.494  -3.792
  493    HB3  CYS  80           HB2      CYS  80   7.502   0.062  -3.510
  494    HA   PRO  81           HA       PRO  81   6.550  -0.456   1.075
  495    HB2  PRO  81           HB1      PRO  81   5.691  -2.962   0.376
  496    HB3  PRO  81           HB2      PRO  81   4.605  -1.600   0.643
  497    HG2  PRO  81           HG1      PRO  81   5.703  -2.681  -1.930
  498    HG3  PRO  81           HG2      PRO  81   4.015  -2.188  -1.529
  499    HD2  PRO  81           HD1      PRO  81   5.705  -0.609  -2.950
  500    HD3  PRO  81           HD2      PRO  81   4.492   0.047  -1.838
  501    H    GLY  82           H        GLY  82   8.532  -0.921   1.795
  502    HA2  GLY  82           HA2      GLY  82  10.290  -2.468   2.155
  503    HA3  GLY  82           HA3      GLY  82   9.983  -3.149   0.563
  504    HA1  GLY  82           HA1      GLY  82  10.179  -1.606   2.012
  505    H    THR  83           H        THR  83  10.095   0.274   0.774
  506    HA   THR  83           HA       THR  83  12.906   0.321  -0.073
  507    HB   THR  83           HB       THR  83  11.855   2.282  -1.649
  508    HG1  THR  83           HG1      THR  83  10.075   0.109  -1.999
  509   HG21  THR  83          HG21      THR  83  13.086   1.094  -3.075
  510   HG22  THR  83          HG22      THR  83  11.791  -0.098  -3.186
  511   HG23  THR  83          HG23      THR  83  13.060  -0.283  -1.974
  512    H    LEU  84           H        LEU  84  13.632   2.716  -0.293
  513    HA   LEU  84           HA       LEU  84  12.422   4.305   1.869
  514    HB2  LEU  84           HB1      LEU  84  15.136   3.259   1.617
  515    HB3  LEU  84           HB2      LEU  84  15.087   5.012   1.870
  516    HG   LEU  84           HG       LEU  84  13.617   3.116   3.679
  517   HD11  LEU  84          HD11      LEU  84  16.157   2.681   3.444
  518   HD12  LEU  84          HD12      LEU  84  15.458   2.849   5.055
  519   HD13  LEU  84          HD13      LEU  84  16.329   4.199   4.327
  520   HD21  LEU  84          HD21      LEU  84  13.223   5.667   3.559
  521   HD22  LEU  84          HD22      LEU  84  14.785   5.785   4.370
  522   HD23  LEU  84          HD23      LEU  84  13.458   4.913   5.138
  523    H    CYS  85           H        CYS  85  12.999   6.626   1.768
  524    HA   CYS  85           HA       CYS  85  13.113   7.505  -1.034
  525    HB2  CYS  85           HB1      CYS  85  11.097   8.091   0.352
  526    HB3  CYS  85           HB2      CYS  85  12.154   9.077   1.363
  527    H    VAL  86           H        VAL  86  15.130   8.011  -1.604
  528    HA   VAL  86           HA       VAL  86  16.699   9.706   0.228
  529    HB   VAL  86           HB       VAL  86  17.808   7.674  -1.712
  530   HG11  VAL  86          HG11      VAL  86  19.781   8.341   0.086
  531   HG12  VAL  86          HG12      VAL  86  19.640   8.947  -1.565
  532   HG13  VAL  86          HG13      VAL  86  18.983   9.883  -0.222
  533   HG21  VAL  86          HG21      VAL  86  17.547   7.597   1.290
  534   HG22  VAL  86          HG22      VAL  86  16.765   6.527   0.126
  535   HG23  VAL  86          HG23      VAL  86  18.515   6.467   0.342
  536    H    ASN  87           H        ASN  87  17.592  11.526  -0.594
  537    HA   ASN  87           HA       ASN  87  17.890  13.284  -2.008
  538    HB2  ASN  87           HB1      ASN  87  18.477  10.914  -3.767
  539    HB3  ASN  87           HB2      ASN  87  18.533  12.555  -4.423
  540   HD21  ASN  87          HD21      ASN  87  20.515  13.293  -4.529
  541   HD22  ASN  87          HD22      ASN  87  21.768  13.032  -3.368
  542    H    ASP  88           H        ASP  88  15.201  12.417  -1.589
  543    HA   ASP  88           HA       ASP  88  13.100  12.870  -2.336
  544    HB2  ASP  88           HB1      ASP  88  14.753  14.850  -3.462
  545    HB3  ASP  88           HB2      ASP  88  13.701  14.297  -4.773
  546    HD2  ASP  88           HD       ASP  88  10.962  15.862  -3.433
  547    H    VAL  89           H        VAL  89  14.670  10.558  -3.343
  548    HA   VAL  89           HA       VAL  89  12.862   9.854  -5.526
  549    HB   VAL  89           HB       VAL  89  15.859   9.517  -5.726
  550   HG11  VAL  89          HG11      VAL  89  15.394   8.569  -7.941
  551   HG12  VAL  89          HG12      VAL  89  14.676   7.602  -6.652
  552   HG13  VAL  89          HG13      VAL  89  13.664   8.676  -7.618
  553   HG21  VAL  89          HG21      VAL  89  13.905  11.358  -7.062
  554   HG22  VAL  89          HG22      VAL  89  15.438  11.745  -6.280
  555   HG23  VAL  89          HG23      VAL  89  15.427  10.921  -7.839
  556    H    CYS  90           H        CYS  90  12.328   7.703  -5.602
  557    HA   CYS  90           HA       CYS  90  12.651   6.183  -3.250
  558    HB2  CYS  90           HB1      CYS  90  11.031   6.087  -5.522
  559    HB3  CYS  90           HB2      CYS  90  11.952   4.582  -5.576
  560    H    THR  91           H        THR  91  13.928   4.443  -2.759
  561    HA   THR  91           HA       THR  91  15.780   3.388  -4.731
  562    HB   THR  91           HB       THR  91  16.943   5.376  -3.766
  563    HG1  THR  91           HG1      THR  91  18.591   4.146  -4.240
  564   HG21  THR  91          HG21      THR  91  17.773   5.225  -1.453
  565   HG22  THR  91          HG22      THR  91  16.809   3.768  -1.212
  566   HG23  THR  91          HG23      THR  91  16.013   5.312  -1.516
  567    H    THR  92           H        THR  92  16.684   1.391  -4.155
  568    HA   THR  92           HA       THR  92  15.096  -0.248  -2.514
  569    HB   THR  92           HB       THR  92  16.877  -1.961  -2.819
  570    HG1  THR  92           HG1      THR  92  18.816  -1.283  -3.293
  571   HG21  THR  92          HG21      THR  92  15.150  -1.739  -4.506
  572   HG22  THR  92          HG22      THR  92  16.694  -2.087  -5.283
  573   HG23  THR  92          HG23      THR  92  16.051  -0.445  -5.297
  574    H    MET  93           H        MET  93  15.591  -1.318  -0.551
  575    HA   MET  93           HA       MET  93  16.682   0.317   1.453
  576    HB2  MET  93           HB1      MET  93  15.042  -1.783   1.504
  577    HB3  MET  93           HB2      MET  93  16.551  -2.625   1.889
  578    HG2  MET  93           HG1      MET  93  16.895  -1.322   3.848
  579    HG3  MET  93           HG2      MET  93  15.596  -0.214   3.400
  580    HE1  MET  93           HE1      MET  93  12.386  -1.889   4.408
  581    HE2  MET  93           HE2      MET  93  13.258  -0.401   4.036
  582    HE3  MET  93           HE3      MET  93  13.010  -1.615   2.780
  583    H    GLU  94           H        GLU  94  18.107  -2.102  -0.600
  584    HA   GLU  94           HA       GLU  94  20.459  -2.518   0.959
  585    HB2  GLU  94           HB1      GLU  94  20.193  -2.948  -2.018
  586    HB3  GLU  94           HB2      GLU  94  21.284  -3.769  -0.891
  587    HG2  GLU  94           HG1      GLU  94  18.824  -4.348   0.169
  588    HG3  GLU  94           HG2      GLU  94  18.508  -4.349  -1.572
  589    HE2  GLU  94           HE       GLU  94  21.123  -7.045  -0.254
  590    H    ASP  95           H        ASP  95  19.511  -0.265  -1.540
  591    HA   ASP  95           HA       ASP  95  22.143   0.717  -2.066
  592    HB2  ASP  95           HB1      ASP  95  19.395   1.329  -2.923
  593    HB3  ASP  95           HB2      ASP  95  20.462   2.738  -2.848
  594    HD2  ASP  95           HD       ASP  95  20.907   0.233  -5.798
  595    H    ALA  96           H        ALA  96  19.469   1.727   0.006
  596    HA   ALA  96           HA       ALA  96  20.866   4.080   0.929
  597    HB1  ALA  96           HB1      ALA  96  18.226   3.386   0.800
  598    HB2  ALA  96           HB2      ALA  96  18.581   3.190   2.517
  599    HB3  ALA  96           HB3      ALA  96  18.882   4.737   1.725
  600    H    THR  97           H        THR  97  22.592   3.782   2.191
  601    HA   THR  97           HA       THR  97  22.258   2.247   4.650
  602    HB   THR  97           HB       THR  97  24.261   0.981   4.424
  603    HG1  THR  97           HG1      THR  97  25.823   1.689   3.195
  604   HG21  THR  97          HG21      THR  97  23.762  -0.473   2.587
  605   HG22  THR  97          HG22      THR  97  22.904   0.812   1.734
  606   HG23  THR  97          HG23      THR  97  22.232   0.136   3.217
  607    H    GLU  98           H        GLU  98  24.804   2.403   5.641
  608    HA   GLU  98           HA       GLU  98  25.292   5.308   5.734
  609    HB2  GLU  98           HB1      GLU  98  25.389   3.225   7.913
  610    HB3  GLU  98           HB2      GLU  98  26.169   4.805   8.083
  611    HG2  GLU  98           HG1      GLU  98  23.247   4.502   7.425
  612    HG3  GLU  98           HG2      GLU  98  23.862   4.566   9.083
  613    HE2  GLU  98           HE       GLU  98  24.531   7.971   8.860
  614    H    ASN  99           H        ASN  99  27.435   6.027   5.915
  615    HA   ASN  99           HA       ASN  99  29.381   4.174   4.786
  616    HB2  ASN  99           HB1      ASN  99  29.055   6.441   3.798
  617    HB3  ASN  99           HB2      ASN  99  29.651   7.142   5.306
  618   HD21  ASN  99          HD21      ASN  99  30.503   5.340   2.461
  619   HD22  ASN  99          HD22      ASN  99  32.214   5.523   2.612
  620    H    LEU 100           H        LEU 100  30.219   2.903   6.354
  621    HA   LEU 100           HA       LEU 100  32.031   4.080   8.228
  622    HB2  LEU 100           HB1      LEU 100  29.706   4.236   9.298
  623    HB3  LEU 100           HB2      LEU 100  29.803   2.472   9.439
  624    HG   LEU 100           HG       LEU 100  32.032   2.955  10.694
  625   HD11  LEU 100          HD11      LEU 100  31.987   5.072  11.933
  626   HD12  LEU 100          HD12      LEU 100  30.598   5.591  10.979
  627   HD13  LEU 100          HD13      LEU 100  32.155   5.323  10.196
  628   HD21  LEU 100          HD21      LEU 100  29.787   3.819  12.380
  629   HD22  LEU 100          HD22      LEU 100  30.898   2.464  12.573
  630   HD23  LEU 100          HD23      LEU 100  29.518   2.325  11.482
  631    H    TYR 101           H        TYR 101  33.609   2.668   8.814
  632    HA   TYR 101           HA       TYR 101  33.199  -0.193   8.518
  633    HB2  TYR 101           HB1      TYR 101  34.975  -0.551   6.952
  634    HB3  TYR 101           HB2      TYR 101  33.884   0.649   6.257
  635    HD1  TYR 101           HD1      TYR 101  37.234   0.063   7.567
  636    HD2  TYR 101           HD2      TYR 101  34.544   3.009   6.089
  637    HE1  TYR 101           HE1      TYR 101  39.117   1.615   7.253
  638    HE2  TYR 101           HE2      TYR 101  36.417   4.568   5.770
  639    HH   TYR 101           HH       TYR 101  39.301   3.939   5.438
  640    H    PHE 102           H        PHE 102  34.406  -1.351   9.914
  641    HA   PHE 102           HA       PHE 102  36.375   0.133  11.520
  642    HB2  PHE 102           HB1      PHE 102  34.357  -1.956  12.159
  643    HB3  PHE 102           HB2      PHE 102  35.887  -2.035  13.036
  644    HD1  PHE 102           HD1      PHE 102  33.791   0.846  11.931
  645    HD2  PHE 102           HD2      PHE 102  35.597  -1.242  15.171
  646    HE1  PHE 102           HE1      PHE 102  33.016   2.591  13.483
  647    HE2  PHE 102           HE2      PHE 102  34.825   0.499  16.727
  648    HZ   PHE 102           HZ       PHE 102  33.532   2.418  15.885
  649    H    GLN 103           H        GLN 103  35.819  -3.336  10.966
  650    HA   GLN 103           HA       GLN 103  38.171  -3.755   9.454
  651    HB2  GLN 103           HB1      GLN 103  39.493  -4.982  11.148
  652    HB3  GLN 103           HB2      GLN 103  39.334  -3.257  11.517
  653    HG2  GLN 103           HG1      GLN 103  37.703  -3.677  13.208
  654    HG3  GLN 103           HG2      GLN 103  37.596  -5.380  12.744
  655   HE21  GLN 103          HE21      GLN 103  38.321  -6.449  14.459
  656   HE22  GLN 103          HE22      GLN 103  39.848  -6.191  15.227
  657    H    SER 104           H        SER 104  38.736  -6.173   9.404
  658    HA   SER 104           HA       SER 104  36.911  -8.112  10.295
  659    HB2  SER 104           HB1      SER 104  36.158  -8.522   7.720
  660    HB3  SER 104           HB2      SER 104  35.189  -7.615   8.895
  661    HG   SER 104           HG       SER 104  35.428  -5.951   7.655
  662    H    LEU 105           H        LEU 105  38.556  -9.498  10.623
  663    HA   LEU 105           HA       LEU 105  39.749 -10.752   8.314
  664    HB2  LEU 105           HB1      LEU 105  41.149  -8.669   9.151
  665    HB3  LEU 105           HB2      LEU 105  41.708  -9.839  10.360
  666    HG   LEU 105           HG       LEU 105  42.292 -11.324   8.327
  667   HD11  LEU 105          HD11      LEU 105  41.981  -8.624   7.031
  668   HD12  LEU 105          HD12      LEU 105  41.191 -10.137   6.585
  669   HD13  LEU 105          HD13      LEU 105  42.925  -9.942   6.337
  670   HD21  LEU 105          HD21      LEU 105  43.705  -9.006   9.478
  671   HD22  LEU 105          HD22      LEU 105  44.375  -9.658   7.983
  672   HD23  LEU 105          HD23      LEU 105  44.181 -10.702   9.392
  673    H    GLU 106           H        GLU 106  40.345 -12.845   8.700
  674    HA   GLU 106           HA       GLU 106  40.666 -13.825  11.400
  675    HB2  GLU 106           HB1      GLU 106  38.111 -13.765  10.518
  676    HB3  GLU 106           HB2      GLU 106  38.619 -15.346   9.903
  677    HG2  GLU 106           HG1      GLU 106  38.251 -16.227  11.895
  678    HG3  GLU 106           HG2      GLU 106  39.531 -15.199  12.556
  679    HE2  GLU 106           HE       GLU 106  37.265 -13.106  14.097
  680    H    HIS 107           H        HIS 107  42.440 -15.014  11.213
  681    HA   HIS 107           HA       HIS 107  42.736 -16.735   8.839
  682    HB2  HIS 107           HB1      HIS 107  45.182 -16.601   9.224
  683    HB3  HIS 107           HB2      HIS 107  44.455 -15.031   8.870
  684    HD1  HIS 107           HD1      HIS 107  44.458 -13.255  10.725
  685    HD2  HIS 107           HD2      HIS 107  46.166 -16.868  11.861
  686    HE1  HIS 107           HE1      HIS 107  45.629 -12.791  12.902
  687    HE2  HIS 107           HE2      HIS 107  46.672 -14.999  13.597
  688    H    HIS 108           H        HIS 108  43.113 -16.503  12.331
  689    HA   HIS 108           HA       HIS 108  44.188 -19.050  12.802
  690    HB2  HIS 108           HB1      HIS 108  42.677 -17.050  14.429
  691    HB3  HIS 108           HB2      HIS 108  42.861 -18.683  15.076
  692    HD1  HIS 108           HD1      HIS 108  44.243 -15.979  16.155
  693    HD2  HIS 108           HD2      HIS 108  46.041 -19.029  13.981
  694    HE1  HIS 108           HE1      HIS 108  46.697 -15.822  16.680
  695    HE2  HIS 108           HE2      HIS 108  47.797 -17.686  15.351
  696    H    HIS 109           H        HIS 109  43.351 -21.026  12.675
  697    HA   HIS 109           HA       HIS 109  40.502 -21.457  13.037
  698    HB2  HIS 109           HB1      HIS 109  41.334 -21.041  10.493
  699    HB3  HIS 109           HB2      HIS 109  41.578 -22.786  10.621
  700    HD1  HIS 109           HD1      HIS 109  38.724 -20.552  11.804
  701    HD2  HIS 109           HD2      HIS 109  39.407 -23.985   9.566
  702    HE1  HIS 109           HE1      HIS 109  36.447 -21.371  11.118
  703    HE2  HIS 109           HE2      HIS 109  36.864 -23.468   9.749
  704    H    HIS 110           H        HIS 110  42.941 -22.174  14.459
  705    HA   HIS 110           HA       HIS 110  42.350 -24.909  14.957
  706    HB2  HIS 110           HB1      HIS 110  44.325 -24.357  12.949
  707    HB3  HIS 110           HB2      HIS 110  45.115 -25.090  14.348
  708    HD1  HIS 110           HD1      HIS 110  43.326 -27.233  15.266
  709    HD2  HIS 110           HD2      HIS 110  43.768 -26.368  11.226
  710    HE1  HIS 110           HE1      HIS 110  42.632 -29.323  14.051
  711    HE2  HIS 110           HE2      HIS 110  42.900 -28.794  11.581
  712    H    HIS 111           H        HIS 111  43.161 -25.594  16.910
  713    HA   HIS 111           HA       HIS 111  45.294 -24.199  18.237
  714    HB2  HIS 111           HB1      HIS 111  42.891 -22.971  18.487
  715    HB3  HIS 111           HB2      HIS 111  42.814 -24.093  19.849
  716    HD1  HIS 111           HD1      HIS 111  43.229 -20.850  19.844
  717    HD2  HIS 111           HD2      HIS 111  46.012 -23.798  20.754
  718    HE1  HIS 111           HE1      HIS 111  44.945 -19.728  21.299
  719    HE2  HIS 111           HE2      HIS 111  46.645 -21.529  21.858
  720    H    HIS 112           H        HIS 112  44.794 -26.893  17.468
  721    HA   HIS 112           HA       HIS 112  45.475 -28.225  19.868
  722    HB2  HIS 112           HB1      HIS 112  42.859 -27.865  19.902
  723    HB3  HIS 112           HB2      HIS 112  42.874 -29.256  18.813
  724    HD1  HIS 112           HD1      HIS 112  42.081 -31.127  20.248
  725    HD2  HIS 112           HD2      HIS 112  45.042 -28.878  22.099
  726    HE1  HIS 112           HE1      HIS 112  42.624 -32.352  22.376
  727    HE2  HIS 112           HE2      HIS 112  44.435 -30.978  23.508
  Start of MODEL   66
    1    H1   MET  18           H        MET  18 -30.728  28.840  49.915
    2    HA   MET  18           HA       MET  18 -30.884  26.811  51.302
    3    HB2  MET  18           HB1      MET  18 -33.116  26.363  49.945
    4    HB3  MET  18           HB2      MET  18 -32.032  25.383  48.946
    5    HG2  MET  18           HG1      MET  18 -32.236  23.713  50.383
    6    HG3  MET  18           HG2      MET  18 -31.458  24.717  51.611
    7    HE1  MET  18           HE1      MET  18 -34.008  25.372  54.145
    8    HE2  MET  18           HE2      MET  18 -32.781  24.123  53.928
    9    HE3  MET  18           HE3      MET  18 -32.434  25.791  53.465
   10    H    LEU  19           H        LEU  19 -30.462  26.751  47.766
   11    HA   LEU  19           HA       LEU  19 -27.679  25.953  48.167
   12    HB2  LEU  19           HB1      LEU  19 -29.437  24.018  47.638
   13    HB3  LEU  19           HB2      LEU  19 -29.152  24.587  45.984
   14    HG   LEU  19           HG       LEU  19 -26.601  24.275  47.004
   15   HD11  LEU  19          HD11      LEU  19 -27.715  21.650  47.616
   16   HD12  LEU  19          HD12      LEU  19 -28.182  22.901  48.768
   17   HD13  LEU  19          HD13      LEU  19 -26.476  22.582  48.455
   18   HD21  LEU  19          HD21      LEU  19 -27.024  23.662  44.801
   19   HD22  LEU  19          HD22      LEU  19 -28.374  22.617  45.247
   20   HD23  LEU  19          HD23      LEU  19 -26.718  22.119  45.600
   21    H    VAL  20           H        VAL  20 -26.334  26.297  46.278
   22    HA   VAL  20           HA       VAL  20 -27.312  28.551  44.683
   23    HB   VAL  20           HB       VAL  20 -24.476  27.541  44.917
   24   HG11  VAL  20          HG11      VAL  20 -25.709  29.437  43.214
   25   HG12  VAL  20          HG12      VAL  20 -24.692  30.321  44.353
   26   HG13  VAL  20          HG13      VAL  20 -23.996  29.042  43.357
   27   HG21  VAL  20          HG21      VAL  20 -26.037  29.464  46.593
   28   HG22  VAL  20          HG22      VAL  20 -24.917  28.196  47.093
   29   HG23  VAL  20          HG23      VAL  20 -24.300  29.685  46.376
   30    H    LEU  21           H        LEU  21 -27.538  28.479  42.517
   31    HA   LEU  21           HA       LEU  21 -27.404  25.896  41.232
   32    HB2  LEU  21           HB1      LEU  21 -28.750  28.422  40.803
   33    HB3  LEU  21           HB2      LEU  21 -28.006  27.825  39.308
   34    HG   LEU  21           HG       LEU  21 -30.390  27.177  39.597
   35   HD11  LEU  21          HD11      LEU  21 -29.983  24.724  39.128
   36   HD12  LEU  21          HD12      LEU  21 -28.273  25.053  39.406
   37   HD13  LEU  21          HD13      LEU  21 -29.127  25.872  38.097
   38   HD21  LEU  21          HD21      LEU  21 -31.142  25.827  41.293
   39   HD22  LEU  21          HD22      LEU  21 -29.940  26.789  42.153
   40   HD23  LEU  21          HD23      LEU  21 -29.542  25.157  41.617
   41    H    ASP  22           H        ASP  22 -25.595  25.163  40.355
   42    HA   ASP  22           HA       ASP  22 -23.598  27.077  39.375
   43    HB2  ASP  22           HB1      ASP  22 -23.368  24.122  40.007
   44    HB3  ASP  22           HB2      ASP  22 -22.046  25.135  39.412
   45    HD2  ASP  22           HD       ASP  22 -22.449  25.006  43.182
   46    H    PHE  23           H        PHE  23 -25.881  26.708  37.797
   47    HA   PHE  23           HA       PHE  23 -24.866  25.101  35.549
   48    HB2  PHE  23           HB1      PHE  23 -27.467  25.326  36.747
   49    HB3  PHE  23           HB2      PHE  23 -27.552  25.878  35.072
   50    HD1  PHE  23           HD1      PHE  23 -28.050  23.121  37.010
   51    HD2  PHE  23           HD2      PHE  23 -26.007  24.271  33.458
   52    HE1  PHE  23           HE1      PHE  23 -28.111  20.790  36.223
   53    HE2  PHE  23           HE2      PHE  23 -26.066  21.943  32.665
   54    HZ   PHE  23           HZ       PHE  23 -27.119  20.199  34.048
   55    H    ASN  24           H        ASN  24 -23.686  26.435  34.306
   56    HA   ASN  24           HA       ASN  24 -24.949  28.955  33.445
   57    HB2  ASN  24           HB1      ASN  24 -22.823  30.034  33.357
   58    HB3  ASN  24           HB2      ASN  24 -22.925  29.238  34.932
   59   HD21  ASN  24          HD21      ASN  24 -20.549  30.035  33.567
   60   HD22  ASN  24          HD22      ASN  24 -19.620  28.607  33.280
   61    H    ASN  25           H        ASN  25 -24.499  29.633  31.280
   62    HA   ASN  25           HA       ASN  25 -23.434  27.550  29.506
   63    HB2  ASN  25           HB1      ASN  25 -26.126  27.943  29.773
   64    HB3  ASN  25           HB2      ASN  25 -25.745  29.032  28.434
   65   HD21  ASN  25          HD21      ASN  25 -26.529  27.978  26.725
   66   HD22  ASN  25          HD22      ASN  25 -26.060  26.388  26.241
   67    H    ILE  26           H        ILE  26 -22.138  28.296  27.934
   68    HA   ILE  26           HA       ILE  26 -22.027  31.214  27.534
   69    HB   ILE  26           HB       ILE  26 -19.633  30.858  26.887
   70   HG12  ILE  26          HG11      ILE  26 -19.523  28.324  28.396
   71   HG13  ILE  26          HG12      ILE  26 -20.283  28.213  26.799
   72   HG21  ILE  26          HG21      ILE  26 -18.830  30.626  29.214
   73   HG22  ILE  26          HG22      ILE  26 -20.182  31.745  29.058
   74   HG23  ILE  26          HG23      ILE  26 -20.451  30.122  29.692
   75   HD11  ILE  26          HD11      ILE  26 -17.693  27.870  27.117
   76   HD12  ILE  26          HD12      ILE  26 -18.354  28.653  25.682
   77   HD13  ILE  26          HD13      ILE  26 -17.686  29.629  26.990
   78    H    ARG  27           H        ARG  27 -21.324  31.933  25.404
   79    HA   ARG  27           HA       ARG  27 -21.522  32.001  23.139
   80    HB2  ARG  27           HB1      ARG  27 -20.256  29.524  23.771
   81    HB3  ARG  27           HB2      ARG  27 -21.367  29.249  22.421
   82    HG2  ARG  27           HG1      ARG  27 -20.092  31.604  21.727
   83    HG3  ARG  27           HG2      ARG  27 -18.816  30.626  22.473
   84    HD2  ARG  27           HD1      ARG  27 -18.885  29.019  20.847
   85    HD3  ARG  27           HD2      ARG  27 -20.610  29.271  20.541
   86    HE   ARG  27           HE       ARG  27 -20.074  30.829  18.948
   87   HH11  ARG  27          HH11      ARG  27 -17.269  30.164  20.902
   88   HH12  ARG  27          HH12      ARG  27 -16.188  31.058  19.886
   89   HH21  ARG  27          HH21      ARG  27 -18.660  32.009  17.603
   90   HH22  ARG  27          HH22      ARG  27 -16.980  32.107  18.009
   91    H    SER  28           H        SER  28 -22.771  30.922  21.221
   92    HA   SER  28           HA       SER  28 -25.518  30.594  22.154
   93    HB2  SER  28           HB1      SER  28 -24.658  32.212  20.257
   94    HB3  SER  28           HB2      SER  28 -24.781  30.755  19.255
   95    HG   SER  28           HG       SER  28 -26.724  32.368  19.880
   96    H    SER  29           H        SER  29 -23.344  29.055  19.782
   97    HA   SER  29           HA       SER  29 -23.186  26.914  19.028
   98    HB2  SER  29           HB1      SER  29 -24.818  25.716  21.184
   99    HB3  SER  29           HB2      SER  29 -23.184  25.307  20.633
  100    HG   SER  29           HG       SER  29 -23.907  26.783  22.744
  101    H    ALA  30           H        ALA  30 -24.537  24.968  18.358
  102    HA   ALA  30           HA       ALA  30 -26.254  24.166  17.095
  103    HB1  ALA  30           HB1      ALA  30 -28.588  24.842  17.979
  104    HB2  ALA  30           HB2      ALA  30 -27.529  23.877  19.009
  105    HB3  ALA  30           HB3      ALA  30 -27.688  25.611  19.288
  106    H    ASP  31           H        ASP  31 -25.044  26.128  15.788
  107    HA   ASP  31           HA       ASP  31 -27.036  27.125  14.052
  108    HB2  ASP  31           HB1      ASP  31 -26.562  28.748  16.321
  109    HB3  ASP  31           HB2      ASP  31 -25.788  29.556  14.950
  110    HD2  ASP  31           HD       ASP  31 -29.135  29.408  13.385
  111    H    LEU  32           H        LEU  32 -26.141  27.357  12.102
  112    HA   LEU  32           HA       LEU  32 -24.561  27.352  10.462
  113    HB2  LEU  32           HB1      LEU  32 -23.467  29.384  12.398
  114    HB3  LEU  32           HB2      LEU  32 -22.675  29.029  10.853
  115    HG   LEU  32           HG       LEU  32 -25.534  29.952  11.038
  116   HD11  LEU  32          HD11      LEU  32 -24.636  31.862  11.839
  117   HD12  LEU  32          HD12      LEU  32 -24.232  32.119  10.142
  118   HD13  LEU  32          HD13      LEU  32 -23.018  31.478  11.249
  119   HD21  LEU  32          HD21      LEU  32 -24.575  28.779   8.973
  120   HD22  LEU  32          HD22      LEU  32 -23.622  30.246   8.745
  121   HD23  LEU  32          HD23      LEU  32 -25.384  30.328   8.738
  122    H    HIS  33           H        HIS  33 -24.170  25.083  11.298
  123    HA   HIS  33           HA       HIS  33 -21.312  24.815  11.910
  124    HB2  HIS  33           HB1      HIS  33 -22.739  24.458  13.965
  125    HB3  HIS  33           HB2      HIS  33 -23.428  23.050  13.151
  126    HD1  HIS  33           HD1      HIS  33 -20.456  24.152  15.039
  127    HD2  HIS  33           HD2      HIS  33 -21.600  20.887  12.739
  128    HE1  HIS  33           HE1      HIS  33 -18.770  22.353  15.539
  129    HE2  HIS  33           HE2      HIS  33 -19.469  20.357  14.133
  130    H    GLY  34           H        GLY  34 -20.298  23.542  10.503
  131    HA2  GLY  34           HA2      GLY  34 -20.503  21.166   9.552
  132    HA3  GLY  34           HA3      GLY  34 -21.947  21.808   8.783
  133    HA1  GLY  34           HA1      GLY  34 -20.001  21.886   9.635
  134    H    ALA  35           H        ALA  35 -19.093  20.841   7.947
  135    HA   ALA  35           HA       ALA  35 -18.945  22.451   5.612
  136    HB1  ALA  35           HB1      ALA  35 -17.895  23.887   7.484
  137    HB2  ALA  35           HB2      ALA  35 -16.529  22.780   7.350
  138    HB3  ALA  35           HB3      ALA  35 -17.037  23.727   5.951
  139    H    ARG  36           H        ARG  36 -19.230  19.942   5.412
  140    HA   ARG  36           HA       ARG  36 -16.560  18.847   4.837
  141    HB2  ARG  36           HB1      ARG  36 -18.439  17.859   6.736
  142    HB3  ARG  36           HB2      ARG  36 -18.365  16.708   5.393
  143    HG2  ARG  36           HG1      ARG  36 -15.704  17.316   5.885
  144    HG3  ARG  36           HG2      ARG  36 -16.443  17.222   7.494
  145    HD2  ARG  36           HD1      ARG  36 -17.190  15.003   7.148
  146    HD3  ARG  36           HD2      ARG  36 -16.891  15.105   5.408
  147    HE   ARG  36           HE       ARG  36 -14.436  15.484   6.552
  148   HH11  ARG  36          HH11      ARG  36 -16.883  13.012   6.694
  149   HH12  ARG  36          HH12      ARG  36 -15.756  11.728   6.978
  150   HH21  ARG  36          HH21      ARG  36 -12.942  13.802   6.925
  151   HH22  ARG  36          HH22      ARG  36 -13.513  12.178   7.110
  152    H    LYS  37           H        LYS  37 -16.345  18.431   2.750
  153    HA   LYS  37           HA       LYS  37 -18.394  17.084   1.255
  154    HB2  LYS  37           HB1      LYS  37 -18.514  18.850  -0.525
  155    HB3  LYS  37           HB2      LYS  37 -19.299  19.282   1.003
  156    HG2  LYS  37           HG1      LYS  37 -17.377  20.640   1.641
  157    HG3  LYS  37           HG2      LYS  37 -16.561  20.187   0.133
  158    HD2  LYS  37           HD1      LYS  37 -19.154  21.167  -0.532
  159    HD3  LYS  37           HD2      LYS  37 -18.391  22.314   0.584
  160    HE2  LYS  37           HE1      LYS  37 -16.399  22.406  -0.852
  161    HE3  LYS  37           HE2      LYS  37 -17.162  21.258  -1.961
  162    HZ1  LYS  37           HZ1      LYS  37 -19.032  22.999  -2.056
  163    HZ2  LYS  37           HZ2      LYS  37 -17.609  23.292  -2.922
  164    HZ3  LYS  37           HZ3      LYS  37 -17.873  24.069  -1.443
  165    H    GLY  38           H        GLY  38 -17.554  15.958  -0.435
  166    HA2  GLY  38           HA2      GLY  38 -16.002  15.546  -2.179
  167    HA3  GLY  38           HA3      GLY  38 -14.884  16.664  -1.413
  168    HA1  GLY  38           HA1      GLY  38 -16.353  15.130  -1.487
  169    H    SER  39           H        SER  39 -13.105  15.424  -1.175
  170    HA   SER  39           HA       SER  39 -11.706  13.847  -0.321
  171    HB2  SER  39           HB1      SER  39 -13.183  14.571   1.766
  172    HB3  SER  39           HB2      SER  39 -13.764  12.901   1.627
  173    HG   SER  39           HG       SER  39 -11.011  13.559   1.704
  174    H    GLN  40           H        GLN  40 -11.667  12.512  -2.115
  175    HA   GLN  40           HA       GLN  40 -13.676  10.561  -2.644
  176    HB2  GLN  40           HB1      GLN  40 -11.311  11.558  -3.919
  177    HB3  GLN  40           HB2      GLN  40 -11.246   9.789  -3.879
  178    HG2  GLN  40           HG1      GLN  40 -13.822  10.227  -4.675
  179    HG3  GLN  40           HG2      GLN  40 -12.959  11.571  -5.435
  180   HE21  GLN  40          HE21      GLN  40 -12.110  11.188  -7.346
  181   HE22  GLN  40          HE22      GLN  40 -11.700   9.637  -7.988
  182    H    CYS  41           H        CYS  41 -10.806  10.641  -0.708
  183    HA   CYS  41           HA       CYS  41 -11.229   7.807  -0.026
  184    HB2  CYS  41           HB1      CYS  41  -8.846   7.512   0.283
  185    HB3  CYS  41           HB2      CYS  41  -9.155   8.112  -1.348
  186    H    LEU  42           H        LEU  42 -11.086   7.249   2.128
  187    HA   LEU  42           HA       LEU  42 -11.411   9.441   3.996
  188    HB2  LEU  42           HB1      LEU  42 -12.440   6.858   3.780
  189    HB3  LEU  42           HB2      LEU  42 -11.355   6.800   5.179
  190    HG   LEU  42           HG       LEU  42 -12.644   8.890   5.986
  191   HD11  LEU  42          HD11      LEU  42 -14.352   7.907   3.743
  192   HD12  LEU  42          HD12      LEU  42 -13.951   9.560   4.209
  193   HD13  LEU  42          HD13      LEU  42 -15.097   8.626   5.171
  194   HD21  LEU  42          HD21      LEU  42 -12.851   6.939   7.248
  195   HD22  LEU  42          HD22      LEU  42 -13.672   6.072   5.950
  196   HD23  LEU  42          HD23      LEU  42 -14.515   7.349   6.828
  197    H    SER  43           H        SER  43  -9.068   6.962   3.226
  198    HA   SER  43           HA       SER  43  -7.089   8.316   4.850
  199    HB2  SER  43           HB1      SER  43  -7.982   5.480   5.409
  200    HB3  SER  43           HB2      SER  43  -6.408   6.109   5.930
  201    HG   SER  43           HG       SER  43  -7.430   6.897   7.577
  202    H    ASP  44           H        ASP  44  -4.964   6.817   4.722
  203    HA   ASP  44           HA       ASP  44  -4.311   6.746   1.943
  204    HB2  ASP  44           HB1      ASP  44  -2.082   6.095   2.665
  205    HB3  ASP  44           HB2      ASP  44  -2.684   7.409   3.684
  206    HD2  ASP  44           HD       ASP  44  -2.390   5.514   6.513
  207    H    THR  45           H        THR  45  -5.342   4.405   4.278
  208    HA   THR  45           HA       THR  45  -4.515   2.133   2.682
  209    HB   THR  45           HB       THR  45  -5.528   0.753   4.403
  210    HG1  THR  45           HG1      THR  45  -6.345   3.135   5.722
  211   HG21  THR  45          HG21      THR  45  -3.287   2.000   4.750
  212   HG22  THR  45          HG22      THR  45  -4.047   1.226   6.141
  213   HG23  THR  45          HG23      THR  45  -4.187   2.969   5.914
  214    H    ASP  46           H        ASP  46  -6.854   4.313   2.259
  215    HA   ASP  46           HA       ASP  46  -9.009   2.461   1.606
  216    HB2  ASP  46           HB1      ASP  46  -8.839   5.234   2.327
  217    HB3  ASP  46           HB2      ASP  46  -9.644   5.092   0.758
  218    HD2  ASP  46           HD       ASP  46 -11.507   2.927   3.481
  219    H    CYS  47           H        CYS  47  -6.286   3.043   0.137
  220    HA   CYS  47           HA       CYS  47  -7.444   3.391  -2.548
  221    HB2  CYS  47           HB1      CYS  47  -4.655   3.883  -1.492
  222    HB3  CYS  47           HB2      CYS  47  -5.040   3.872  -3.213
  223    H    ASN  48           H        ASN  48  -8.103   1.141  -2.516
  224    HA   ASN  48           HA       ASN  48  -7.866  -0.993  -3.277
  225    HB2  ASN  48           HB1      ASN  48  -5.626   0.414  -4.400
  226    HB3  ASN  48           HB2      ASN  48  -5.122  -1.217  -3.941
  227   HD21  ASN  48          HD21      ASN  48  -6.716   0.655  -6.238
  228   HD22  ASN  48          HD22      ASN  48  -7.362  -0.627  -7.201
  229    H    THR  49           H        THR  49  -4.561  -0.469  -2.088
  230    HA   THR  49           HA       THR  49  -5.050  -1.850   0.382
  231    HB   THR  49           HB       THR  49  -3.141  -3.236  -1.488
  232    HG1  THR  49           HG1      THR  49  -5.920  -3.729  -1.100
  233   HG21  THR  49          HG21      THR  49  -4.574  -4.107   1.026
  234   HG22  THR  49          HG22      THR  49  -2.869  -3.672   0.897
  235   HG23  THR  49          HG23      THR  49  -3.478  -5.107   0.073
  236    H    ARG  50           H        ARG  50  -2.253  -1.512  -1.809
  237    HA   ARG  50           HA       ARG  50  -0.890  -0.015   0.333
  238    HB2  ARG  50           HB1      ARG  50   0.049  -2.123  -1.559
  239    HB3  ARG  50           HB2      ARG  50   1.191  -0.853  -1.093
  240    HG2  ARG  50           HG1      ARG  50   1.285  -1.523   1.101
  241    HG3  ARG  50           HG2      ARG  50  -0.316  -2.278   1.042
  242    HD2  ARG  50           HD1      ARG  50   0.627  -4.034  -0.470
  243    HD3  ARG  50           HD2      ARG  50   2.224  -3.319  -0.204
  244    HE   ARG  50           HE       ARG  50   1.079  -3.869   2.291
  245   HH11  ARG  50          HH11      ARG  50   2.312  -5.548  -0.499
  246   HH12  ARG  50          HH12      ARG  50   2.797  -6.949   0.396
  247   HH21  ARG  50          HH21      ARG  50   1.713  -5.709   3.481
  248   HH22  ARG  50          HH22      ARG  50   2.455  -7.041   2.660
  249    H    LYS  51           H        LYS  51  -1.920   1.900  -0.596
  250    HA   LYS  51           HA       LYS  51  -0.197   3.104  -2.595
  251    HB2  LYS  51           HB1      LYS  51  -3.002   2.323  -3.108
  252    HB3  LYS  51           HB2      LYS  51  -2.569   3.971  -3.589
  253    HG2  LYS  51           HG1      LYS  51  -1.992   2.964  -5.518
  254    HG3  LYS  51           HG2      LYS  51  -0.488   2.641  -4.637
  255    HD2  LYS  51           HD1      LYS  51  -1.803   0.497  -3.828
  256    HD3  LYS  51           HD2      LYS  51  -2.729   0.794  -5.309
  257    HE2  LYS  51           HE1      LYS  51  -1.080   0.037  -6.619
  258    HE3  LYS  51           HE2      LYS  51   0.125   1.013  -5.765
  259    HZ1  LYS  51           HZ1      LYS  51   0.729  -1.227  -5.453
  260    HZ2  LYS  51           HZ2      LYS  51  -0.845  -1.691  -5.043
  261    HZ3  LYS  51           HZ3      LYS  51   0.057  -0.731  -3.982
  262    H    PHE  52           H        PHE  52  -0.270   5.388  -2.601
  263    HA   PHE  52           HA       PHE  52  -1.395   6.503  -0.137
  264    HB2  PHE  52           HB1      PHE  52   0.205   8.254  -0.310
  265    HB3  PHE  52           HB2      PHE  52   1.062   6.755  -0.674
  266    HD1  PHE  52           HD1      PHE  52  -0.092   9.933  -2.004
  267    HD2  PHE  52           HD2      PHE  52   1.759   6.219  -2.956
  268    HE1  PHE  52           HE1      PHE  52   0.680  10.870  -4.144
  269    HE2  PHE  52           HE2      PHE  52   2.536   7.151  -5.096
  270    HZ   PHE  52           HZ       PHE  52   1.997   9.479  -5.693
  271    H    CYS  53           H        CYS  53  -2.750   8.265  -0.115
  272    HA   CYS  53           HA       CYS  53  -4.175   8.772  -2.602
  273    HB2  CYS  53           HB1      CYS  53  -5.146   8.344  -0.169
  274    HB3  CYS  53           HB2      CYS  53  -4.924  10.087  -0.027
  275    H    LEU  54           H        LEU  54  -3.313  10.278  -3.879
  276    HA   LEU  54           HA       LEU  54  -1.833  12.512  -2.805
  277    HB2  LEU  54           HB1      LEU  54  -1.133  11.362  -4.868
  278    HB3  LEU  54           HB2      LEU  54  -2.635  11.893  -5.645
  279    HG   LEU  54           HG       LEU  54  -1.554  14.267  -4.816
  280   HD11  LEU  54          HD11      LEU  54   0.801  14.184  -5.623
  281   HD12  LEU  54          HD12      LEU  54   0.688  12.424  -5.620
  282   HD13  LEU  54          HD13      LEU  54   0.523  13.320  -4.110
  283   HD21  LEU  54          HD21      LEU  54  -1.679  12.750  -7.358
  284   HD22  LEU  54          HD22      LEU  54  -0.655  14.187  -7.320
  285   HD23  LEU  54          HD23      LEU  54  -2.373  14.315  -6.934
  286    H    GLN  55           H        GLN  55  -2.680  14.398  -2.243
  287    HA   GLN  55           HA       GLN  55  -5.294  15.153  -3.375
  288    HB2  GLN  55           HB1      GLN  55  -4.198  16.005  -0.690
  289    HB3  GLN  55           HB2      GLN  55  -5.837  16.249  -1.311
  290    HG2  GLN  55           HG1      GLN  55  -6.292  13.882  -1.217
  291    HG3  GLN  55           HG2      GLN  55  -4.623  13.560  -0.727
  292   HE21  GLN  55          HE21      GLN  55  -7.549  15.273   0.259
  293   HE22  GLN  55          HE22      GLN  55  -7.285  15.112   1.959
  294    HA   PRO  56           HA       PRO  56  -2.373  18.344  -4.882
  295    HB2  PRO  56           HB1      PRO  56  -3.746  18.807  -7.207
  296    HB3  PRO  56           HB2      PRO  56  -2.581  17.498  -7.009
  297    HG2  PRO  56           HG1      PRO  56  -5.572  17.432  -6.787
  298    HG3  PRO  56           HG2      PRO  56  -4.465  16.290  -7.639
  299    HD2  PRO  56           HD1      PRO  56  -5.546  15.745  -5.211
  300    HD3  PRO  56           HD2      PRO  56  -3.929  15.196  -5.683
  301    H    ARG  57           H        ARG  57  -2.599  20.581  -4.978
  302    HA   ARG  57           HA       ARG  57  -4.953  21.626  -3.666
  303    HB2  ARG  57           HB1      ARG  57  -2.218  22.585  -4.276
  304    HB3  ARG  57           HB2      ARG  57  -3.476  23.825  -4.203
  305    HG2  ARG  57           HG1      ARG  57  -3.665  23.698  -1.975
  306    HG3  ARG  57           HG2      ARG  57  -3.549  21.930  -1.978
  307    HD2  ARG  57           HD1      ARG  57  -1.316  21.933  -1.629
  308    HD3  ARG  57           HD2      ARG  57  -1.066  23.330  -2.686
  309    HE   ARG  57           HE       ARG  57  -2.353  24.112  -0.285
  310   HH11  ARG  57          HH11      ARG  57   0.738  23.161  -1.574
  311   HH12  ARG  57          HH12      ARG  57   1.649  24.037  -0.387
  312   HH21  ARG  57          HH21      ARG  57  -1.165  25.268   1.283
  313   HH22  ARG  57          HH22      ARG  57   0.565  25.234   1.237
  314    H    ASP  58           H        ASP  58  -3.546  21.614  -6.859
  315    HA   ASP  58           HA       ASP  58  -5.409  23.608  -7.855
  316    HB2  ASP  58           HB1      ASP  58  -2.913  23.161  -8.593
  317    HB3  ASP  58           HB2      ASP  58  -3.671  21.964  -9.651
  318    HD2  ASP  58           HD       ASP  58  -4.838  24.375 -11.794
  319    H    GLU  59           H        GLU  59  -5.148  20.180  -7.613
  320    HA   GLU  59           HA       GLU  59  -7.532  19.886  -9.321
  321    HB2  GLU  59           HB1      GLU  59  -5.034  18.628  -9.573
  322    HB3  GLU  59           HB2      GLU  59  -6.121  17.400  -8.904
  323    HG2  GLU  59           HG1      GLU  59  -7.738  18.181 -10.794
  324    HG3  GLU  59           HG2      GLU  59  -6.258  18.819 -11.523
  325    HE2  GLU  59           HE       GLU  59  -5.552  15.715 -12.756
  326    H    LYS  60           H        LYS  60  -8.514  17.539  -8.718
  327    HA   LYS  60           HA       LYS  60  -9.335  17.830  -5.944
  328    HB2  LYS  60           HB1      LYS  60 -11.006  16.056  -6.544
  329    HB3  LYS  60           HB2      LYS  60 -11.122  17.539  -7.506
  330    HG2  LYS  60           HG1      LYS  60 -10.920  16.379  -9.379
  331    HG3  LYS  60           HG2      LYS  60  -9.358  15.744  -8.833
  332    HD2  LYS  60           HD1      LYS  60 -10.505  13.777  -9.077
  333    HD3  LYS  60           HD2      LYS  60 -10.898  14.153  -7.390
  334    HE2  LYS  60           HE1      LYS  60 -12.777  15.473  -9.121
  335    HE3  LYS  60           HE2      LYS  60 -12.678  13.756  -9.540
  336    HZ1  LYS  60           HZ1      LYS  60 -12.753  14.054  -6.731
  337    HZ2  LYS  60           HZ2      LYS  60 -13.838  13.242  -7.742
  338    HZ3  LYS  60           HZ3      LYS  60 -14.052  14.889  -7.422
  339    HA   PRO  61           HA       PRO  61  -6.986  14.509  -4.294
  340    HB2  PRO  61           HB1      PRO  61  -8.708  13.510  -2.414
  341    HB3  PRO  61           HB2      PRO  61  -7.872  15.053  -2.245
  342    HG2  PRO  61           HG1      PRO  61 -10.660  14.495  -3.198
  343    HG3  PRO  61           HG2      PRO  61 -10.080  15.749  -2.039
  344    HD2  PRO  61           HD1      PRO  61 -10.672  16.308  -4.629
  345    HD3  PRO  61           HD2      PRO  61  -9.383  17.140  -3.740
  346    H    PHE  62           H        PHE  62  -6.600  12.369  -4.630
  347    HA   PHE  62           HA       PHE  62  -8.678  10.476  -5.161
  348    HB2  PHE  62           HB1      PHE  62  -8.187   9.973  -7.456
  349    HB3  PHE  62           HB2      PHE  62  -8.521  11.702  -7.339
  350    HD1  PHE  62           HD1      PHE  62  -6.404  13.225  -6.956
  351    HD2  PHE  62           HD2      PHE  62  -6.321   9.318  -8.646
  352    HE1  PHE  62           HE1      PHE  62  -4.252  13.739  -8.032
  353    HE2  PHE  62           HE2      PHE  62  -4.168   9.826  -9.722
  354    HZ   PHE  62           HZ       PHE  62  -3.130  12.039  -9.416
  355    H    CYS  63           H        CYS  63  -7.563   8.372  -6.110
  356    HA   CYS  63           HA       CYS  63  -5.342   7.827  -4.310
  357    HB2  CYS  63           HB1      CYS  63  -7.162   6.087  -5.973
  358    HB3  CYS  63           HB2      CYS  63  -5.736   5.436  -5.163
  359    H    ALA  64           H        ALA  64  -3.320   7.165  -4.933
  360    HA   ALA  64           HA       ALA  64  -2.738   6.979  -7.798
  361    HB1  ALA  64           HB1      ALA  64  -0.559   8.358  -6.726
  362    HB2  ALA  64           HB2      ALA  64  -1.776   8.979  -7.842
  363    HB3  ALA  64           HB3      ALA  64  -1.990   9.179  -6.102
  364    H    THR  65           H        THR  65  -0.812   5.843  -8.303
  365    HA   THR  65           HA       THR  65  -0.099   3.880  -6.280
  366    HB   THR  65           HB       THR  65   1.350   3.049  -8.341
  367    HG1  THR  65           HG1      THR  65  -0.775   4.290  -9.731
  368   HG21  THR  65          HG21      THR  65  -1.406   2.491  -9.006
  369   HG22  THR  65          HG22      THR  65  -1.146   2.414  -7.263
  370   HG23  THR  65          HG23      THR  65  -0.173   1.418  -8.345
  371    H    CYS  66           H        CYS  66   2.177   3.253  -5.981
  372    HA   CYS  66           HA       CYS  66   3.762   5.423  -5.187
  373    HB2  CYS  66           HB1      CYS  66   5.570   3.739  -4.896
  374    HB3  CYS  66           HB2      CYS  66   4.044   3.267  -4.146
  375    H    ARG  67           H        ARG  67   6.171   5.531  -5.938
  376    HA   ARG  67           HA       ARG  67   6.111   5.924  -8.849
  377    HB2  ARG  67           HB1      ARG  67   8.133   7.080  -6.933
  378    HB3  ARG  67           HB2      ARG  67   7.757   7.611  -8.579
  379    HG2  ARG  67           HG1      ARG  67   5.366   8.034  -7.546
  380    HG3  ARG  67           HG2      ARG  67   6.301   8.127  -6.043
  381    HD2  ARG  67           HD1      ARG  67   7.729   9.861  -7.001
  382    HD3  ARG  67           HD2      ARG  67   6.850   9.739  -8.532
  383    HE   ARG  67           HE       ARG  67   5.131  10.337  -6.324
  384   HH11  ARG  67          HH11      ARG  67   7.331  11.703  -8.650
  385   HH12  ARG  67          HH12      ARG  67   6.617  13.281  -8.594
  386   HH21  ARG  67          HH21      ARG  67   4.180  12.409  -6.242
  387   HH22  ARG  67          HH22      ARG  67   4.825  13.681  -7.224
  388    H    GLY  68           H        GLY  68   8.758   6.063  -9.450
  389    HA2  GLY  68           HA2      GLY  68   9.560   3.259  -9.133
  390    HA3  GLY  68           HA3      GLY  68  10.134   4.362 -10.376
  391    HA1  GLY  68           HA1      GLY  68   9.515   3.783  -8.426
  392    H    LEU  69           H        LEU  69  12.166   3.200  -9.518
  393    HA   LEU  69           HA       LEU  69  13.221   4.117  -7.018
  394    HB2  LEU  69           HB1      LEU  69  14.200   2.478  -9.304
  395    HB3  LEU  69           HB2      LEU  69  15.402   3.207  -8.222
  396    HG   LEU  69           HG       LEU  69  13.206   1.312  -7.385
  397   HD11  LEU  69          HD11      LEU  69  15.182   0.436  -8.771
  398   HD12  LEU  69          HD12      LEU  69  14.806  -0.373  -7.251
  399   HD13  LEU  69          HD13      LEU  69  16.152   0.764  -7.336
  400   HD21  LEU  69          HD21      LEU  69  15.248   2.891  -5.889
  401   HD22  LEU  69          HD22      LEU  69  14.788   1.294  -5.299
  402   HD23  LEU  69          HD23      LEU  69  13.565   2.552  -5.483
  403    H    ARG  70           H        ARG  70  13.241   5.259 -10.284
  404    HA   ARG  70           HA       ARG  70  15.390   7.162  -9.736
  405    HB2  ARG  70           HB1      ARG  70  13.851   6.486 -12.251
  406    HB3  ARG  70           HB2      ARG  70  15.057   7.779 -12.158
  407    HG2  ARG  70           HG1      ARG  70  16.080   5.254 -11.140
  408    HG3  ARG  70           HG2      ARG  70  15.531   5.146 -12.821
  409    HD2  ARG  70           HD1      ARG  70  17.055   6.730 -13.574
  410    HD3  ARG  70           HD2      ARG  70  17.247   7.437 -11.963
  411    HE   ARG  70           HE       ARG  70  18.918   5.936 -11.553
  412   HH11  ARG  70          HH11      ARG  70  17.012   4.788 -14.229
  413   HH12  ARG  70          HH12      ARG  70  18.069   3.461 -14.582
  414   HH21  ARG  70          HH21      ARG  70  20.318   4.194 -12.007
  415   HH22  ARG  70          HH22      ARG  70  19.949   3.123 -13.316
  416    H    ARG  71           H        ARG  71  12.410   7.124  -8.784
  417    HA   ARG  71           HA       ARG  71  11.714   9.846  -9.650
  418    HB2  ARG  71           HB1      ARG  71  10.075   7.590  -8.499
  419    HB3  ARG  71           HB2      ARG  71   9.467   9.250  -8.583
  420    HG2  ARG  71           HG1      ARG  71  10.444   7.720 -10.989
  421    HG3  ARG  71           HG2      ARG  71   8.755   7.757 -10.460
  422    HD2  ARG  71           HD1      ARG  71   8.451   9.948 -11.063
  423    HD3  ARG  71           HD2      ARG  71  10.152  10.355 -10.798
  424    HE   ARG  71           HE       ARG  71  10.544   9.905 -12.998
  425   HH11  ARG  71          HH11      ARG  71   7.599   8.311 -12.046
  426   HH12  ARG  71          HH12      ARG  71   7.224   7.764 -13.647
  427   HH21  ARG  71          HH21      ARG  71  10.062   9.191 -15.109
  428   HH22  ARG  71          HH22      ARG  71   8.626   8.265 -15.389
  429    H    ARG  72           H        ARG  72  11.257  11.455  -8.152
  430    HA   ARG  72           HA       ARG  72  12.687  11.269  -5.681
  431    HB2  ARG  72           HB1      ARG  72  11.819  13.593  -5.314
  432    HB3  ARG  72           HB2      ARG  72  12.717  13.368  -6.823
  433    HG2  ARG  72           HG1      ARG  72   9.821  12.949  -7.072
  434    HG3  ARG  72           HG2      ARG  72  10.302  14.594  -6.619
  435    HD2  ARG  72           HD1      ARG  72  12.098  14.079  -8.591
  436    HD3  ARG  72           HD2      ARG  72  10.710  13.130  -9.140
  437    HE   ARG  72           HE       ARG  72   9.677  15.584  -8.484
  438   HH11  ARG  72          HH11      ARG  72  12.136  14.405 -10.648
  439   HH12  ARG  72          HH12      ARG  72  11.913  15.676 -11.803
  440   HH21  ARG  72          HH21      ARG  72   9.373  17.262  -9.999
  441   HH22  ARG  72          HH22      ARG  72  10.341  17.302 -11.433
  442    H    CYS  73           H        CYS  73  11.777  11.726  -3.569
  443    HA   CYS  73           HA       CYS  73   8.932  11.365  -3.195
  444    HB2  CYS  73           HB1      CYS  73   9.180   9.407  -1.713
  445    HB3  CYS  73           HB2      CYS  73   9.638   9.047  -3.377
  446    H    GLN  74           H        GLN  74   8.325  11.522  -0.878
  447    HA   GLN  74           HA       GLN  74  10.275  13.170   0.593
  448    HB2  GLN  74           HB1      GLN  74   7.635  13.776  -0.254
  449    HB3  GLN  74           HB2      GLN  74   7.599  13.618   1.509
  450    HG2  GLN  74           HG1      GLN  74   8.240  15.750   1.554
  451    HG3  GLN  74           HG2      GLN  74   9.840  15.128   1.120
  452   HE21  GLN  74          HE21      GLN  74  10.384  15.042  -1.157
  453   HE22  GLN  74          HE22      GLN  74   9.712  16.215  -2.232
  454    H    ARG  75           H        ARG  75   8.088  10.491   0.699
  455    HA   ARG  75           HA       ARG  75   8.916   9.971   3.475
  456    HB2  ARG  75           HB1      ARG  75   6.358  10.612   2.764
  457    HB3  ARG  75           HB2      ARG  75   6.321   8.844   2.667
  458    HG2  ARG  75           HG1      ARG  75   7.555   9.140   5.043
  459    HG3  ARG  75           HG2      ARG  75   6.554  10.602   5.015
  460    HD2  ARG  75           HD1      ARG  75   4.707   9.436   5.462
  461    HD3  ARG  75           HD2      ARG  75   5.028   8.341   4.109
  462    HE   ARG  75           HE       ARG  75   6.720   7.619   6.206
  463   HH11  ARG  75          HH11      ARG  75   3.318   7.689   5.473
  464   HH12  ARG  75          HH12      ARG  75   2.936   6.345   6.498
  465   HH21  ARG  75          HH21      ARG  75   6.231   5.849   7.558
  466   HH22  ARG  75          HH22      ARG  75   4.594   5.300   7.684
  467    H    ASP  76           H        ASP  76   8.558   7.601   4.056
  468    HA   ASP  76           HA       ASP  76   9.900   6.006   2.068
  469    HB2  ASP  76           HB1      ASP  76   8.815   4.886   4.635
  470    HB3  ASP  76           HB2      ASP  76  10.294   4.459   3.764
  471    HD2  ASP  76           HD       ASP  76  10.482   7.232   6.506
  472    H    ALA  77           H        ALA  77   6.853   5.638   3.888
  473    HA   ALA  77           HA       ALA  77   5.892   3.446   2.423
  474    HB1  ALA  77           HB1      ALA  77   5.077   4.703   4.657
  475    HB2  ALA  77           HB2      ALA  77   3.884   5.312   3.510
  476    HB3  ALA  77           HB3      ALA  77   4.071   3.575   3.749
  477    H    MET  78           H        MET  78   5.956   6.830   1.710
  478    HA   MET  78           HA       MET  78   3.834   7.082  -0.068
  479    HB2  MET  78           HB1      MET  78   6.440   8.464   0.327
  480    HB3  MET  78           HB2      MET  78   5.594   8.748  -1.203
  481    HG2  MET  78           HG1      MET  78   3.561   9.377   0.129
  482    HG3  MET  78           HG2      MET  78   4.576   9.294   1.572
  483    HE1  MET  78           HE1      MET  78   3.965  10.927  -1.834
  484    HE2  MET  78           HE2      MET  78   5.018  12.341  -1.847
  485    HE3  MET  78           HE3      MET  78   5.706  10.728  -2.037
  486    H    CYS  79           H        CYS  79   6.866   5.452  -0.429
  487    HA   CYS  79           HA       CYS  79   6.477   5.166  -3.319
  488    HB2  CYS  79           HB1      CYS  79   8.749   5.579  -1.833
  489    HB3  CYS  79           HB2      CYS  79   8.796   3.835  -2.095
  490    H    CYS  80           H        CYS  80   7.471   2.794  -3.946
  491    HA   CYS  80           HA       CYS  80   5.408   0.984  -3.217
  492    HB2  CYS  80           HB1      CYS  80   8.013   0.268  -4.572
  493    HB3  CYS  80           HB2      CYS  80   6.466  -0.572  -4.696
  494    HA   PRO  81           HA       PRO  81   7.057  -1.041   0.311
  495    HB2  PRO  81           HB1      PRO  81   6.086  -3.577  -0.036
  496    HB3  PRO  81           HB2      PRO  81   5.078  -2.204   0.416
  497    HG2  PRO  81           HG1      PRO  81   5.538  -3.416  -2.289
  498    HG3  PRO  81           HG2      PRO  81   3.992  -2.901  -1.519
  499    HD2  PRO  81           HD1      PRO  81   5.272  -1.396  -3.381
  500    HD3  PRO  81           HD2      PRO  81   4.354  -0.686  -2.043
  501    H    GLY  82           H        GLY  82   9.160  -1.467   0.554
  502    HA2  GLY  82           HA2      GLY  82  10.719  -3.432   0.458
  503    HA3  GLY  82           HA3      GLY  82  10.399  -3.436  -1.270
  504    HA1  GLY  82           HA1      GLY  82  10.632  -2.579   0.660
  505    H    THR  83           H        THR  83  10.364  -0.313  -0.784
  506    HA   THR  83           HA       THR  83  13.285  -0.024  -1.056
  507    HB   THR  83           HB       THR  83  12.601   2.145  -2.316
  508    HG1  THR  83           HG1      THR  83  10.317   0.673  -3.038
  509   HG21  THR  83          HG21      THR  83  12.705  -0.657  -3.241
  510   HG22  THR  83          HG22      THR  83  13.650   0.742  -3.750
  511   HG23  THR  83          HG23      THR  83  12.021   0.503  -4.378
  512    H    LEU  84           H        LEU  84  14.046   2.253  -0.545
  513    HA   LEU  84           HA       LEU  84  12.535   3.392   1.708
  514    HB2  LEU  84           HB1      LEU  84  14.645   1.898   2.206
  515    HB3  LEU  84           HB2      LEU  84  15.516   3.373   1.755
  516    HG   LEU  84           HG       LEU  84  13.400   3.806   3.734
  517   HD11  LEU  84          HD11      LEU  84  14.493   2.766   5.581
  518   HD12  LEU  84          HD12      LEU  84  15.830   2.232   4.562
  519   HD13  LEU  84          HD13      LEU  84  14.227   1.530   4.349
  520   HD21  LEU  84          HD21      LEU  84  15.559   5.172   2.835
  521   HD22  LEU  84          HD22      LEU  84  16.209   4.452   4.308
  522   HD23  LEU  84          HD23      LEU  84  14.769   5.468   4.384
  523    H    CYS  85           H        CYS  85  12.366   5.559   1.724
  524    HA   CYS  85           HA       CYS  85  13.203   7.037  -0.565
  525    HB2  CYS  85           HB1      CYS  85  11.114   7.382   0.913
  526    HB3  CYS  85           HB2      CYS  85  12.196   8.268   1.990
  527    H    VAL  86           H        VAL  86  15.388   7.206  -0.749
  528    HA   VAL  86           HA       VAL  86  16.811   8.528   1.471
  529    HB   VAL  86           HB       VAL  86  17.974   6.703  -0.638
  530   HG11  VAL  86          HG11      VAL  86  19.565   8.397   0.009
  531   HG12  VAL  86          HG12      VAL  86  19.251   8.088   1.718
  532   HG13  VAL  86          HG13      VAL  86  20.032   6.855   0.726
  533   HG21  VAL  86          HG21      VAL  86  16.735   5.369   0.883
  534   HG22  VAL  86          HG22      VAL  86  18.428   5.231   1.358
  535   HG23  VAL  86          HG23      VAL  86  17.338   6.272   2.272
  536    H    ASN  87           H        ASN  87  18.056  10.303   1.040
  537    HA   ASN  87           HA       ASN  87  18.664  12.225  -0.019
  538    HB2  ASN  87           HB1      ASN  87  19.826  10.158  -1.358
  539    HB3  ASN  87           HB2      ASN  87  18.937  10.945  -2.667
  540   HD21  ASN  87          HD21      ASN  87  21.736  10.799  -2.505
  541   HD22  ASN  87          HD22      ASN  87  22.351  12.406  -2.346
  542    H    ASP  88           H        ASP  88  15.867  11.651   0.066
  543    HA   ASP  88           HA       ASP  88  13.905  12.488  -0.725
  544    HB2  ASP  88           HB1      ASP  88  15.498  14.534  -0.974
  545    HB3  ASP  88           HB2      ASP  88  15.415  14.169  -2.703
  546    HD2  ASP  88           HD       ASP  88  12.309  15.576  -2.986
  547    H    VAL  89           H        VAL  89  15.325  10.211  -2.040
  548    HA   VAL  89           HA       VAL  89  13.609  10.089  -4.399
  549    HB   VAL  89           HB       VAL  89  16.562   9.458  -4.521
  550   HG11  VAL  89          HG11      VAL  89  14.451   9.307  -6.672
  551   HG12  VAL  89          HG12      VAL  89  16.173   8.970  -6.872
  552   HG13  VAL  89          HG13      VAL  89  15.181   7.927  -5.852
  553   HG21  VAL  89          HG21      VAL  89  16.730  11.317  -6.061
  554   HG22  VAL  89          HG22      VAL  89  14.999  11.625  -5.925
  555   HG23  VAL  89          HG23      VAL  89  16.051  11.875  -4.532
  556    H    CYS  90           H        CYS  90  12.901   8.044  -4.905
  557    HA   CYS  90           HA       CYS  90  12.863   6.122  -2.858
  558    HB2  CYS  90           HB1      CYS  90  11.302   6.540  -4.965
  559    HB3  CYS  90           HB2      CYS  90  12.340   5.307  -5.683
  560    H    THR  91           H        THR  91  14.662   5.129  -2.191
  561    HA   THR  91           HA       THR  91  16.375   3.867  -4.233
  562    HB   THR  91           HB       THR  91  17.256   4.928  -1.541
  563    HG1  THR  91           HG1      THR  91  18.172   6.583  -2.690
  564   HG21  THR  91          HG21      THR  91  18.490   2.922  -2.328
  565   HG22  THR  91          HG22      THR  91  19.500   4.366  -2.247
  566   HG23  THR  91          HG23      THR  91  18.902   3.795  -3.804
  567    H    THR  92           H        THR  92  16.435   1.724  -4.148
  568    HA   THR  92           HA       THR  92  14.987   0.163  -2.379
  569    HB   THR  92           HB       THR  92  17.066  -1.504  -3.186
  570    HG1  THR  92           HG1      THR  92  18.021  -0.135  -4.585
  571   HG21  THR  92          HG21      THR  92  15.456  -2.503  -4.537
  572   HG22  THR  92          HG22      THR  92  14.690  -0.964  -4.932
  573   HG23  THR  92          HG23      THR  92  14.482  -1.667  -3.329
  574    H    MET  93           H        MET  93  15.748  -1.419  -0.796
  575    HA   MET  93           HA       MET  93  17.432  -0.193   1.156
  576    HB2  MET  93           HB1      MET  93  15.536  -2.342   1.049
  577    HB3  MET  93           HB2      MET  93  17.022  -2.916   1.819
  578    HG2  MET  93           HG1      MET  93  16.033  -0.290   2.742
  579    HG3  MET  93           HG2      MET  93  15.030  -1.688   3.136
  580    HE1  MET  93           HE1      MET  93  16.498  -1.143   6.453
  581    HE2  MET  93           HE2      MET  93  15.129  -1.105   5.342
  582    HE3  MET  93           HE3      MET  93  15.721  -2.648   5.961
  583    H    GLU  94           H        GLU  94  17.876  -2.577  -1.332
  584    HA   GLU  94           HA       GLU  94  20.288  -3.700  -0.308
  585    HB2  GLU  94           HB1      GLU  94  18.895  -3.739  -2.970
  586    HB3  GLU  94           HB2      GLU  94  20.534  -4.389  -2.808
  587    HG2  GLU  94           HG1      GLU  94  19.873  -6.152  -1.499
  588    HG3  GLU  94           HG2      GLU  94  18.437  -5.305  -0.907
  589    HE2  GLU  94           HE       GLU  94  16.517  -6.866  -3.260
  590    H    ASP  95           H        ASP  95  19.507  -0.879  -2.160
  591    HA   ASP  95           HA       ASP  95  22.233  -0.449  -3.044
  592    HB2  ASP  95           HB1      ASP  95  19.634   1.029  -3.376
  593    HB3  ASP  95           HB2      ASP  95  21.168   1.824  -3.755
  594    HD2  ASP  95           HD       ASP  95  20.896  -1.379  -5.988
  595    H    ALA  96           H        ALA  96  19.938   1.171  -0.858
  596    HA   ALA  96           HA       ALA  96  21.641   3.166   0.078
  597    HB1  ALA  96           HB1      ALA  96  19.125   2.867   0.456
  598    HB2  ALA  96           HB2      ALA  96  19.586   1.860   1.828
  599    HB3  ALA  96           HB3      ALA  96  20.079   3.552   1.771
  600    H    THR  97           H        THR  97  23.563   2.929   0.999
  601    HA   THR  97           HA       THR  97  23.862   1.008   3.185
  602    HB   THR  97           HB       THR  97  25.992   1.233   1.063
  603    HG1  THR  97           HG1      THR  97  25.016  -0.298  -0.051
  604   HG21  THR  97          HG21      THR  97  26.323  -1.174   2.202
  605   HG22  THR  97          HG22      THR  97  25.596  -0.311   3.558
  606   HG23  THR  97          HG23      THR  97  27.080   0.292   2.821
  607    H    GLU  98           H        GLU  98  25.956   3.211   1.313
  608    HA   GLU  98           HA       GLU  98  26.247   4.964   3.598
  609    HB2  GLU  98           HB1      GLU  98  28.021   2.869   3.398
  610    HB3  GLU  98           HB2      GLU  98  28.882   4.184   2.584
  611    HG2  GLU  98           HG1      GLU  98  27.668   4.460   5.327
  612    HG3  GLU  98           HG2      GLU  98  29.334   3.937   5.041
  613    HE2  GLU  98           HE       GLU  98  30.313   7.153   4.077
  614    H    ASN  99           H        ASN  99  25.294   5.089   0.814
  615    HA   ASN  99           HA       ASN  99  25.356   6.494  -0.972
  616    HB2  ASN  99           HB1      ASN  99  25.507   8.107   1.053
  617    HB3  ASN  99           HB2      ASN  99  27.201   8.290   0.583
  618   HD21  ASN  99          HD21      ASN  99  24.977  10.213   0.569
  619   HD22  ASN  99          HD22      ASN  99  24.899  10.819  -1.048
  620    H    LEU 100           H        LEU 100  26.739   4.649  -1.824
  621    HA   LEU 100           HA       LEU 100  29.557   5.121  -2.088
  622    HB2  LEU 100           HB1      LEU 100  27.728   2.983  -2.573
  623    HB3  LEU 100           HB2      LEU 100  28.646   3.294  -4.056
  624    HG   LEU 100           HG       LEU 100  30.684   3.219  -2.338
  625   HD11  LEU 100          HD11      LEU 100  28.724   2.648  -0.596
  626   HD12  LEU 100          HD12      LEU 100  30.372   2.045  -0.437
  627   HD13  LEU 100          HD13      LEU 100  29.124   1.020  -1.143
  628   HD21  LEU 100          HD21      LEU 100  30.274   1.839  -4.386
  629   HD22  LEU 100          HD22      LEU 100  29.380   0.707  -3.371
  630   HD23  LEU 100          HD23      LEU 100  31.096   0.991  -3.076
  631    H    TYR 101           H        TYR 101  30.691   5.601  -4.011
  632    HA   TYR 101           HA       TYR 101  29.521   6.190  -6.484
  633    HB2  TYR 101           HB1      TYR 101  28.781   8.102  -4.693
  634    HB3  TYR 101           HB2      TYR 101  30.267   8.806  -5.334
  635    HD1  TYR 101           HD1      TYR 101  30.480   9.286  -7.765
  636    HD2  TYR 101           HD2      TYR 101  26.801   8.026  -6.038
  637    HE1  TYR 101           HE1      TYR 101  29.277  10.085  -9.757
  638    HE2  TYR 101           HE2      TYR 101  25.589   8.821  -8.025
  639    HH   TYR 101           HH       TYR 101  26.337  10.826  -9.955
  640    H    PHE 102           H        PHE 102  31.048   6.711  -8.029
  641    HA   PHE 102           HA       PHE 102  33.723   7.483  -7.220
  642    HB2  PHE 102           HB1      PHE 102  34.856   5.588  -8.143
  643    HB3  PHE 102           HB2      PHE 102  33.644   4.983  -7.012
  644    HD1  PHE 102           HD1      PHE 102  31.520   4.007  -7.862
  645    HD2  PHE 102           HD2      PHE 102  34.759   5.000 -10.439
  646    HE1  PHE 102           HE1      PHE 102  30.562   2.569  -9.614
  647    HE2  PHE 102           HE2      PHE 102  33.805   3.565 -12.195
  648    HZ   PHE 102           HZ       PHE 102  31.704   2.348 -11.784
  649    H    GLN 103           H        GLN 103  34.696   8.699  -8.735
  650    HA   GLN 103           HA       GLN 103  34.203   8.414 -11.531
  651    HB2  GLN 103           HB1      GLN 103  33.303  10.794 -11.770
  652    HB3  GLN 103           HB2      GLN 103  32.174   9.555 -11.195
  653    HG2  GLN 103           HG1      GLN 103  32.144  10.376  -9.031
  654    HG3  GLN 103           HG2      GLN 103  33.681  11.229  -9.236
  655   HE21  GLN 103          HE21      GLN 103  33.301  13.312  -8.998
  656   HE22  GLN 103          HE22      GLN 103  32.032  14.205  -9.757
  657    H    SER 104           H        SER 104  36.420   8.566  -9.630
  658    HA   SER 104           HA       SER 104  37.808  10.944 -10.682
  659    HB2  SER 104           HB1      SER 104  38.804   9.463  -8.270
  660    HB3  SER 104           HB2      SER 104  38.981  11.173  -8.694
  661    HG   SER 104           HG       SER 104  36.762   9.845  -7.581
  662    H    LEU 105           H        LEU 105  39.631  10.672 -11.832
  663    HA   LEU 105           HA       LEU 105  41.370   8.462 -11.628
  664    HB2  LEU 105           HB1      LEU 105  39.320   7.447 -12.744
  665    HB3  LEU 105           HB2      LEU 105  39.733   8.446 -14.149
  666    HG   LEU 105           HG       LEU 105  42.082   7.067 -13.521
  667   HD11  LEU 105          HD11      LEU 105  41.614   4.939 -12.958
  668   HD12  LEU 105          HD12      LEU 105  40.094   4.922 -13.851
  669   HD13  LEU 105          HD13      LEU 105  40.167   5.658 -12.251
  670   HD21  LEU 105          HD21      LEU 105  40.872   7.725 -15.733
  671   HD22  LEU 105          HD22      LEU 105  40.169   6.112 -15.607
  672   HD23  LEU 105          HD23      LEU 105  41.921   6.306 -15.692
  673    H    GLU 106           H        GLU 106  43.251   9.375 -12.088
  674    HA   GLU 106           HA       GLU 106  43.478  11.046 -14.483
  675    HB2  GLU 106           HB1      GLU 106  43.958  11.869 -11.673
  676    HB3  GLU 106           HB2      GLU 106  45.161  12.386 -12.865
  677    HG2  GLU 106           HG1      GLU 106  43.666  13.715 -14.019
  678    HG3  GLU 106           HG2      GLU 106  42.263  12.830 -13.407
  679    HE2  GLU 106           HE       GLU 106  42.888  14.573 -10.227
  680    H    HIS 107           H        HIS 107  45.607  10.124 -11.777
  681    HA   HIS 107           HA       HIS 107  47.614   9.055 -11.714
  682    HB2  HIS 107           HB1      HIS 107  46.123   7.718 -13.879
  683    HB3  HIS 107           HB2      HIS 107  47.876   7.522 -13.963
  684    HD1  HIS 107           HD1      HIS 107  48.942   5.876 -12.396
  685    HD2  HIS 107           HD2      HIS 107  44.991   6.694 -11.407
  686    HE1  HIS 107           HE1      HIS 107  48.348   4.232 -10.589
  687    HE2  HIS 107           HE2      HIS 107  45.933   4.731  -9.983
  688    H    HIS 108           H        HIS 108  49.665   8.605 -13.161
  689    HA   HIS 108           HA       HIS 108  50.023  10.795 -15.082
  690    HB2  HIS 108           HB1      HIS 108  51.212  10.592 -12.452
  691    HB3  HIS 108           HB2      HIS 108  52.462  10.580 -13.701
  692    HD1  HIS 108           HD1      HIS 108  50.637  12.881 -11.704
  693    HD2  HIS 108           HD2      HIS 108  51.970  12.861 -15.639
  694    HE1  HIS 108           HE1      HIS 108  50.638  15.290 -12.426
  695    HE2  HIS 108           HE2      HIS 108  51.452  15.279 -14.831
  696    H    HIS 109           H        HIS 109  52.068  10.550 -16.347
  697    HA   HIS 109           HA       HIS 109  53.373   8.015 -16.433
  698    HB2  HIS 109           HB1      HIS 109  52.578   7.274 -18.620
  699    HB3  HIS 109           HB2      HIS 109  51.241   7.369 -17.469
  700    HD1  HIS 109           HD1      HIS 109  52.374   8.681 -20.711
  701    HD2  HIS 109           HD2      HIS 109  49.473   9.602 -17.883
  702    HE1  HIS 109           HE1      HIS 109  50.770  10.229 -21.874
  703    HE2  HIS 109           HE2      HIS 109  48.996  10.794 -20.145
  704    H    HIS 110           H        HIS 110  54.689   7.863 -18.586
  705    HA   HIS 110           HA       HIS 110  55.354  10.399 -19.783
  706    HB2  HIS 110           HB1      HIS 110  57.109   9.094 -17.736
  707    HB3  HIS 110           HB2      HIS 110  57.856   9.954 -19.087
  708    HD1  HIS 110           HD1      HIS 110  56.110  12.411 -19.336
  709    HD2  HIS 110           HD2      HIS 110  57.342  10.864 -15.682
  710    HE1  HIS 110           HE1      HIS 110  55.976  14.328 -17.715
  711    HE2  HIS 110           HE2      HIS 110  56.728  13.386 -15.481
  712    H    HIS 111           H        HIS 111  56.917  10.190 -21.522
  713    HA   HIS 111           HA       HIS 111  57.980   7.700 -22.329
  714    HB2  HIS 111           HB1      HIS 111  56.556   7.135 -24.185
  715    HB3  HIS 111           HB2      HIS 111  55.561   7.240 -22.730
  716    HD1  HIS 111           HD1      HIS 111  54.907   7.818 -25.948
  717    HD2  HIS 111           HD2      HIS 111  54.940  10.450 -22.734
  718    HE1  HIS 111           HE1      HIS 111  53.436   9.738 -26.637
  719    HE2  HIS 111           HE2      HIS 111  53.455  11.348 -24.672
  720    H    HIS 112           H        HIS 112  58.778   7.801 -24.646
  721    HA   HIS 112           HA       HIS 112  60.163   8.838 -26.131
  722    HB2  HIS 112           HB1      HIS 112  57.787   9.657 -26.746
  723    HB3  HIS 112           HB2      HIS 112  58.290  11.192 -26.031
  724    HD1  HIS 112           HD1      HIS 112  57.683  11.573 -28.823
  725    HD2  HIS 112           HD2      HIS 112  61.387  10.083 -27.675
  726    HE1  HIS 112           HE1      HIS 112  59.220  12.028 -30.760
  727    HE2  HIS 112           HE2      HIS 112  61.485  11.117 -30.059
  Start of MODEL   67
    1    H1   MET  18           H        MET  18 -67.200  -3.486 -18.694
    2    HA   MET  18           HA       MET  18 -68.328  -2.542 -16.359
    3    HB2  MET  18           HB1      MET  18 -66.224  -4.266 -17.064
    4    HB3  MET  18           HB2      MET  18 -65.520  -3.080 -15.954
    5    HG2  MET  18           HG1      MET  18 -66.541  -3.956 -14.177
    6    HG3  MET  18           HG2      MET  18 -68.085  -4.062 -15.027
    7    HE1  MET  18           HE1      MET  18 -68.777  -7.150 -14.356
    8    HE2  MET  18           HE2      MET  18 -69.191  -5.738 -15.328
    9    HE3  MET  18           HE3      MET  18 -68.716  -7.243 -16.117
   10    H    LEU  19           H        LEU  19 -65.199  -1.498 -17.726
   11    HA   LEU  19           HA       LEU  19 -65.293   0.892 -16.052
   12    HB2  LEU  19           HB1      LEU  19 -63.243  -0.745 -16.625
   13    HB3  LEU  19           HB2      LEU  19 -63.052   0.437 -17.931
   14    HG   LEU  19           HG       LEU  19 -63.128   2.193 -16.019
   15   HD11  LEU  19          HD11      LEU  19 -62.648   1.526 -13.869
   16   HD12  LEU  19          HD12      LEU  19 -62.003  -0.033 -14.381
   17   HD13  LEU  19          HD13      LEU  19 -63.744   0.249 -14.396
   18   HD21  LEU  19          HD21      LEU  19 -61.138   2.111 -17.159
   19   HD22  LEU  19          HD22      LEU  19 -60.890   0.396 -16.828
   20   HD23  LEU  19          HD23      LEU  19 -60.621   1.589 -15.555
   21    H    VAL  20           H        VAL  20 -65.055   3.001 -16.910
   22    HA   VAL  20           HA       VAL  20 -65.983   3.244 -19.697
   23    HB   VAL  20           HB       VAL  20 -67.587   4.090 -18.032
   24   HG11  VAL  20          HG11      VAL  20 -67.072   6.047 -16.687
   25   HG12  VAL  20          HG12      VAL  20 -65.961   4.730 -16.305
   26   HG13  VAL  20          HG13      VAL  20 -65.425   6.070 -17.319
   27   HG21  VAL  20          HG21      VAL  20 -68.212   5.815 -19.351
   28   HG22  VAL  20          HG22      VAL  20 -66.636   6.600 -19.258
   29   HG23  VAL  20          HG23      VAL  20 -66.883   5.246 -20.362
   30    H    LEU  21           H        LEU  21 -64.968   4.640 -21.085
   31    HA   LEU  21           HA       LEU  21 -62.260   5.355 -20.424
   32    HB2  LEU  21           HB1      LEU  21 -63.548   4.648 -22.733
   33    HB3  LEU  21           HB2      LEU  21 -63.377   6.401 -22.922
   34    HG   LEU  21           HG       LEU  21 -61.104   4.479 -22.424
   35   HD11  LEU  21          HD11      LEU  21 -60.696   4.397 -24.655
   36   HD12  LEU  21          HD12      LEU  21 -61.402   5.984 -24.959
   37   HD13  LEU  21          HD13      LEU  21 -62.449   4.588 -24.713
   38   HD21  LEU  21          HD21      LEU  21 -61.334   7.348 -22.240
   39   HD22  LEU  21          HD22      LEU  21 -60.177   6.884 -23.488
   40   HD23  LEU  21          HD23      LEU  21 -59.974   6.300 -21.835
   41    H    ASP  22           H        ASP  22 -61.534   7.264 -19.749
   42    HA   ASP  22           HA       ASP  22 -63.076   9.685 -20.283
   43    HB2  ASP  22           HB1      ASP  22 -62.605  10.329 -17.799
   44    HB3  ASP  22           HB2      ASP  22 -63.988   9.296 -18.182
   45    HD2  ASP  22           HD       ASP  22 -62.698   6.650 -16.416
   46    H    PHE  23           H        PHE  23 -60.197   8.412 -18.615
   47    HA   PHE  23           HA       PHE  23 -58.452  10.057 -20.180
   48    HB2  PHE  23           HB1      PHE  23 -57.487  11.316 -18.272
   49    HB3  PHE  23           HB2      PHE  23 -59.159  11.761 -18.611
   50    HD1  PHE  23           HD1      PHE  23 -57.057   9.722 -16.348
   51    HD2  PHE  23           HD2      PHE  23 -60.826  11.597 -16.978
   52    HE1  PHE  23           HE1      PHE  23 -57.673   9.259 -14.011
   53    HE2  PHE  23           HE2      PHE  23 -61.448  11.137 -14.641
   54    HZ   PHE  23           HZ       PHE  23 -59.871   9.969 -13.155
   55    H    ASN  24           H        ASN  24 -56.295   9.434 -20.025
   56    HA   ASN  24           HA       ASN  24 -55.632   7.326 -18.105
   57    HB2  ASN  24           HB1      ASN  24 -56.422   6.368 -20.345
   58    HB3  ASN  24           HB2      ASN  24 -54.935   7.040 -21.025
   59   HD21  ASN  24          HD21      ASN  24 -54.218   4.960 -21.558
   60   HD22  ASN  24          HD22      ASN  24 -53.585   3.889 -20.359
   61    H    ASN  25           H        ASN  25 -54.836   9.984 -17.992
   62    HA   ASN  25           HA       ASN  25 -52.304  10.416 -19.214
   63    HB2  ASN  25           HB1      ASN  25 -53.812  11.751 -16.973
   64    HB3  ASN  25           HB2      ASN  25 -52.154  12.227 -17.366
   65   HD21  ASN  25          HD21      ASN  25 -53.871  14.169 -17.587
   66   HD22  ASN  25          HD22      ASN  25 -54.280  14.509 -19.231
   67    H    ILE  26           H        ILE  26 -50.370   9.671 -18.652
   68    HA   ILE  26           HA       ILE  26 -50.018   8.607 -15.925
   69    HB   ILE  26           HB       ILE  26 -48.327   7.038 -16.942
   70   HG12  ILE  26          HG11      ILE  26 -49.678   7.192 -19.558
   71   HG13  ILE  26          HG12      ILE  26 -48.626   8.567 -19.186
   72   HG21  ILE  26          HG21      ILE  26 -50.252   5.630 -18.062
   73   HG22  ILE  26          HG22      ILE  26 -50.229   5.929 -16.325
   74   HG23  ILE  26          HG23      ILE  26 -51.267   6.896 -17.374
   75   HD11  ILE  26          HD11      ILE  26 -47.008   6.525 -18.495
   76   HD12  ILE  26          HD12      ILE  26 -47.930   5.787 -19.805
   77   HD13  ILE  26          HD13      ILE  26 -47.034   7.279 -20.088
   78    H    ARG  27           H        ARG  27 -48.125   9.066 -14.862
   79    HA   ARG  27           HA       ARG  27 -46.283  10.916 -16.229
   80    HB2  ARG  27           HB1      ARG  27 -47.894  11.571 -14.139
   81    HB3  ARG  27           HB2      ARG  27 -46.430  11.055 -13.286
   82    HG2  ARG  27           HG1      ARG  27 -45.725  13.151 -13.567
   83    HG3  ARG  27           HG2      ARG  27 -45.413  12.669 -15.243
   84    HD2  ARG  27           HD1      ARG  27 -48.091  13.269 -15.313
   85    HD3  ARG  27           HD2      ARG  27 -47.464  14.448 -14.150
   86    HE   ARG  27           HE       ARG  27 -45.726  14.577 -16.254
   87   HH11  ARG  27          HH11      ARG  27 -49.168  14.926 -15.870
   88   HH12  ARG  27          HH12      ARG  27 -49.333  16.046 -17.181
   89   HH21  ARG  27          HH21      ARG  27 -45.928  16.051 -17.983
   90   HH22  ARG  27          HH22      ARG  27 -47.489  16.685 -18.382
   91    H    SER  28           H        SER  28 -44.325  10.095 -16.495
   92    HA   SER  28           HA       SER  28 -43.024   8.646 -14.355
   93    HB2  SER  28           HB1      SER  28 -43.569   7.342 -17.040
   94    HB3  SER  28           HB2      SER  28 -42.441   6.713 -15.826
   95    HG   SER  28           HG       SER  28 -45.249   6.992 -15.611
   96    H    SER  29           H        SER  29 -42.522  11.149 -15.528
   97    HA   SER  29           HA       SER  29 -40.080  10.666 -17.099
   98    HB2  SER  29           HB1      SER  29 -40.427  12.624 -18.231
   99    HB3  SER  29           HB2      SER  29 -42.109  12.276 -17.793
  100    HG   SER  29           HG       SER  29 -41.644  13.576 -15.844
  101    H    ALA  30           H        ALA  30 -38.132  11.277 -16.341
  102    HA   ALA  30           HA       ALA  30 -37.723  13.251 -14.350
  103    HB1  ALA  30           HB1      ALA  30 -37.037  11.870 -12.489
  104    HB2  ALA  30           HB2      ALA  30 -38.706  11.497 -12.921
  105    HB3  ALA  30           HB3      ALA  30 -37.405  10.407 -13.401
  106    H    ASP  31           H        ASP  31 -35.385  13.008 -13.424
  107    HA   ASP  31           HA       ASP  31 -33.511  11.540 -15.002
  108    HB2  ASP  31           HB1      ASP  31 -34.299  13.590 -16.422
  109    HB3  ASP  31           HB2      ASP  31 -33.250  14.510 -15.333
  110    HD2  ASP  31           HD       ASP  31 -30.806  11.959 -16.800
  111    H    LEU  32           H        LEU  32 -34.060  14.286 -12.844
  112    HA   LEU  32           HA       LEU  32 -33.070  14.869 -10.877
  113    HB2  LEU  32           HB1      LEU  32 -32.602  12.084 -11.103
  114    HB3  LEU  32           HB2      LEU  32 -31.091  12.835 -10.559
  115    HG   LEU  32           HG       LEU  32 -32.733  14.000  -8.825
  116   HD11  LEU  32          HD11      LEU  32 -34.562  12.479 -10.083
  117   HD12  LEU  32          HD12      LEU  32 -34.687  12.968  -8.394
  118   HD13  LEU  32          HD13      LEU  32 -34.060  11.372  -8.805
  119   HD21  LEU  32          HD21      LEU  32 -30.828  12.018  -8.747
  120   HD22  LEU  32          HD22      LEU  32 -32.223  11.261  -7.979
  121   HD23  LEU  32          HD23      LEU  32 -31.586  12.780  -7.349
  122    H    HIS  33           H        HIS  33 -30.420  13.159 -12.536
  123    HA   HIS  33           HA       HIS  33 -28.368  13.846 -13.235
  124    HB2  HIS  33           HB1      HIS  33 -30.083  15.518 -14.423
  125    HB3  HIS  33           HB2      HIS  33 -29.223  16.693 -13.424
  126    HD1  HIS  33           HD1      HIS  33 -28.736  14.424 -16.349
  127    HD2  HIS  33           HD2      HIS  33 -26.559  17.189 -14.142
  128    HE1  HIS  33           HE1      HIS  33 -26.658  14.869 -17.692
  129    HE2  HIS  33           HE2      HIS  33 -25.326  16.559 -16.345
  130    H    GLY  34           H        GLY  34 -28.928  13.832 -10.423
  131    HA2  GLY  34           HA2      GLY  34 -27.686  16.183  -9.283
  132    HA3  GLY  34           HA3      GLY  34 -28.223  14.756  -8.409
  133    HA1  GLY  34           HA1      GLY  34 -27.284  15.832  -9.984
  134    H    ALA  35           H        ALA  35 -25.618  16.461  -8.727
  135    HA   ALA  35           HA       ALA  35 -23.853  14.187  -8.376
  136    HB1  ALA  35           HB1      ALA  35 -22.180  15.262  -9.998
  137    HB2  ALA  35           HB2      ALA  35 -23.526  14.347 -10.680
  138    HB3  ALA  35           HB3      ALA  35 -23.578  16.109 -10.661
  139    H    ARG  36           H        ARG  36 -22.487  14.587  -6.760
  140    HA   ARG  36           HA       ARG  36 -21.648  17.347  -6.236
  141    HB2  ARG  36           HB1      ARG  36 -23.367  15.686  -4.548
  142    HB3  ARG  36           HB2      ARG  36 -21.938  16.295  -3.698
  143    HG2  ARG  36           HG1      ARG  36 -23.259  18.349  -5.295
  144    HG3  ARG  36           HG2      ARG  36 -24.303  17.645  -4.048
  145    HD2  ARG  36           HD1      ARG  36 -21.635  18.161  -3.026
  146    HD3  ARG  36           HD2      ARG  36 -22.375  19.621  -3.697
  147    HE   ARG  36           HE       ARG  36 -24.167  18.202  -1.985
  148   HH11  ARG  36          HH11      ARG  36 -21.485  20.421  -2.029
  149   HH12  ARG  36          HH12      ARG  36 -21.882  21.135  -0.502
  150   HH21  ARG  36          HH21      ARG  36 -24.699  19.134   0.027
  151   HH22  ARG  36          HH22      ARG  36 -23.710  20.401   0.667
  152    H    LYS  37           H        LYS  37 -21.286  14.105  -4.785
  153    HA   LYS  37           HA       LYS  37 -19.451  12.898  -4.196
  154    HB2  LYS  37           HB1      LYS  37 -18.870  14.075  -6.757
  155    HB3  LYS  37           HB2      LYS  37 -17.386  13.979  -5.795
  156    HG2  LYS  37           HG1      LYS  37 -17.241  11.767  -6.025
  157    HG3  LYS  37           HG2      LYS  37 -18.963  11.538  -5.672
  158    HD2  LYS  37           HD1      LYS  37 -19.360  12.457  -8.057
  159    HD3  LYS  37           HD2      LYS  37 -17.642  12.101  -8.306
  160    HE2  LYS  37           HE1      LYS  37 -17.940   9.834  -8.209
  161    HE3  LYS  37           HE2      LYS  37 -19.314   9.966  -7.103
  162    HZ1  LYS  37           HZ1      LYS  37 -19.299  10.388 -10.033
  163    HZ2  LYS  37           HZ2      LYS  37 -20.581  10.897  -9.054
  164    HZ3  LYS  37           HZ3      LYS  37 -20.188   9.254  -9.146
  165    H    GLY  38           H        GLY  38 -16.949  13.225  -3.634
  166    HA2  GLY  38           HA2      GLY  38 -16.476  15.854  -2.453
  167    HA3  GLY  38           HA3      GLY  38 -16.604  14.499  -1.340
  168    HA1  GLY  38           HA1      GLY  38 -16.211  15.460  -3.195
  169    H    SER  39           H        SER  39 -14.956  12.984  -1.229
  170    HA   SER  39           HA       SER  39 -12.521  13.661  -2.745
  171    HB2  SER  39           HB1      SER  39 -11.282  12.764  -0.688
  172    HB3  SER  39           HB2      SER  39 -12.070  14.342  -0.521
  173    HG   SER  39           HG       SER  39 -13.655  13.448   0.687
  174    H    GLN  40           H        GLN  40 -10.884  11.741  -2.531
  175    HA   GLN  40           HA       GLN  40 -12.338   9.349  -3.396
  176    HB2  GLN  40           HB1      GLN  40 -10.389  10.623  -4.685
  177    HB3  GLN  40           HB2      GLN  40  -9.381   9.575  -3.674
  178    HG2  GLN  40           HG1      GLN  40 -11.622   8.278  -5.112
  179    HG3  GLN  40           HG2      GLN  40 -10.265   8.862  -6.087
  180   HE21  GLN  40          HE21      GLN  40 -11.433   6.260  -4.485
  181   HE22  GLN  40          HE22      GLN  40  -9.961   5.402  -4.200
  182    H    CYS  41           H        CYS  41  -9.367  10.088  -1.559
  183    HA   CYS  41           HA       CYS  41 -10.137   8.166   0.477
  184    HB2  CYS  41           HB1      CYS  41  -8.044   6.905   0.346
  185    HB3  CYS  41           HB2      CYS  41  -8.957   6.771  -1.156
  186    H    LEU  42           H        LEU  42  -8.985   8.400   2.435
  187    HA   LEU  42           HA       LEU  42  -7.729  11.025   2.715
  188    HB2  LEU  42           HB1      LEU  42  -9.538   9.523   4.275
  189    HB3  LEU  42           HB2      LEU  42  -8.024   9.616   5.193
  190    HG   LEU  42           HG       LEU  42  -9.558  11.397   5.832
  191   HD11  LEU  42          HD11      LEU  42  -7.069  12.230   4.366
  192   HD12  LEU  42          HD12      LEU  42  -7.274  11.937   6.094
  193   HD13  LEU  42          HD13      LEU  42  -8.029  13.342   5.342
  194   HD21  LEU  42          HD21      LEU  42  -9.262  12.785   3.234
  195   HD22  LEU  42          HD22      LEU  42 -10.587  12.824   4.398
  196   HD23  LEU  42          HD23      LEU  42 -10.412  11.450   3.306
  197    H    SER  43           H        SER  43  -7.026   7.629   2.930
  198    HA   SER  43           HA       SER  43  -4.198   8.225   3.184
  199    HB2  SER  43           HB1      SER  43  -5.259   6.148   5.071
  200    HB3  SER  43           HB2      SER  43  -3.778   7.117   5.176
  201    HG   SER  43           HG       SER  43  -6.339   7.710   6.021
  202    H    ASP  44           H        ASP  44  -2.895   6.133   3.048
  203    HA   ASP  44           HA       ASP  44  -3.608   4.766   0.701
  204    HB2  ASP  44           HB1      ASP  44  -1.686   3.300   1.185
  205    HB3  ASP  44           HB2      ASP  44  -1.283   5.009   1.399
  206    HD2  ASP  44           HD       ASP  44  -1.177   2.635   4.545
  207    H    THR  45           H        THR  45  -4.292   4.140   4.040
  208    HA   THR  45           HA       THR  45  -4.791   1.406   4.015
  209    HB   THR  45           HB       THR  45  -6.423   1.869   5.870
  210    HG1  THR  45           HG1      THR  45  -7.181   3.899   5.277
  211   HG21  THR  45          HG21      THR  45  -4.474   1.590   6.946
  212   HG22  THR  45          HG22      THR  45  -4.459   3.347   7.097
  213   HG23  THR  45          HG23      THR  45  -3.588   2.567   5.777
  214    H    ASP  46           H        ASP  46  -6.628   4.023   2.673
  215    HA   ASP  46           HA       ASP  46  -9.112   2.653   2.445
  216    HB2  ASP  46           HB1      ASP  46  -8.194   5.253   1.998
  217    HB3  ASP  46           HB2      ASP  46  -8.688   4.673   0.401
  218    HD2  ASP  46           HD       ASP  46 -12.035   4.686   1.250
  219    H    CYS  47           H        CYS  47  -6.203   2.744   0.552
  220    HA   CYS  47           HA       CYS  47  -7.495   1.366  -1.682
  221    HB2  CYS  47           HB1      CYS  47  -4.989   2.902  -1.300
  222    HB3  CYS  47           HB2      CYS  47  -4.894   1.543  -2.421
  223    H    ASN  48           H        ASN  48  -4.366   0.930  -0.028
  224    HA   ASN  48           HA       ASN  48  -3.217  -0.937   0.579
  225    HB2  ASN  48           HB1      ASN  48  -6.067  -1.630   1.161
  226    HB3  ASN  48           HB2      ASN  48  -4.855  -2.914   1.262
  227   HD21  ASN  48          HD21      ASN  48  -6.167  -2.305   3.500
  228   HD22  ASN  48          HD22      ASN  48  -5.149  -1.453   4.607
  229    H    THR  49           H        THR  49  -4.104  -0.554  -2.249
  230    HA   THR  49           HA       THR  49  -4.015  -3.357  -3.148
  231    HB   THR  49           HB       THR  49  -4.759  -1.043  -4.920
  232    HG1  THR  49           HG1      THR  49  -6.451  -2.538  -3.181
  233   HG21  THR  49          HG21      THR  49  -6.131  -3.553  -5.327
  234   HG22  THR  49          HG22      THR  49  -4.382  -3.777  -5.346
  235   HG23  THR  49          HG23      THR  49  -5.135  -2.625  -6.448
  236    H    ARG  50           H        ARG  50  -1.634  -2.327  -2.313
  237    HA   ARG  50           HA       ARG  50   0.537  -2.107  -2.953
  238    HB2  ARG  50           HB1      ARG  50  -0.262  -2.617  -5.807
  239    HB3  ARG  50           HB2      ARG  50   1.230  -3.069  -4.971
  240    HG2  ARG  50           HG1      ARG  50  -1.494  -4.289  -4.519
  241    HG3  ARG  50           HG2      ARG  50  -0.147  -5.020  -5.407
  242    HD2  ARG  50           HD1      ARG  50  -0.024  -4.219  -2.493
  243    HD3  ARG  50           HD2      ARG  50  -0.398  -5.849  -3.068
  244    HE   ARG  50           HE       ARG  50   1.954  -5.315  -4.281
  245   HH11  ARG  50          HH11      ARG  50   0.875  -5.104  -0.977
  246   HH12  ARG  50          HH12      ARG  50   2.440  -5.435  -0.309
  247   HH21  ARG  50          HH21      ARG  50   4.018  -5.751  -3.413
  248   HH22  ARG  50          HH22      ARG  50   4.226  -5.801  -1.696
  249    H    LYS  51           H        LYS  51  -1.374   0.144  -3.074
  250    HA   LYS  51           HA       LYS  51   0.322   1.956  -4.610
  251    HB2  LYS  51           HB1      LYS  51  -2.694   1.871  -4.882
  252    HB3  LYS  51           HB2      LYS  51  -1.633   3.099  -5.590
  253    HG2  LYS  51           HG1      LYS  51  -0.480   1.215  -6.832
  254    HG3  LYS  51           HG2      LYS  51  -1.823   0.187  -6.303
  255    HD2  LYS  51           HD1      LYS  51  -3.400   1.850  -7.344
  256    HD3  LYS  51           HD2      LYS  51  -1.977   2.655  -8.029
  257    HE2  LYS  51           HE1      LYS  51  -2.601   1.269  -9.773
  258    HE3  LYS  51           HE2      LYS  51  -1.398   0.281  -8.931
  259    HZ1  LYS  51           HZ1      LYS  51  -4.256   0.043  -8.250
  260    HZ2  LYS  51           HZ2      LYS  51  -3.015  -1.086  -8.035
  261    HZ3  LYS  51           HZ3      LYS  51  -3.622  -0.782  -9.585
  262    H    PHE  52           H        PHE  52   0.223   4.140  -3.914
  263    HA   PHE  52           HA       PHE  52  -0.804   4.415  -1.178
  264    HB2  PHE  52           HB1      PHE  52   0.777   6.339  -1.013
  265    HB3  PHE  52           HB2      PHE  52   1.569   4.795  -1.330
  266    HD1  PHE  52           HD1      PHE  52   2.964   4.502  -3.177
  267    HD2  PHE  52           HD2      PHE  52   0.388   7.886  -2.999
  268    HE1  PHE  52           HE1      PHE  52   4.082   5.452  -5.151
  269    HE2  PHE  52           HE2      PHE  52   1.502   8.841  -4.973
  270    HZ   PHE  52           HZ       PHE  52   3.351   7.624  -6.054
  271    H    CYS  53           H        CYS  53  -1.711   6.490  -0.535
  272    HA   CYS  53           HA       CYS  53  -3.374   7.600  -2.674
  273    HB2  CYS  53           HB1      CYS  53  -3.628   7.345   0.286
  274    HB3  CYS  53           HB2      CYS  53  -4.419   8.720  -0.484
  275    H    LEU  54           H        LEU  54  -2.236   9.173  -3.680
  276    HA   LEU  54           HA       LEU  54  -0.642  11.063  -2.180
  277    HB2  LEU  54           HB1      LEU  54   0.169  10.283  -4.326
  278    HB3  LEU  54           HB2      LEU  54  -1.303  10.873  -5.115
  279    HG   LEU  54           HG       LEU  54  -0.336  13.158  -3.975
  280   HD11  LEU  54          HD11      LEU  54   1.919  11.293  -4.442
  281   HD12  LEU  54          HD12      LEU  54   1.749  12.598  -3.270
  282   HD13  LEU  54          HD13      LEU  54   2.125  12.968  -4.953
  283   HD21  LEU  54          HD21      LEU  54  -0.854  13.601  -6.100
  284   HD22  LEU  54          HD22      LEU  54  -0.485  11.957  -6.621
  285   HD23  LEU  54          HD23      LEU  54   0.809  13.149  -6.479
  286    H    GLN  55           H        GLN  55  -1.217  13.064  -1.578
  287    HA   GLN  55           HA       GLN  55  -3.821  14.077  -2.514
  288    HB2  GLN  55           HB1      GLN  55  -3.889  15.290  -0.282
  289    HB3  GLN  55           HB2      GLN  55  -4.112  13.533  -0.233
  290    HG2  GLN  55           HG1      GLN  55  -2.223  13.175   0.929
  291    HG3  GLN  55           HG2      GLN  55  -1.336  14.439   0.066
  292   HE21  GLN  55          HE21      GLN  55  -1.477  13.834   2.928
  293   HE22  GLN  55          HE22      GLN  55  -2.007  15.290   3.692
  294    HA   PRO  56           HA       PRO  56  -0.729  17.145  -3.930
  295    HB2  PRO  56           HB1      PRO  56  -2.158  17.875  -6.151
  296    HB3  PRO  56           HB2      PRO  56  -1.089  16.474  -6.098
  297    HG2  PRO  56           HG1      PRO  56  -4.065  16.612  -5.743
  298    HG3  PRO  56           HG2      PRO  56  -3.085  15.458  -6.723
  299    HD2  PRO  56           HD1      PRO  56  -4.104  14.817  -4.289
  300    HD3  PRO  56           HD2      PRO  56  -2.554  14.187  -4.874
  301    H    ARG  57           H        ARG  57  -0.792  19.398  -3.879
  302    HA   ARG  57           HA       ARG  57  -2.991  20.516  -2.373
  303    HB2  ARG  57           HB1      ARG  57  -0.240  21.039  -2.604
  304    HB3  ARG  57           HB2      ARG  57  -1.056  22.469  -3.253
  305    HG2  ARG  57           HG1      ARG  57  -1.040  23.122  -1.098
  306    HG3  ARG  57           HG2      ARG  57  -2.494  22.111  -1.017
  307    HD2  ARG  57           HD1      ARG  57  -0.755  20.191  -0.522
  308    HD3  ARG  57           HD2      ARG  57   0.261  21.553  -0.024
  309    HE   ARG  57           HE       ARG  57  -1.995  20.490   1.376
  310   HH11  ARG  57          HH11      ARG  57  -0.137  23.376   0.793
  311   HH12  ARG  57          HH12      ARG  57  -0.573  24.118   2.297
  312   HH21  ARG  57          HH21      ARG  57  -2.576  21.456   3.359
  313   HH22  ARG  57          HH22      ARG  57  -1.960  23.025   3.756
  314    H    ASP  58           H        ASP  58  -1.816  20.553  -5.644
  315    HA   ASP  58           HA       ASP  58  -3.536  22.766  -6.411
  316    HB2  ASP  58           HB1      ASP  58  -1.810  20.986  -8.154
  317    HB3  ASP  58           HB2      ASP  58  -2.561  22.516  -8.625
  318    HD2  ASP  58           HD       ASP  58   0.908  23.082  -7.589
  319    H    GLU  59           H        GLU  59  -3.582  19.321  -6.350
  320    HA   GLU  59           HA       GLU  59  -6.115  19.344  -7.854
  321    HB2  GLU  59           HB1      GLU  59  -3.727  17.814  -8.307
  322    HB3  GLU  59           HB2      GLU  59  -5.054  16.723  -7.882
  323    HG2  GLU  59           HG1      GLU  59  -6.427  17.960  -9.644
  324    HG3  GLU  59           HG2      GLU  59  -4.883  18.638 -10.181
  325    HE2  GLU  59           HE       GLU  59  -5.811  15.110 -11.428
  326    H    LYS  60           H        LYS  60  -7.228  17.037  -7.344
  327    HA   LYS  60           HA       LYS  60  -7.758  17.143  -4.489
  328    HB2  LYS  60           HB1      LYS  60  -9.165  16.200  -6.898
  329    HB3  LYS  60           HB2      LYS  60  -9.390  15.178  -5.469
  330    HG2  LYS  60           HG1      LYS  60 -10.756  16.643  -4.495
  331    HG3  LYS  60           HG2      LYS  60  -9.682  18.003  -4.864
  332    HD2  LYS  60           HD1      LYS  60 -10.601  17.576  -7.328
  333    HD3  LYS  60           HD2      LYS  60 -11.969  16.913  -6.417
  334    HE2  LYS  60           HE1      LYS  60 -11.987  19.071  -5.086
  335    HE3  LYS  60           HE2      LYS  60 -10.835  19.699  -6.272
  336    HZ1  LYS  60           HZ1      LYS  60 -12.860  18.638  -7.777
  337    HZ2  LYS  60           HZ2      LYS  60 -12.597  20.280  -7.466
  338    HZ3  LYS  60           HZ3      LYS  60 -13.661  19.395  -6.493
  339    HA   PRO  61           HA       PRO  61  -5.601  13.516  -3.290
  340    HB2  PRO  61           HB1      PRO  61  -7.334  12.356  -1.514
  341    HB3  PRO  61           HB2      PRO  61  -6.434  13.833  -1.171
  342    HG2  PRO  61           HG1      PRO  61  -9.257  13.503  -2.132
  343    HG3  PRO  61           HG2      PRO  61  -8.611  14.579  -0.838
  344    HD2  PRO  61           HD1      PRO  61  -9.218  15.479  -3.327
  345    HD3  PRO  61           HD2      PRO  61  -7.885  16.144  -2.366
  346    H    PHE  62           H        PHE  62  -5.232  11.638  -4.279
  347    HA   PHE  62           HA       PHE  62  -7.423   9.832  -4.895
  348    HB2  PHE  62           HB1      PHE  62  -6.558   9.568  -7.274
  349    HB3  PHE  62           HB2      PHE  62  -7.453  11.048  -6.927
  350    HD1  PHE  62           HD1      PHE  62  -6.598  13.039  -7.674
  351    HD2  PHE  62           HD2      PHE  62  -3.931   9.817  -6.887
  352    HE1  PHE  62           HE1      PHE  62  -4.720  14.400  -8.495
  353    HE2  PHE  62           HE2      PHE  62  -2.047  11.172  -7.707
  354    HZ   PHE  62           HZ       PHE  62  -2.440  13.466  -8.511
  355    H    CYS  63           H        CYS  63  -6.462   7.798  -6.030
  356    HA   CYS  63           HA       CYS  63  -4.162   6.989  -4.425
  357    HB2  CYS  63           HB1      CYS  63  -6.488   5.721  -4.861
  358    HB3  CYS  63           HB2      CYS  63  -5.552   5.052  -6.199
  359    H    ALA  64           H        ALA  64  -2.196   7.068  -5.261
  360    HA   ALA  64           HA       ALA  64  -1.887   6.916  -8.183
  361    HB1  ALA  64           HB1      ALA  64  -0.775   8.826  -7.797
  362    HB2  ALA  64           HB2      ALA  64  -0.555   8.468  -6.083
  363    HB3  ALA  64           HB3      ALA  64   0.533   7.763  -7.277
  364    H    THR  65           H        THR  65  -0.424   5.512  -9.115
  365    HA   THR  65           HA       THR  65   0.070   3.085  -7.708
  366    HB   THR  65           HB       THR  65   1.551   3.617 -10.226
  367    HG1  THR  65           HG1      THR  65  -0.295   3.613 -11.462
  368   HG21  THR  65          HG21      THR  65  -0.060   1.359 -10.454
  369   HG22  THR  65          HG22      THR  65   0.437   1.380  -8.761
  370   HG23  THR  65          HG23      THR  65   1.653   1.394 -10.039
  371    H    CYS  66           H        CYS  66   2.310   2.052  -7.802
  372    HA   CYS  66           HA       CYS  66   4.058   3.499  -6.156
  373    HB2  CYS  66           HB1      CYS  66   4.070   1.094  -6.119
  374    HB3  CYS  66           HB2      CYS  66   4.507   1.021  -7.827
  375    H    ARG  67           H        ARG  67   5.812   4.744  -6.534
  376    HA   ARG  67           HA       ARG  67   6.242   5.624  -9.273
  377    HB2  ARG  67           HB1      ARG  67   7.465   6.636  -6.694
  378    HB3  ARG  67           HB2      ARG  67   7.574   7.413  -8.280
  379    HG2  ARG  67           HG1      ARG  67   4.869   6.878  -7.145
  380    HG3  ARG  67           HG2      ARG  67   5.831   8.215  -6.490
  381    HD2  ARG  67           HD1      ARG  67   5.732   8.058  -9.439
  382    HD3  ARG  67           HD2      ARG  67   4.198   8.424  -8.638
  383    HE   ARG  67           HE       ARG  67   6.514  10.128  -8.810
  384   HH11  ARG  67          HH11      ARG  67   3.570   9.432  -7.087
  385   HH12  ARG  67          HH12      ARG  67   3.406  11.036  -6.457
  386   HH21  ARG  67          HH21      ARG  67   6.310  12.245  -7.984
  387   HH22  ARG  67          HH22      ARG  67   4.965  12.637  -6.967
  388    H    GLY  68           H        GLY  68   8.175   5.482 -10.384
  389    HA2  GLY  68           HA2      GLY  68   9.730   3.210 -10.073
  390    HA3  GLY  68           HA3      GLY  68  10.218   4.629 -10.990
  391    HA1  GLY  68           HA1      GLY  68   9.518   3.560  -9.290
  392    H    LEU  69           H        LEU  69  12.226   3.338  -9.902
  393    HA   LEU  69           HA       LEU  69  12.811   4.198  -7.222
  394    HB2  LEU  69           HB1      LEU  69  14.294   2.708  -9.358
  395    HB3  LEU  69           HB2      LEU  69  15.160   3.336  -7.945
  396    HG   LEU  69           HG       LEU  69  12.878   1.362  -7.876
  397   HD11  LEU  69          HD11      LEU  69  15.793   1.086  -8.063
  398   HD12  LEU  69          HD12      LEU  69  14.511  -0.054  -8.475
  399   HD13  LEU  69          HD13      LEU  69  15.033   0.119  -6.799
  400   HD21  LEU  69          HD21      LEU  69  13.713   1.142  -5.467
  401   HD22  LEU  69          HD22      LEU  69  12.741   2.557  -5.871
  402   HD23  LEU  69          HD23      LEU  69  14.494   2.702  -5.732
  403    H    ARG  70           H        ARG  70  12.941   5.668 -10.234
  404    HA   ARG  70           HA       ARG  70  15.156   7.438  -9.503
  405    HB2  ARG  70           HB1      ARG  70  13.572   7.331 -12.081
  406    HB3  ARG  70           HB2      ARG  70  15.066   8.236 -11.792
  407    HG2  ARG  70           HG1      ARG  70  15.877   5.730 -11.148
  408    HG3  ARG  70           HG2      ARG  70  14.672   5.393 -12.403
  409    HD2  ARG  70           HD1      ARG  70  16.806   7.481 -12.799
  410    HD3  ARG  70           HD2      ARG  70  17.105   5.768 -13.133
  411    HE   ARG  70           HE       ARG  70  15.536   7.587 -14.705
  412   HH11  ARG  70          HH11      ARG  70  16.042   4.246 -13.866
  413   HH12  ARG  70          HH12      ARG  70  15.363   3.638 -15.339
  414   HH21  ARG  70          HH21      ARG  70  14.639   6.797 -16.649
  415   HH22  ARG  70          HH22      ARG  70  14.565   5.090 -16.921
  416    H    ARG  71           H        ARG  71  11.710   7.337  -9.743
  417    HA   ARG  71           HA       ARG  71  11.078  10.027 -10.054
  418    HB2  ARG  71           HB1      ARG  71   9.724   7.620  -9.317
  419    HB3  ARG  71           HB2      ARG  71   9.246   8.904  -8.197
  420    HG2  ARG  71           HG1      ARG  71   7.710   8.792 -10.073
  421    HG3  ARG  71           HG2      ARG  71   8.606  10.322 -10.079
  422    HD2  ARG  71           HD1      ARG  71   9.864   9.751 -11.931
  423    HD3  ARG  71           HD2      ARG  71   9.679   8.017 -11.634
  424    HE   ARG  71           HE       ARG  71   7.157   8.849 -12.223
  425   HH11  ARG  71          HH11      ARG  71  10.244   9.106 -13.812
  426   HH12  ARG  71          HH12      ARG  71   9.569   9.108 -15.408
  427   HH21  ARG  71          HH21      ARG  71   6.256   8.850 -14.319
  428   HH22  ARG  71          HH22      ARG  71   7.301   8.963 -15.695
  429    H    ARG  72           H        ARG  72  11.099  11.774  -8.756
  430    HA   ARG  72           HA       ARG  72  12.600  11.681  -6.333
  431    HB2  ARG  72           HB1      ARG  72  10.932  13.951  -7.442
  432    HB3  ARG  72           HB2      ARG  72  12.204  14.077  -6.218
  433    HG2  ARG  72           HG1      ARG  72  13.204  12.806  -8.615
  434    HG3  ARG  72           HG2      ARG  72  12.485  14.388  -8.965
  435    HD2  ARG  72           HD1      ARG  72  13.870  15.131  -6.843
  436    HD3  ARG  72           HD2      ARG  72  14.833  13.707  -7.263
  437    HE   ARG  72           HE       ARG  72  14.386  15.382  -9.525
  438   HH11  ARG  72          HH11      ARG  72  16.314  15.016  -6.650
  439   HH12  ARG  72          HH12      ARG  72  17.658  15.911  -7.279
  440   HH21  ARG  72          HH21      ARG  72  16.147  16.563 -10.365
  441   HH22  ARG  72          HH22      ARG  72  17.561  16.792  -9.392
  442    H    CYS  73           H        CYS  73  11.874  12.363  -4.235
  443    HA   CYS  73           HA       CYS  73   9.033  12.415  -3.696
  444    HB2  CYS  73           HB1      CYS  73   9.123  10.551  -2.069
  445    HB3  CYS  73           HB2      CYS  73   9.400  10.021  -3.729
  446    H    GLN  74           H        GLN  74   8.529  13.128  -1.572
  447    HA   GLN  74           HA       GLN  74  10.757  14.552  -0.300
  448    HB2  GLN  74           HB1      GLN  74   7.766  14.948  -0.039
  449    HB3  GLN  74           HB2      GLN  74   9.003  15.924   0.770
  450    HG2  GLN  74           HG1      GLN  74   9.612  15.908  -1.999
  451    HG3  GLN  74           HG2      GLN  74   7.886  16.253  -1.820
  452   HE21  GLN  74          HE21      GLN  74  11.011  17.501  -1.646
  453   HE22  GLN  74          HE22      GLN  74  10.626  19.049  -0.980
  454    H    ARG  75           H        ARG  75   8.427  12.048   0.210
  455    HA   ARG  75           HA       ARG  75   9.594  11.535   2.844
  456    HB2  ARG  75           HB1      ARG  75   6.713  12.068   2.241
  457    HB3  ARG  75           HB2      ARG  75   7.115  10.870   3.482
  458    HG2  ARG  75           HG1      ARG  75   7.893  12.416   4.947
  459    HG3  ARG  75           HG2      ARG  75   8.484  13.484   3.664
  460    HD2  ARG  75           HD1      ARG  75   5.645  13.332   3.440
  461    HD3  ARG  75           HD2      ARG  75   6.056  13.654   5.131
  462    HE   ARG  75           HE       ARG  75   6.377  15.440   2.909
  463   HH11  ARG  75          HH11      ARG  75   7.541  14.606   6.083
  464   HH12  ARG  75          HH12      ARG  75   8.147  16.194   6.420
  465   HH21  ARG  75          HH21      ARG  75   7.171  17.533   3.341
  466   HH22  ARG  75          HH22      ARG  75   7.936  17.858   4.860
  467    H    ASP  76           H        ASP  76   9.129   9.337   3.629
  468    HA   ASP  76           HA       ASP  76   9.392   7.440   1.482
  469    HB2  ASP  76           HB1      ASP  76   9.058   6.647   4.359
  470    HB3  ASP  76           HB2      ASP  76  10.050   5.899   3.100
  471    HD2  ASP  76           HD       ASP  76  11.633   8.713   5.312
  472    H    ALA  77           H        ALA  77   6.854   8.583   3.518
  473    HA   ALA  77           HA       ALA  77   5.130   6.325   3.281
  474    HB1  ALA  77           HB1      ALA  77   4.955   8.012   5.087
  475    HB2  ALA  77           HB2      ALA  77   4.377   9.178   3.896
  476    HB3  ALA  77           HB3      ALA  77   3.432   7.730   4.245
  477    H    MET  78           H        MET  78   5.417   9.404   1.552
  478    HA   MET  78           HA       MET  78   3.168   9.125  -0.095
  479    HB2  MET  78           HB1      MET  78   4.124  10.835  -1.478
  480    HB3  MET  78           HB2      MET  78   4.501  11.217   0.209
  481    HG2  MET  78           HG1      MET  78   6.658  11.324  -0.269
  482    HG3  MET  78           HG2      MET  78   6.621   9.640  -0.800
  483    HE1  MET  78           HE1      MET  78   7.484   9.574  -4.125
  484    HE2  MET  78           HE2      MET  78   6.767   8.778  -2.724
  485    HE3  MET  78           HE3      MET  78   5.735   9.353  -4.036
  486    H    CYS  79           H        CYS  79   6.187   7.507  -0.129
  487    HA   CYS  79           HA       CYS  79   5.897   6.657  -2.907
  488    HB2  CYS  79           HB1      CYS  79   8.090   7.002  -1.107
  489    HB3  CYS  79           HB2      CYS  79   8.047   5.311  -1.609
  490    H    CYS  80           H        CYS  80   5.709   4.480  -3.523
  491    HA   CYS  80           HA       CYS  80   3.880   2.934  -2.159
  492    HB2  CYS  80           HB1      CYS  80   4.739   1.018  -3.571
  493    HB3  CYS  80           HB2      CYS  80   4.258   2.465  -4.457
  494    HA   PRO  81           HA       PRO  81   5.963   0.867   1.103
  495    HB2  PRO  81           HB1      PRO  81   4.701  -1.564   1.106
  496    HB3  PRO  81           HB2      PRO  81   3.938  -0.071   1.650
  497    HG2  PRO  81           HG1      PRO  81   3.750  -1.444  -1.010
  498    HG3  PRO  81           HG2      PRO  81   2.438  -0.733   0.001
  499    HD2  PRO  81           HD1      PRO  81   3.476   0.540  -2.160
  500    HD3  PRO  81           HD2      PRO  81   2.905   1.405  -0.723
  501    H    GLY  82           H        GLY  82   7.682  -0.479   1.507
  502    HA2  GLY  82           HA2      GLY  82   8.994  -2.445   1.033
  503    HA3  GLY  82           HA3      GLY  82   8.504  -2.312  -0.648
  504    HA1  GLY  82           HA1      GLY  82   9.072  -1.599   1.272
  505    H    THR  83           H        THR  83   8.999   0.710  -0.310
  506    HA   THR  83           HA       THR  83  11.927   0.572  -0.629
  507    HB   THR  83           HB       THR  83  11.707   2.508  -2.191
  508    HG1  THR  83           HG1      THR  83   8.929   1.869  -2.099
  509   HG21  THR  83          HG21      THR  83  11.779   0.985  -3.815
  510   HG22  THR  83          HG22      THR  83  10.048   0.685  -3.657
  511   HG23  THR  83          HG23      THR  83  11.194  -0.219  -2.668
  512    H    LEU  84           H        LEU  84  12.904   2.880  -0.445
  513    HA   LEU  84           HA       LEU  84  11.594   4.392   1.701
  514    HB2  LEU  84           HB1      LEU  84  13.458   2.685   2.409
  515    HB3  LEU  84           HB2      LEU  84  14.543   3.949   1.805
  516    HG   LEU  84           HG       LEU  84  12.728   5.232   3.532
  517   HD11  LEU  84          HD11      LEU  84  13.664   2.572   4.553
  518   HD12  LEU  84          HD12      LEU  84  12.051   3.281   4.624
  519   HD13  LEU  84          HD13      LEU  84  13.342   3.922   5.642
  520   HD21  LEU  84          HD21      LEU  84  15.151   5.707   3.041
  521   HD22  LEU  84          HD22      LEU  84  15.554   4.393   4.146
  522   HD23  LEU  84          HD23      LEU  84  14.687   5.810   4.740
  523    H    CYS  85           H        CYS  85  11.744   6.554   1.503
  524    HA   CYS  85           HA       CYS  85  12.747   7.662  -0.916
  525    HB2  CYS  85           HB1      CYS  85  10.777   8.481   0.505
  526    HB3  CYS  85           HB2      CYS  85  11.990   9.239   1.540
  527    H    VAL  86           H        VAL  86  14.870   7.784  -1.281
  528    HA   VAL  86           HA       VAL  86  16.560   8.980   0.815
  529    HB   VAL  86           HB       VAL  86  17.413   6.809  -1.105
  530   HG11  VAL  86          HG11      VAL  86  18.863   8.623   0.696
  531   HG12  VAL  86          HG12      VAL  86  19.320   6.922   0.815
  532   HG13  VAL  86          HG13      VAL  86  19.419   7.756  -0.736
  533   HG21  VAL  86          HG21      VAL  86  17.750   5.645   1.233
  534   HG22  VAL  86          HG22      VAL  86  16.473   6.760   1.721
  535   HG23  VAL  86          HG23      VAL  86  16.188   5.609   0.417
  536    H    ASN  87           H        ASN  87  17.956  10.552   0.182
  537    HA   ASN  87           HA       ASN  87  18.806  12.232  -1.096
  538    HB2  ASN  87           HB1      ASN  87  18.845   9.999  -3.144
  539    HB3  ASN  87           HB2      ASN  87  19.636  11.565  -3.368
  540   HD21  ASN  87          HD21      ASN  87  21.348   9.717  -3.622
  541   HD22  ASN  87          HD22      ASN  87  22.302   9.435  -2.209
  542    H    ASP  88           H        ASP  88  15.964  12.055  -0.921
  543    HA   ASP  88           HA       ASP  88  14.110  13.048  -1.785
  544    HB2  ASP  88           HB1      ASP  88  15.929  14.266  -3.873
  545    HB3  ASP  88           HB2      ASP  88  14.377  14.887  -3.296
  546    HD2  ASP  88           HD       ASP  88  17.605  15.878  -1.355
  547    H    VAL  89           H        VAL  89  15.145  10.461  -2.820
  548    HA   VAL  89           HA       VAL  89  13.365  10.291  -5.120
  549    HB   VAL  89           HB       VAL  89  16.231   9.344  -5.259
  550   HG11  VAL  89          HG11      VAL  89  15.684   8.642  -7.535
  551   HG12  VAL  89          HG12      VAL  89  14.691   7.794  -6.348
  552   HG13  VAL  89          HG13      VAL  89  14.006   9.123  -7.284
  553   HG21  VAL  89          HG21      VAL  89  14.781  11.531  -6.746
  554   HG22  VAL  89          HG22      VAL  89  16.087  11.735  -5.578
  555   HG23  VAL  89          HG23      VAL  89  16.403  10.955  -7.129
  556    H    CYS  90           H        CYS  90  12.360   8.338  -5.311
  557    HA   CYS  90           HA       CYS  90  12.203   6.654  -3.091
  558    HB2  CYS  90           HB1      CYS  90  10.784   6.976  -5.425
  559    HB3  CYS  90           HB2      CYS  90  11.510   5.382  -5.647
  560    H    THR  91           H        THR  91  13.901   5.555  -2.333
  561    HA   THR  91           HA       THR  91  15.497   3.975  -4.241
  562    HB   THR  91           HB       THR  91  16.351   5.010  -1.531
  563    HG1  THR  91           HG1      THR  91  16.948   5.853  -4.184
  564   HG21  THR  91          HG21      THR  91  17.637   3.114  -1.799
  565   HG22  THR  91          HG22      THR  91  18.641   4.318  -2.607
  566   HG23  THR  91          HG23      THR  91  17.631   3.229  -3.558
  567    H    THR  92           H        THR  92  15.324   1.841  -4.100
  568    HA   THR  92           HA       THR  92  13.603   0.488  -2.422
  569    HB   THR  92           HB       THR  92  15.593  -1.387  -2.982
  570    HG1  THR  92           HG1      THR  92  16.319  -0.896  -5.016
  571   HG21  THR  92          HG21      THR  92  12.990  -0.571  -4.161
  572   HG22  THR  92          HG22      THR  92  13.478  -2.110  -3.451
  573   HG23  THR  92          HG23      THR  92  13.991  -1.691  -5.085
  574    H    MET  93           H        MET  93  13.800  -0.672  -0.525
  575    HA   MET  93           HA       MET  93  15.455   0.332   1.471
  576    HB2  MET  93           HB1      MET  93  13.427  -1.665   1.232
  577    HB3  MET  93           HB2      MET  93  14.779  -2.348   2.147
  578    HG2  MET  93           HG1      MET  93  14.101   0.351   3.009
  579    HG3  MET  93           HG2      MET  93  12.755  -0.781   3.154
  580    HE1  MET  93           HE1      MET  93  16.857  -0.829   4.805
  581    HE2  MET  93           HE2      MET  93  15.940   0.478   4.056
  582    HE3  MET  93           HE3      MET  93  15.846   0.220   5.799
  583    H    GLU  94           H        GLU  94  15.754  -2.745  -0.304
  584    HA   GLU  94           HA       GLU  94  18.087  -3.663   0.890
  585    HB2  GLU  94           HB1      GLU  94  16.821  -4.086  -1.795
  586    HB3  GLU  94           HB2      GLU  94  18.433  -4.746  -1.477
  587    HG2  GLU  94           HG1      GLU  94  17.366  -6.542  -0.706
  588    HG3  GLU  94           HG2      GLU  94  17.048  -5.556   0.729
  589    HE2  GLU  94           HE       GLU  94  14.010  -6.747  -1.321
  590    H    ASP  95           H        ASP  95  17.627  -1.233  -1.568
  591    HA   ASP  95           HA       ASP  95  20.403  -1.104  -2.312
  592    HB2  ASP  95           HB1      ASP  95  17.891   0.243  -3.090
  593    HB3  ASP  95           HB2      ASP  95  19.346   1.245  -3.201
  594    HD2  ASP  95           HD       ASP  95  19.961  -1.966  -5.346
  595    H    ALA  96           H        ALA  96  18.332   0.420   0.026
  596    HA   ALA  96           HA       ALA  96  20.262   2.506   0.630
  597    HB1  ALA  96           HB1      ALA  96  17.802   1.918   2.241
  598    HB2  ALA  96           HB2      ALA  96  18.641   3.453   2.012
  599    HB3  ALA  96           HB3      ALA  96  17.707   2.754   0.690
  600    H    THR  97           H        THR  97  21.822   0.611   1.070
  601    HA   THR  97           HA       THR  97  21.987   0.314   3.954
  602    HB   THR  97           HB       THR  97  22.400  -2.207   2.404
  603    HG1  THR  97           HG1      THR  97  20.342  -2.374   1.983
  604   HG21  THR  97          HG21      THR  97  21.113  -2.630   4.865
  605   HG22  THR  97          HG22      THR  97  22.313  -1.370   5.153
  606   HG23  THR  97          HG23      THR  97  22.808  -2.920   4.476
  607    H    GLU  98           H        GLU  98  23.480  -1.010   0.990
  608    HA   GLU  98           HA       GLU  98  26.012   0.229   1.764
  609    HB2  GLU  98           HB1      GLU  98  27.257  -1.855   1.323
  610    HB3  GLU  98           HB2      GLU  98  26.155  -2.005   2.699
  611    HG2  GLU  98           HG1      GLU  98  24.505  -2.942   0.880
  612    HG3  GLU  98           HG2      GLU  98  26.012  -3.273   0.013
  613    HE2  GLU  98           HE       GLU  98  26.913  -5.334   2.930
  614    H    ASN  99           H        ASN  99  27.535   0.411   0.024
  615    HA   ASN  99           HA       ASN  99  26.239   0.303  -2.618
  616    HB2  ASN  99           HB1      ASN  99  27.718   2.129  -3.293
  617    HB3  ASN  99           HB2      ASN  99  26.789   2.577  -1.858
  618   HD21  ASN  99          HD21      ASN  99  29.915   1.956  -3.145
  619   HD22  ASN  99          HD22      ASN  99  30.821   2.399  -1.743
  620    H    LEU 100           H        LEU 100  27.162  -0.828  -4.227
  621    HA   LEU 100           HA       LEU 100  29.767  -2.089  -3.674
  622    HB2  LEU 100           HB1      LEU 100  27.576  -3.108  -5.487
  623    HB3  LEU 100           HB2      LEU 100  29.070  -3.948  -5.035
  624    HG   LEU 100           HG       LEU 100  27.967  -3.572  -2.594
  625   HD11  LEU 100          HD11      LEU 100  25.517  -4.493  -3.286
  626   HD12  LEU 100          HD12      LEU 100  25.810  -3.321  -4.570
  627   HD13  LEU 100          HD13      LEU 100  25.875  -2.814  -2.881
  628   HD21  LEU 100          HD21      LEU 100  27.266  -5.911  -2.736
  629   HD22  LEU 100          HD22      LEU 100  28.845  -5.664  -3.481
  630   HD23  LEU 100          HD23      LEU 100  27.411  -5.850  -4.492
  631    H    TYR 101           H        TYR 101  31.038  -2.649  -5.639
  632    HA   TYR 101           HA       TYR 101  30.602  -1.516  -8.150
  633    HB2  TYR 101           HB1      TYR 101  31.176   0.463  -6.294
  634    HB3  TYR 101           HB2      TYR 101  32.734   0.160  -7.065
  635    HD1  TYR 101           HD1      TYR 101  32.075  -0.422  -9.824
  636    HD2  TYR 101           HD2      TYR 101  30.353   2.447  -7.196
  637    HE1  TYR 101           HE1      TYR 101  31.419   0.948 -11.758
  638    HE2  TYR 101           HE2      TYR 101  29.691   3.824  -9.123
  639    HH   TYR 101           HH       TYR 101  29.419   3.813 -11.386
  640    H    PHE 102           H        PHE 102  32.868  -2.523  -5.690
  641    HA   PHE 102           HA       PHE 102  34.853  -3.640  -5.769
  642    HB2  PHE 102           HB1      PHE 102  33.472  -4.728  -8.231
  643    HB3  PHE 102           HB2      PHE 102  34.995  -5.374  -7.617
  644    HD1  PHE 102           HD1      PHE 102  35.067  -6.290  -5.257
  645    HD2  PHE 102           HD2      PHE 102  31.437  -5.446  -7.313
  646    HE1  PHE 102           HE1      PHE 102  33.849  -7.756  -3.701
  647    HE2  PHE 102           HE2      PHE 102  30.213  -6.911  -5.761
  648    HZ   PHE 102           HZ       PHE 102  31.419  -8.067  -3.951
  649    H    GLN 103           H        GLN 103  36.128  -1.763  -6.073
  650    HA   GLN 103           HA       GLN 103  36.929  -1.131  -8.813
  651    HB2  GLN 103           HB1      GLN 103  36.352   0.541  -6.816
  652    HB3  GLN 103           HB2      GLN 103  38.077   0.317  -6.480
  653    HG2  GLN 103           HG1      GLN 103  38.104   0.781  -9.169
  654    HG3  GLN 103           HG2      GLN 103  36.756   1.792  -8.632
  655   HE21  GLN 103          HE21      GLN 103  39.121   2.812  -9.700
  656   HE22  GLN 103          HE22      GLN 103  39.941   3.708  -8.471
  657    H    SER 104           H        SER 104  39.160  -1.007  -9.409
  658    HA   SER 104           HA       SER 104  41.068  -2.385  -7.684
  659    HB2  SER 104           HB1      SER 104  41.521  -3.451 -10.267
  660    HB3  SER 104           HB2      SER 104  40.975  -4.314  -8.819
  661    HG   SER 104           HG       SER 104  39.257  -4.640 -10.005
  662    H    LEU 105           H        LEU 105  43.291  -2.426  -8.822
  663    HA   LEU 105           HA       LEU 105  43.750  -0.299 -10.718
  664    HB2  LEU 105           HB1      LEU 105  43.578   0.668  -8.306
  665    HB3  LEU 105           HB2      LEU 105  45.187  -0.048  -8.107
  666    HG   LEU 105           HG       LEU 105  44.673   1.808 -10.393
  667   HD11  LEU 105          HD11      LEU 105  43.902   2.728  -8.070
  668   HD12  LEU 105          HD12      LEU 105  44.881   3.723  -9.147
  669   HD13  LEU 105          HD13      LEU 105  45.635   2.890  -7.789
  670   HD21  LEU 105          HD21      LEU 105  46.845   1.476 -10.689
  671   HD22  LEU 105          HD22      LEU 105  46.901   0.438  -9.263
  672   HD23  LEU 105          HD23      LEU 105  47.162   2.176  -9.101
  673    H    GLU 106           H        GLU 106  45.214  -1.086 -12.066
  674    HA   GLU 106           HA       GLU 106  47.077  -3.134 -11.125
  675    HB2  GLU 106           HB1      GLU 106  46.567  -2.214 -13.962
  676    HB3  GLU 106           HB2      GLU 106  47.436  -3.668 -13.450
  677    HG2  GLU 106           HG1      GLU 106  45.435  -4.680 -12.631
  678    HG3  GLU 106           HG2      GLU 106  44.526  -3.182 -12.876
  679    HE2  GLU 106           HE       GLU 106  44.766  -5.667 -15.838
  680    H    HIS 107           H        HIS 107  49.169  -2.935 -12.798
  681    HA   HIS 107           HA       HIS 107  50.203  -0.253 -12.920
  682    HB2  HIS 107           HB1      HIS 107  50.518  -1.524 -10.500
  683    HB3  HIS 107           HB2      HIS 107  52.030  -1.909 -11.330
  684    HD1  HIS 107           HD1      HIS 107  53.761  -0.333 -10.554
  685    HD2  HIS 107           HD2      HIS 107  50.104   1.555 -11.124
  686    HE1  HIS 107           HE1      HIS 107  54.180   2.101 -10.080
  687    HE2  HIS 107           HE2      HIS 107  51.945   3.256 -10.429
  688    H    HIS 108           H        HIS 108  51.714  -0.076 -14.476
  689    HA   HIS 108           HA       HIS 108  52.380  -2.448 -15.988
  690    HB2  HIS 108           HB1      HIS 108  52.362   0.445 -16.436
  691    HB3  HIS 108           HB2      HIS 108  53.766  -0.357 -17.146
  692    HD1  HIS 108           HD1      HIS 108  52.519  -2.964 -18.129
  693    HD2  HIS 108           HD2      HIS 108  50.750   0.764 -18.615
  694    HE1  HIS 108           HE1      HIS 108  50.952  -3.213 -20.081
  695    HE2  HIS 108           HE2      HIS 108  49.871  -0.935 -20.379
  696    H    HIS 109           H        HIS 109  53.779  -3.595 -14.640
  697    HA   HIS 109           HA       HIS 109  56.507  -2.542 -14.590
  698    HB2  HIS 109           HB1      HIS 109  54.899  -2.619 -12.299
  699    HB3  HIS 109           HB2      HIS 109  55.955  -4.028 -12.161
  700    HD1  HIS 109           HD1      HIS 109  56.132  -1.395 -10.381
  701    HD2  HIS 109           HD2      HIS 109  58.587  -2.377 -13.585
  702    HE1  HIS 109           HE1      HIS 109  58.263  -0.109 -10.014
  703    HE2  HIS 109           HE2      HIS 109  59.764  -0.708 -11.972
  704    H    HIS 110           H        HIS 110  57.702  -3.971 -15.646
  705    HA   HIS 110           HA       HIS 110  57.394  -6.815 -15.040
  706    HB2  HIS 110           HB1      HIS 110  57.532  -7.408 -17.437
  707    HB3  HIS 110           HB2      HIS 110  56.063  -6.507 -17.048
  708    HD1  HIS 110           HD1      HIS 110  59.549  -5.632 -18.319
  709    HD2  HIS 110           HD2      HIS 110  55.573  -4.535 -18.818
  710    HE1  HIS 110           HE1      HIS 110  59.559  -3.865 -20.110
  711    HE2  HIS 110           HE2      HIS 110  57.129  -3.194 -20.415
  712    H    HIS 111           H        HIS 111  59.238  -8.102 -16.003
  713    HA   HIS 111           HA       HIS 111  61.679  -6.534 -16.365
  714    HB2  HIS 111           HB1      HIS 111  61.038  -7.658 -13.907
  715    HB3  HIS 111           HB2      HIS 111  62.137  -8.835 -14.632
  716    HD1  HIS 111           HD1      HIS 111  62.283  -5.033 -14.727
  717    HD2  HIS 111           HD2      HIS 111  64.551  -8.303 -13.534
  718    HE1  HIS 111           HE1      HIS 111  64.479  -4.082 -13.956
  719    HE2  HIS 111           HE2      HIS 111  65.867  -6.080 -13.227
  720    H    HIS 112           H        HIS 112  63.136  -7.449 -17.728
  721    HA   HIS 112           HA       HIS 112  62.463 -10.118 -18.782
  722    HB2  HIS 112           HB1      HIS 112  62.998  -7.570 -20.102
  723    HB3  HIS 112           HB2      HIS 112  64.018  -8.875 -20.716
  724    HD1  HIS 112           HD1      HIS 112  62.681 -11.063 -21.580
  725    HD2  HIS 112           HD2      HIS 112  60.456  -7.586 -21.117
  726    HE1  HIS 112           HE1      HIS 112  60.571 -11.435 -22.895
  727    HE2  HIS 112           HE2      HIS 112  59.209  -9.310 -22.613
  Start of MODEL   68
    1    H1   MET  18           H        MET  18 -64.029 -25.005  -6.387
    2    HA   MET  18           HA       MET  18 -63.461 -27.417  -5.905
    3    HB2  MET  18           HB1      MET  18 -64.935 -27.564  -8.520
    4    HB3  MET  18           HB2      MET  18 -63.718 -28.782  -8.110
    5    HG2  MET  18           HG1      MET  18 -65.043 -29.811  -6.625
    6    HG3  MET  18           HG2      MET  18 -65.651 -28.284  -5.979
    7    HE1  MET  18           HE1      MET  18 -68.738 -27.452  -7.948
    8    HE2  MET  18           HE2      MET  18 -68.268 -27.729  -6.271
    9    HE3  MET  18           HE3      MET  18 -67.246 -26.749  -7.322
   10    H    LEU  19           H        LEU  19 -63.215 -25.467  -8.844
   11    HA   LEU  19           HA       LEU  19 -60.529 -26.364  -9.397
   12    HB2  LEU  19           HB1      LEU  19 -62.598 -25.040 -10.814
   13    HB3  LEU  19           HB2      LEU  19 -61.191 -23.963 -10.795
   14    HG   LEU  19           HG       LEU  19 -61.130 -25.259 -12.803
   15   HD11  LEU  19          HD11      LEU  19 -58.948 -26.066 -12.698
   16   HD12  LEU  19          HD12      LEU  19 -59.123 -26.599 -11.026
   17   HD13  LEU  19          HD13      LEU  19 -59.017 -24.878 -11.397
   18   HD21  LEU  19          HD21      LEU  19 -62.347 -27.235 -11.299
   19   HD22  LEU  19          HD22      LEU  19 -60.746 -27.891 -11.642
   20   HD23  LEU  19          HD23      LEU  19 -61.794 -27.380 -12.968
   21    H    VAL  20           H        VAL  20 -58.662 -25.392  -8.853
   22    HA   VAL  20           HA       VAL  20 -58.758 -23.237  -6.928
   23    HB   VAL  20           HB       VAL  20 -56.360 -24.663  -8.089
   24   HG11  VAL  20          HG11      VAL  20 -56.689 -22.717  -5.824
   25   HG12  VAL  20          HG12      VAL  20 -55.309 -23.813  -5.930
   26   HG13  VAL  20          HG13      VAL  20 -55.594 -22.625  -7.203
   27   HG21  VAL  20          HG21      VAL  20 -56.378 -26.060  -6.162
   28   HG22  VAL  20          HG22      VAL  20 -57.674 -25.124  -5.417
   29   HG23  VAL  20          HG23      VAL  20 -58.003 -26.104  -6.846
   30    H    LEU  21           H        LEU  21 -58.049 -21.170  -7.199
   31    HA   LEU  21           HA       LEU  21 -57.977 -20.141  -9.866
   32    HB2  LEU  21           HB1      LEU  21 -57.661 -17.960  -8.803
   33    HB3  LEU  21           HB2      LEU  21 -58.998 -18.869  -8.079
   34    HG   LEU  21           HG       LEU  21 -56.571 -19.347  -6.610
   35   HD11  LEU  21          HD11      LEU  21 -57.401 -16.458  -6.820
   36   HD12  LEU  21          HD12      LEU  21 -55.928 -17.140  -7.507
   37   HD13  LEU  21          HD13      LEU  21 -56.163 -17.129  -5.759
   38   HD21  LEU  21          HD21      LEU  21 -57.939 -18.687  -4.748
   39   HD22  LEU  21          HD22      LEU  21 -58.909 -19.673  -5.842
   40   HD23  LEU  21          HD23      LEU  21 -59.109 -17.920  -5.823
   41    H    ASP  22           H        ASP  22 -56.276 -19.436 -11.057
   42    HA   ASP  22           HA       ASP  22 -53.593 -19.871  -9.918
   43    HB2  ASP  22           HB1      ASP  22 -54.484 -21.355 -11.873
   44    HB3  ASP  22           HB2      ASP  22 -54.145 -19.930 -12.867
   45    HD2  ASP  22           HD       ASP  22 -50.675 -20.268 -12.318
   46    H    PHE  23           H        PHE  23 -53.187 -17.804  -9.216
   47    HA   PHE  23           HA       PHE  23 -53.158 -15.711 -11.290
   48    HB2  PHE  23           HB1      PHE  23 -54.645 -15.537  -9.112
   49    HB3  PHE  23           HB2      PHE  23 -53.120 -15.037  -8.376
   50    HD1  PHE  23           HD1      PHE  23 -55.788 -14.093 -10.651
   51    HD2  PHE  23           HD2      PHE  23 -51.988 -12.986  -9.086
   52    HE1  PHE  23           HE1      PHE  23 -56.115 -11.801 -11.485
   53    HE2  PHE  23           HE2      PHE  23 -52.310 -10.692  -9.915
   54    HZ   PHE  23           HZ       PHE  23 -54.376 -10.097 -11.115
   55    H    ASN  24           H        ASN  24 -51.361 -17.392  -8.840
   56    HA   ASN  24           HA       ASN  24 -49.154 -17.434  -8.293
   57    HB2  ASN  24           HB1      ASN  24 -48.555 -15.919 -10.828
   58    HB3  ASN  24           HB2      ASN  24 -47.583 -17.157 -10.022
   59   HD21  ASN  24          HD21      ASN  24 -48.140 -19.333 -10.235
   60   HD22  ASN  24          HD22      ASN  24 -49.175 -19.886 -11.502
   61    H    ASN  25           H        ASN  25 -47.078 -15.838  -8.327
   62    HA   ASN  25           HA       ASN  25 -48.032 -13.186  -7.478
   63    HB2  ASN  25           HB1      ASN  25 -46.576 -15.223  -5.950
   64    HB3  ASN  25           HB2      ASN  25 -45.805 -13.634  -5.914
   65   HD21  ASN  25          HD21      ASN  25 -46.427 -12.358  -4.341
   66   HD22  ASN  25          HD22      ASN  25 -47.959 -12.390  -3.543
   67    H    ILE  26           H        ILE  26 -46.906 -11.485  -8.227
   68    HA   ILE  26           HA       ILE  26 -44.264 -11.961  -9.419
   69    HB   ILE  26           HB       ILE  26 -46.434 -10.321 -10.729
   70   HG12  ILE  26          HG11      ILE  26 -46.883 -12.737 -10.853
   71   HG13  ILE  26          HG12      ILE  26 -46.484 -12.062 -12.442
   72   HG21  ILE  26          HG21      ILE  26 -44.507  -9.302 -11.433
   73   HG22  ILE  26          HG22      ILE  26 -43.548 -10.774 -11.297
   74   HG23  ILE  26          HG23      ILE  26 -44.659 -10.568 -12.651
   75   HD11  ILE  26          HD11      ILE  26 -45.266 -14.235 -11.105
   76   HD12  ILE  26          HD12      ILE  26 -44.887 -13.561 -12.691
   77   HD13  ILE  26          HD13      ILE  26 -44.072 -12.947 -11.253
   78    H    ARG  27           H        ARG  27 -43.105 -10.884  -7.894
   79    HA   ARG  27           HA       ARG  27 -43.900  -8.139  -7.224
   80    HB2  ARG  27           HB1      ARG  27 -43.503  -9.636  -5.331
   81    HB3  ARG  27           HB2      ARG  27 -41.865  -9.957  -5.923
   82    HG2  ARG  27           HG1      ARG  27 -41.421  -7.474  -5.691
   83    HG3  ARG  27           HG2      ARG  27 -42.953  -7.392  -4.805
   84    HD2  ARG  27           HD1      ARG  27 -42.036  -9.217  -3.293
   85    HD3  ARG  27           HD2      ARG  27 -40.473  -8.927  -4.070
   86    HE   ARG  27           HE       ARG  27 -40.257  -7.014  -2.836
   87   HH11  ARG  27          HH11      ARG  27 -43.591  -8.015  -2.797
   88   HH12  ARG  27          HH12      ARG  27 -44.068  -6.830  -1.626
   89   HH21  ARG  27          HH21      ARG  27 -40.873  -5.449  -1.295
   90   HH22  ARG  27          HH22      ARG  27 -42.521  -5.371  -0.773
   91    H    SER  28           H        SER  28 -42.744  -6.417  -7.863
   92    HA   SER  28           HA       SER  28 -40.440  -6.909  -9.595
   93    HB2  SER  28           HB1      SER  28 -41.672  -5.450 -10.821
   94    HB3  SER  28           HB2      SER  28 -42.512  -4.817  -9.395
   95    HG   SER  28           HG       SER  28 -41.174  -3.210  -9.394
   96    H    SER  29           H        SER  29 -41.317  -5.428  -6.568
   97    HA   SER  29           HA       SER  29 -40.039  -4.694  -4.826
   98    HB2  SER  29           HB1      SER  29 -37.531  -5.320  -6.378
   99    HB3  SER  29           HB2      SER  29 -37.797  -5.367  -4.626
  100    HG   SER  29           HG       SER  29 -38.592  -7.320  -4.782
  101    H    ALA  30           H        ALA  30 -37.969  -3.950  -7.630
  102    HA   ALA  30           HA       ALA  30 -37.078  -1.990  -8.375
  103    HB1  ALA  30           HB1      ALA  30 -39.002  -1.244  -9.300
  104    HB2  ALA  30           HB2      ALA  30 -39.915  -1.403  -7.799
  105    HB3  ALA  30           HB3      ALA  30 -38.856  -0.013  -8.045
  106    H    ASP  31           H        ASP  31 -35.426  -1.861  -6.816
  107    HA   ASP  31           HA       ASP  31 -35.510   0.504  -5.212
  108    HB2  ASP  31           HB1      ASP  31 -34.834  -0.827  -3.091
  109    HB3  ASP  31           HB2      ASP  31 -36.546  -0.716  -3.515
  110    HD2  ASP  31           HD       ASP  31 -36.702  -4.125  -3.403
  111    H    LEU  32           H        LEU  32 -33.421   0.934  -4.153
  112    HA   LEU  32           HA       LEU  32 -31.162   1.166  -4.285
  113    HB2  LEU  32           HB1      LEU  32 -31.156  -1.796  -4.879
  114    HB3  LEU  32           HB2      LEU  32 -29.845  -0.829  -4.179
  115    HG   LEU  32           HG       LEU  32 -32.452  -1.568  -2.856
  116   HD11  LEU  32          HD11      LEU  32 -30.511  -2.440  -1.224
  117   HD12  LEU  32          HD12      LEU  32 -29.693  -2.608  -2.777
  118   HD13  LEU  32          HD13      LEU  32 -31.228  -3.429  -2.496
  119   HD21  LEU  32          HD21      LEU  32 -30.487   0.537  -2.274
  120   HD22  LEU  32          HD22      LEU  32 -30.904  -0.494  -0.905
  121   HD23  LEU  32          HD23      LEU  32 -32.170   0.379  -1.769
  122    H    HIS  33           H        HIS  33 -32.477   1.831  -6.612
  123    HA   HIS  33           HA       HIS  33 -30.778   0.744  -8.752
  124    HB2  HIS  33           HB1      HIS  33 -33.129   0.508  -9.230
  125    HB3  HIS  33           HB2      HIS  33 -33.419   2.212  -8.866
  126    HD1  HIS  33           HD1      HIS  33 -34.072   3.210 -11.043
  127    HD2  HIS  33           HD2      HIS  33 -30.720   0.778 -11.384
  128    HE1  HIS  33           HE1      HIS  33 -33.280   3.485 -13.414
  129    HE2  HIS  33           HE2      HIS  33 -31.232   1.999 -13.623
  130    H    GLY  34           H        GLY  34 -28.937   1.948  -8.642
  131    HA2  GLY  34           HA2      GLY  34 -28.338   4.118  -9.924
  132    HA3  GLY  34           HA3      GLY  34 -29.204   4.876  -8.596
  133    HA1  GLY  34           HA1      GLY  34 -28.043   3.375  -9.554
  134    H    ALA  35           H        ALA  35 -26.588   5.538  -9.122
  135    HA   ALA  35           HA       ALA  35 -25.265   4.506  -6.714
  136    HB1  ALA  35           HB1      ALA  35 -23.781   4.944  -9.296
  137    HB2  ALA  35           HB2      ALA  35 -23.174   4.222  -7.806
  138    HB3  ALA  35           HB3      ALA  35 -24.379   3.370  -8.772
  139    H    ARG  36           H        ARG  36 -23.180   5.912  -6.337
  140    HA   ARG  36           HA       ARG  36 -23.941   8.730  -6.748
  141    HB2  ARG  36           HB1      ARG  36 -22.787   7.320  -4.352
  142    HB3  ARG  36           HB2      ARG  36 -22.591   9.066  -4.567
  143    HG2  ARG  36           HG1      ARG  36 -24.500   9.184  -3.391
  144    HG3  ARG  36           HG2      ARG  36 -25.250   8.829  -4.957
  145    HD2  ARG  36           HD1      ARG  36 -24.680   6.315  -4.094
  146    HD3  ARG  36           HD2      ARG  36 -24.983   7.142  -2.560
  147    HE   ARG  36           HE       ARG  36 -27.080   7.882  -4.133
  148   HH11  ARG  36          HH11      ARG  36 -25.710   4.835  -3.154
  149   HH12  ARG  36          HH12      ARG  36 -27.220   3.987  -3.216
  150   HH21  ARG  36          HH21      ARG  36 -29.074   6.778  -4.218
  151   HH22  ARG  36          HH22      ARG  36 -29.133   5.093  -3.822
  152    H    LYS  37           H        LYS  37 -22.482  10.030  -7.670
  153    HA   LYS  37           HA       LYS  37 -19.814   8.927  -8.209
  154    HB2  LYS  37           HB1      LYS  37 -21.468   9.727 -10.058
  155    HB3  LYS  37           HB2      LYS  37 -20.943  11.348  -9.575
  156    HG2  LYS  37           HG1      LYS  37 -18.717  10.955 -10.225
  157    HG3  LYS  37           HG2      LYS  37 -18.985   9.206 -10.336
  158    HD2  LYS  37           HD1      LYS  37 -20.852  10.532 -12.055
  159    HD3  LYS  37           HD2      LYS  37 -19.221  11.144 -12.383
  160    HE2  LYS  37           HE1      LYS  37 -19.536   8.200 -12.073
  161    HE3  LYS  37           HE2      LYS  37 -20.188   8.946 -13.540
  162    HZ1  LYS  37           HZ1      LYS  37 -17.883  10.058 -13.668
  163    HZ2  LYS  37           HZ2      LYS  37 -18.035   8.440 -14.136
  164    HZ3  LYS  37           HZ3      LYS  37 -17.393   8.825 -12.618
  165    H    GLY  38           H        GLY  38 -18.811   9.486  -6.262
  166    HA2  GLY  38           HA2      GLY  38 -18.666  12.364  -5.654
  167    HA3  GLY  38           HA3      GLY  38 -18.295  11.069  -4.526
  168    HA1  GLY  38           HA1      GLY  38 -18.364  12.038  -6.418
  169    H    SER  39           H        SER  39 -16.217  10.723  -4.148
  170    HA   SER  39           HA       SER  39 -14.274  11.481  -6.232
  171    HB2  SER  39           HB1      SER  39 -12.726  12.198  -4.494
  172    HB3  SER  39           HB2      SER  39 -14.265  13.057  -4.309
  173    HG   SER  39           HG       SER  39 -13.201  12.015  -2.371
  174    H    GLN  40           H        GLN  40 -12.330  10.250  -6.321
  175    HA   GLN  40           HA       GLN  40 -12.676   7.491  -6.107
  176    HB2  GLN  40           HB1      GLN  40 -10.694   9.269  -7.073
  177    HB3  GLN  40           HB2      GLN  40  -9.884   8.137  -5.979
  178    HG2  GLN  40           HG1      GLN  40 -11.331   6.376  -7.364
  179    HG3  GLN  40           HG2      GLN  40 -11.189   7.646  -8.585
  180   HE21  GLN  40          HE21      GLN  40  -8.999   8.419  -9.066
  181   HE22  GLN  40          HE22      GLN  40  -7.695   7.287  -9.012
  182    H    CYS  41           H        CYS  41 -10.332   9.409  -4.220
  183    HA   CYS  41           HA       CYS  41 -10.970   7.762  -1.875
  184    HB2  CYS  41           HB1      CYS  41  -8.546   7.648  -1.325
  185    HB3  CYS  41           HB2      CYS  41  -8.973   6.766  -2.791
  186    H    LEU  42           H        LEU  42 -10.844   8.797   0.085
  187    HA   LEU  42           HA       LEU  42 -10.602  11.709  -0.054
  188    HB2  LEU  42           HB1      LEU  42 -12.196   9.821   1.471
  189    HB3  LEU  42           HB2      LEU  42 -11.400  11.013   2.516
  190    HG   LEU  42           HG       LEU  42 -12.452  12.620   0.587
  191   HD11  LEU  42          HD11      LEU  42 -13.710  10.152   0.184
  192   HD12  LEU  42          HD12      LEU  42 -14.171  11.718  -0.483
  193   HD13  LEU  42          HD13      LEU  42 -14.884  11.160   1.031
  194   HD21  LEU  42          HD21      LEU  42 -12.698  13.213   2.826
  195   HD22  LEU  42          HD22      LEU  42 -13.485  11.690   3.245
  196   HD23  LEU  42          HD23      LEU  42 -14.352  12.902   2.299
  197    H    SER  43           H        SER  43  -9.141   8.901   1.415
  198    HA   SER  43           HA       SER  43  -6.860  10.494   2.215
  199    HB2  SER  43           HB1      SER  43  -8.439  10.574   4.170
  200    HB3  SER  43           HB2      SER  43  -8.286   8.811   4.287
  201    HG   SER  43           HG       SER  43  -6.371  10.799   4.800
  202    H    ASP  44           H        ASP  44  -5.199   8.945   3.337
  203    HA   ASP  44           HA       ASP  44  -4.480   6.989   1.480
  204    HB2  ASP  44           HB1      ASP  44  -2.655   6.503   2.865
  205    HB3  ASP  44           HB2      ASP  44  -3.033   8.187   3.248
  206    HD2  ASP  44           HD       ASP  44  -3.724   5.444   6.027
  207    H    THR  45           H        THR  45  -6.508   6.817   4.293
  208    HA   THR  45           HA       THR  45  -6.442   4.001   4.646
  209    HB   THR  45           HB       THR  45  -8.659   4.403   5.857
  210    HG1  THR  45           HG1      THR  45  -9.423   6.406   5.939
  211   HG21  THR  45          HG21      THR  45  -7.527   4.935   7.769
  212   HG22  THR  45          HG22      THR  45  -6.622   6.240   7.001
  213   HG23  THR  45          HG23      THR  45  -6.152   4.561   6.731
  214    H    ASP  46           H        ASP  46  -8.175   6.114   2.510
  215    HA   ASP  46           HA       ASP  46 -10.257   4.283   1.828
  216    HB2  ASP  46           HB1      ASP  46  -9.446   6.971   1.097
  217    HB3  ASP  46           HB2      ASP  46  -9.915   6.036  -0.331
  218    HD2  ASP  46           HD       ASP  46 -13.172   5.566   1.174
  219    H    CYS  47           H        CYS  47  -6.998   4.815   0.745
  220    HA   CYS  47           HA       CYS  47  -7.385   2.829  -1.395
  221    HB2  CYS  47           HB1      CYS  47  -5.601   5.211  -1.120
  222    HB3  CYS  47           HB2      CYS  47  -5.012   3.833  -2.051
  223    H    ASN  48           H        ASN  48  -7.134   0.993  -0.120
  224    HA   ASN  48           HA       ASN  48  -4.593   0.686   1.309
  225    HB2  ASN  48           HB1      ASN  48  -7.238  -0.746   1.420
  226    HB3  ASN  48           HB2      ASN  48  -5.775  -1.516   2.050
  227   HD21  ASN  48          HD21      ASN  48  -8.059  -0.800   3.565
  228   HD22  ASN  48          HD22      ASN  48  -7.565   0.375   4.733
  229    H    THR  49           H        THR  49  -4.962   0.590  -1.656
  230    HA   THR  49           HA       THR  49  -4.311  -2.197  -2.249
  231    HB   THR  49           HB       THR  49  -4.356  -0.119  -4.386
  232    HG1  THR  49           HG1      THR  49  -6.477   0.182  -4.258
  233   HG21  THR  49          HG21      THR  49  -5.503  -1.988  -5.593
  234   HG22  THR  49          HG22      THR  49  -5.278  -2.984  -4.155
  235   HG23  THR  49          HG23      THR  49  -3.876  -2.377  -5.037
  236    H    ARG  50           H        ARG  50  -2.425  -0.665  -0.742
  237    HA   ARG  50           HA       ARG  50  -0.184  -0.294  -0.637
  238    HB2  ARG  50           HB1      ARG  50  -0.014  -1.637  -3.341
  239    HB3  ARG  50           HB2      ARG  50   1.262  -1.498  -2.122
  240    HG2  ARG  50           HG1      ARG  50   0.091  -2.992  -0.634
  241    HG3  ARG  50           HG2      ARG  50  -1.285  -3.058  -1.747
  242    HD2  ARG  50           HD1      ARG  50  -0.148  -5.023  -2.245
  243    HD3  ARG  50           HD2      ARG  50   0.444  -3.898  -3.475
  244    HE   ARG  50           HE       ARG  50   2.532  -4.129  -2.598
  245   HH11  ARG  50          HH11      ARG  50   0.207  -5.020  -0.165
  246   HH12  ARG  50          HH12      ARG  50   1.405  -5.527   0.981
  247   HH21  ARG  50          HH21      ARG  50   4.118  -4.793  -1.099
  248   HH22  ARG  50          HH22      ARG  50   3.629  -5.397   0.448
  249    H    LYS  51           H        LYS  51  -1.816   1.753  -1.664
  250    HA   LYS  51           HA       LYS  51   0.177   3.239  -3.181
  251    HB2  LYS  51           HB1      LYS  51  -2.701   2.962  -4.084
  252    HB3  LYS  51           HB2      LYS  51  -1.507   4.064  -4.790
  253    HG2  LYS  51           HG1      LYS  51  -0.177   2.232  -5.586
  254    HG3  LYS  51           HG2      LYS  51  -1.212   1.068  -4.735
  255    HD2  LYS  51           HD1      LYS  51  -3.138   2.000  -6.145
  256    HD3  LYS  51           HD2      LYS  51  -1.875   2.751  -7.137
  257    HE2  LYS  51           HE1      LYS  51  -1.811   0.831  -8.285
  258    HE3  LYS  51           HE2      LYS  51  -0.999   0.150  -6.866
  259    HZ1  LYS  51           HZ1      LYS  51  -3.892   0.218  -6.713
  260    HZ2  LYS  51           HZ2      LYS  51  -2.812  -1.008  -6.276
  261    HZ3  LYS  51           HZ3      LYS  51  -3.263  -0.817  -7.896
  262    H    PHE  52           H        PHE  52  -0.200   5.556  -3.160
  263    HA   PHE  52           HA       PHE  52  -1.585   6.368  -0.713
  264    HB2  PHE  52           HB1      PHE  52  -0.291   8.482  -0.956
  265    HB3  PHE  52           HB2      PHE  52   0.728   7.048  -0.822
  266    HD1  PHE  52           HD1      PHE  52   2.352   6.581  -2.415
  267    HD2  PHE  52           HD2      PHE  52  -0.733   9.368  -3.325
  268    HE1  PHE  52           HE1      PHE  52   3.512   7.178  -4.501
  269    HE2  PHE  52           HE2      PHE  52   0.423   9.969  -5.413
  270    HZ   PHE  52           HZ       PHE  52   2.548   8.873  -6.003
  271    H    CYS  53           H        CYS  53  -3.016   8.131  -0.664
  272    HA   CYS  53           HA       CYS  53  -4.531   8.460  -3.121
  273    HB2  CYS  53           HB1      CYS  53  -5.711   7.991  -1.015
  274    HB3  CYS  53           HB2      CYS  53  -5.070   9.482  -0.324
  275    H    LEU  54           H        LEU  54  -3.381   9.819  -4.438
  276    HA   LEU  54           HA       LEU  54  -2.126  12.206  -3.545
  277    HB2  LEU  54           HB1      LEU  54  -1.850  10.733  -5.739
  278    HB3  LEU  54           HB2      LEU  54  -3.009  11.915  -6.369
  279    HG   LEU  54           HG       LEU  54  -0.716  12.528  -6.927
  280   HD11  LEU  54          HD11      LEU  54  -1.991  14.359  -4.901
  281   HD12  LEU  54          HD12      LEU  54  -2.342  14.303  -6.627
  282   HD13  LEU  54          HD13      LEU  54  -0.753  14.823  -6.068
  283   HD21  LEU  54          HD21      LEU  54   0.979  12.388  -5.496
  284   HD22  LEU  54          HD22      LEU  54  -0.132  11.615  -4.365
  285   HD23  LEU  54          HD23      LEU  54   0.130  13.358  -4.293
  286    H    GLN  55           H        GLN  55  -3.210  13.883  -2.754
  287    HA   GLN  55           HA       GLN  55  -5.743  14.651  -4.050
  288    HB2  GLN  55           HB1      GLN  55  -6.249  15.797  -1.849
  289    HB3  GLN  55           HB2      GLN  55  -6.248  14.027  -1.820
  290    HG2  GLN  55           HG1      GLN  55  -4.639  13.950  -0.293
  291    HG3  GLN  55           HG2      GLN  55  -3.634  15.086  -1.203
  292   HE21  GLN  55          HE21      GLN  55  -6.660  15.165   0.656
  293   HE22  GLN  55          HE22      GLN  55  -6.275  16.598   1.542
  294    HA   PRO  56           HA       PRO  56  -2.848  18.060  -5.041
  295    HB2  PRO  56           HB1      PRO  56  -4.049  18.671  -7.425
  296    HB3  PRO  56           HB2      PRO  56  -2.849  17.392  -7.239
  297    HG2  PRO  56           HG1      PRO  56  -5.842  17.201  -7.275
  298    HG3  PRO  56           HG2      PRO  56  -4.624  16.177  -8.122
  299    HD2  PRO  56           HD1      PRO  56  -5.873  15.387  -5.844
  300    HD3  PRO  56           HD2      PRO  56  -4.200  14.939  -6.224
  301    H    ARG  57           H        ARG  57  -3.154  20.277  -4.926
  302    HA   ARG  57           HA       ARG  57  -5.664  21.122  -3.765
  303    HB2  ARG  57           HB1      ARG  57  -3.274  21.817  -3.047
  304    HB3  ARG  57           HB2      ARG  57  -3.365  22.947  -4.407
  305    HG2  ARG  57           HG1      ARG  57  -5.755  23.156  -2.835
  306    HG3  ARG  57           HG2      ARG  57  -4.328  23.313  -1.798
  307    HD2  ARG  57           HD1      ARG  57  -3.650  25.261  -2.764
  308    HD3  ARG  57           HD2      ARG  57  -4.266  24.794  -4.356
  309    HE   ARG  57           HE       ARG  57  -6.412  25.253  -2.568
  310   HH11  ARG  57          HH11      ARG  57  -3.987  26.918  -4.429
  311   HH12  ARG  57          HH12      ARG  57  -4.923  28.367  -4.597
  312   HH21  ARG  57          HH21      ARG  57  -7.655  27.154  -2.782
  313   HH22  ARG  57          HH22      ARG  57  -7.009  28.500  -3.659
  314    H    ASP  58           H        ASP  58  -4.036  21.337  -6.818
  315    HA   ASP  58           HA       ASP  58  -5.816  23.421  -7.800
  316    HB2  ASP  58           HB1      ASP  58  -3.213  22.802  -8.379
  317    HB3  ASP  58           HB2      ASP  58  -4.068  22.053  -9.733
  318    HD2  ASP  58           HD       ASP  58  -4.616  25.083 -11.217
  319    H    GLU  59           H        GLU  59  -5.526  19.987  -7.808
  320    HA   GLU  59           HA       GLU  59  -7.793  19.817  -9.682
  321    HB2  GLU  59           HB1      GLU  59  -5.218  18.562  -9.820
  322    HB3  GLU  59           HB2      GLU  59  -6.461  17.319  -9.607
  323    HG2  GLU  59           HG1      GLU  59  -6.778  19.462 -11.680
  324    HG3  GLU  59           HG2      GLU  59  -5.795  18.025 -11.992
  325    HE2  GLU  59           HE       GLU  59  -9.572  17.680 -12.518
  326    H    LYS  60           H        LYS  60  -8.719  17.391  -9.403
  327    HA   LYS  60           HA       LYS  60  -9.715  17.343  -6.683
  328    HB2  LYS  60           HB1      LYS  60 -10.555  16.301  -9.296
  329    HB3  LYS  60           HB2      LYS  60 -10.853  15.187  -7.951
  330    HG2  LYS  60           HG1      LYS  60 -11.755  17.567  -6.934
  331    HG3  LYS  60           HG2      LYS  60 -12.191  17.683  -8.648
  332    HD2  LYS  60           HD1      LYS  60 -12.812  15.240  -6.989
  333    HD3  LYS  60           HD2      LYS  60 -13.911  16.625  -7.098
  334    HE2  LYS  60           HE1      LYS  60 -13.497  16.262  -9.712
  335    HE3  LYS  60           HE2      LYS  60 -13.182  14.612  -9.155
  336    HZ1  LYS  60           HZ1      LYS  60 -15.429  14.569  -9.543
  337    HZ2  LYS  60           HZ2      LYS  60 -15.678  16.159  -9.024
  338    HZ3  LYS  60           HZ3      LYS  60 -15.402  14.934  -7.890
  339    HA   PRO  61           HA       PRO  61  -7.329  14.013  -5.111
  340    HB2  PRO  61           HB1      PRO  61  -9.168  12.597  -3.659
  341    HB3  PRO  61           HB2      PRO  61  -8.551  14.174  -3.172
  342    HG2  PRO  61           HG1      PRO  61 -11.092  13.489  -4.609
  343    HG3  PRO  61           HG2      PRO  61 -10.832  14.617  -3.226
  344    HD2  PRO  61           HD1      PRO  61 -11.116  15.477  -5.784
  345    HD3  PRO  61           HD2      PRO  61 -10.071  16.294  -4.611
  346    H    PHE  62           H        PHE  62  -6.686  11.946  -5.575
  347    HA   PHE  62           HA       PHE  62  -8.432   9.986  -6.699
  348    HB2  PHE  62           HB1      PHE  62  -7.572   9.852  -8.915
  349    HB3  PHE  62           HB2      PHE  62  -8.006  11.539  -8.643
  350    HD1  PHE  62           HD1      PHE  62  -5.536   9.447  -9.912
  351    HD2  PHE  62           HD2      PHE  62  -6.028  13.022  -7.654
  352    HE1  PHE  62           HE1      PHE  62  -3.264  10.153 -10.539
  353    HE2  PHE  62           HE2      PHE  62  -3.758  13.733  -8.279
  354    HZ   PHE  62           HZ       PHE  62  -2.372  12.299  -9.724
  355    H    CYS  63           H        CYS  63  -7.351   7.951  -7.109
  356    HA   CYS  63           HA       CYS  63  -5.116   7.571  -5.309
  357    HB2  CYS  63           HB1      CYS  63  -7.270   6.054  -5.795
  358    HB3  CYS  63           HB2      CYS  63  -6.161   5.326  -6.959
  359    H    ALA  64           H        ALA  64  -3.047   7.285  -5.864
  360    HA   ALA  64           HA       ALA  64  -2.409   6.777  -8.692
  361    HB1  ALA  64           HB1      ALA  64  -1.675   8.889  -8.794
  362    HB2  ALA  64           HB2      ALA  64  -1.658   9.068  -7.040
  363    HB3  ALA  64           HB3      ALA  64  -0.299   8.300  -7.861
  364    H    THR  65           H        THR  65  -0.681   5.447  -9.089
  365    HA   THR  65           HA       THR  65  -0.015   3.478  -7.274
  366    HB   THR  65           HB       THR  65   2.088   3.183  -8.766
  367    HG1  THR  65           HG1      THR  65   2.340   4.593 -10.330
  368   HG21  THR  65          HG21      THR  65  -0.737   3.024  -9.810
  369   HG22  THR  65          HG22      THR  65   0.205   1.746  -9.044
  370   HG23  THR  65          HG23      THR  65   0.650   2.328 -10.648
  371    H    CYS  66           H        CYS  66   2.156   2.970  -6.375
  372    HA   CYS  66           HA       CYS  66   3.024   5.068  -4.669
  373    HB2  CYS  66           HB1      CYS  66   4.735   3.446  -3.908
  374    HB3  CYS  66           HB2      CYS  66   3.104   2.773  -3.903
  375    H    ARG  67           H        ARG  67   5.097   6.041  -4.544
  376    HA   ARG  67           HA       ARG  67   6.100   6.993  -6.984
  377    HB2  ARG  67           HB1      ARG  67   7.282   7.000  -4.202
  378    HB3  ARG  67           HB2      ARG  67   8.012   7.847  -5.574
  379    HG2  ARG  67           HG1      ARG  67   5.193   8.357  -4.635
  380    HG3  ARG  67           HG2      ARG  67   6.601   9.260  -4.052
  381    HD2  ARG  67           HD1      ARG  67   7.021  10.221  -6.146
  382    HD3  ARG  67           HD2      ARG  67   6.050   9.004  -6.987
  383    HE   ARG  67           HE       ARG  67   4.272  10.310  -5.369
  384   HH11  ARG  67          HH11      ARG  67   6.511  11.251  -7.862
  385   HH12  ARG  67          HH12      ARG  67   5.565  12.605  -8.384
  386   HH21  ARG  67          HH21      ARG  67   3.015  12.089  -6.046
  387   HH22  ARG  67          HH22      ARG  67   3.576  13.081  -7.350
  388    H    GLY  68           H        GLY  68   7.306   5.994  -8.448
  389    HA2  GLY  68           HA2      GLY  68   8.457   3.456  -8.077
  390    HA3  GLY  68           HA3      GLY  68   8.789   4.539  -9.420
  391    HA1  GLY  68           HA1      GLY  68   8.577   3.984  -7.379
  392    H    LEU  69           H        LEU  69  10.906   3.251  -8.927
  393    HA   LEU  69           HA       LEU  69  12.503   4.035  -6.733
  394    HB2  LEU  69           HB1      LEU  69  12.906   2.610  -9.298
  395    HB3  LEU  69           HB2      LEU  69  14.343   3.354  -8.574
  396    HG   LEU  69           HG       LEU  69  12.563   1.312  -7.243
  397   HD11  LEU  69          HD11      LEU  69  14.006  -0.313  -7.865
  398   HD12  LEU  69          HD12      LEU  69  15.401   0.767  -7.860
  399   HD13  LEU  69          HD13      LEU  69  14.280   0.779  -9.222
  400   HD21  LEU  69          HD21      LEU  69  15.068   2.715  -6.336
  401   HD22  LEU  69          HD22      LEU  69  14.439   1.253  -5.580
  402   HD23  LEU  69          HD23      LEU  69  13.480   2.733  -5.569
  403    H    ARG  70           H        ARG  70  11.996   5.387  -9.927
  404    HA   ARG  70           HA       ARG  70  14.102   7.362  -9.536
  405    HB2  ARG  70           HB1      ARG  70  12.204   6.866 -11.842
  406    HB3  ARG  70           HB2      ARG  70  13.458   8.116 -11.824
  407    HG2  ARG  70           HG1      ARG  70  15.073   6.133 -11.333
  408    HG3  ARG  70           HG2      ARG  70  13.753   5.153 -11.991
  409    HD2  ARG  70           HD1      ARG  70  14.726   7.566 -13.488
  410    HD3  ARG  70           HD2      ARG  70  15.610   6.037 -13.579
  411    HE   ARG  70           HE       ARG  70  12.934   5.476 -14.092
  412   HH11  ARG  70          HH11      ARG  70  15.541   7.289 -15.518
  413   HH12  ARG  70          HH12      ARG  70  14.958   7.100 -17.140
  414   HH21  ARG  70          HH21      ARG  70  12.157   5.221 -16.221
  415   HH22  ARG  70          HH22      ARG  70  13.032   5.925 -17.537
  416    H    ARG  71           H        ARG  71  11.299   7.128  -8.162
  417    HA   ARG  71           HA       ARG  71  10.364   9.852  -8.729
  418    HB2  ARG  71           HB1      ARG  71   9.067   7.446  -7.466
  419    HB3  ARG  71           HB2      ARG  71   8.389   9.069  -7.270
  420    HG2  ARG  71           HG1      ARG  71   8.866   7.683  -9.911
  421    HG3  ARG  71           HG2      ARG  71   7.306   7.837  -9.083
  422    HD2  ARG  71           HD1      ARG  71   7.636  10.347  -9.160
  423    HD3  ARG  71           HD2      ARG  71   9.004  10.037 -10.238
  424    HE   ARG  71           HE       ARG  71   7.532   9.575 -11.934
  425   HH11  ARG  71          HH11      ARG  71   5.829   9.582  -8.897
  426   HH12  ARG  71          HH12      ARG  71   4.261   9.482  -9.628
  427   HH21  ARG  71          HH21      ARG  71   5.473   9.444 -12.907
  428   HH22  ARG  71          HH22      ARG  71   4.059   9.403 -11.908
  429    H    ARG  72           H        ARG  72  10.197  11.395  -7.133
  430    HA   ARG  72           HA       ARG  72  12.045  11.222  -4.988
  431    HB2  ARG  72           HB1      ARG  72   9.864  13.243  -5.565
  432    HB3  ARG  72           HB2      ARG  72  11.112  13.433  -4.324
  433    HG2  ARG  72           HG1      ARG  72  12.031  12.882  -7.092
  434    HG3  ARG  72           HG2      ARG  72  11.344  14.480  -6.752
  435    HD2  ARG  72           HD1      ARG  72  12.947  14.397  -4.668
  436    HD3  ARG  72           HD2      ARG  72  13.803  13.199  -5.649
  437    HE   ARG  72           HE       ARG  72  13.463  15.291  -7.349
  438   HH11  ARG  72          HH11      ARG  72  14.815  14.950  -4.159
  439   HH12  ARG  72          HH12      ARG  72  15.955  16.239  -4.363
  440   HH21  ARG  72          HH21      ARG  72  14.959  16.989  -7.629
  441   HH22  ARG  72          HH22      ARG  72  16.036  17.399  -6.336
  442    H    CYS  73           H        CYS  73  11.656  11.255  -2.742
  443    HA   CYS  73           HA       CYS  73   8.962  10.641  -1.811
  444    HB2  CYS  73           HB1      CYS  73   9.538   8.613  -0.715
  445    HB3  CYS  73           HB2      CYS  73  10.119   8.466  -2.373
  446    H    GLN  74           H        GLN  74   8.616  11.097   0.368
  447    HA   GLN  74           HA       GLN  74  10.824  12.526   1.697
  448    HB2  GLN  74           HB1      GLN  74   8.624  13.739   0.870
  449    HB3  GLN  74           HB2      GLN  74   7.973  13.087   2.381
  450    HG2  GLN  74           HG1      GLN  74   8.737  14.957   3.320
  451    HG3  GLN  74           HG2      GLN  74  10.323  14.179   3.219
  452   HE21  GLN  74          HE21      GLN  74   9.569  17.015   3.130
  453   HE22  GLN  74          HE22      GLN  74  10.231  17.630   1.659
  454    H    ARG  75           H        ARG  75   8.358  10.111   1.972
  455    HA   ARG  75           HA       ARG  75   9.188   9.611   4.755
  456    HB2  ARG  75           HB1      ARG  75   6.605  10.111   3.754
  457    HB3  ARG  75           HB2      ARG  75   6.665   8.377   4.105
  458    HG2  ARG  75           HG1      ARG  75   7.504   8.931   6.393
  459    HG3  ARG  75           HG2      ARG  75   7.205  10.636   6.015
  460    HD2  ARG  75           HD1      ARG  75   5.028  10.435   6.455
  461    HD3  ARG  75           HD2      ARG  75   4.896   9.048   5.366
  462    HE   ARG  75           HE       ARG  75   5.013   7.643   7.175
  463   HH11  ARG  75          HH11      ARG  75   5.967  10.851   8.134
  464   HH12  ARG  75          HH12      ARG  75   5.992  10.479   9.826
  465   HH21  ARG  75          HH21      ARG  75   5.043   7.141   9.401
  466   HH22  ARG  75          HH22      ARG  75   5.468   8.368  10.545
  467    H    ASP  76           H        ASP  76   9.515   7.471   5.389
  468    HA   ASP  76           HA       ASP  76  10.701   5.764   3.546
  469    HB2  ASP  76           HB1      ASP  76  10.295   3.981   5.378
  470    HB3  ASP  76           HB2      ASP  76  11.296   5.385   5.775
  471    HD2  ASP  76           HD       ASP  76   7.977   4.833   7.766
  472    H    ALA  77           H        ALA  77   7.373   5.929   4.658
  473    HA   ALA  77           HA       ALA  77   6.602   3.511   3.279
  474    HB1  ALA  77           HB1      ALA  77   4.642   5.515   4.314
  475    HB2  ALA  77           HB2      ALA  77   4.524   3.756   4.256
  476    HB3  ALA  77           HB3      ALA  77   5.579   4.532   5.438
  477    H    MET  78           H        MET  78   6.652   6.933   2.647
  478    HA   MET  78           HA       MET  78   4.760   7.145   0.624
  479    HB2  MET  78           HB1      MET  78   7.053   8.678   1.570
  480    HB3  MET  78           HB2      MET  78   6.820   8.824  -0.179
  481    HG2  MET  78           HG1      MET  78   4.693   9.351   1.900
  482    HG3  MET  78           HG2      MET  78   5.670  10.583   1.096
  483    HE1  MET  78           HE1      MET  78   5.698  10.278  -1.971
  484    HE2  MET  78           HE2      MET  78   4.172  11.117  -2.254
  485    HE3  MET  78           HE3      MET  78   5.237  11.638  -0.947
  486    H    CYS  79           H        CYS  79   7.890   5.663   0.602
  487    HA   CYS  79           HA       CYS  79   8.093   5.582  -2.280
  488    HB2  CYS  79           HB1      CYS  79  10.062   5.710  -0.689
  489    HB3  CYS  79           HB2      CYS  79   9.734   4.026  -0.278
  490    H    CYS  80           H        CYS  80   8.113   3.641  -3.529
  491    HA   CYS  80           HA       CYS  80   5.935   1.981  -3.189
  492    HB2  CYS  80           HB1      CYS  80   8.449   1.802  -4.800
  493    HB3  CYS  80           HB2      CYS  80   7.399   0.387  -4.719
  494    HA   PRO  81           HA       PRO  81   6.968  -1.134  -0.281
  495    HB2  PRO  81           HB1      PRO  81   5.866  -3.379  -1.402
  496    HB3  PRO  81           HB2      PRO  81   4.912  -2.073  -0.699
  497    HG2  PRO  81           HG1      PRO  81   5.623  -2.576  -3.569
  498    HG3  PRO  81           HG2      PRO  81   4.032  -2.124  -2.850
  499    HD2  PRO  81           HD1      PRO  81   5.643  -0.327  -4.093
  500    HD3  PRO  81           HD2      PRO  81   4.617   0.102  -2.713
  501    H    GLY  82           H        GLY  82   8.985  -1.827   0.053
  502    HA2  GLY  82           HA2      GLY  82  10.639  -3.524  -0.189
  503    HA3  GLY  82           HA3      GLY  82  10.140  -3.731  -1.861
  504    HA1  GLY  82           HA1      GLY  82  10.576  -2.652  -0.082
  505    H    THR  83           H        THR  83  10.905  -0.709  -0.192
  506    HA   THR  83           HA       THR  83  13.477  -0.497  -1.500
  507    HB   THR  83           HB       THR  83  12.495   1.919  -2.290
  508    HG1  THR  83           HG1      THR  83  10.400   0.046  -2.296
  509   HG21  THR  83          HG21      THR  83  12.583  -0.659  -3.862
  510   HG22  THR  83          HG22      THR  83  13.897   0.499  -3.653
  511   HG23  THR  83          HG23      THR  83  12.463   0.948  -4.576
  512    H    LEU  84           H        LEU  84  14.402   1.796  -1.062
  513    HA   LEU  84           HA       LEU  84  13.574   2.650   1.633
  514    HB2  LEU  84           HB1      LEU  84  16.165   1.747   0.623
  515    HB3  LEU  84           HB2      LEU  84  16.239   3.312   1.452
  516    HG   LEU  84           HG       LEU  84  16.748   1.398   2.929
  517   HD11  LEU  84          HD11      LEU  84  15.340   2.098   4.770
  518   HD12  LEU  84          HD12      LEU  84  14.204   2.848   3.648
  519   HD13  LEU  84          HD13      LEU  84  15.833   3.500   3.820
  520   HD21  LEU  84          HD21      LEU  84  14.835   0.044   1.650
  521   HD22  LEU  84          HD22      LEU  84  13.895   0.614   3.030
  522   HD23  LEU  84          HD23      LEU  84  15.350  -0.349   3.289
  523    H    CYS  85           H        CYS  85  14.248   4.877   2.187
  524    HA   CYS  85           HA       CYS  85  13.987   6.617  -0.166
  525    HB2  CYS  85           HB1      CYS  85  13.020   6.743   2.631
  526    HB3  CYS  85           HB2      CYS  85  13.548   8.276   1.931
  527    H    VAL  86           H        VAL  86  15.909   7.291  -0.870
  528    HA   VAL  86           HA       VAL  86  17.792   8.392   1.107
  529    HB   VAL  86           HB       VAL  86  18.543   6.772  -1.331
  530   HG11  VAL  86          HG11      VAL  86  20.848   7.044  -0.562
  531   HG12  VAL  86          HG12      VAL  86  20.107   8.604  -0.926
  532   HG13  VAL  86          HG13      VAL  86  20.291   8.084   0.750
  533   HG21  VAL  86          HG21      VAL  86  17.695   5.426   0.547
  534   HG22  VAL  86          HG22      VAL  86  19.409   5.142   0.244
  535   HG23  VAL  86          HG23      VAL  86  18.908   6.153   1.600
  536    H    ASN  87           H        ASN  87  18.735  10.308   0.587
  537    HA   ASN  87           HA       ASN  87  19.022  12.314  -0.445
  538    HB2  ASN  87           HB1      ASN  87  19.944  10.443  -2.177
  539    HB3  ASN  87           HB2      ASN  87  18.703  11.213  -3.174
  540   HD21  ASN  87          HD21      ASN  87  19.154  13.074  -4.147
  541   HD22  ASN  87          HD22      ASN  87  20.565  14.030  -3.867
  542    H    ASP  88           H        ASP  88  16.334  11.458   0.206
  543    HA   ASP  88           HA       ASP  88  14.199  12.208  -0.023
  544    HB2  ASP  88           HB1      ASP  88  15.102  14.204  -2.082
  545    HB3  ASP  88           HB2      ASP  88  13.845  14.366  -0.848
  546    HD2  ASP  88           HD       ASP  88  17.523  15.365   0.073
  547    H    VAL  89           H        VAL  89  15.417  10.211  -1.882
  548    HA   VAL  89           HA       VAL  89  13.201  10.146  -3.771
  549    HB   VAL  89           HB       VAL  89  15.012  11.288  -5.000
  550   HG11  VAL  89          HG11      VAL  89  16.539   8.762  -4.398
  551   HG12  VAL  89          HG12      VAL  89  17.015   9.926  -5.637
  552   HG13  VAL  89          HG13      VAL  89  16.962  10.412  -3.941
  553   HG21  VAL  89          HG21      VAL  89  14.482   8.488  -5.991
  554   HG22  VAL  89          HG22      VAL  89  13.392   9.862  -6.179
  555   HG23  VAL  89          HG23      VAL  89  14.966   9.870  -6.973
  556    H    CYS  90           H        CYS  90  12.711   8.073  -4.542
  557    HA   CYS  90           HA       CYS  90  13.186   5.950  -2.794
  558    HB2  CYS  90           HB1      CYS  90  12.144   6.100  -5.615
  559    HB3  CYS  90           HB2      CYS  90  12.348   4.545  -4.806
  560    H    THR  91           H        THR  91  14.621   4.293  -2.738
  561    HA   THR  91           HA       THR  91  16.455   3.835  -4.933
  562    HB   THR  91           HB       THR  91  17.495   4.709  -2.230
  563    HG1  THR  91           HG1      THR  91  18.057   5.938  -4.714
  564   HG21  THR  91          HG21      THR  91  18.836   2.905  -3.235
  565   HG22  THR  91          HG22      THR  91  19.714   4.434  -3.198
  566   HG23  THR  91          HG23      THR  91  19.004   3.862  -4.706
  567    H    THR  92           H        THR  92  17.102   1.756  -5.025
  568    HA   THR  92           HA       THR  92  15.856  -0.240  -3.587
  569    HB   THR  92           HB       THR  92  17.480  -1.795  -4.483
  570    HG1  THR  92           HG1      THR  92  19.019   0.398  -5.419
  571   HG21  THR  92          HG21      THR  92  16.684  -1.567  -6.562
  572   HG22  THR  92          HG22      THR  92  17.511  -0.026  -6.792
  573   HG23  THR  92          HG23      THR  92  15.936  -0.073  -6.002
  574    H    MET  93           H        MET  93  16.524  -1.655  -1.931
  575    HA   MET  93           HA       MET  93  17.869  -0.404   0.227
  576    HB2  MET  93           HB1      MET  93  16.089  -2.028   0.597
  577    HB3  MET  93           HB2      MET  93  17.067  -3.293  -0.163
  578    HG2  MET  93           HG1      MET  93  18.407  -3.571   1.652
  579    HG3  MET  93           HG2      MET  93  18.268  -1.878   2.137
  580    HE1  MET  93           HE1      MET  93  18.330  -2.510   4.349
  581    HE2  MET  93           HE2      MET  93  16.867  -2.714   5.312
  582    HE3  MET  93           HE3      MET  93  17.772  -4.129   4.774
  583    H    GLU  94           H        GLU  94  18.841  -2.746  -2.203
  584    HA   GLU  94           HA       GLU  94  21.252  -3.585  -1.044
  585    HB2  GLU  94           HB1      GLU  94  20.586  -3.296  -3.985
  586    HB3  GLU  94           HB2      GLU  94  21.899  -4.273  -3.306
  587    HG2  GLU  94           HG1      GLU  94  20.015  -5.476  -1.995
  588    HG3  GLU  94           HG2      GLU  94  18.953  -4.754  -3.213
  589    HE2  GLU  94           HE       GLU  94  20.798  -6.654  -5.714
  590    H    ASP  95           H        ASP  95  20.422  -0.726  -2.877
  591    HA   ASP  95           HA       ASP  95  23.217   0.114  -2.998
  592    HB2  ASP  95           HB1      ASP  95  21.554   0.350  -4.943
  593    HB3  ASP  95           HB2      ASP  95  20.848   1.678  -4.010
  594    HD2  ASP  95           HD       ASP  95  23.685   3.688  -4.519
  595    H    ALA  96           H        ALA  96  20.261   0.774  -1.292
  596    HA   ALA  96           HA       ALA  96  21.045   3.288  -0.201
  597    HB1  ALA  96           HB1      ALA  96  18.930   1.311   0.630
  598    HB2  ALA  96           HB2      ALA  96  19.154   2.890   1.384
  599    HB3  ALA  96           HB3      ALA  96  18.716   2.782  -0.320
  600    H    THR  97           H        THR  97  21.765   3.769   1.889
  601    HA   THR  97           HA       THR  97  22.984   3.507   3.794
  602    HB   THR  97           HB       THR  97  22.446   0.587   3.984
  603    HG1  THR  97           HG1      THR  97  20.281   1.426   4.891
  604   HG21  THR  97          HG21      THR  97  23.410   1.343   5.926
  605   HG22  THR  97          HG22      THR  97  21.707   1.568   6.325
  606   HG23  THR  97          HG23      THR  97  22.677   2.942   5.795
  607    H    GLU  98           H        GLU  98  24.370   3.349   1.412
  608    HA   GLU  98           HA       GLU  98  26.091   1.059   1.357
  609    HB2  GLU  98           HB1      GLU  98  25.464   2.542  -0.618
  610    HB3  GLU  98           HB2      GLU  98  26.616   3.717   0.036
  611    HG2  GLU  98           HG1      GLU  98  28.258   1.665  -0.001
  612    HG3  GLU  98           HG2      GLU  98  27.122   1.071  -1.219
  613    HE2  GLU  98           HE       GLU  98  27.992   3.715  -3.410
  614    H    ASN  99           H        ASN  99  28.031   0.766   2.291
  615    HA   ASN  99           HA       ASN  99  28.815   2.379   4.466
  616    HB2  ASN  99           HB1      ASN  99  30.160   0.138   2.958
  617    HB3  ASN  99           HB2      ASN  99  30.971   0.973   4.289
  618   HD21  ASN  99          HD21      ASN  99  29.776  -1.803   3.840
  619   HD22  ASN  99          HD22      ASN  99  28.848  -2.077   5.272
  620    H    LEU 100           H        LEU 100  30.968   3.398   4.717
  621    HA   LEU 100           HA       LEU 100  31.769   4.781   2.241
  622    HB2  LEU 100           HB1      LEU 100  30.692   5.915   4.482
  623    HB3  LEU 100           HB2      LEU 100  32.432   6.074   4.788
  624    HG   LEU 100           HG       LEU 100  32.659   7.254   2.615
  625   HD11  LEU 100          HD11      LEU 100  30.832   6.470   1.353
  626   HD12  LEU 100          HD12      LEU 100  30.496   8.171   1.671
  627   HD13  LEU 100          HD13      LEU 100  29.673   6.921   2.603
  628   HD21  LEU 100          HD21      LEU 100  30.710   9.002   3.773
  629   HD22  LEU 100          HD22      LEU 100  32.470   9.114   3.809
  630   HD23  LEU 100          HD23      LEU 100  31.619   8.194   5.051
  631    H    TYR 101           H        TYR 101  34.028   5.540   2.205
  632    HA   TYR 101           HA       TYR 101  35.793   3.418   3.003
  633    HB2  TYR 101           HB1      TYR 101  35.795   5.534   1.072
  634    HB3  TYR 101           HB2      TYR 101  37.271   5.646   2.034
  635    HD1  TYR 101           HD1      TYR 101  39.083   4.673   1.002
  636    HD2  TYR 101           HD2      TYR 101  35.279   2.802   0.632
  637    HE1  TYR 101           HE1      TYR 101  40.108   2.860  -0.306
  638    HE2  TYR 101           HE2      TYR 101  36.295   0.984  -0.676
  639    HH   TYR 101           HH       TYR 101  38.338  -0.014  -1.165
  640    H    PHE 102           H        PHE 102  37.991   4.053   3.953
  641    HA   PHE 102           HA       PHE 102  37.697   6.094   6.044
  642    HB2  PHE 102           HB1      PHE 102  38.432   3.192   6.397
  643    HB3  PHE 102           HB2      PHE 102  38.949   4.415   7.559
  644    HD1  PHE 102           HD1      PHE 102  36.122   2.522   6.275
  645    HD2  PHE 102           HD2      PHE 102  37.334   5.606   8.946
  646    HE1  PHE 102           HE1      PHE 102  33.954   2.370   7.429
  647    HE2  PHE 102           HE2      PHE 102  35.169   5.459  10.106
  648    HZ   PHE 102           HZ       PHE 102  33.476   3.837   9.348
  649    H    GLN 103           H        GLN 103  39.159   5.995   3.492
  650    HA   GLN 103           HA       GLN 103  41.916   5.568   3.969
  651    HB2  GLN 103           HB1      GLN 103  40.237   6.516   1.805
  652    HB3  GLN 103           HB2      GLN 103  41.714   7.483   1.938
  653    HG2  GLN 103           HG1      GLN 103  42.436   4.745   2.191
  654    HG3  GLN 103           HG2      GLN 103  41.378   4.919   0.785
  655   HE21  GLN 103          HE21      GLN 103  42.430   5.242  -1.026
  656   HE22  GLN 103          HE22      GLN 103  43.917   6.102  -1.209
  657    H    SER 104           H        SER 104  43.591   7.255   3.935
  658    HA   SER 104           HA       SER 104  43.049   9.951   4.545
  659    HB2  SER 104           HB1      SER 104  42.634   8.240   6.732
  660    HB3  SER 104           HB2      SER 104  44.219   8.982   7.014
  661    HG   SER 104           HG       SER 104  41.860  10.073   7.408
  662    H    LEU 105           H        LEU 105  45.072  11.054   5.456
  663    HA   LEU 105           HA       LEU 105  47.456   9.695   4.382
  664    HB2  LEU 105           HB1      LEU 105  46.402  12.443   4.053
  665    HB3  LEU 105           HB2      LEU 105  48.154  12.292   4.280
  666    HG   LEU 105           HG       LEU 105  47.277  10.419   2.292
  667   HD11  LEU 105          HD11      LEU 105  46.100  11.632   0.786
  668   HD12  LEU 105          HD12      LEU 105  46.812  13.164   1.293
  669   HD13  LEU 105          HD13      LEU 105  45.525  12.430   2.250
  670   HD21  LEU 105          HD21      LEU 105  49.177  12.708   2.519
  671   HD22  LEU 105          HD22      LEU 105  48.825  12.028   0.929
  672   HD23  LEU 105          HD23      LEU 105  49.499  11.004   2.198
  673    H    GLU 106           H        GLU 106  48.704   9.043   6.005
  674    HA   GLU 106           HA       GLU 106  49.051  10.847   8.311
  675    HB2  GLU 106           HB1      GLU 106  48.635   7.919   8.127
  676    HB3  GLU 106           HB2      GLU 106  49.838   8.464   9.306
  677    HG2  GLU 106           HG1      GLU 106  47.033   9.556   9.196
  678    HG3  GLU 106           HG2      GLU 106  47.501   8.161  10.178
  679    HE2  GLU 106           HE       GLU 106  49.001  10.149  12.562
  680    H    HIS 107           H        HIS 107  50.936  11.862   8.072
  681    HA   HIS 107           HA       HIS 107  53.372  10.348   7.965
  682    HB2  HIS 107           HB1      HIS 107  52.282  11.155   5.513
  683    HB3  HIS 107           HB2      HIS 107  53.564  12.323   5.853
  684    HD1  HIS 107           HD1      HIS 107  55.451  11.588   4.413
  685    HD2  HIS 107           HD2      HIS 107  53.739   8.420   6.485
  686    HE1  HIS 107           HE1      HIS 107  56.909   9.598   3.924
  687    HE2  HIS 107           HE2      HIS 107  55.864   7.662   5.190
  688    H    HIS 108           H        HIS 108  55.272  11.684   8.299
  689    HA   HIS 108           HA       HIS 108  54.659  13.958   9.981
  690    HB2  HIS 108           HB1      HIS 108  57.097  12.316   9.402
  691    HB3  HIS 108           HB2      HIS 108  57.297  13.920  10.115
  692    HD1  HIS 108           HD1      HIS 108  56.106  10.487  10.918
  693    HD2  HIS 108           HD2      HIS 108  56.359  14.203  12.759
  694    HE1  HIS 108           HE1      HIS 108  55.679  10.058  13.359
  695    HE2  HIS 108           HE2      HIS 108  55.833  12.328  14.485
  696    H    HIS 109           H        HIS 109  56.113  15.929   9.794
  697    HA   HIS 109           HA       HIS 109  56.842  16.600   7.051
  698    HB2  HIS 109           HB1      HIS 109  54.359  17.241   7.742
  699    HB3  HIS 109           HB2      HIS 109  55.176  18.607   8.506
  700    HD1  HIS 109           HD1      HIS 109  54.023  17.387   5.247
  701    HD2  HIS 109           HD2      HIS 109  56.641  20.286   6.663
  702    HE1  HIS 109           HE1      HIS 109  54.448  18.918   3.298
  703    HE2  HIS 109           HE2      HIS 109  56.048  20.690   4.163
  704    H    HIS 110           H        HIS 110  58.968  16.851   7.588
  705    HA   HIS 110           HA       HIS 110  59.660  18.648   9.791
  706    HB2  HIS 110           HB1      HIS 110  61.991  17.868   9.379
  707    HB3  HIS 110           HB2      HIS 110  60.870  16.565   9.790
  708    HD1  HIS 110           HD1      HIS 110  62.792  17.952   6.870
  709    HD2  HIS 110           HD2      HIS 110  60.514  14.620   7.854
  710    HE1  HIS 110           HE1      HIS 110  63.131  16.324   4.983
  711    HE2  HIS 110           HE2      HIS 110  61.739  14.287   5.584
  712    H    HIS 111           H        HIS 111  60.420  20.652   9.490
  713    HA   HIS 111           HA       HIS 111  61.271  21.443   6.788
  714    HB2  HIS 111           HB1      HIS 111  59.048  22.496   8.401
  715    HB3  HIS 111           HB2      HIS 111  60.131  23.739   7.767
  716    HD1  HIS 111           HD1      HIS 111  57.079  22.721   6.867
  717    HD2  HIS 111           HD2      HIS 111  60.667  22.533   4.782
  718    HE1  HIS 111           HE1      HIS 111  56.438  22.578   4.440
  719    HE2  HIS 111           HE2      HIS 111  58.631  22.462   3.164
  720    H    HIS 112           H        HIS 112  62.550  23.460   6.766
  721    HA   HIS 112           HA       HIS 112  64.528  24.435   7.393
  722    HB2  HIS 112           HB1      HIS 112  64.279  25.983   9.120
  723    HB3  HIS 112           HB2      HIS 112  62.617  25.693   8.595
  724    HD1  HIS 112           HD1      HIS 112  60.991  24.756  10.279
  725    HD2  HIS 112           HD2      HIS 112  64.919  24.718  11.632
  726    HE1  HIS 112           HE1      HIS 112  60.857  24.139  12.713
  727    HE2  HIS 112           HE2      HIS 112  63.258  24.116  13.541
  Start of MODEL   69
    1    H1   MET  18           H        MET  18  32.202 -26.439  28.709
    2    HA   MET  18           HA       MET  18  31.212 -24.497  30.139
    3    HB2  MET  18           HB1      MET  18  33.781 -23.401  28.980
    4    HB3  MET  18           HB2      MET  18  32.481 -22.385  29.618
    5    HG2  MET  18           HG1      MET  18  32.721 -23.566  31.811
    6    HG3  MET  18           HG2      MET  18  34.139 -24.375  31.142
    7    HE1  MET  18           HE1      MET  18  36.508 -23.247  30.838
    8    HE2  MET  18           HE2      MET  18  36.864 -22.157  32.178
    9    HE3  MET  18           HE3      MET  18  36.047 -23.691  32.482
   10    H    LEU  19           H        LEU  19  29.587 -25.038  28.652
   11    HA   LEU  19           HA       LEU  19  29.498 -23.299  26.336
   12    HB2  LEU  19           HB1      LEU  19  28.780 -25.181  24.841
   13    HB3  LEU  19           HB2      LEU  19  30.493 -25.175  25.295
   14    HG   LEU  19           HG       LEU  19  29.001 -26.804  27.133
   15   HD11  LEU  19          HD11      LEU  19  27.398 -27.485  25.681
   16   HD12  LEU  19          HD12      LEU  19  28.687 -28.577  25.172
   17   HD13  LEU  19          HD13      LEU  19  28.365 -27.103  24.257
   18   HD21  LEU  19          HD21      LEU  19  31.077 -27.544  25.076
   19   HD22  LEU  19          HD22      LEU  19  30.653 -28.446  26.531
   20   HD23  LEU  19          HD23      LEU  19  31.436 -26.871  26.666
   21    H    VAL  20           H        VAL  20  27.623 -22.292  26.577
   22    HA   VAL  20           HA       VAL  20  25.338 -23.778  27.683
   23    HB   VAL  20           HB       VAL  20  24.349 -21.485  28.053
   24   HG11  VAL  20          HG11      VAL  20  26.887 -21.570  29.584
   25   HG12  VAL  20          HG12      VAL  20  25.223 -21.402  30.151
   26   HG13  VAL  20          HG13      VAL  20  25.836 -22.984  29.669
   27   HG21  VAL  20          HG21      VAL  20  26.466 -20.666  26.467
   28   HG22  VAL  20          HG22      VAL  20  25.395 -19.624  27.404
   29   HG23  VAL  20          HG23      VAL  20  26.928 -20.159  28.092
   30    H    LEU  21           H        LEU  21  23.629 -24.205  26.443
   31    HA   LEU  21           HA       LEU  21  23.644 -23.454  23.674
   32    HB2  LEU  21           HB1      LEU  21  22.107 -25.266  25.420
   33    HB3  LEU  21           HB2      LEU  21  21.214 -24.592  24.045
   34    HG   LEU  21           HG       LEU  21  22.219 -26.831  23.623
   35   HD11  LEU  21          HD11      LEU  21  23.624 -25.031  21.751
   36   HD12  LEU  21          HD12      LEU  21  21.889 -24.782  21.934
   37   HD13  LEU  21          HD13      LEU  21  22.505 -26.357  21.434
   38   HD21  LEU  21          HD21      LEU  21  24.361 -26.049  24.950
   39   HD22  LEU  21          HD22      LEU  21  24.888 -25.546  23.344
   40   HD23  LEU  21          HD23      LEU  21  24.468 -27.234  23.647
   41    H    ASP  22           H        ASP  22  22.609 -21.820  22.720
   42    HA   ASP  22           HA       ASP  22  20.936 -20.090  24.381
   43    HB2  ASP  22           HB1      ASP  22  22.701 -19.715  22.059
   44    HB3  ASP  22           HB2      ASP  22  21.187 -18.806  21.969
   45    HD2  ASP  22           HD       ASP  22  23.939 -17.618  24.491
   46    H    PHE  23           H        PHE  23  18.811 -19.750  24.031
   47    HA   PHE  23           HA       PHE  23  17.587 -20.875  21.613
   48    HB2  PHE  23           HB1      PHE  23  17.427 -22.464  23.591
   49    HB3  PHE  23           HB2      PHE  23  16.389 -21.260  24.357
   50    HD1  PHE  23           HD1      PHE  23  16.666 -23.089  21.118
   51    HD2  PHE  23           HD2      PHE  23  14.117 -21.454  24.109
   52    HE1  PHE  23           HE1      PHE  23  14.706 -24.002  19.942
   53    HE2  PHE  23           HE2      PHE  23  12.153 -22.365  22.938
   54    HZ   PHE  23           HZ       PHE  23  12.446 -23.641  20.853
   55    H    ASN  24           H        ASN  24  16.899 -19.050  20.661
   56    HA   ASN  24           HA       ASN  24  14.733 -17.599  21.825
   57    HB2  ASN  24           HB1      ASN  24  17.147 -16.649  22.633
   58    HB3  ASN  24           HB2      ASN  24  16.908 -15.712  21.153
   59   HD21  ASN  24          HD21      ASN  24  15.276 -16.640  24.148
   60   HD22  ASN  24          HD22      ASN  24  14.391 -15.167  24.328
   61    H    ASN  25           H        ASN  25  13.420 -17.458  20.138
   62    HA   ASN  25           HA       ASN  25  14.138 -16.051  17.777
   63    HB2  ASN  25           HB1      ASN  25  15.254 -18.048  17.095
   64    HB3  ASN  25           HB2      ASN  25  13.898 -19.056  17.611
   65   HD21  ASN  25          HD21      ASN  25  14.547 -16.328  15.438
   66   HD22  ASN  25          HD22      ASN  25  13.546 -16.896  14.150
   67    H    ILE  26           H        ILE  26  12.278 -14.912  18.493
   68    HA   ILE  26           HA       ILE  26   9.778 -16.172  17.619
   69    HB   ILE  26           HB       ILE  26   8.591 -15.022  19.519
   70   HG12  ILE  26          HG11      ILE  26  11.224 -15.030  20.957
   71   HG13  ILE  26          HG12      ILE  26  10.771 -13.628  19.974
   72   HG21  ILE  26          HG21      ILE  26   8.527 -17.107  20.276
   73   HG22  ILE  26          HG22      ILE  26  10.056 -17.472  19.479
   74   HG23  ILE  26          HG23      ILE  26  10.050 -16.828  21.120
   75   HD11  ILE  26          HD11      ILE  26  10.158 -13.226  22.259
   76   HD12  ILE  26          HD12      ILE  26   8.698 -13.405  21.287
   77   HD13  ILE  26          HD13      ILE  26   9.241 -14.731  22.316
   78    H    ARG  27           H        ARG  27   8.364 -14.826  16.585
   79    HA   ARG  27           HA       ARG  27   8.401 -12.009  16.744
   80    HB2  ARG  27           HB1      ARG  27  10.501 -12.952  15.245
   81    HB3  ARG  27           HB2      ARG  27   9.265 -12.653  14.016
   82    HG2  ARG  27           HG1      ARG  27  10.326 -10.624  14.057
   83    HG3  ARG  27           HG2      ARG  27   9.023 -10.353  15.227
   84    HD2  ARG  27           HD1      ARG  27  10.465 -10.608  17.078
   85    HD3  ARG  27           HD2      ARG  27  11.732 -11.331  16.078
   86    HE   ARG  27           HE       ARG  27  11.256  -8.746  15.130
   87   HH11  ARG  27          HH11      ARG  27  12.511 -10.334  17.964
   88   HH12  ARG  27          HH12      ARG  27  13.571  -9.031  18.385
   89   HH21  ARG  27          HH21      ARG  27  12.649  -7.023  15.674
   90   HH22  ARG  27          HH22      ARG  27  13.649  -7.147  17.083
   91    H    SER  28           H        SER  28   6.419 -11.379  16.210
   92    HA   SER  28           HA       SER  28   5.049 -12.419  13.907
   93    HB2  SER  28           HB1      SER  28   4.593 -13.619  16.497
   94    HB3  SER  28           HB2      SER  28   3.117 -12.827  15.917
   95    HG   SER  28           HG       SER  28   4.644 -14.816  14.595
   96    H    SER  29           H        SER  29   3.339 -11.127  13.257
   97    HA   SER  29           HA       SER  29   2.281  -9.061  14.950
   98    HB2  SER  29           HB1      SER  29   4.648  -8.457  13.587
   99    HB3  SER  29           HB2      SER  29   3.364  -7.730  12.605
  100    HG   SER  29           HG       SER  29   2.656  -6.599  14.414
  101    H    ALA  30           H        ALA  30   0.352  -8.286  14.211
  102    HA   ALA  30           HA       ALA  30  -0.486  -8.346  11.513
  103    HB1  ALA  30           HB1      ALA  30  -1.060 -10.739  13.162
  104    HB2  ALA  30           HB2      ALA  30  -2.361 -10.130  12.137
  105    HB3  ALA  30           HB3      ALA  30  -0.816 -10.590  11.421
  106    H    ASP  31           H        ASP  31  -2.122  -6.949  11.281
  107    HA   ASP  31           HA       ASP  31  -4.289  -6.670  13.058
  108    HB2  ASP  31           HB1      ASP  31  -3.656  -4.256  13.761
  109    HB3  ASP  31           HB2      ASP  31  -2.950  -5.613  14.653
  110    HD2  ASP  31           HD       ASP  31   0.241  -4.946  13.424
  111    H    LEU  32           H        LEU  32  -5.914  -5.831  11.922
  112    HA   LEU  32           HA       LEU  32  -5.364  -3.830   9.863
  113    HB2  LEU  32           HB1      LEU  32  -5.708  -6.487   9.211
  114    HB3  LEU  32           HB2      LEU  32  -7.331  -5.805   9.008
  115    HG   LEU  32           HG       LEU  32  -6.217  -5.767   6.891
  116   HD11  LEU  32          HD11      LEU  32  -6.889  -3.701   6.324
  117   HD12  LEU  32          HD12      LEU  32  -5.870  -2.923   7.534
  118   HD13  LEU  32          HD13      LEU  32  -7.422  -3.615   8.003
  119   HD21  LEU  32          HD21      LEU  32  -4.068  -3.969   7.927
  120   HD22  LEU  32          HD22      LEU  32  -4.086  -4.983   6.484
  121   HD23  LEU  32          HD23      LEU  32  -3.900  -5.718   8.076
  122    H    HIS  33           H        HIS  33  -6.766  -2.207   9.978
  123    HA   HIS  33           HA       HIS  33  -9.486  -2.720  10.941
  124    HB2  HIS  33           HB1      HIS  33  -7.541  -1.579  12.559
  125    HB3  HIS  33           HB2      HIS  33  -8.425  -0.186  11.929
  126    HD1  HIS  33           HD1      HIS  33  -9.668  -3.574  13.155
  127    HD2  HIS  33           HD2      HIS  33 -10.246   0.489  13.799
  128    HE1  HIS  33           HE1      HIS  33 -11.511  -3.419  14.859
  129    HE2  HIS  33           HE2      HIS  33 -11.864  -0.935  15.254
  130    H    GLY  34           H        GLY  34 -11.043  -1.166  10.278
  131    HA2  GLY  34           HA2      GLY  34 -10.412   1.122   8.738
  132    HA3  GLY  34           HA3      GLY  34 -10.757  -0.229   7.669
  133    HA1  GLY  34           HA1      GLY  34 -10.836   0.890   9.476
  134    H    ALA  35           H        ALA  35 -12.140   2.411   8.645
  135    HA   ALA  35           HA       ALA  35 -14.731   1.274   9.398
  136    HB1  ALA  35           HB1      ALA  35 -14.569   3.030  10.792
  137    HB2  ALA  35           HB2      ALA  35 -13.418   3.879   9.759
  138    HB3  ALA  35           HB3      ALA  35 -15.143   3.948   9.399
  139    H    ARG  36           H        ARG  36 -13.088   2.854   6.770
  140    HA   ARG  36           HA       ARG  36 -13.672   3.109   4.580
  141    HB2  ARG  36           HB1      ARG  36 -14.936   0.897   5.106
  142    HB3  ARG  36           HB2      ARG  36 -16.376   1.923   5.114
  143    HG2  ARG  36           HG1      ARG  36 -15.594   2.729   2.803
  144    HG3  ARG  36           HG2      ARG  36 -14.531   1.312   2.837
  145    HD2  ARG  36           HD1      ARG  36 -17.196   0.563   3.644
  146    HD3  ARG  36           HD2      ARG  36 -17.235   1.410   2.090
  147    HE   ARG  36           HE       ARG  36 -15.185  -0.475   1.972
  148   HH11  ARG  36          HH11      ARG  36 -18.654  -0.380   2.250
  149   HH12  ARG  36          HH12      ARG  36 -18.889  -1.901   1.457
  150   HH21  ARG  36          HH21      ARG  36 -15.483  -2.481   0.927
  151   HH22  ARG  36          HH22      ARG  36 -17.085  -3.096   0.705
  152    H    LYS  37           H        LYS  37 -16.800   3.417   6.263
  153    HA   LYS  37           HA       LYS  37 -18.303   5.120   6.379
  154    HB2  LYS  37           HB1      LYS  37 -15.788   6.195   7.015
  155    HB3  LYS  37           HB2      LYS  37 -16.537   7.359   5.911
  156    HG2  LYS  37           HG1      LYS  37 -18.622   7.060   7.471
  157    HG3  LYS  37           HG2      LYS  37 -17.402   6.503   8.630
  158    HD2  LYS  37           HD1      LYS  37 -16.634   8.576   8.989
  159    HD3  LYS  37           HD2      LYS  37 -16.602   8.941   7.255
  160    HE2  LYS  37           HE1      LYS  37 -19.251   8.810   8.634
  161    HE3  LYS  37           HE2      LYS  37 -18.219  10.224   8.896
  162    HZ1  LYS  37           HZ1      LYS  37 -19.843  10.395   7.014
  163    HZ2  LYS  37           HZ2      LYS  37 -18.922   9.239   6.191
  164    HZ3  LYS  37           HZ3      LYS  37 -18.235  10.728   6.607
  165    H    GLY  38           H        GLY  38 -18.619   7.522   5.162
  166    HA2  GLY  38           HA2      GLY  38 -18.786   6.733   2.331
  167    HA3  GLY  38           HA3      GLY  38 -19.829   7.905   3.125
  168    HA1  GLY  38           HA1      GLY  38 -18.009   6.885   2.719
  169    H    SER  39           H        SER  39 -16.318   7.463   2.659
  170    HA   SER  39           HA       SER  39 -16.197  10.131   1.464
  171    HB2  SER  39           HB1      SER  39 -14.037  10.473   2.877
  172    HB3  SER  39           HB2      SER  39 -15.613  10.753   3.641
  173    HG   SER  39           HG       SER  39 -13.872   8.554   3.946
  174    H    GLN  40           H        GLN  40 -13.685  10.497   0.898
  175    HA   GLN  40           HA       GLN  40 -13.100   8.726  -1.175
  176    HB2  GLN  40           HB1      GLN  40 -11.881  11.067   0.041
  177    HB3  GLN  40           HB2      GLN  40 -10.663   9.898  -0.493
  178    HG2  GLN  40           HG1      GLN  40 -10.844  10.966  -2.455
  179    HG3  GLN  40           HG2      GLN  40 -12.263   9.929  -2.656
  180   HE21  GLN  40          HE21      GLN  40 -13.974  10.964  -3.356
  181   HE22  GLN  40          HE22      GLN  40 -14.395  12.603  -3.007
  182    H    CYS  41           H        CYS  41 -10.964   9.209   1.633
  183    HA   CYS  41           HA       CYS  41 -10.830   6.391   2.185
  184    HB2  CYS  41           HB1      CYS  41  -8.465   6.095   1.705
  185    HB3  CYS  41           HB2      CYS  41  -9.328   6.554   0.237
  186    H    LEU  42           H        LEU  42 -10.083   5.978   4.220
  187    HA   LEU  42           HA       LEU  42  -9.833   8.212   5.993
  188    HB2  LEU  42           HB1      LEU  42 -10.418   5.437   6.193
  189    HB3  LEU  42           HB2      LEU  42  -9.043   5.787   7.255
  190    HG   LEU  42           HG       LEU  42 -10.536   7.705   8.159
  191   HD11  LEU  42          HD11      LEU  42 -12.839   7.540   7.888
  192   HD12  LEU  42          HD12      LEU  42 -12.746   5.899   7.252
  193   HD13  LEU  42          HD13      LEU  42 -12.216   7.258   6.263
  194   HD21  LEU  42          HD21      LEU  42  -9.976   5.989   9.632
  195   HD22  LEU  42          HD22      LEU  42 -10.853   4.773   8.702
  196   HD23  LEU  42          HD23      LEU  42 -11.740   5.981   9.633
  197    H    SER  43           H        SER  43  -7.639   6.063   4.374
  198    HA   SER  43           HA       SER  43  -5.393   7.691   5.077
  199    HB2  SER  43           HB1      SER  43  -5.792   6.101   7.084
  200    HB3  SER  43           HB2      SER  43  -5.181   4.834   6.005
  201    HG   SER  43           HG       SER  43  -3.592   5.965   7.383
  202    H    ASP  44           H        ASP  44  -3.423   7.014   3.984
  203    HA   ASP  44           HA       ASP  44  -3.821   6.275   1.340
  204    HB2  ASP  44           HB1      ASP  44  -1.377   6.015   1.196
  205    HB3  ASP  44           HB2      ASP  44  -1.828   7.476   2.086
  206    HD2  ASP  44           HD       ASP  44  -0.500   6.267   5.056
  207    H    THR  45           H        THR  45  -3.335   4.302   4.155
  208    HA   THR  45           HA       THR  45  -2.518   1.918   2.892
  209    HB   THR  45           HB       THR  45  -3.930   1.043   5.081
  210    HG1  THR  45           HG1      THR  45  -2.756   3.462   5.941
  211   HG21  THR  45          HG21      THR  45  -1.354   1.047   4.273
  212   HG22  THR  45          HG22      THR  45  -1.877   0.497   5.864
  213   HG23  THR  45          HG23      THR  45  -1.248   2.132   5.659
  214    H    ASP  46           H        ASP  46  -5.607   3.453   3.216
  215    HA   ASP  46           HA       ASP  46  -7.051   1.051   2.418
  216    HB2  ASP  46           HB1      ASP  46  -7.812   3.760   3.426
  217    HB3  ASP  46           HB2      ASP  46  -8.990   2.865   2.458
  218    HD2  ASP  46           HD       ASP  46  -8.076   1.433   6.044
  219    H    CYS  47           H        CYS  47  -5.159   2.948   0.765
  220    HA   CYS  47           HA       CYS  47  -6.927   3.690  -1.413
  221    HB2  CYS  47           HB1      CYS  47  -5.080   5.180  -0.782
  222    HB3  CYS  47           HB2      CYS  47  -3.920   3.902  -1.154
  223    H    ASN  48           H        ASN  48  -7.660   1.557  -1.954
  224    HA   ASN  48           HA       ASN  48  -7.695  -0.241  -3.352
  225    HB2  ASN  48           HB1      ASN  48  -5.663   1.472  -4.449
  226    HB3  ASN  48           HB2      ASN  48  -5.160  -0.214  -4.617
  227   HD21  ASN  48          HD21      ASN  48  -6.998   2.243  -5.930
  228   HD22  ASN  48          HD22      ASN  48  -7.929   1.308  -7.045
  229    H    THR  49           H        THR  49  -4.192  -0.059  -2.788
  230    HA   THR  49           HA       THR  49  -4.080  -1.926  -0.694
  231    HB   THR  49           HB       THR  49  -2.869  -3.609  -2.535
  232    HG1  THR  49           HG1      THR  49  -4.000  -2.485  -4.220
  233   HG21  THR  49          HG21      THR  49  -4.245  -5.173  -1.623
  234   HG22  THR  49          HG22      THR  49  -5.687  -4.177  -1.823
  235   HG23  THR  49          HG23      THR  49  -4.580  -3.867  -0.486
  236    H    ARG  50           H        ARG  50  -2.165  -1.760  -3.694
  237    HA   ARG  50           HA       ARG  50   0.184  -1.092  -2.076
  238    HB2  ARG  50           HB1      ARG  50  -0.104  -2.089  -4.917
  239    HB3  ARG  50           HB2      ARG  50   1.442  -1.635  -4.185
  240    HG2  ARG  50           HG1      ARG  50   1.627  -3.562  -3.070
  241    HG3  ARG  50           HG2      ARG  50  -0.073  -3.533  -2.574
  242    HD2  ARG  50           HD1      ARG  50  -0.805  -4.562  -4.554
  243    HD3  ARG  50           HD2      ARG  50   0.707  -4.191  -5.394
  244    HE   ARG  50           HE       ARG  50   1.443  -5.832  -3.330
  245   HH11  ARG  50          HH11      ARG  50  -0.777  -6.041  -6.002
  246   HH12  ARG  50          HH12      ARG  50  -0.628  -7.760  -6.163
  247   HH21  ARG  50          HH21      ARG  50   1.649  -8.095  -3.530
  248   HH22  ARG  50          HH22      ARG  50   0.751  -8.927  -4.754
  249    H    LYS  51           H        LYS  51  -1.633   0.976  -2.380
  250    HA   LYS  51           HA       LYS  51  -0.004   2.890  -3.856
  251    HB2  LYS  51           HB1      LYS  51  -2.924   2.356  -4.382
  252    HB3  LYS  51           HB2      LYS  51  -2.181   3.919  -4.755
  253    HG2  LYS  51           HG1      LYS  51  -1.877   2.966  -6.775
  254    HG3  LYS  51           HG2      LYS  51  -0.431   2.313  -5.984
  255    HD2  LYS  51           HD1      LYS  51  -1.167   0.264  -6.462
  256    HD3  LYS  51           HD2      LYS  51  -2.494   0.544  -5.321
  257    HE2  LYS  51           HE1      LYS  51  -3.708   1.690  -7.267
  258    HE3  LYS  51           HE2      LYS  51  -2.475   0.953  -8.298
  259    HZ1  LYS  51           HZ1      LYS  51  -3.702  -0.892  -6.457
  260    HZ2  LYS  51           HZ2      LYS  51  -3.412  -1.051  -8.116
  261    HZ3  LYS  51           HZ3      LYS  51  -4.786  -0.227  -7.572
  262    H    PHE  52           H        PHE  52  -0.818   5.181  -3.424
  263    HA   PHE  52           HA       PHE  52  -1.899   5.361  -0.691
  264    HB2  PHE  52           HB1      PHE  52  -0.362   7.104  -0.144
  265    HB3  PHE  52           HB2      PHE  52   0.579   5.780  -0.830
  266    HD1  PHE  52           HD1      PHE  52   1.529   5.940  -3.083
  267    HD2  PHE  52           HD2      PHE  52  -0.506   9.213  -1.277
  268    HE1  PHE  52           HE1      PHE  52   2.511   7.464  -4.747
  269    HE2  PHE  52           HE2      PHE  52   0.471  10.742  -2.939
  270    HZ   PHE  52           HZ       PHE  52   1.981   9.868  -4.678
  271    H    CYS  53           H        CYS  53  -2.955   7.394  -0.175
  272    HA   CYS  53           HA       CYS  53  -4.567   8.317  -2.385
  273    HB2  CYS  53           HB1      CYS  53  -4.593   8.688   0.588
  274    HB3  CYS  53           HB2      CYS  53  -5.503   9.810  -0.425
  275    H    LEU  54           H        LEU  54  -3.243   9.533  -3.706
  276    HA   LEU  54           HA       LEU  54  -1.541  11.599  -2.722
  277    HB2  LEU  54           HB1      LEU  54  -1.140  10.406  -4.841
  278    HB3  LEU  54           HB2      LEU  54  -2.605  11.149  -5.506
  279    HG   LEU  54           HG       LEU  54  -0.938  13.245  -4.580
  280   HD11  LEU  54          HD11      LEU  54   0.923  12.680  -6.347
  281   HD12  LEU  54          HD12      LEU  54   0.504  11.019  -5.930
  282   HD13  LEU  54          HD13      LEU  54   1.057  12.129  -4.676
  283   HD21  LEU  54          HD21      LEU  54  -1.280  14.088  -6.695
  284   HD22  LEU  54          HD22      LEU  54  -2.644  12.982  -6.535
  285   HD23  LEU  54          HD23      LEU  54  -1.219  12.499  -7.456
  286    H    GLN  55           H        GLN  55  -2.003  13.647  -2.242
  287    HA   GLN  55           HA       GLN  55  -4.585  14.742  -3.143
  288    HB2  GLN  55           HB1      GLN  55  -4.554  16.072  -0.985
  289    HB3  GLN  55           HB2      GLN  55  -4.858  14.334  -0.826
  290    HG2  GLN  55           HG1      GLN  55  -2.026  14.992  -0.650
  291    HG3  GLN  55           HG2      GLN  55  -3.005  15.798   0.584
  292   HE21  GLN  55          HE21      GLN  55  -1.029  13.577   0.714
  293   HE22  GLN  55          HE22      GLN  55  -1.847  12.299   1.539
  294    HA   PRO  56           HA       PRO  56  -1.334  17.526  -4.773
  295    HB2  PRO  56           HB1      PRO  56  -2.754  18.221  -7.009
  296    HB3  PRO  56           HB2      PRO  56  -1.773  16.760  -6.894
  297    HG2  PRO  56           HG1      PRO  56  -4.727  17.103  -6.507
  298    HG3  PRO  56           HG2      PRO  56  -3.839  15.837  -7.432
  299    HD2  PRO  56           HD1      PRO  56  -4.853  15.399  -4.953
  300    HD3  PRO  56           HD2      PRO  56  -3.355  14.640  -5.522
  301    H    ARG  57           H        ARG  57  -1.258  19.778  -4.847
  302    HA   ARG  57           HA       ARG  57  -3.359  21.113  -3.379
  303    HB2  ARG  57           HB1      ARG  57  -0.558  21.674  -4.128
  304    HB3  ARG  57           HB2      ARG  57  -1.613  23.092  -4.035
  305    HG2  ARG  57           HG1      ARG  57  -2.300  22.279  -1.734
  306    HG3  ARG  57           HG2      ARG  57  -0.952  21.135  -1.857
  307    HD2  ARG  57           HD1      ARG  57   0.194  23.545  -2.598
  308    HD3  ARG  57           HD2      ARG  57  -0.925  23.991  -1.303
  309    HE   ARG  57           HE       ARG  57   1.496  22.463  -1.047
  310   HH11  ARG  57          HH11      ARG  57  -1.611  23.164   0.359
  311   HH12  ARG  57          HH12      ARG  57  -1.135  22.702   1.960
  312   HH21  ARG  57          HH21      ARG  57   2.134  21.853   1.056
  313   HH22  ARG  57          HH22      ARG  57   0.995  21.958   2.355
  314    H    ASP  58           H        ASP  58  -2.191  20.941  -6.659
  315    HA   ASP  58           HA       ASP  58  -3.803  23.196  -7.525
  316    HB2  ASP  58           HB1      ASP  58  -1.461  22.109  -8.451
  317    HB3  ASP  58           HB2      ASP  58  -2.644  21.456  -9.592
  318    HD2  ASP  58           HD       ASP  58  -3.445  24.718 -10.722
  319    H    GLU  59           H        GLU  59  -4.047  19.766  -7.287
  320    HA   GLU  59           HA       GLU  59  -6.584  19.858  -8.785
  321    HB2  GLU  59           HB1      GLU  59  -4.295  18.109  -9.075
  322    HB3  GLU  59           HB2      GLU  59  -5.755  17.183  -8.695
  323    HG2  GLU  59           HG1      GLU  59  -6.620  17.484 -10.725
  324    HG3  GLU  59           HG2      GLU  59  -6.225  19.208 -10.719
  325    HE2  GLU  59           HE       GLU  59  -3.082  18.561 -12.213
  326    H    LYS  60           H        LYS  60  -7.854  17.682  -8.137
  327    HA   LYS  60           HA       LYS  60  -8.368  17.989  -5.297
  328    HB2  LYS  60           HB1      LYS  60  -9.804  16.818  -7.628
  329    HB3  LYS  60           HB2      LYS  60 -10.171  16.154  -6.027
  330    HG2  LYS  60           HG1      LYS  60 -11.412  17.912  -5.468
  331    HG3  LYS  60           HG2      LYS  60 -10.165  19.048  -6.011
  332    HD2  LYS  60           HD1      LYS  60 -10.982  19.110  -8.199
  333    HD3  LYS  60           HD2      LYS  60 -11.878  17.595  -7.996
  334    HE2  LYS  60           HE1      LYS  60 -13.595  18.606  -6.789
  335    HE3  LYS  60           HE2      LYS  60 -12.582  19.985  -6.339
  336    HZ1  LYS  60           HZ1      LYS  60 -14.406  20.032  -8.294
  337    HZ2  LYS  60           HZ2      LYS  60 -13.012  19.673  -9.183
  338    HZ3  LYS  60           HZ3      LYS  60 -13.069  21.066  -8.225
  339    HA   PRO  61           HA       PRO  61  -6.433  14.323  -3.861
  340    HB2  PRO  61           HB1      PRO  61  -8.231  13.383  -2.021
  341    HB3  PRO  61           HB2      PRO  61  -7.245  14.823  -1.770
  342    HG2  PRO  61           HG1      PRO  61 -10.083  14.602  -2.718
  343    HG3  PRO  61           HG2      PRO  61  -9.373  15.718  -1.493
  344    HD2  PRO  61           HD1      PRO  61  -9.926  16.493  -4.037
  345    HD3  PRO  61           HD2      PRO  61  -8.554  17.137  -3.115
  346    H    PHE  62           H        PHE  62  -6.213  12.261  -4.513
  347    HA   PHE  62           HA       PHE  62  -8.403  10.498  -4.959
  348    HB2  PHE  62           HB1      PHE  62  -8.338  10.257  -7.325
  349    HB3  PHE  62           HB2      PHE  62  -8.487  11.985  -7.001
  350    HD1  PHE  62           HD1      PHE  62  -6.802   9.632  -8.923
  351    HD2  PHE  62           HD2      PHE  62  -6.147  13.244  -6.767
  352    HE1  PHE  62           HE1      PHE  62  -4.804  10.081 -10.286
  353    HE2  PHE  62           HE2      PHE  62  -4.149  13.698  -8.128
  354    HZ   PHE  62           HZ       PHE  62  -3.476  12.116  -9.891
  355    H    CYS  63           H        CYS  63  -7.679   8.375  -5.794
  356    HA   CYS  63           HA       CYS  63  -5.181   7.653  -4.587
  357    HB2  CYS  63           HB1      CYS  63  -7.504   6.254  -5.767
  358    HB3  CYS  63           HB2      CYS  63  -5.962   5.405  -5.909
  359    H    ALA  64           H        ALA  64  -3.254   7.352  -5.518
  360    HA   ALA  64           HA       ALA  64  -3.108   7.165  -8.447
  361    HB1  ALA  64           HB1      ALA  64  -1.157   8.688  -8.428
  362    HB2  ALA  64           HB2      ALA  64  -2.656   9.475  -7.931
  363    HB3  ALA  64           HB3      ALA  64  -1.461   9.009  -6.721
  364    H    THR  65           H        THR  65  -0.940   6.419  -9.196
  365    HA   THR  65           HA       THR  65  -0.169   4.093  -7.721
  366    HB   THR  65           HB       THR  65   1.659   4.880  -9.864
  367    HG1  THR  65           HG1      THR  65   0.227   5.385 -11.332
  368   HG21  THR  65          HG21      THR  65   0.109   2.517  -8.974
  369   HG22  THR  65          HG22      THR  65   1.796   2.644  -9.470
  370   HG23  THR  65          HG23      THR  65   0.520   2.600 -10.686
  371    H    CYS  66           H        CYS  66   1.943   3.592  -6.945
  372    HA   CYS  66           HA       CYS  66   3.119   5.659  -5.414
  373    HB2  CYS  66           HB1      CYS  66   4.667   4.023  -4.642
  374    HB3  CYS  66           HB2      CYS  66   3.117   3.205  -4.843
  375    H    ARG  67           H        ARG  67   5.635   5.886  -5.473
  376    HA   ARG  67           HA       ARG  67   6.288   6.827  -8.160
  377    HB2  ARG  67           HB1      ARG  67   7.424   7.378  -5.423
  378    HB3  ARG  67           HB2      ARG  67   8.265   7.877  -6.899
  379    HG2  ARG  67           HG1      ARG  67   5.473   8.716  -6.105
  380    HG3  ARG  67           HG2      ARG  67   6.942   9.695  -5.943
  381    HD2  ARG  67           HD1      ARG  67   6.590  10.464  -8.006
  382    HD3  ARG  67           HD2      ARG  67   6.925   8.832  -8.600
  383    HE   ARG  67           HE       ARG  67   4.208   9.219  -7.733
  384   HH11  ARG  67          HH11      ARG  67   6.448   9.485 -10.386
  385   HH12  ARG  67          HH12      ARG  67   5.218   9.398 -11.603
  386   HH21  ARG  67          HH21      ARG  67   2.580   9.103  -9.327
  387   HH22  ARG  67          HH22      ARG  67   3.018   9.180 -11.000
  388    H    GLY  68           H        GLY  68   7.804   5.924  -9.422
  389    HA2  GLY  68           HA2      GLY  68   8.854   3.371  -8.801
  390    HA3  GLY  68           HA3      GLY  68   9.305   4.361 -10.180
  391    HA1  GLY  68           HA1      GLY  68   8.920   3.942  -8.134
  392    H    LEU  69           H        LEU  69  11.252   2.891  -9.109
  393    HA   LEU  69           HA       LEU  69  12.681   4.006  -6.968
  394    HB2  LEU  69           HB1      LEU  69  13.647   2.420  -9.354
  395    HB3  LEU  69           HB2      LEU  69  14.632   2.799  -7.929
  396    HG   LEU  69           HG       LEU  69  12.186   1.038  -8.029
  397   HD11  LEU  69          HD11      LEU  69  14.951   0.292  -7.144
  398   HD12  LEU  69          HD12      LEU  69  14.473   0.215  -8.839
  399   HD13  LEU  69          HD13      LEU  69  13.621  -0.757  -7.640
  400   HD21  LEU  69          HD21      LEU  69  13.214   0.682  -5.558
  401   HD22  LEU  69          HD22      LEU  69  11.878   1.773  -5.923
  402   HD23  LEU  69          HD23      LEU  69  13.520   2.404  -5.789
  403    H    ARG  70           H        ARG  70  12.358   4.987 -10.258
  404    HA   ARG  70           HA       ARG  70  14.650   6.798 -10.057
  405    HB2  ARG  70           HB1      ARG  70  12.888   5.970 -12.367
  406    HB3  ARG  70           HB2      ARG  70  14.088   7.266 -12.487
  407    HG2  ARG  70           HG1      ARG  70  15.519   5.157 -11.403
  408    HG3  ARG  70           HG2      ARG  70  14.448   4.395 -12.592
  409    HD2  ARG  70           HD1      ARG  70  15.211   6.209 -14.223
  410    HD3  ARG  70           HD2      ARG  70  16.474   6.570 -13.037
  411    HE   ARG  70           HE       ARG  70  17.579   4.667 -13.673
  412   HH11  ARG  70          HH11      ARG  70  14.315   4.556 -14.877
  413   HH12  ARG  70          HH12      ARG  70  14.582   3.147 -15.849
  414   HH21  ARG  70          HH21      ARG  70  17.944   2.811 -14.949
  415   HH22  ARG  70          HH22      ARG  70  16.646   2.155 -15.889
  416    H    ARG  71           H        ARG  71  11.762   6.955  -8.862
  417    HA   ARG  71           HA       ARG  71  11.133   9.659  -9.838
  418    HB2  ARG  71           HB1      ARG  71   9.461   7.485  -8.607
  419    HB3  ARG  71           HB2      ARG  71   8.928   9.172  -8.550
  420    HG2  ARG  71           HG1      ARG  71   9.564   7.631 -11.068
  421    HG3  ARG  71           HG2      ARG  71   7.943   7.950 -10.430
  422    HD2  ARG  71           HD1      ARG  71   7.925   9.848 -11.602
  423    HD3  ARG  71           HD2      ARG  71   9.184  10.445 -10.510
  424    HE   ARG  71           HE       ARG  71  10.277   8.864 -12.613
  425   HH11  ARG  71          HH11      ARG  71   9.031  12.022 -11.846
  426   HH12  ARG  71          HH12      ARG  71   9.941  12.825 -13.083
  427   HH21  ARG  71          HH21      ARG  71  11.481   9.909 -14.245
  428   HH22  ARG  71          HH22      ARG  71  11.333  11.621 -14.447
  429    H    ARG  72           H        ARG  72  10.589  11.297  -8.308
  430    HA   ARG  72           HA       ARG  72  12.231  11.197  -5.948
  431    HB2  ARG  72           HB1      ARG  72  10.344  13.341  -6.957
  432    HB3  ARG  72           HB2      ARG  72  11.488  13.529  -5.620
  433    HG2  ARG  72           HG1      ARG  72  12.678  12.602  -8.148
  434    HG3  ARG  72           HG2      ARG  72  11.999  14.237  -8.176
  435    HD2  ARG  72           HD1      ARG  72  13.302  14.619  -5.990
  436    HD3  ARG  72           HD2      ARG  72  14.180  13.145  -6.426
  437    HE   ARG  72           HE       ARG  72  15.324  14.344  -7.996
  438   HH11  ARG  72          HH11      ARG  72  12.443  16.095  -7.127
  439   HH12  ARG  72          HH12      ARG  72  12.863  17.500  -8.050
  440   HH21  ARG  72          HH21      ARG  72  15.888  16.188  -9.213
  441   HH22  ARG  72          HH22      ARG  72  14.822  17.552  -9.236
  442    H    CYS  73           H        CYS  73  11.491  11.611  -3.795
  443    HA   CYS  73           HA       CYS  73   8.670  11.344  -3.211
  444    HB2  CYS  73           HB1      CYS  73   8.813   9.333  -1.919
  445    HB3  CYS  73           HB2      CYS  73   9.477   8.994  -3.519
  446    H    GLN  74           H        GLN  74   8.125  12.148  -1.221
  447    HA   GLN  74           HA       GLN  74  10.311  13.406   0.274
  448    HB2  GLN  74           HB1      GLN  74   7.947  14.445  -0.650
  449    HB3  GLN  74           HB2      GLN  74   7.559  14.083   1.039
  450    HG2  GLN  74           HG1      GLN  74   9.459  15.414   1.789
  451    HG3  GLN  74           HG2      GLN  74   9.876  15.763   0.104
  452   HE21  GLN  74          HE21      GLN  74   9.638  17.961   0.299
  453   HE22  GLN  74          HE22      GLN  74   8.103  18.726   0.508
  454    H    ARG  75           H        ARG  75   7.823  11.012   0.517
  455    HA   ARG  75           HA       ARG  75   8.715  10.416   3.251
  456    HB2  ARG  75           HB1      ARG  75   6.382  11.630   2.947
  457    HB3  ARG  75           HB2      ARG  75   5.843   9.990   2.556
  458    HG2  ARG  75           HG1      ARG  75   6.980   9.299   4.761
  459    HG3  ARG  75           HG2      ARG  75   6.954  11.031   5.132
  460    HD2  ARG  75           HD1      ARG  75   4.383  10.202   4.127
  461    HD3  ARG  75           HD2      ARG  75   4.879   9.172   5.476
  462    HE   ARG  75           HE       ARG  75   4.641  10.956   6.900
  463   HH11  ARG  75          HH11      ARG  75   4.593  12.082   3.607
  464   HH12  ARG  75          HH12      ARG  75   4.110  13.691   4.026
  465   HH21  ARG  75          HH21      ARG  75   4.003  13.072   7.466
  466   HH22  ARG  75          HH22      ARG  75   3.776  14.254   6.222
  467    H    ASP  76           H        ASP  76   8.687   8.236   3.827
  468    HA   ASP  76           HA       ASP  76   9.046   6.407   1.672
  469    HB2  ASP  76           HB1      ASP  76   8.687   5.546   4.531
  470    HB3  ASP  76           HB2      ASP  76   9.736   4.858   3.283
  471    HD2  ASP  76           HD       ASP  76  11.045   8.048   5.247
  472    H    ALA  77           H        ALA  77   6.354   7.357   3.577
  473    HA   ALA  77           HA       ALA  77   4.791   5.008   3.401
  474    HB1  ALA  77           HB1      ALA  77   2.881   6.790   3.657
  475    HB2  ALA  77           HB2      ALA  77   3.980   6.444   4.993
  476    HB3  ALA  77           HB3      ALA  77   4.232   7.873   3.991
  477    H    MET  78           H        MET  78   4.971   7.912   1.366
  478    HA   MET  78           HA       MET  78   2.946   7.069  -0.445
  479    HB2  MET  78           HB1      MET  78   3.694   8.908  -1.858
  480    HB3  MET  78           HB2      MET  78   3.571   9.430  -0.172
  481    HG2  MET  78           HG1      MET  78   5.858   9.613   0.098
  482    HG3  MET  78           HG2      MET  78   6.195   8.486  -1.219
  483    HE1  MET  78           HE1      MET  78   5.098  10.577  -4.312
  484    HE2  MET  78           HE2      MET  78   6.481   9.529  -3.996
  485    HE3  MET  78           HE3      MET  78   4.866   9.036  -3.484
  486    H    CYS  79           H        CYS  79   6.303   6.366  -0.109
  487    HA   CYS  79           HA       CYS  79   6.704   5.514  -2.828
  488    HB2  CYS  79           HB1      CYS  79   8.486   6.389  -1.207
  489    HB3  CYS  79           HB2      CYS  79   8.434   4.788  -0.469
  490    H    CYS  80           H        CYS  80   6.730   3.450  -3.631
  491    HA   CYS  80           HA       CYS  80   4.966   1.570  -2.650
  492    HB2  CYS  80           HB1      CYS  80   7.048   1.652  -4.712
  493    HB3  CYS  80           HB2      CYS  80   6.773   0.036  -4.061
  494    HA   PRO  81           HA       PRO  81   6.929  -0.679   0.565
  495    HB2  PRO  81           HB1      PRO  81   6.143  -3.252   0.053
  496    HB3  PRO  81           HB2      PRO  81   5.054  -2.003   0.657
  497    HG2  PRO  81           HG1      PRO  81   5.481  -2.961  -2.154
  498    HG3  PRO  81           HG2      PRO  81   3.936  -2.634  -1.282
  499    HD2  PRO  81           HD1      PRO  81   5.005  -0.893  -3.069
  500    HD3  PRO  81           HD2      PRO  81   4.100  -0.364  -1.641
  501    H    GLY  82           H        GLY  82   8.610  -2.179   1.095
  502    HA2  GLY  82           HA2      GLY  82  10.536  -3.392   0.732
  503    HA3  GLY  82           HA3      GLY  82  10.001  -3.649  -0.922
  504    HA1  GLY  82           HA1      GLY  82  10.410  -2.526   0.835
  505    H    THR  83           H        THR  83  10.365  -0.461   0.464
  506    HA   THR  83           HA       THR  83  12.991  -0.060  -0.672
  507    HB   THR  83           HB       THR  83  11.892   2.046  -1.915
  508    HG1  THR  83           HG1      THR  83   9.935  -0.023  -2.087
  509   HG21  THR  83          HG21      THR  83  11.602  -0.077  -3.766
  510   HG22  THR  83          HG22      THR  83  12.923  -0.506  -2.678
  511   HG23  THR  83          HG23      THR  83  12.972   1.015  -3.567
  512    H    LEU  84           H        LEU  84  13.567   2.379  -0.499
  513    HA   LEU  84           HA       LEU  84  12.272   3.580   1.846
  514    HB2  LEU  84           HB1      LEU  84  14.807   2.341   1.844
  515    HB3  LEU  84           HB2      LEU  84  15.094   4.089   1.891
  516    HG   LEU  84           HG       LEU  84  13.208   3.840   3.821
  517   HD11  LEU  84          HD11      LEU  84  14.583   1.222   3.543
  518   HD12  LEU  84          HD12      LEU  84  12.939   1.589   4.062
  519   HD13  LEU  84          HD13      LEU  84  14.289   1.845   5.167
  520   HD21  LEU  84          HD21      LEU  84  14.968   4.198   5.373
  521   HD22  LEU  84          HD22      LEU  84  15.452   4.972   3.863
  522   HD23  LEU  84          HD23      LEU  84  16.146   3.415   4.319
  523    H    CYS  85           H        CYS  85  12.867   5.880   2.143
  524    HA   CYS  85           HA       CYS  85  13.166   7.176  -0.474
  525    HB2  CYS  85           HB1      CYS  85  11.681   7.819   2.018
  526    HB3  CYS  85           HB2      CYS  85  12.350   9.186   1.126
  527    H    VAL  86           H        VAL  86  15.192   7.772  -0.883
  528    HA   VAL  86           HA       VAL  86  16.680   9.175   1.235
  529    HB   VAL  86           HB       VAL  86  17.951   7.317  -0.778
  530   HG11  VAL  86          HG11      VAL  86  19.693   7.627   1.299
  531   HG12  VAL  86          HG12      VAL  86  19.747   8.537  -0.213
  532   HG13  VAL  86          HG13      VAL  86  18.953   9.225   1.205
  533   HG21  VAL  86          HG21      VAL  86  18.273   5.752   1.056
  534   HG22  VAL  86          HG22      VAL  86  17.408   6.829   2.151
  535   HG23  VAL  86          HG23      VAL  86  16.555   6.066   0.808
  536    H    ASN  87           H        ASN  87  17.741  10.999   0.627
  537    HA   ASN  87           HA       ASN  87  18.209  12.850  -0.612
  538    HB2  ASN  87           HB1      ASN  87  19.591  10.822  -1.703
  539    HB3  ASN  87           HB2      ASN  87  18.590  11.258  -3.094
  540   HD21  ASN  87          HD21      ASN  87  21.398  11.512  -2.958
  541   HD22  ASN  87          HD22      ASN  87  21.785  13.190  -3.097
  542    H    ASP  88           H        ASP  88  15.457  12.021  -0.488
  543    HA   ASP  88           HA       ASP  88  13.439  12.615  -1.356
  544    HB2  ASP  88           HB1      ASP  88  14.981  14.741  -1.834
  545    HB3  ASP  88           HB2      ASP  88  14.672  14.263  -3.509
  546    HD2  ASP  88           HD       ASP  88  11.899  16.215  -1.686
  547    H    VAL  89           H        VAL  89  14.974  10.343  -2.431
  548    HA   VAL  89           HA       VAL  89  13.429   9.997  -4.895
  549    HB   VAL  89           HB       VAL  89  16.357   9.285  -4.665
  550   HG11  VAL  89          HG11      VAL  89  16.091   8.743  -7.098
  551   HG12  VAL  89          HG12      VAL  89  15.249   7.647  -5.999
  552   HG13  VAL  89          HG13      VAL  89  14.348   8.887  -6.874
  553   HG21  VAL  89          HG21      VAL  89  16.799  11.014  -6.237
  554   HG22  VAL  89          HG22      VAL  89  15.080  11.312  -6.492
  555   HG23  VAL  89          HG23      VAL  89  15.827  11.726  -4.949
  556    H    CYS  90           H        CYS  90  12.655   7.954  -5.219
  557    HA   CYS  90           HA       CYS  90  12.580   6.208  -2.971
  558    HB2  CYS  90           HB1      CYS  90  11.444   6.206  -5.734
  559    HB3  CYS  90           HB2      CYS  90  11.488   4.677  -4.852
  560    H    THR  91           H        THR  91  14.235   4.971  -2.396
  561    HA   THR  91           HA       THR  91  15.799   3.646  -4.515
  562    HB   THR  91           HB       THR  91  17.095   5.304  -3.175
  563    HG1  THR  91           HG1      THR  91  18.802   3.759  -2.686
  564   HG21  THR  91          HG21      THR  91  15.963   5.031  -1.031
  565   HG22  THR  91          HG22      THR  91  17.692   4.722  -0.860
  566   HG23  THR  91          HG23      THR  91  16.555   3.374  -0.915
  567    H    THR  92           H        THR  92  16.904   1.602  -3.679
  568    HA   THR  92           HA       THR  92  14.851  -0.045  -2.415
  569    HB   THR  92           HB       THR  92  16.630  -1.885  -3.064
  570    HG1  THR  92           HG1      THR  92  18.298  -0.746  -3.860
  571   HG21  THR  92          HG21      THR  92  15.118  -0.533  -5.287
  572   HG22  THR  92          HG22      THR  92  14.311  -1.455  -4.019
  573   HG23  THR  92          HG23      THR  92  15.465  -2.249  -5.087
  574    H    MET  93           H        MET  93  15.302  -1.462  -0.679
  575    HA   MET  93           HA       MET  93  16.734  -0.386   1.440
  576    HB2  MET  93           HB1      MET  93  15.070  -2.599   1.017
  577    HB3  MET  93           HB2      MET  93  16.585  -3.269   1.641
  578    HG2  MET  93           HG1      MET  93  16.458  -1.987   3.632
  579    HG3  MET  93           HG2      MET  93  15.151  -0.997   2.978
  580    HE1  MET  93           HE1      MET  93  13.817  -1.368   5.230
  581    HE2  MET  93           HE2      MET  93  12.807  -1.313   3.786
  582    HE3  MET  93           HE3      MET  93  12.483  -2.506   5.044
  583    H    GLU  94           H        GLU  94  17.740  -2.670  -1.033
  584    HA   GLU  94           HA       GLU  94  20.175  -3.454   0.165
  585    HB2  GLU  94           HB1      GLU  94  19.308  -3.388  -2.734
  586    HB3  GLU  94           HB2      GLU  94  20.813  -4.127  -2.167
  587    HG2  GLU  94           HG1      GLU  94  18.719  -5.181  -0.582
  588    HG3  GLU  94           HG2      GLU  94  18.201  -5.246  -2.272
  589    HE2  GLU  94           HE       GLU  94  21.073  -7.656  -1.080
  590    H    ASP  95           H        ASP  95  19.250  -0.706  -1.781
  591    HA   ASP  95           HA       ASP  95  21.959   0.153  -2.261
  592    HB2  ASP  95           HB1      ASP  95  19.233   1.117  -2.949
  593    HB3  ASP  95           HB2      ASP  95  20.502   2.344  -2.846
  594    HD2  ASP  95           HD       ASP  95  21.563  -0.394  -5.459
  595    H    ALA  96           H        ALA  96  19.350   0.971  -0.040
  596    HA   ALA  96           HA       ALA  96  20.859   3.125   1.170
  597    HB1  ALA  96           HB1      ALA  96  18.149   1.941   1.627
  598    HB2  ALA  96           HB2      ALA  96  18.867   3.024   2.819
  599    HB3  ALA  96           HB3      ALA  96  18.589   3.587   1.172
  600    H    THR  97           H        THR  97  22.371   2.804   2.650
  601    HA   THR  97           HA       THR  97  22.471   0.264   4.089
  602    HB   THR  97           HB       THR  97  24.726   0.944   4.780
  603    HG1  THR  97           HG1      THR  97  24.738   3.118   4.895
  604   HG21  THR  97          HG21      THR  97  25.611   0.248   2.836
  605   HG22  THR  97          HG22      THR  97  24.926   1.600   1.935
  606   HG23  THR  97          HG23      THR  97  23.943   0.175   2.270
  607    H    GLU  98           H        GLU  98  20.726   0.664   5.536
  608    HA   GLU  98           HA       GLU  98  21.542   1.888   7.981
  609    HB2  GLU  98           HB1      GLU  98  20.672   3.791   6.428
  610    HB3  GLU  98           HB2      GLU  98  19.075   3.128   6.808
  611    HG2  GLU  98           HG1      GLU  98  19.558   3.425   9.220
  612    HG3  GLU  98           HG2      GLU  98  21.086   4.198   8.773
  613    HE2  GLU  98           HE       GLU  98  19.111   7.054   9.017
  614    H    ASN  99           H        ASN  99  20.135   1.407   9.729
  615    HA   ASN  99           HA       ASN  99  17.634   0.144   9.445
  616    HB2  ASN  99           HB1      ASN  99  19.446  -1.587   8.595
  617    HB3  ASN  99           HB2      ASN  99  19.662  -1.865  10.327
  618   HD21  ASN  99          HD21      ASN  99  18.913  -4.023   9.836
  619   HD22  ASN  99          HD22      ASN  99  17.216  -4.333   9.756
  620    H    LEU 100           H        LEU 100  17.079  -1.093  11.577
  621    HA   LEU 100           HA       LEU 100  18.471   0.111  13.861
  622    HB2  LEU 100           HB1      LEU 100  15.973   0.972  12.886
  623    HB3  LEU 100           HB2      LEU 100  15.643   0.030  14.351
  624    HG   LEU 100           HG       LEU 100  17.451   1.537  15.438
  625   HD11  LEU 100          HD11      LEU 100  17.047   3.887  14.208
  626   HD12  LEU 100          HD12      LEU 100  17.032   2.810  12.812
  627   HD13  LEU 100          HD13      LEU 100  18.432   2.845  13.883
  628   HD21  LEU 100          HD21      LEU 100  14.762   1.548  15.475
  629   HD22  LEU 100          HD22      LEU 100  15.065   3.161  14.830
  630   HD23  LEU 100          HD23      LEU 100  15.755   2.688  16.384
  631    H    TYR 101           H        TYR 101  18.266  -2.606  12.654
  632    HA   TYR 101           HA       TYR 101  17.520  -4.003  15.117
  633    HB2  TYR 101           HB1      TYR 101  16.631  -4.822  12.338
  634    HB3  TYR 101           HB2      TYR 101  16.433  -5.803  13.793
  635    HD1  TYR 101           HD1      TYR 101  15.163  -2.953  11.920
  636    HD2  TYR 101           HD2      TYR 101  14.859  -5.128  15.564
  637    HE1  TYR 101           HE1      TYR 101  13.013  -1.856  12.389
  638    HE2  TYR 101           HE2      TYR 101  12.706  -4.038  16.042
  639    HH   TYR 101           HH       TYR 101  11.052  -2.771  15.175
  640    H    PHE 102           H        PHE 102  18.442  -6.178  15.256
  641    HA   PHE 102           HA       PHE 102  21.037  -6.287  13.887
  642    HB2  PHE 102           HB1      PHE 102  20.070  -7.038  16.575
  643    HB3  PHE 102           HB2      PHE 102  21.193  -8.183  15.842
  644    HD1  PHE 102           HD1      PHE 102  23.431  -7.895  16.232
  645    HD2  PHE 102           HD2      PHE 102  20.872  -4.496  16.314
  646    HE1  PHE 102           HE1      PHE 102  25.338  -6.480  16.878
  647    HE2  PHE 102           HE2      PHE 102  22.774  -3.075  16.959
  648    HZ   PHE 102           HZ       PHE 102  25.010  -4.067  17.241
  649    H    GLN 103           H        GLN 103  18.285  -8.328  14.810
  650    HA   GLN 103           HA       GLN 103  17.482 -10.284  13.971
  651    HB2  GLN 103           HB1      GLN 103  17.670  -8.702  11.882
  652    HB3  GLN 103           HB2      GLN 103  18.959  -9.821  11.410
  653    HG2  GLN 103           HG1      GLN 103  17.342 -11.007  10.441
  654    HG3  GLN 103           HG2      GLN 103  16.952 -11.537  12.083
  655   HE21  GLN 103          HE21      GLN 103  14.857 -11.509  12.412
  656   HE22  GLN 103          HE22      GLN 103  13.750 -10.303  11.861
  657    H    SER 104           H        SER 104  19.862 -10.456  15.454
  658    HA   SER 104           HA       SER 104  21.360 -12.570  14.059
  659    HB2  SER 104           HB1      SER 104  22.431 -10.389  15.162
  660    HB3  SER 104           HB2      SER 104  22.356 -11.400  16.616
  661    HG   SER 104           HG       SER 104  23.959 -12.532  15.881
  662    H    LEU 105           H        LEU 105  19.001 -13.460  14.894
  663    HA   LEU 105           HA       LEU 105  19.441 -14.732  17.505
  664    HB2  LEU 105           HB1      LEU 105  16.914 -14.507  15.860
  665    HB3  LEU 105           HB2      LEU 105  17.050 -15.246  17.465
  666    HG   LEU 105           HG       LEU 105  18.018 -12.537  17.537
  667   HD11  LEU 105          HD11      LEU 105  15.186 -12.883  16.565
  668   HD12  LEU 105          HD12      LEU 105  16.518 -12.218  15.621
  669   HD13  LEU 105          HD13      LEU 105  15.948 -11.372  17.059
  670   HD21  LEU 105          HD21      LEU 105  17.371 -13.621  19.530
  671   HD22  LEU 105          HD22      LEU 105  15.807 -14.089  18.860
  672   HD23  LEU 105          HD23      LEU 105  16.139 -12.396  19.229
  673    H    GLU 106           H        GLU 106  20.878 -16.339  16.782
  674    HA   GLU 106           HA       GLU 106  19.608 -18.437  15.149
  675    HB2  GLU 106           HB1      GLU 106  22.292 -17.201  14.975
  676    HB3  GLU 106           HB2      GLU 106  22.240 -18.963  14.813
  677    HG2  GLU 106           HG1      GLU 106  20.168 -17.824  13.206
  678    HG3  GLU 106           HG2      GLU 106  21.702 -17.019  12.851
  679    HE2  GLU 106           HE       GLU 106  23.103 -20.105  11.762
  680    H    HIS 107           H        HIS 107  20.246 -20.625  15.645
  681    HA   HIS 107           HA       HIS 107  20.740 -20.968  18.503
  682    HB2  HIS 107           HB1      HIS 107  20.012 -23.314  18.105
  683    HB3  HIS 107           HB2      HIS 107  18.795 -22.117  17.653
  684    HD1  HIS 107           HD1      HIS 107  21.336 -24.408  16.041
  685    HD2  HIS 107           HD2      HIS 107  17.943 -22.223  15.053
  686    HE1  HIS 107           HE1      HIS 107  20.759 -25.088  13.690
  687    HE2  HIS 107           HE2      HIS 107  18.685 -23.752  13.085
  688    H    HIS 108           H        HIS 108  22.174 -22.700  19.234
  689    HA   HIS 108           HA       HIS 108  24.490 -23.009  17.439
  690    HB2  HIS 108           HB1      HIS 108  24.282 -22.548  20.398
  691    HB3  HIS 108           HB2      HIS 108  25.693 -23.384  19.740
  692    HD1  HIS 108           HD1      HIS 108  25.834 -20.558  21.096
  693    HD2  HIS 108           HD2      HIS 108  25.692 -21.264  17.004
  694    HE1  HIS 108           HE1      HIS 108  26.850 -18.521  20.026
  695    HE2  HIS 108           HE2      HIS 108  26.763 -18.952  17.524
  696    H    HIS 109           H        HIS 109  25.641 -24.991  17.491
  697    HA   HIS 109           HA       HIS 109  24.068 -27.251  18.545
  698    HB2  HIS 109           HB1      HIS 109  24.988 -28.592  16.667
  699    HB3  HIS 109           HB2      HIS 109  23.974 -27.251  16.129
  700    HD1  HIS 109           HD1      HIS 109  27.515 -28.436  16.103
  701    HD2  HIS 109           HD2      HIS 109  25.283 -25.221  14.711
  702    HE1  HIS 109           HE1      HIS 109  29.021 -27.217  14.500
  703    HE2  HIS 109           HE2      HIS 109  27.659 -25.250  13.648
  704    H    HIS 110           H        HIS 110  27.265 -25.904  18.013
  705    HA   HIS 110           HA       HIS 110  29.286 -26.330  18.967
  706    HB2  HIS 110           HB1      HIS 110  27.309 -27.134  20.987
  707    HB3  HIS 110           HB2      HIS 110  28.878 -27.920  21.173
  708    HD1  HIS 110           HD1      HIS 110  30.873 -25.796  20.625
  709    HD2  HIS 110           HD2      HIS 110  27.347 -25.020  22.682
  710    HE1  HIS 110           HE1      HIS 110  31.318 -23.712  21.960
  711    HE2  HIS 110           HE2      HIS 110  29.164 -23.236  23.218
  712    H    HIS 111           H        HIS 111  29.975 -27.613  17.220
  713    HA   HIS 111           HA       HIS 111  29.457 -30.392  17.025
  714    HB2  HIS 111           HB1      HIS 111  30.584 -28.478  15.392
  715    HB3  HIS 111           HB2      HIS 111  31.970 -29.485  15.819
  716    HD1  HIS 111           HD1      HIS 111  29.104 -29.372  13.579
  717    HD2  HIS 111           HD2      HIS 111  31.589 -32.308  15.150
  718    HE1  HIS 111           HE1      HIS 111  28.759 -31.393  12.124
  719    HE2  HIS 111           HE2      HIS 111  30.277 -33.189  13.083
  720    H    HIS 112           H        HIS 112  30.597 -32.148  17.714
  721    HA   HIS 112           HA       HIS 112  33.133 -31.768  19.096
  722    HB2  HIS 112           HB1      HIS 112  30.846 -31.755  20.587
  723    HB3  HIS 112           HB2      HIS 112  31.255 -33.474  20.600
  724    HD1  HIS 112           HD1      HIS 112  32.292 -30.222  22.013
  725    HD2  HIS 112           HD2      HIS 112  33.753 -34.107  21.833
  726    HE1  HIS 112           HE1      HIS 112  34.120 -30.333  23.736
  727    HE2  HIS 112           HE2      HIS 112  35.014 -32.706  23.628
  Start of MODEL   70
    1    H1   MET  18           H        MET  18 -41.855  51.242  15.441
    2    HA   MET  18           HA       MET  18 -41.853  51.067  13.167
    3    HB2  MET  18           HB1      MET  18 -39.138  52.392  13.173
    4    HB3  MET  18           HB2      MET  18 -40.305  52.317  11.845
    5    HG2  MET  18           HG1      MET  18 -41.023  54.320  12.468
    6    HG3  MET  18           HG2      MET  18 -41.700  53.539  13.900
    7    HE1  MET  18           HE1      MET  18 -40.386  56.386  15.897
    8    HE2  MET  18           HE2      MET  18 -41.722  55.760  14.931
    9    HE3  MET  18           HE3      MET  18 -41.108  54.827  16.296
   10    H    LEU  19           H        LEU  19 -41.091  48.904  14.646
   11    HA   LEU  19           HA       LEU  19 -38.855  47.750  13.117
   12    HB2  LEU  19           HB1      LEU  19 -38.609  46.136  14.952
   13    HB3  LEU  19           HB2      LEU  19 -38.394  47.813  15.482
   14    HG   LEU  19           HG       LEU  19 -41.091  46.614  15.812
   15   HD11  LEU  19          HD11      LEU  19 -38.816  45.976  17.683
   16   HD12  LEU  19          HD12      LEU  19 -39.513  44.837  16.532
   17   HD13  LEU  19          HD13      LEU  19 -40.502  45.483  17.841
   18   HD21  LEU  19          HD21      LEU  19 -41.127  48.712  16.669
   19   HD22  LEU  19          HD22      LEU  19 -39.401  48.718  17.031
   20   HD23  LEU  19          HD23      LEU  19 -40.524  47.872  18.097
   21    H    VAL  20           H        VAL  20 -41.335  47.866  11.911
   22    HA   VAL  20           HA       VAL  20 -42.954  45.593  12.310
   23    HB   VAL  20           HB       VAL  20 -43.787  46.045   9.993
   24   HG11  VAL  20          HG11      VAL  20 -44.358  48.575  10.665
   25   HG12  VAL  20          HG12      VAL  20 -45.112  47.180  11.437
   26   HG13  VAL  20          HG13      VAL  20 -43.753  47.993  12.215
   27   HG21  VAL  20          HG21      VAL  20 -42.563  47.205   8.551
   28   HG22  VAL  20          HG22      VAL  20 -42.595  48.605   9.623
   29   HG23  VAL  20          HG23      VAL  20 -41.314  47.403   9.780
   30    H    LEU  21           H        LEU  21 -42.706  43.532  11.737
   31    HA   LEU  21           HA       LEU  21 -40.338  42.782  10.212
   32    HB2  LEU  21           HB1      LEU  21 -40.830  40.498  10.948
   33    HB3  LEU  21           HB2      LEU  21 -40.722  41.634  12.304
   34    HG   LEU  21           HG       LEU  21 -43.399  41.638  11.838
   35   HD11  LEU  21          HD11      LEU  21 -44.208  39.703  11.025
   36   HD12  LEU  21          HD12      LEU  21 -42.905  38.740  11.718
   37   HD13  LEU  21          HD13      LEU  21 -42.643  39.624  10.215
   38   HD21  LEU  21          HD21      LEU  21 -42.078  41.317  13.969
   39   HD22  LEU  21          HD22      LEU  21 -42.043  39.596  13.583
   40   HD23  LEU  21          HD23      LEU  21 -43.586  40.410  13.849
   41    H    ASP  22           H        ASP  22 -40.365  41.753   8.267
   42    HA   ASP  22           HA       ASP  22 -42.904  40.917   7.108
   43    HB2  ASP  22           HB1      ASP  22 -42.182  43.443   6.590
   44    HB3  ASP  22           HB2      ASP  22 -41.221  42.628   5.348
   45    HD2  ASP  22           HD       ASP  22 -45.158  42.181   5.014
   46    H    PHE  23           H        PHE  23 -42.666  39.089   5.996
   47    HA   PHE  23           HA       PHE  23 -40.108  38.486   4.719
   48    HB2  PHE  23           HB1      PHE  23 -40.150  37.516   7.064
   49    HB3  PHE  23           HB2      PHE  23 -41.466  36.475   6.517
   50    HD1  PHE  23           HD1      PHE  23 -37.941  36.848   6.730
   51    HD2  PHE  23           HD2      PHE  23 -41.033  34.974   4.485
   52    HE1  PHE  23           HE1      PHE  23 -36.316  35.219   5.859
   53    HE2  PHE  23           HE2      PHE  23 -39.414  33.341   3.610
   54    HZ   PHE  23           HZ       PHE  23 -37.052  33.461   4.298
   55    H    ASN  24           H        ASN  24 -40.951  38.539   2.686
   56    HA   ASN  24           HA       ASN  24 -42.663  36.316   1.942
   57    HB2  ASN  24           HB1      ASN  24 -44.134  38.337   2.501
   58    HB3  ASN  24           HB2      ASN  24 -43.445  39.091   1.057
   59   HD21  ASN  24          HD21      ASN  24 -44.964  36.050   2.067
   60   HD22  ASN  24          HD22      ASN  24 -45.899  35.843   0.628
   61    H    ASN  25           H        ASN  25 -40.261  36.080   1.228
   62    HA   ASN  25           HA       ASN  25 -40.204  36.691  -1.610
   63    HB2  ASN  25           HB1      ASN  25 -37.965  37.540   0.249
   64    HB3  ASN  25           HB2      ASN  25 -37.902  37.596  -1.516
   65   HD21  ASN  25          HD21      ASN  25 -38.896  39.223  -2.606
   66   HD22  ASN  25          HD22      ASN  25 -39.650  40.572  -1.833
   67    H    ILE  26           H        ILE  26 -40.553  34.371  -1.589
   68    HA   ILE  26           HA       ILE  26 -38.008  32.931  -1.461
   69    HB   ILE  26           HB       ILE  26 -39.185  30.946  -0.483
   70   HG12  ILE  26          HG11      ILE  26 -41.304  33.009   0.168
   71   HG13  ILE  26          HG12      ILE  26 -41.488  31.680  -0.989
   72   HG21  ILE  26          HG21      ILE  26 -39.305  33.243   1.436
   73   HG22  ILE  26          HG22      ILE  26 -38.769  31.587   1.715
   74   HG23  ILE  26          HG23      ILE  26 -37.769  32.690   0.771
   75   HD11  ILE  26          HD11      ILE  26 -41.533  31.626   1.965
   76   HD12  ILE  26          HD12      ILE  26 -42.483  30.711   0.794
   77   HD13  ILE  26          HD13      ILE  26 -40.819  30.243   1.139
   78    H    ARG  27           H        ARG  27 -39.200  33.894  -3.754
   79    HA   ARG  27           HA       ARG  27 -40.976  32.210  -5.074
   80    HB2  ARG  27           HB1      ARG  27 -40.079  34.498  -5.792
   81    HB3  ARG  27           HB2      ARG  27 -38.694  33.614  -6.451
   82    HG2  ARG  27           HG1      ARG  27 -39.921  32.634  -8.130
   83    HG3  ARG  27           HG2      ARG  27 -41.443  32.777  -7.235
   84    HD2  ARG  27           HD1      ARG  27 -41.797  34.945  -7.878
   85    HD3  ARG  27           HD2      ARG  27 -40.067  35.290  -8.004
   86    HE   ARG  27           HE       ARG  27 -40.600  33.501 -10.022
   87   HH11  ARG  27          HH11      ARG  27 -41.730  36.661  -9.095
   88   HH12  ARG  27          HH12      ARG  27 -42.079  37.155 -10.718
   89   HH21  ARG  27          HH21      ARG  27 -41.056  34.140 -12.163
   90   HH22  ARG  27          HH22      ARG  27 -41.697  35.720 -12.462
   91    H    SER  28           H        SER  28 -37.468  32.008  -4.752
   92    HA   SER  28           HA       SER  28 -35.984  30.337  -5.172
   93    HB2  SER  28           HB1      SER  28 -38.383  28.488  -5.256
   94    HB3  SER  28           HB2      SER  28 -36.707  28.069  -4.863
   95    HG   SER  28           HG       SER  28 -37.749  28.275  -2.933
   96    H    SER  29           H        SER  29 -35.904  28.154  -6.732
   97    HA   SER  29           HA       SER  29 -37.136  28.589  -9.291
   98    HB2  SER  29           HB1      SER  29 -34.483  29.690  -8.721
   99    HB3  SER  29           HB2      SER  29 -34.490  28.595 -10.114
  100    HG   SER  29           HG       SER  29 -35.186  31.063 -10.173
  101    H    ALA  30           H        ALA  30 -34.403  27.042  -7.623
  102    HA   ALA  30           HA       ALA  30 -35.339  24.426  -8.090
  103    HB1  ALA  30           HB1      ALA  30 -33.587  25.585 -10.157
  104    HB2  ALA  30           HB2      ALA  30 -33.158  23.967  -9.600
  105    HB3  ALA  30           HB3      ALA  30 -34.762  24.274 -10.265
  106    H    ASP  31           H        ASP  31 -34.566  23.320  -6.426
  107    HA   ASP  31           HA       ASP  31 -31.879  23.989  -5.416
  108    HB2  ASP  31           HB1      ASP  31 -34.441  23.874  -4.062
  109    HB3  ASP  31           HB2      ASP  31 -33.284  22.751  -3.332
  110    HD2  ASP  31           HD       ASP  31 -32.427  26.626  -3.140
  111    H    LEU  32           H        LEU  32 -30.471  22.414  -5.763
  112    HA   LEU  32           HA       LEU  32 -31.440  19.631  -5.743
  113    HB2  LEU  32           HB1      LEU  32 -29.722  21.111  -7.601
  114    HB3  LEU  32           HB2      LEU  32 -29.046  19.558  -7.078
  115    HG   LEU  32           HG       LEU  32 -31.566  18.811  -7.752
  116   HD11  LEU  32          HD11      LEU  32 -31.976  19.880  -9.981
  117   HD12  LEU  32          HD12      LEU  32 -30.798  21.113  -9.532
  118   HD13  LEU  32          HD13      LEU  32 -32.274  20.921  -8.588
  119   HD21  LEU  32          HD21      LEU  32 -30.539  18.042  -9.887
  120   HD22  LEU  32          HD22      LEU  32 -29.594  17.648  -8.451
  121   HD23  LEU  32          HD23      LEU  32 -29.108  18.992  -9.486
  122    H    HIS  33           H        HIS  33 -28.461  21.538  -5.267
  123    HA   HIS  33           HA       HIS  33 -27.978  20.533  -2.677
  124    HB2  HIS  33           HB1      HIS  33 -27.286  18.726  -4.694
  125    HB3  HIS  33           HB2      HIS  33 -25.757  19.475  -4.221
  126    HD1  HIS  33           HD1      HIS  33 -26.012  19.740  -1.240
  127    HD2  HIS  33           HD2      HIS  33 -27.315  16.384  -3.315
  128    HE1  HIS  33           HE1      HIS  33 -26.053  17.877   0.451
  129    HE2  HIS  33           HE2      HIS  33 -26.847  15.826  -0.817
  130    H    GLY  34           H        GLY  34 -26.402  21.688  -5.645
  131    HA2  GLY  34           HA2      GLY  34 -25.636  24.094  -5.358
  132    HA3  GLY  34           HA3      GLY  34 -24.753  23.474  -3.970
  133    HA1  GLY  34           HA1      GLY  34 -25.665  23.389  -5.889
  134    H    ALA  35           H        ALA  35 -22.808  22.493  -4.262
  135    HA   ALA  35           HA       ALA  35 -21.941  21.619  -6.870
  136    HB1  ALA  35           HB1      ALA  35 -20.725  24.070  -5.607
  137    HB2  ALA  35           HB2      ALA  35 -19.971  23.154  -6.913
  138    HB3  ALA  35           HB3      ALA  35 -21.523  23.949  -7.177
  139    H    ARG  36           H        ARG  36 -22.123  19.905  -4.971
  140    HA   ARG  36           HA       ARG  36 -19.419  19.629  -3.831
  141    HB2  ARG  36           HB1      ARG  36 -22.002  18.582  -2.648
  142    HB3  ARG  36           HB2      ARG  36 -20.385  18.443  -1.940
  143    HG2  ARG  36           HG1      ARG  36 -20.995  21.204  -2.496
  144    HG3  ARG  36           HG2      ARG  36 -22.261  20.462  -1.503
  145    HD2  ARG  36           HD1      ARG  36 -20.319  19.527  -0.081
  146    HD3  ARG  36           HD2      ARG  36 -19.334  20.738  -0.914
  147    HE   ARG  36           HE       ARG  36 -21.674  21.918   0.173
  148   HH11  ARG  36          HH11      ARG  36 -18.540  20.680   1.050
  149   HH12  ARG  36          HH12      ARG  36 -18.388  21.691   2.449
  150   HH21  ARG  36          HH21      ARG  36 -21.485  23.254   2.013
  151   HH22  ARG  36          HH22      ARG  36 -20.064  23.153   2.996
  152    H    LYS  37           H        LYS  37 -18.575  17.491  -3.692
  153    HA   LYS  37           HA       LYS  37 -19.954  15.488  -5.342
  154    HB2  LYS  37           HB1      LYS  37 -17.099  16.434  -5.581
  155    HB3  LYS  37           HB2      LYS  37 -17.630  14.865  -6.211
  156    HG2  LYS  37           HG1      LYS  37 -19.489  16.430  -7.345
  157    HG3  LYS  37           HG2      LYS  37 -18.153  17.588  -7.220
  158    HD2  LYS  37           HD1      LYS  37 -16.692  16.166  -8.480
  159    HD3  LYS  37           HD2      LYS  37 -17.867  14.840  -8.429
  160    HE2  LYS  37           HE1      LYS  37 -18.225  15.677 -10.554
  161    HE3  LYS  37           HE2      LYS  37 -19.439  16.555  -9.610
  162    HZ1  LYS  37           HZ1      LYS  37 -17.488  18.267  -9.376
  163    HZ2  LYS  37           HZ2      LYS  37 -18.485  18.265 -10.742
  164    HZ3  LYS  37           HZ3      LYS  37 -16.957  17.542 -10.809
  165    H    GLY  38           H        GLY  38 -16.884  15.743  -3.537
  166    HA2  GLY  38           HA2      GLY  38 -17.340  14.425  -1.261
  167    HA3  GLY  38           HA3      GLY  38 -17.342  13.098  -2.414
  168    HA1  GLY  38           HA1      GLY  38 -16.848  15.029  -1.675
  169    H    SER  39           H        SER  39 -15.493  12.031  -2.140
  170    HA   SER  39           HA       SER  39 -13.001  13.369  -2.688
  171    HB2  SER  39           HB1      SER  39 -13.773  12.571   0.073
  172    HB3  SER  39           HB2      SER  39 -12.122  12.176  -0.441
  173    HG   SER  39           HG       SER  39 -12.974  14.489   0.414
  174    H    GLN  40           H        GLN  40 -11.639  12.023  -3.701
  175    HA   GLN  40           HA       GLN  40 -12.434   9.458  -4.485
  176    HB2  GLN  40           HB1      GLN  40 -10.450  11.237  -5.213
  177    HB3  GLN  40           HB2      GLN  40  -9.543   9.871  -4.543
  178    HG2  GLN  40           HG1      GLN  40  -9.770   9.562  -6.907
  179    HG3  GLN  40           HG2      GLN  40 -10.757   8.358  -6.066
  180   HE21  GLN  40          HE21      GLN  40 -12.561   7.995  -7.122
  181   HE22  GLN  40          HE22      GLN  40 -13.547   9.180  -7.902
  182    H    CYS  41           H        CYS  41  -9.744  10.334  -2.308
  183    HA   CYS  41           HA       CYS  41 -10.353   8.052  -0.620
  184    HB2  CYS  41           HB1      CYS  41  -7.974   7.248  -0.712
  185    HB3  CYS  41           HB2      CYS  41  -8.905   6.969  -2.184
  186    H    LEU  42           H        LEU  42  -9.313   8.132   1.431
  187    HA   LEU  42           HA       LEU  42  -8.448  10.842   2.147
  188    HB2  LEU  42           HB1      LEU  42  -9.940   8.692   3.499
  189    HB3  LEU  42           HB2      LEU  42  -8.767   9.550   4.515
  190    HG   LEU  42           HG       LEU  42  -9.889  11.688   3.908
  191   HD11  LEU  42          HD11      LEU  42 -11.569   9.804   2.338
  192   HD12  LEU  42          HD12      LEU  42 -11.025  11.434   1.944
  193   HD13  LEU  42          HD13      LEU  42 -12.345  11.198   3.089
  194   HD21  LEU  42          HD21      LEU  42 -10.611   9.775   5.769
  195   HD22  LEU  42          HD22      LEU  42 -12.140  10.228   5.016
  196   HD23  LEU  42          HD23      LEU  42 -11.120  11.465   5.752
  197    H    SER  43           H        SER  43  -7.395   7.540   2.025
  198    HA   SER  43           HA       SER  43  -4.676   8.318   2.500
  199    HB2  SER  43           HB1      SER  43  -6.281   7.097   4.658
  200    HB3  SER  43           HB2      SER  43  -4.721   6.314   4.353
  201    HG   SER  43           HG       SER  43  -5.224   8.998   5.080
  202    H    ASP  44           H        ASP  44  -3.200   6.375   2.401
  203    HA   ASP  44           HA       ASP  44  -3.630   4.927   0.083
  204    HB2  ASP  44           HB1      ASP  44  -1.706   3.611   0.667
  205    HB3  ASP  44           HB2      ASP  44  -1.426   5.268   1.222
  206    HD2  ASP  44           HD       ASP  44  -1.526   4.320   4.573
  207    H    THR  45           H        THR  45  -4.582   4.208   3.361
  208    HA   THR  45           HA       THR  45  -5.070   1.483   3.211
  209    HB   THR  45           HB       THR  45  -7.200   2.569   4.710
  210    HG1  THR  45           HG1      THR  45  -6.498   4.458   5.329
  211   HG21  THR  45          HG21      THR  45  -6.272   0.806   5.779
  212   HG22  THR  45          HG22      THR  45  -5.292   2.048   6.560
  213   HG23  THR  45          HG23      THR  45  -4.654   1.162   5.176
  214    H    ASP  46           H        ASP  46  -6.988   4.176   2.026
  215    HA   ASP  46           HA       ASP  46  -9.313   2.644   1.423
  216    HB2  ASP  46           HB1      ASP  46  -8.703   5.334   1.516
  217    HB3  ASP  46           HB2      ASP  46  -8.899   5.035  -0.216
  218    HD2  ASP  46           HD       ASP  46 -12.103   5.402   1.863
  219    H    CYS  47           H        CYS  47  -6.325   3.288  -0.219
  220    HA   CYS  47           HA       CYS  47  -7.319   2.322  -2.772
  221    HB2  CYS  47           HB1      CYS  47  -5.300   4.074  -2.030
  222    HB3  CYS  47           HB2      CYS  47  -4.425   2.628  -2.535
  223    H    ASN  48           H        ASN  48  -7.525   0.211  -3.084
  224    HA   ASN  48           HA       ASN  48  -6.274  -1.755  -1.473
  225    HB2  ASN  48           HB1      ASN  48  -7.882  -1.827  -4.017
  226    HB3  ASN  48           HB2      ASN  48  -7.117  -3.296  -3.398
  227   HD21  ASN  48          HD21      ASN  48  -9.608  -3.666  -3.504
  228   HD22  ASN  48          HD22      ASN  48 -10.430  -3.443  -2.001
  229    H    THR  49           H        THR  49  -5.177  -3.691  -2.766
  230    HA   THR  49           HA       THR  49  -3.219  -4.436  -3.659
  231    HB   THR  49           HB       THR  49  -2.870  -2.455  -5.741
  232    HG1  THR  49           HG1      THR  49  -4.940  -2.000  -5.959
  233   HG21  THR  49          HG21      THR  49  -2.014  -4.535  -6.244
  234   HG22  THR  49          HG22      THR  49  -3.566  -4.605  -7.082
  235   HG23  THR  49          HG23      THR  49  -3.373  -5.389  -5.514
  236    H    ARG  50           H        ARG  50  -1.035  -3.374  -4.774
  237    HA   ARG  50           HA       ARG  50   0.154  -1.944  -2.582
  238    HB2  ARG  50           HB1      ARG  50   2.232  -2.079  -3.957
  239    HB3  ARG  50           HB2      ARG  50   1.466  -3.646  -3.654
  240    HG2  ARG  50           HG1      ARG  50   0.469  -2.491  -6.104
  241    HG3  ARG  50           HG2      ARG  50   2.238  -2.595  -6.115
  242    HD2  ARG  50           HD1      ARG  50   0.485  -4.917  -5.310
  243    HD3  ARG  50           HD2      ARG  50   0.971  -4.617  -6.985
  244    HE   ARG  50           HE       ARG  50   3.307  -4.599  -5.534
  245   HH11  ARG  50          HH11      ARG  50   0.715  -6.851  -6.108
  246   HH12  ARG  50          HH12      ARG  50   1.718  -8.252  -5.932
  247   HH21  ARG  50          HH21      ARG  50   4.639  -6.436  -5.299
  248   HH22  ARG  50          HH22      ARG  50   3.949  -8.015  -5.470
  249    H    LYS  51           H        LYS  51  -1.518  -0.147  -3.068
  250    HA   LYS  51           HA       LYS  51  -0.138   1.889  -4.673
  251    HB2  LYS  51           HB1      LYS  51  -2.925   0.911  -4.949
  252    HB3  LYS  51           HB2      LYS  51  -2.695   2.665  -5.029
  253    HG2  LYS  51           HG1      LYS  51  -2.243   2.403  -7.188
  254    HG3  LYS  51           HG2      LYS  51  -0.713   1.667  -6.678
  255    HD2  LYS  51           HD1      LYS  51  -1.621  -0.535  -6.792
  256    HD3  LYS  51           HD2      LYS  51  -3.265   0.098  -6.989
  257    HE2  LYS  51           HE1      LYS  51  -1.251   0.949  -9.002
  258    HE3  LYS  51           HE2      LYS  51  -1.773  -0.741  -9.044
  259    HZ1  LYS  51           HZ1      LYS  51  -4.113   0.160  -9.031
  260    HZ2  LYS  51           HZ2      LYS  51  -3.227   0.419 -10.449
  261    HZ3  LYS  51           HZ3      LYS  51  -3.445   1.683  -9.345
  262    H    PHE  52           H        PHE  52  -0.689   4.100  -4.065
  263    HA   PHE  52           HA       PHE  52  -1.668   4.307  -1.295
  264    HB2  PHE  52           HB1      PHE  52   0.007   5.931  -0.774
  265    HB3  PHE  52           HB2      PHE  52   0.827   4.550  -1.504
  266    HD1  PHE  52           HD1      PHE  52   0.214   8.069  -1.725
  267    HD2  PHE  52           HD2      PHE  52   1.488   4.663  -3.936
  268    HE1  PHE  52           HE1      PHE  52   1.251   9.546  -3.397
  269    HE2  PHE  52           HE2      PHE  52   2.526   6.134  -5.612
  270    HZ   PHE  52           HZ       PHE  52   2.410   8.580  -5.343
  271    H    CYS  53           H        CYS  53  -2.360   6.555  -0.720
  272    HA   CYS  53           HA       CYS  53  -3.868   7.690  -2.966
  273    HB2  CYS  53           HB1      CYS  53  -5.212   6.958  -1.069
  274    HB3  CYS  53           HB2      CYS  53  -4.262   7.971   0.020
  275    H    LEU  54           H        LEU  54  -2.633   9.201  -3.932
  276    HA   LEU  54           HA       LEU  54  -0.879  10.934  -2.466
  277    HB2  LEU  54           HB1      LEU  54  -0.748  10.054  -4.935
  278    HB3  LEU  54           HB2      LEU  54  -1.738  11.486  -5.271
  279    HG   LEU  54           HG       LEU  54   0.701  11.981  -3.691
  280   HD11  LEU  54          HD11      LEU  54   1.890  10.592  -5.057
  281   HD12  LEU  54          HD12      LEU  54   1.900  12.059  -6.036
  282   HD13  LEU  54          HD13      LEU  54   0.762  10.762  -6.402
  283   HD21  LEU  54          HD21      LEU  54  -0.883  13.290  -5.855
  284   HD22  LEU  54          HD22      LEU  54   0.787  13.783  -5.578
  285   HD23  LEU  54          HD23      LEU  54  -0.400  13.915  -4.279
  286    H    GLN  55           H        GLN  55  -1.210  12.980  -1.790
  287    HA   GLN  55           HA       GLN  55  -3.763  14.264  -2.492
  288    HB2  GLN  55           HB1      GLN  55  -3.713  15.223  -0.131
  289    HB3  GLN  55           HB2      GLN  55  -4.127  13.509  -0.288
  290    HG2  GLN  55           HG1      GLN  55  -2.175  12.787   0.663
  291    HG3  GLN  55           HG2      GLN  55  -1.284  14.236   0.177
  292   HE21  GLN  55          HE21      GLN  55  -2.495  16.298   1.177
  293   HE22  GLN  55          HE22      GLN  55  -2.683  16.200   2.893
  294    HA   PRO  56           HA       PRO  56  -0.392  17.173  -3.570
  295    HB2  PRO  56           HB1      PRO  56  -1.736  18.280  -5.684
  296    HB3  PRO  56           HB2      PRO  56  -0.802  16.789  -5.796
  297    HG2  PRO  56           HG1      PRO  56  -3.754  17.161  -5.411
  298    HG3  PRO  56           HG2      PRO  56  -2.881  16.039  -6.522
  299    HD2  PRO  56           HD1      PRO  56  -3.966  15.222  -4.172
  300    HD3  PRO  56           HD2      PRO  56  -2.479  14.524  -4.832
  301    H    ARG  57           H        ARG  57  -0.241  19.393  -3.238
  302    HA   ARG  57           HA       ARG  57  -2.342  20.535  -1.618
  303    HB2  ARG  57           HB1      ARG  57   0.459  20.832  -1.824
  304    HB3  ARG  57           HB2      ARG  57  -0.246  22.403  -2.234
  305    HG2  ARG  57           HG1      ARG  57  -1.542  22.347  -0.126
  306    HG3  ARG  57           HG2      ARG  57  -0.718  20.836   0.291
  307    HD2  ARG  57           HD1      ARG  57   1.042  23.088  -0.477
  308    HD3  ARG  57           HD2      ARG  57   0.151  23.278   1.039
  309    HE   ARG  57           HE       ARG  57   1.297  20.741   1.063
  310   HH11  ARG  57          HH11      ARG  57   2.311  24.071   1.046
  311   HH12  ARG  57          HH12      ARG  57   3.784  23.764   1.907
  312   HH21  ARG  57          HH21      ARG  57   3.231  20.324   2.197
  313   HH22  ARG  57          HH22      ARG  57   4.305  21.631   2.561
  314    H    ASP  58           H        ASP  58  -0.994  20.978  -4.823
  315    HA   ASP  58           HA       ASP  58  -2.547  23.367  -5.331
  316    HB2  ASP  58           HB1      ASP  58  -0.298  22.034  -6.538
  317    HB3  ASP  58           HB2      ASP  58  -1.542  22.331  -7.759
  318    HD2  ASP  58           HD       ASP  58   0.555  25.356  -6.472
  319    H    GLU  59           H        GLU  59  -2.883  19.959  -5.723
  320    HA   GLU  59           HA       GLU  59  -5.349  20.394  -7.280
  321    HB2  GLU  59           HB1      GLU  59  -3.139  18.893  -8.028
  322    HB3  GLU  59           HB2      GLU  59  -4.282  17.687  -7.415
  323    HG2  GLU  59           HG1      GLU  59  -5.969  19.055  -8.946
  324    HG3  GLU  59           HG2      GLU  59  -4.464  19.438  -9.796
  325    HE2  GLU  59           HE       GLU  59  -6.021  15.896 -10.274
  326    H    LYS  60           H        LYS  60  -6.691  18.160  -7.060
  327    HA   LYS  60           HA       LYS  60  -7.333  18.021  -4.228
  328    HB2  LYS  60           HB1      LYS  60  -8.736  17.558  -6.757
  329    HB3  LYS  60           HB2      LYS  60  -9.087  16.334  -5.527
  330    HG2  LYS  60           HG1      LYS  60  -9.643  18.187  -3.940
  331    HG3  LYS  60           HG2      LYS  60  -9.484  19.307  -5.304
  332    HD2  LYS  60           HD1      LYS  60 -11.287  18.261  -6.484
  333    HD3  LYS  60           HD2      LYS  60 -11.349  16.938  -5.305
  334    HE2  LYS  60           HE1      LYS  60 -13.029  18.159  -4.406
  335    HE3  LYS  60           HE2      LYS  60 -11.691  19.047  -3.662
  336    HZ1  LYS  60           HZ1      LYS  60 -13.241  20.567  -4.679
  337    HZ2  LYS  60           HZ2      LYS  60 -13.093  19.790  -6.173
  338    HZ3  LYS  60           HZ3      LYS  60 -11.773  20.621  -5.517
  339    HA   PRO  61           HA       PRO  61  -5.601  14.081  -3.376
  340    HB2  PRO  61           HB1      PRO  61  -7.511  12.922  -1.793
  341    HB3  PRO  61           HB2      PRO  61  -6.485  14.253  -1.262
  342    HG2  PRO  61           HG1      PRO  61  -9.283  14.322  -2.338
  343    HG3  PRO  61           HG2      PRO  61  -8.588  15.181  -0.913
  344    HD2  PRO  61           HD1      PRO  61  -9.000  16.402  -3.302
  345    HD3  PRO  61           HD2      PRO  61  -7.647  16.818  -2.235
  346    H    PHE  62           H        PHE  62  -5.424  12.163  -4.377
  347    HA   PHE  62           HA       PHE  62  -7.747  10.729  -5.322
  348    HB2  PHE  62           HB1      PHE  62  -7.197  10.713  -7.649
  349    HB3  PHE  62           HB2      PHE  62  -7.242  12.399  -7.131
  350    HD1  PHE  62           HD1      PHE  62  -4.927  13.381  -6.334
  351    HD2  PHE  62           HD2      PHE  62  -5.394  10.030  -8.916
  352    HE1  PHE  62           HE1      PHE  62  -2.650  13.733  -7.197
  353    HE2  PHE  62           HE2      PHE  62  -3.117  10.377  -9.783
  354    HZ   PHE  62           HZ       PHE  62  -1.742  12.230  -8.923
  355    H    CYS  63           H        CYS  63  -7.079   8.651  -6.418
  356    HA   CYS  63           HA       CYS  63  -4.938   7.462  -4.865
  357    HB2  CYS  63           HB1      CYS  63  -7.335   6.535  -6.255
  358    HB3  CYS  63           HB2      CYS  63  -5.941   5.493  -6.544
  359    H    ALA  64           H        ALA  64  -2.939   7.182  -5.583
  360    HA   ALA  64           HA       ALA  64  -2.455   7.337  -8.485
  361    HB1  ALA  64           HB1      ALA  64  -0.326   8.268  -8.049
  362    HB2  ALA  64           HB2      ALA  64  -1.460   9.123  -7.004
  363    HB3  ALA  64           HB3      ALA  64  -0.421   7.866  -6.334
  364    H    THR  65           H        THR  65  -0.723   6.018  -9.350
  365    HA   THR  65           HA       THR  65  -0.827   3.336  -8.319
  366    HB   THR  65           HB       THR  65   0.639   2.781 -10.256
  367    HG1  THR  65           HG1      THR  65   1.545   4.336 -11.395
  368   HG21  THR  65          HG21      THR  65  -1.195   2.620 -11.527
  369   HG22  THR  65          HG22      THR  65  -1.371   4.371 -11.628
  370   HG23  THR  65          HG23      THR  65  -2.035   3.496 -10.248
  371    H    CYS  66           H        CYS  66   1.250   2.034  -8.204
  372    HA   CYS  66           HA       CYS  66   2.849   2.985  -6.121
  373    HB2  CYS  66           HB1      CYS  66   2.486   0.582  -6.744
  374    HB3  CYS  66           HB2      CYS  66   3.594   0.821  -8.098
  375    H    ARG  67           H        ARG  67   4.908   3.832  -6.019
  376    HA   ARG  67           HA       ARG  67   5.805   5.191  -8.436
  377    HB2  ARG  67           HB1      ARG  67   6.811   5.434  -5.592
  378    HB3  ARG  67           HB2      ARG  67   7.237   6.489  -6.947
  379    HG2  ARG  67           HG1      ARG  67   4.562   6.750  -7.012
  380    HG3  ARG  67           HG2      ARG  67   4.804   6.434  -5.286
  381    HD2  ARG  67           HD1      ARG  67   5.527   8.516  -4.953
  382    HD3  ARG  67           HD2      ARG  67   6.781   8.294  -6.182
  383    HE   ARG  67           HE       ARG  67   4.432   8.762  -7.557
  384   HH11  ARG  67          HH11      ARG  67   6.417  10.444  -5.245
  385   HH12  ARG  67          HH12      ARG  67   5.989  12.018  -5.826
  386   HH21  ARG  67          HH21      ARG  67   3.860  10.831  -8.332
  387   HH22  ARG  67          HH22      ARG  67   4.534  12.238  -7.582
  388    H    GLY  68           H        GLY  68   7.818   4.935  -9.362
  389    HA2  GLY  68           HA2      GLY  68   9.105   2.385  -8.810
  390    HA3  GLY  68           HA3      GLY  68   9.429   3.446 -10.173
  391    HA1  GLY  68           HA1      GLY  68   9.036   2.957  -8.142
  392    H    LEU  69           H        LEU  69  11.649   2.589  -9.335
  393    HA   LEU  69           HA       LEU  69  12.739   3.860  -7.024
  394    HB2  LEU  69           HB1      LEU  69  14.033   2.469  -9.372
  395    HB3  LEU  69           HB2      LEU  69  14.920   3.069  -7.959
  396    HG   LEU  69           HG       LEU  69  12.859   0.868  -7.993
  397   HD11  LEU  69          HD11      LEU  69  15.716   0.643  -7.134
  398   HD12  LEU  69          HD12      LEU  69  15.270   0.502  -8.834
  399   HD13  LEU  69          HD13      LEU  69  14.602  -0.623  -7.652
  400   HD21  LEU  69          HD21      LEU  69  12.502   1.870  -5.932
  401   HD22  LEU  69          HD22      LEU  69  14.196   2.329  -5.747
  402   HD23  LEU  69          HD23      LEU  69  13.713   0.641  -5.565
  403    H    ARG  70           H        ARG  70  12.379   4.733 -10.355
  404    HA   ARG  70           HA       ARG  70  14.273   6.942 -10.115
  405    HB2  ARG  70           HB1      ARG  70  12.583   6.098 -12.482
  406    HB3  ARG  70           HB2      ARG  70  13.896   7.286 -12.496
  407    HG2  ARG  70           HG1      ARG  70  15.337   5.290 -11.609
  408    HG3  ARG  70           HG2      ARG  70  14.039   4.317 -12.319
  409    HD2  ARG  70           HD1      ARG  70  14.405   5.855 -14.410
  410    HD3  ARG  70           HD2      ARG  70  15.980   6.150 -13.660
  411    HE   ARG  70           HE       ARG  70  15.089   3.719 -14.923
  412   HH11  ARG  70          HH11      ARG  70  17.338   5.146 -12.682
  413   HH12  ARG  70          HH12      ARG  70  18.508   3.879 -12.846
  414   HH21  ARG  70          HH21      ARG  70  16.622   2.044 -15.149
  415   HH22  ARG  70          HH22      ARG  70  18.100   2.116 -14.250
  416    H    ARG  71           H        ARG  71  11.405   6.582  -8.914
  417    HA   ARG  71           HA       ARG  71  10.153   9.000  -9.973
  418    HB2  ARG  71           HB1      ARG  71   9.240   6.594  -8.578
  419    HB3  ARG  71           HB2      ARG  71   8.531   8.084  -7.939
  420    HG2  ARG  71           HG1      ARG  71   8.542   7.577 -10.891
  421    HG3  ARG  71           HG2      ARG  71   7.329   6.818  -9.847
  422    HD2  ARG  71           HD1      ARG  71   7.020   9.260  -8.925
  423    HD3  ARG  71           HD2      ARG  71   7.750   9.706 -10.474
  424    HE   ARG  71           HE       ARG  71   5.105   8.685 -10.047
  425   HH11  ARG  71          HH11      ARG  71   7.713   8.966 -12.335
  426   HH12  ARG  71          HH12      ARG  71   6.686   8.816 -13.723
  427   HH21  ARG  71          HH21      ARG  71   3.742   8.485 -11.865
  428   HH22  ARG  71          HH22      ARG  71   4.427   8.543 -13.453
  429    H    ARG  72           H        ARG  72  10.368  10.908  -9.014
  430    HA   ARG  72           HA       ARG  72  11.928  11.240  -6.668
  431    HB2  ARG  72           HB1      ARG  72  10.092  13.283  -7.933
  432    HB3  ARG  72           HB2      ARG  72  11.506  13.592  -6.914
  433    HG2  ARG  72           HG1      ARG  72  11.632  12.272  -9.625
  434    HG3  ARG  72           HG2      ARG  72  11.888  14.001  -9.332
  435    HD2  ARG  72           HD1      ARG  72  13.518  12.565  -7.495
  436    HD3  ARG  72           HD2      ARG  72  13.753  11.866  -9.102
  437    HE   ARG  72           HE       ARG  72  13.947  14.511  -9.581
  438   HH11  ARG  72          HH11      ARG  72  15.457  12.408  -7.253
  439   HH12  ARG  72          HH12      ARG  72  16.915  13.339  -7.164
  440   HH21  ARG  72          HH21      ARG  72  15.863  15.746  -9.471
  441   HH22  ARG  72          HH22      ARG  72  17.144  15.238  -8.425
  442    H    CYS  73           H        CYS  73  11.352  11.227  -4.597
  443    HA   CYS  73           HA       CYS  73   8.503  11.562  -3.926
  444    HB2  CYS  73           HB1      CYS  73   8.723   9.878  -2.182
  445    HB3  CYS  73           HB2      CYS  73   9.142   9.193  -3.752
  446    H    GLN  74           H        GLN  74   8.053  12.470  -1.864
  447    HA   GLN  74           HA       GLN  74  10.281  14.073  -0.805
  448    HB2  GLN  74           HB1      GLN  74   7.850  14.919  -1.773
  449    HB3  GLN  74           HB2      GLN  74   7.573  14.877  -0.025
  450    HG2  GLN  74           HG1      GLN  74   9.990  16.118  -0.138
  451    HG3  GLN  74           HG2      GLN  74   9.222  16.690  -1.626
  452   HE21  GLN  74          HE21      GLN  74   9.870  17.896   1.097
  453   HE22  GLN  74          HE22      GLN  74   8.405  18.690   1.551
  454    H    ARG  75           H        ARG  75   7.662  11.908   0.026
  455    HA   ARG  75           HA       ARG  75   8.636  11.874   2.808
  456    HB2  ARG  75           HB1      ARG  75   6.110  12.535   1.991
  457    HB3  ARG  75           HB2      ARG  75   5.940  10.804   2.315
  458    HG2  ARG  75           HG1      ARG  75   7.374  11.830   4.495
  459    HG3  ARG  75           HG2      ARG  75   6.079  12.993   4.163
  460    HD2  ARG  75           HD1      ARG  75   4.386  11.398   4.468
  461    HD3  ARG  75           HD2      ARG  75   5.520  10.050   4.289
  462    HE   ARG  75           HE       ARG  75   6.365  11.423   6.516
  463   HH11  ARG  75          HH11      ARG  75   3.446   9.821   5.501
  464   HH12  ARG  75          HH12      ARG  75   2.974   9.379   7.109
  465   HH21  ARG  75          HH21      ARG  75   5.755  10.847   8.637
  466   HH22  ARG  75          HH22      ARG  75   4.288   9.964   8.892
  467    H    ASP  76           H        ASP  76   8.241   9.757   3.924
  468    HA   ASP  76           HA       ASP  76   9.372   7.648   2.351
  469    HB2  ASP  76           HB1      ASP  76   8.229   7.237   5.100
  470    HB3  ASP  76           HB2      ASP  76   9.646   6.484   4.357
  471    HD2  ASP  76           HD       ASP  76  10.235   9.604   6.534
  472    H    ALA  77           H        ALA  77   6.315   7.946   4.166
  473    HA   ALA  77           HA       ALA  77   5.163   5.558   3.301
  474    HB1  ALA  77           HB1      ALA  77   4.211   8.033   4.563
  475    HB2  ALA  77           HB2      ALA  77   2.988   7.127   3.672
  476    HB3  ALA  77           HB3      ALA  77   3.887   6.349   4.974
  477    H    MET  78           H        MET  78   5.544   8.594   1.678
  478    HA   MET  78           HA       MET  78   3.507   8.508  -0.203
  479    HB2  MET  78           HB1      MET  78   6.290   9.633  -0.225
  480    HB3  MET  78           HB2      MET  78   5.299   9.692  -1.690
  481    HG2  MET  78           HG1      MET  78   4.213  10.720   0.907
  482    HG3  MET  78           HG2      MET  78   5.301  11.706  -0.071
  483    HE1  MET  78           HE1      MET  78   5.077  11.533  -2.599
  484    HE2  MET  78           HE2      MET  78   3.559  11.461  -3.495
  485    HE3  MET  78           HE3      MET  78   4.057  12.967  -2.722
  486    H    CYS  79           H        CYS  79   6.621   6.858  -0.175
  487    HA   CYS  79           HA       CYS  79   6.220   5.736  -2.810
  488    HB2  CYS  79           HB1      CYS  79   8.389   5.866  -0.832
  489    HB3  CYS  79           HB2      CYS  79   8.299   4.326  -1.691
  490    H    CYS  80           H        CYS  80   6.715   3.250  -2.938
  491    HA   CYS  80           HA       CYS  80   4.547   1.952  -1.561
  492    HB2  CYS  80           HB1      CYS  80   6.456   1.234  -3.741
  493    HB3  CYS  80           HB2      CYS  80   5.682  -0.084  -2.858
  494    HA   PRO  81           HA       PRO  81   6.682  -0.001   1.735
  495    HB2  PRO  81           HB1      PRO  81   5.526  -2.483   1.803
  496    HB3  PRO  81           HB2      PRO  81   4.697  -1.010   2.299
  497    HG2  PRO  81           HG1      PRO  81   4.585  -2.464  -0.321
  498    HG3  PRO  81           HG2      PRO  81   3.236  -1.783   0.663
  499    HD2  PRO  81           HD1      PRO  81   4.232  -0.527  -1.529
  500    HD3  PRO  81           HD2      PRO  81   3.614   0.352  -0.120
  501    H    GLY  82           H        GLY  82   8.758  -0.585   1.671
  502    HA2  GLY  82           HA2      GLY  82  10.096  -2.729   1.433
  503    HA3  GLY  82           HA3      GLY  82   9.564  -2.684  -0.241
  504    HA1  GLY  82           HA1      GLY  82  10.112  -1.873   1.647
  505    H    THR  83           H        THR  83   9.818   0.347  -0.099
  506    HA   THR  83           HA       THR  83  12.746   0.439  -0.432
  507    HB   THR  83           HB       THR  83  12.261   2.366  -2.026
  508    HG1  THR  83           HG1      THR  83   9.680   1.186  -2.170
  509   HG21  THR  83          HG21      THR  83  11.075  -0.166  -3.087
  510   HG22  THR  83          HG22      THR  83  12.762  -0.138  -2.571
  511   HG23  THR  83          HG23      THR  83  12.213   0.945  -3.850
  512    H    LEU  84           H        LEU  84  13.540   2.819  -0.360
  513    HA   LEU  84           HA       LEU  84  12.187   4.240   1.833
  514    HB2  LEU  84           HB1      LEU  84  14.411   2.861   2.289
  515    HB3  LEU  84           HB2      LEU  84  15.151   4.334   1.636
  516    HG   LEU  84           HG       LEU  84  13.861   5.608   3.409
  517   HD11  LEU  84          HD11      LEU  84  12.957   4.462   5.258
  518   HD12  LEU  84          HD12      LEU  84  13.622   2.917   4.728
  519   HD13  LEU  84          HD13      LEU  84  12.297   3.661   3.832
  520   HD21  LEU  84          HD21      LEU  84  16.055   5.554   3.966
  521   HD22  LEU  84          HD22      LEU  84  16.171   3.802   3.799
  522   HD23  LEU  84          HD23      LEU  84  15.456   4.505   5.250
  523    H    CYS  85           H        CYS  85  12.199   6.460   1.743
  524    HA   CYS  85           HA       CYS  85  12.705   7.612  -0.850
  525    HB2  CYS  85           HB1      CYS  85  10.753   8.127   0.766
  526    HB3  CYS  85           HB2      CYS  85  11.911   9.160   1.605
  527    H    VAL  86           H        VAL  86  14.793   7.950  -1.335
  528    HA   VAL  86           HA       VAL  86  16.367   9.588   0.539
  529    HB   VAL  86           HB       VAL  86  17.426   7.308  -1.138
  530   HG11  VAL  86          HG11      VAL  86  18.860   9.181   0.744
  531   HG12  VAL  86          HG12      VAL  86  19.575   7.779  -0.057
  532   HG13  VAL  86          HG13      VAL  86  19.012   9.152  -1.013
  533   HG21  VAL  86          HG21      VAL  86  17.926   6.238   0.996
  534   HG22  VAL  86          HG22      VAL  86  17.203   7.596   1.859
  535   HG23  VAL  86          HG23      VAL  86  16.198   6.560   0.846
  536    H    ASN  87           H        ASN  87  17.589  11.208  -0.347
  537    HA   ASN  87           HA       ASN  87  18.190  12.805  -1.848
  538    HB2  ASN  87           HB1      ASN  87  18.254  10.388  -3.672
  539    HB3  ASN  87           HB2      ASN  87  18.858  11.986  -4.130
  540   HD21  ASN  87          HD21      ASN  87  20.555   9.903  -4.228
  541   HD22  ASN  87          HD22      ASN  87  21.724  10.009  -2.960
  542    H    ASP  88           H        ASP  88  15.372  12.299  -1.410
  543    HA   ASP  88           HA       ASP  88  13.362  13.041  -2.176
  544    HB2  ASP  88           HB1      ASP  88  14.842  14.322  -4.479
  545    HB3  ASP  88           HB2      ASP  88  13.309  14.822  -3.754
  546    HD2  ASP  88           HD       ASP  88  16.590  16.280  -2.282
  547    H    VAL  89           H        VAL  89  14.638  10.535  -3.176
  548    HA   VAL  89           HA       VAL  89  12.712  10.020  -5.298
  549    HB   VAL  89           HB       VAL  89  14.769  10.669  -6.496
  550   HG11  VAL  89          HG11      VAL  89  16.713   9.094  -6.395
  551   HG12  VAL  89          HG12      VAL  89  16.467  10.055  -4.936
  552   HG13  VAL  89          HG13      VAL  89  15.968   8.364  -4.974
  553   HG21  VAL  89          HG21      VAL  89  14.141   7.728  -6.727
  554   HG22  VAL  89          HG22      VAL  89  13.206   9.031  -7.461
  555   HG23  VAL  89          HG23      VAL  89  14.869   8.744  -7.971
  556    H    CYS  90           H        CYS  90  12.153   7.836  -5.522
  557    HA   CYS  90           HA       CYS  90  12.310   6.293  -3.162
  558    HB2  CYS  90           HB1      CYS  90  10.705   6.297  -5.380
  559    HB3  CYS  90           HB2      CYS  90  11.664   4.838  -5.640
  560    H    THR  91           H        THR  91  14.123   5.382  -2.454
  561    HA   THR  91           HA       THR  91  15.862   4.024  -4.410
  562    HB   THR  91           HB       THR  91  16.647   5.286  -1.776
  563    HG1  THR  91           HG1      THR  91  16.261   6.510  -3.942
  564   HG21  THR  91          HG21      THR  91  18.352   3.890  -3.843
  565   HG22  THR  91          HG22      THR  91  17.943   3.257  -2.248
  566   HG23  THR  91          HG23      THR  91  18.940   4.705  -2.395
  567    H    THR  92           H        THR  92  16.430   1.938  -4.052
  568    HA   THR  92           HA       THR  92  14.843   0.296  -2.460
  569    HB   THR  92           HB       THR  92  16.858  -1.357  -2.754
  570    HG1  THR  92           HG1      THR  92  18.084  -0.633  -4.668
  571   HG21  THR  92          HG21      THR  92  15.660  -2.148  -4.475
  572   HG22  THR  92          HG22      THR  92  15.930  -0.692  -5.434
  573   HG23  THR  92          HG23      THR  92  14.623  -0.739  -4.251
  574    H    MET  93           H        MET  93  15.018  -0.552  -0.440
  575    HA   MET  93           HA       MET  93  16.447   0.845   1.525
  576    HB2  MET  93           HB1      MET  93  14.391  -0.928   1.551
  577    HB3  MET  93           HB2      MET  93  15.709  -1.946   2.155
  578    HG2  MET  93           HG1      MET  93  15.376   0.750   3.372
  579    HG3  MET  93           HG2      MET  93  14.190  -0.498   3.765
  580    HE1  MET  93           HE1      MET  93  16.218   0.837   6.095
  581    HE2  MET  93           HE2      MET  93  14.764  -0.157   6.183
  582    HE3  MET  93           HE3      MET  93  16.244  -0.686   6.985
  583    H    GLU  94           H        GLU  94  17.306  -1.883  -0.445
  584    HA   GLU  94           HA       GLU  94  19.432  -2.873   1.144
  585    HB2  GLU  94           HB1      GLU  94  18.713  -3.120  -1.770
  586    HB3  GLU  94           HB2      GLU  94  20.206  -3.821  -1.129
  587    HG2  GLU  94           HG1      GLU  94  18.028  -4.579   0.561
  588    HG3  GLU  94           HG2      GLU  94  17.620  -4.932  -1.125
  589    HE2  GLU  94           HE       GLU  94  20.806  -6.814   0.338
  590    H    ASP  95           H        ASP  95  19.195  -0.350  -1.275
  591    HA   ASP  95           HA       ASP  95  22.031   0.025  -1.514
  592    HB2  ASP  95           HB1      ASP  95  19.800   0.803  -2.981
  593    HB3  ASP  95           HB2      ASP  95  20.400   2.315  -2.284
  594    HD2  ASP  95           HD       ASP  95  22.690   0.451  -4.931
  595    H    ALA  96           H        ALA  96  19.389   1.738   0.125
  596    HA   ALA  96           HA       ALA  96  20.822   3.875   1.161
  597    HB1  ALA  96           HB1      ALA  96  19.077   3.792   3.027
  598    HB2  ALA  96           HB2      ALA  96  18.494   3.977   1.372
  599    HB3  ALA  96           HB3      ALA  96  18.407   2.405   2.167
  600    H    THR  97           H        THR  97  22.282   4.120   2.738
  601    HA   THR  97           HA       THR  97  22.491   2.411   4.999
  602    HB   THR  97           HB       THR  97  25.052   1.952   4.096
  603    HG1  THR  97           HG1      THR  97  24.886   1.207   2.003
  604   HG21  THR  97          HG21      THR  97  24.377   0.014   4.973
  605   HG22  THR  97          HG22      THR  97  23.590  -0.346   3.436
  606   HG23  THR  97          HG23      THR  97  22.683   0.437   4.730
  607    H    GLU  98           H        GLU  98  23.166   3.710   6.565
  608    HA   GLU  98           HA       GLU  98  24.113   6.293   6.204
  609    HB2  GLU  98           HB1      GLU  98  24.630   4.514   8.597
  610    HB3  GLU  98           HB2      GLU  98  24.656   6.283   8.572
  611    HG2  GLU  98           HG1      GLU  98  22.532   6.245   9.201
  612    HG3  GLU  98           HG2      GLU  98  22.149   5.623   7.589
  613    HE2  GLU  98           HE       GLU  98  20.887   2.849   9.154
  614    H    ASN  99           H        ASN  99  26.118   7.250   6.213
  615    HA   ASN  99           HA       ASN  99  28.240   5.948   5.004
  616    HB2  ASN  99           HB1      ASN  99  28.005   8.486   6.590
  617    HB3  ASN  99           HB2      ASN  99  29.602   7.918   6.083
  618   HD21  ASN  99          HD21      ASN  99  27.028   9.790   5.223
  619   HD22  ASN  99          HD22      ASN  99  27.313   9.898   3.522
  620    H    LEU 100           H        LEU 100  30.482   5.715   5.944
  621    HA   LEU 100           HA       LEU 100  30.283   4.133   8.387
  622    HB2  LEU 100           HB1      LEU 100  32.316   4.364   6.187
  623    HB3  LEU 100           HB2      LEU 100  32.724   3.595   7.731
  624    HG   LEU 100           HG       LEU 100  30.298   2.449   6.747
  625   HD11  LEU 100          HD11      LEU 100  30.743   1.773   4.613
  626   HD12  LEU 100          HD12      LEU 100  32.489   1.927   4.807
  627   HD13  LEU 100          HD13      LEU 100  31.497   3.368   4.586
  628   HD21  LEU 100          HD21      LEU 100  33.098   1.381   7.094
  629   HD22  LEU 100          HD22      LEU 100  31.662   0.393   6.821
  630   HD23  LEU 100          HD23      LEU 100  31.803   1.358   8.291
  631    H    TYR 101           H        TYR 101  32.491   4.220   9.691
  632    HA   TYR 101           HA       TYR 101  32.698   6.969  10.622
  633    HB2  TYR 101           HB1      TYR 101  33.816   4.392  11.757
  634    HB3  TYR 101           HB2      TYR 101  33.934   5.976  12.529
  635    HD1  TYR 101           HD1      TYR 101  32.294   3.057  12.883
  636    HD2  TYR 101           HD2      TYR 101  31.385   7.184  12.391
  637    HE1  TYR 101           HE1      TYR 101  30.125   2.704  13.985
  638    HE2  TYR 101           HE2      TYR 101  29.213   6.843  13.494
  639    HH   TYR 101           HH       TYR 101  27.680   5.174  14.062
  640    H    PHE 102           H        PHE 102  34.600   4.547   8.995
  641    HA   PHE 102           HA       PHE 102  36.630   4.617   7.971
  642    HB2  PHE 102           HB1      PHE 102  36.204   7.599   8.273
  643    HB3  PHE 102           HB2      PHE 102  37.517   6.877   7.341
  644    HD1  PHE 102           HD1      PHE 102  37.054   5.609   5.287
  645    HD2  PHE 102           HD2      PHE 102  33.978   7.659   7.397
  646    HE1  PHE 102           HE1      PHE 102  35.601   5.461   3.307
  647    HE2  PHE 102           HE2      PHE 102  32.520   7.514   5.421
  648    HZ   PHE 102           HZ       PHE 102  33.331   6.412   3.373
  649    H    GLN 103           H        GLN 103  37.135   7.519   9.929
  650    HA   GLN 103           HA       GLN 103  38.615   8.013  11.584
  651    HB2  GLN 103           HB1      GLN 103  37.694   5.313  12.149
  652    HB3  GLN 103           HB2      GLN 103  39.341   5.584  12.738
  653    HG2  GLN 103           HG1      GLN 103  37.346   7.692  13.335
  654    HG3  GLN 103           HG2      GLN 103  37.173   6.146  14.179
  655   HE21  GLN 103          HE21      GLN 103  39.179   5.314  15.223
  656   HE22  GLN 103          HE22      GLN 103  40.207   6.463  16.001
  657    H    SER 104           H        SER 104  40.895   7.508  12.392
  658    HA   SER 104           HA       SER 104  42.572   7.183  10.079
  659    HB2  SER 104           HB1      SER 104  43.849   7.307  12.748
  660    HB3  SER 104           HB2      SER 104  44.168   8.260  11.289
  661    HG   SER 104           HG       SER 104  42.154   9.376  11.771
  662    H    LEU 105           H        LEU 105  44.805   5.957  10.801
  663    HA   LEU 105           HA       LEU 105  44.411   3.485  12.170
  664    HB2  LEU 105           HB1      LEU 105  43.397   3.441   9.661
  665    HB3  LEU 105           HB2      LEU 105  45.073   2.956   9.347
  666    HG   LEU 105           HG       LEU 105  44.202   1.384  11.509
  667   HD11  LEU 105          HD11      LEU 105  42.147   0.511  10.988
  668   HD12  LEU 105          HD12      LEU 105  42.247   0.995   9.295
  669   HD13  LEU 105          HD13      LEU 105  41.910   2.200  10.537
  670   HD21  LEU 105          HD21      LEU 105  44.350  -0.429   9.759
  671   HD22  LEU 105          HD22      LEU 105  45.782   0.585   9.939
  672   HD23  LEU 105          HD23      LEU 105  44.679   0.847   8.588
  673    H    GLU 106           H        GLU 106  46.363   1.972  11.690
  674    HA   GLU 106           HA       GLU 106  48.720   3.495  12.185
  675    HB2  GLU 106           HB1      GLU 106  48.177   0.555  11.804
  676    HB3  GLU 106           HB2      GLU 106  49.820   1.180  12.021
  677    HG2  GLU 106           HG1      GLU 106  49.419   1.870  14.207
  678    HG3  GLU 106           HG2      GLU 106  47.665   1.838  13.987
  679    HE2  GLU 106           HE       GLU 106  49.429  -1.389  15.269
  680    H    HIS 107           H        HIS 107  50.808   2.706  10.953
  681    HA   HIS 107           HA       HIS 107  50.298   2.614   8.067
  682    HB2  HIS 107           HB1      HIS 107  50.924   4.971   9.269
  683    HB3  HIS 107           HB2      HIS 107  52.537   4.357   8.894
  684    HD1  HIS 107           HD1      HIS 107  53.319   4.483   6.503
  685    HD2  HIS 107           HD2      HIS 107  49.283   5.373   6.925
  686    HE1  HIS 107           HE1      HIS 107  52.584   5.349   4.259
  687    HE2  HIS 107           HE2      HIS 107  50.117   5.895   4.517
  688    H    HIS 108           H        HIS 108  51.259   0.692  10.113
  689    HA   HIS 108           HA       HIS 108  52.788  -0.986  10.267
  690    HB2  HIS 108           HB1      HIS 108  52.540  -0.468   7.572
  691    HB3  HIS 108           HB2      HIS 108  54.285  -0.355   7.828
  692    HD1  HIS 108           HD1      HIS 108  51.502  -2.817   8.661
  693    HD2  HIS 108           HD2      HIS 108  55.547  -2.742   7.715
  694    HE1  HIS 108           HE1      HIS 108  52.200  -5.227   8.503
  695    HE2  HIS 108           HE2      HIS 108  54.673  -5.183   7.927
  696    H    HIS 109           H        HIS 109  54.002  -0.347  11.984
  697    HA   HIS 109           HA       HIS 109  56.467   1.145  11.362
  698    HB2  HIS 109           HB1      HIS 109  56.392   2.164  13.565
  699    HB3  HIS 109           HB2      HIS 109  54.899   2.515  12.692
  700    HD1  HIS 109           HD1      HIS 109  56.116   1.127  15.829
  701    HD2  HIS 109           HD2      HIS 109  52.646   0.861  13.559
  702    HE1  HIS 109           HE1      HIS 109  54.366   0.207  17.382
  703    HE2  HIS 109           HE2      HIS 109  52.244   0.043  15.996
  704    H    HIS 110           H        HIS 110  58.347   0.547  12.512
  705    HA   HIS 110           HA       HIS 110  58.273  -1.733  14.286
  706    HB2  HIS 110           HB1      HIS 110  59.924  -3.016  12.867
  707    HB3  HIS 110           HB2      HIS 110  58.270  -2.965  12.249
  708    HD1  HIS 110           HD1      HIS 110  58.410  -2.878   9.784
  709    HD2  HIS 110           HD2      HIS 110  61.226  -0.406  11.578
  710    HE1  HIS 110           HE1      HIS 110  59.563  -1.689   7.892
  711    HE2  HIS 110           HE2      HIS 110  61.285  -0.178   8.986
  712    H    HIS 111           H        HIS 111  60.405  -2.226  15.194
  713    HA   HIS 111           HA       HIS 111  62.300  -1.564  16.266
  714    HB2  HIS 111           HB1      HIS 111  62.939  -1.580  13.719
  715    HB3  HIS 111           HB2      HIS 111  63.017   0.172  13.931
  716    HD1  HIS 111           HD1      HIS 111  64.915   1.129  15.398
  717    HD2  HIS 111           HD2      HIS 111  65.005  -3.005  14.993
  718    HE1  HIS 111           HE1      HIS 111  67.171   0.419  16.254
  719    HE2  HIS 111           HE2      HIS 111  67.227  -2.107  16.008
  720    H    HIS 112           H        HIS 112  60.938  -0.346  17.745
  721    HA   HIS 112           HA       HIS 112  60.416   1.501  18.970
  722    HB2  HIS 112           HB1      HIS 112  62.944   1.691  18.817
  723    HB3  HIS 112           HB2      HIS 112  62.688   2.868  17.525
  724    HD1  HIS 112           HD1      HIS 112  61.734   2.416  21.176
  725    HD2  HIS 112           HD2      HIS 112  62.370   5.423  18.381
  726    HE1  HIS 112           HE1      HIS 112  61.565   4.573  22.459
  727    HE2  HIS 112           HE2      HIS 112  61.952   6.411  20.750