*HEADER    HORMONE                                 29-DEC-12   2M2P              
*TITLE     STRUCTURE OF [D-HISB24] INSULIN ANALOGUE AT PH 8.0                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: INSULIN A CHAIN;                                           
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MOL_ID: 2;                                                           
*COMPND   6 MOLECULE: INSULIN B CHAIN;                                           
*COMPND   7 CHAIN: B;                                                            
*COMPND   8 ENGINEERED: YES;                                                     
*COMPND   9 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   4 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   5 ORGANISM_TAXID: 9606;                                                
*SOURCE   6 MOL_ID: 2;                                                           
*SOURCE   7 SYNTHETIC: YES;                                                      
*SOURCE   8 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   9 ORGANISM_COMMON: HUMAN;                                              
*SOURCE  10 ORGANISM_TAXID: 9606                                                 
*KEYWDS    INSULIN, HORMONE                                                      
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    30                                                                    
*AUTHOR    L.ZAKOVA, V.VEVERKA, J.JIRACEK                                        
*REVDAT   1   06-MAR-13 2M2P    0                                                


#
#  49 CYX  H      49 CYX  HB2     3.80             (#peak     1 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 1, nxpk= 0, iat= 596, 600, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
#  49 CYX  H      49 CYX  HB3     3.80             (#peak     2 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 2, nxpk= 0, iat= 596, 601, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  37 CYX  H      37 CYX  HB3     4.13             (#peak     5 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 5, nxpk= 0, iat= 416, 421, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  37 CYX  H      37 CYX  HB2     4.13             (#peak     6 #SUP  1.00)
 &rst
  ixpk= 6, nxpk= 0, iat= 416, 420, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  18 ASN  H      18 ASN  QB      3.45             (#peak     8 #SUP  1.00)
 &rst
  ixpk= 8, nxpk= 0, iat= 254,  -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr2= 258, 259,
 &end
#
#  18 ASN  QB     19 TYR  H       3.61             (#peak    10 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 10, nxpk= 0, iat=  -1, 268, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr1= 258, 259,
 &end
#
#  19 TYR  H      19 TYR  HB2     3.08             (#peak    11 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 11, nxpk= 0, iat= 268, 272, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
#  19 TYR  H      19 TYR  HB3     4.09             (#peak    12 #SUP  0.97  #QF  0.94)
 &rst
  ixpk= 12, nxpk= 0, iat= 268, 273, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#  20 CYX  HB2    21 ASN  H       4.25             (#peak    12 #SUP  0.97  #QF  0.94)
 &rst
  ixpk= 12, nxpk= 0, iat= 293, 299, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  14 TYR  QB     15 GLN  H       3.71             (#peak    13 #SUP  0.95  #QF  0.87)
 &rst
  ixpk= 13, nxpk= 0, iat=  -1, 203, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr1= 186, 187,
 &end
#
#  19 TYR  HB2    20 CYX  H       4.13             (#peak    13 #SUP  0.95  #QF  0.87)
 &rst
  ixpk= 13, nxpk= 0, iat= 272, 289, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  19 TYR  HB3    20 CYX  H       4.41             (#peak    15 #SUP  1.00  #QF  0.61)
 &rst
  ixpk= 15, nxpk= 0, iat= 273, 289, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#  20 CYX  HB3    21 ASN  H       4.25             (#peak    16 #SUP  0.77  #QF  0.77)
 &rst
  ixpk= 16, nxpk= 0, iat= 294, 299, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  21 ASN  H      21 ASN  HB2     3.82             (#peak    17 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 17, nxpk= 0, iat= 299, 303, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#  21 ASN  H      21 ASN  HB3     3.82             (#peak    18 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 18, nxpk= 0, iat= 299, 304, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#  59 LYS  HA     60 THR  H       2.93             (#peak    22 #SUP  0.63  #QF  0.63)
 &rst
  ixpk= 22, nxpk= 0, iat= 747, 767, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43,  &end
#
#  44 ALA  H      44 ALA  QB      2.78             (#peak    23 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 23, nxpk= 0, iat= 511,  -1, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
 igr2= 515, 516, 517,
 &end
#
#  44 ALA  QB     45 LEU  H       3.22             (#peak    24 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 24, nxpk= 0, iat=  -1, 521, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr1= 515, 516, 517,
 &end
#
#  43 GLU  QB     44 ALA  H       3.21             (#peak    26 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 26, nxpk= 0, iat=  -1, 511, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 500, 501,
 &end
#
#  43 GLU  H      43 GLU  QB      2.96             (#peak    28 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 28, nxpk= 0, iat= 496,  -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
 igr2= 500, 501,
 &end
#
#  43 GLU  H      43 GLU  HG3     4.11             (#peak    29 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 29, nxpk= 0, iat= 496, 504, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  43 GLU  H      43 GLU  HG2     4.11             (#peak    30 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 30, nxpk= 0, iat= 496, 503, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  43 GLU  HA     46 TYR  QD      3.23             (#peak    34 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 34, nxpk= 0, iat= 498,  -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
 igr2= 548, 557,
 &end
#
#  46 TYR  HA     46 TYR  QD      2.88             (#peak    35 #SUP  0.79  #QF  0.79)
 &rst
  ixpk= 35, nxpk= 0, iat= 542,  -1, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
 igr2= 548, 557,
 &end
#
#  48 VAL  H      48 VAL  QG1     3.80             (#peak    38 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 38, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 586, 587, 588,
 &end
#
#  48 VAL  H      48 VAL  QG2     3.25             (#peak    39 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 39, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
 igr2= 590, 591, 592,
 &end
#
#  47 LEU  HB2    48 VAL  H       4.10             (#peak    40 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 40, nxpk= 0, iat= 565, 580, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
#  47 LEU  HB3    48 VAL  H       4.10             (#peak    41 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 41, nxpk= 0, iat= 566, 580, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
#  47 LEU  H      47 LEU  HB2     3.75             (#peak    42 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 42, nxpk= 0, iat= 561, 565, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#  47 LEU  H      47 LEU  HB3     3.75             (#peak    43 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 43, nxpk= 0, iat= 561, 566, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#  46 TYR  QB     47 LEU  H       3.40             (#peak    44 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 44, nxpk= 0, iat=  -1, 561, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1= 544, 545,
 &end
#
#  46 TYR  H      46 TYR  QB      2.79             (#peak    45 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 45, nxpk= 0, iat= 540,  -1, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,
 igr2= 544, 545,
 &end
#
#  46 TYR  HA     46 TYR  QE      4.24             (#peak    48 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 48, nxpk= 0, iat= 542,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr2= 550, 555,
 &end
#
#  19 TYR  HA     19 TYR  QD      3.21             (#peak    60 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 60, nxpk= 0, iat= 270,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 276, 285,
 &end
#
#  19 TYR  HA     19 TYR  QE      4.65             (#peak    61 #SUP  1.00)
 &rst
  ixpk= 61, nxpk= 0, iat= 270,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2= 278, 283,
 &end
#
#  14 TYR  H      14 TYR  QB      3.27             (#peak    64 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 64, nxpk= 0, iat= 182,  -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
 igr2= 186, 187,
 &end
#
#  15 GLN  H      15 GLN  HG2     4.02             (#peak    65 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 65, nxpk= 0, iat= 203, 210, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  15 GLN  H      15 GLN  HG3     4.02             (#peak    66 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 66, nxpk= 0, iat= 203, 211, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  15 GLN  H      15 GLN  HB2     3.94             (#peak    67 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 67, nxpk= 0, iat= 203, 207, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  15 GLN  H      15 GLN  HB3     3.94             (#peak    68 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 68, nxpk= 0, iat= 203, 208, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  13 LEU  HA     16 LEU  H       3.77             (#peak    69 #SUP  0.88  #QF  0.45)
 &rst
  ixpk= 69, nxpk= 0, iat= 165, 220, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#  14 TYR  HA     14 TYR  QD      3.12             (#peak    75 #SUP  0.77  #QF  0.77)
 &rst
  ixpk= 75, nxpk= 0, iat= 184,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr2= 190, 199,
 &end
#
#   9 SER  HB3    10 ILE  H       3.77             (#peak    77 #SUP  0.99  #QF  0.21)
 &rst
  ixpk= 77, nxpk= 0, iat= 117, 123, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#  16 LEU  HB2    17 GLU  H       2.99             (#peak    79 #SUP  0.61  #QF  0.61)
 &rst
  ixpk= 79, nxpk= 0, iat= 224, 239, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
#  16 LEU  H      16 LEU  HB3     3.72             (#peak    81 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 81, nxpk= 0, iat= 220, 225, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#  16 LEU  H      16 LEU  QQD     3.52             (#peak    82 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 82, nxpk= 0, iat= 220, 226, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,  &end
#
#  16 LEU  H      16 LEU  HB2     3.19             (#peak    83 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 83, nxpk= 0, iat= 220, 224, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,  &end
#
#  56 TYR  QD     58 PRO  QD      3.94             (#peak    88 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 88, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 704, 713,
 igr2= 732, 733,
 &end
#
#  56 TYR  QE     58 PRO  QD      4.12             (#peak    89 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 89, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 706, 711,
 igr2= 732, 733,
 &end
#
#  56 TYR  HA     56 TYR  QD      2.95             (#peak    92 #SUP  0.62  #QF  0.62)
 &rst
  ixpk= 92, nxpk= 0, iat= 698,  -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
 igr2= 704, 713,
 &end
#
#  56 TYR  HA     56 TYR  QE      4.56             (#peak    93 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 93, nxpk= 0, iat= 698,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 706, 711,
 &end
#
#  31 PHE  HA     31 PHE  QD      3.76             (#peak    95 #SUP  1.00)
 &rst
  ixpk= 95, nxpk= 0, iat= 315,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2= 321, 329,
 &end
#
#  56 TYR  H      56 TYR  QB      4.12             (#peak    96 #SUP  1.00)
 &rst
  ixpk= 96, nxpk= 0, iat= 696,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2= 700, 701,
 &end
#
#  55 PHE  HA     55 PHE  QD      3.41             (#peak    99 #SUP  0.84  #QF  0.84)
 &rst
  ixpk= 99, nxpk= 0, iat= 678,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2= 684, 692,
 &end
#
#  55 PHE  HA     55 PHE  QE      4.92             (#peak   100 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 100, nxpk= 0, iat= 678,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2= 686, 690,
 &end
#
#  60 THR  H      60 THR  QG2     4.50             (#peak   101 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 101, nxpk= 0, iat= 767,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 773, 774, 775,
 &end
#
#  10 ILE  H      10 ILE  QG2     4.13             (#peak   112 #SUP  1.00)
 &rst
  ixpk= 112, nxpk= 0, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 129, 130, 131,
 &end
#
#  10 ILE  H      10 ILE  HB      3.53             (#peak   113 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 113, nxpk= 0, iat= 123, 127, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
#  48 VAL  H      49 CYX  H       4.02             (#peak   114 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 114, nxpk= 0, iat= 580, 596, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  47 LEU  H      48 VAL  H       4.02             (#peak   116 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 116, nxpk= 0, iat= 561, 580, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  49 CYX  H      50 GLY  H       4.18             (#peak   118 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 118, nxpk= 0, iat= 596, 606, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#  43 GLU  H      44 ALA  H       3.58             (#peak   120 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 120, nxpk= 0, iat= 496, 511, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
#  44 ALA  H      45 LEU  H       3.50             (#peak   121 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 121, nxpk= 0, iat= 511, 521, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  46 TYR  H      47 LEU  H       3.76             (#peak   123 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 123, nxpk= 0, iat= 540, 561, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#  45 LEU  H      46 TYR  H       3.62             (#peak   124 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 124, nxpk= 0, iat= 521, 540, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#  46 TYR  H      46 TYR  QD      3.67             (#peak   126 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 126, nxpk= 0, iat= 540,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 548, 557,
 &end
#
#  17 GLU  H      18 ASN  H       4.36             (#peak   128 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 128, nxpk= 0, iat= 239, 254, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#  16 LEU  H      17 GLU  H       3.63             (#peak   130 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 130, nxpk= 0, iat= 220, 239, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
#  19 TYR  H      19 TYR  QE      5.06             (#peak   133 #SUP  0.99  #QF  0.98)
 &rst
  ixpk= 133, nxpk= 0, iat= 268,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr2= 278, 283,
 &end
#
#  56 TYR  QE     57 THR  H       5.50             (#peak   133 #SUP  0.99  #QF  0.98)
 &rst
  ixpk= 133, nxpk= 0, iat=  -1, 717, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 706, 711,
 &end
#
#  19 TYR  H      20 CYX  H       3.31             (#peak   134 #SUP  0.80  #QF  0.70)
 &rst
  ixpk= 134, nxpk= 0, iat= 268, 289, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,  &end
#
#  20 CYX  H      21 ASN  H       3.74             (#peak   134 #SUP  0.80  #QF  0.70)
 &rst
  ixpk= 134, nxpk= 0, iat= 289, 299, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#   9 SER  HA     10 ILE  H       3.54             (#peak   135 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 135, nxpk= 0, iat= 114, 123, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#  10 ILE  QG1    35 HIS  HE1     4.37             (#peak   136 #SUP  0.81  #QF  0.81)
 &rst
  ixpk= 136, nxpk= 0, iat=  -1, 389, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1= 133, 134,
 &end
#
#  48 VAL  QG1    49 CYX  H       3.96             (#peak   137 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 137, nxpk= 0, iat=  -1, 596, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 586, 587, 588,
 &end
#
#  48 VAL  QG2    49 CYX  H       3.95             (#peak   138 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 138, nxpk= 0, iat=  -1, 596, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1= 590, 591, 592,
 &end
#
#  48 VAL  HB     49 CYX  H       3.59             (#peak   139 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 139, nxpk= 0, iat= 584, 596, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#  19 TYR  HB3    55 PHE  QE      4.32             (#peak   140 #SUP  0.95  #QF  0.42)
 &rst
  ixpk= 140, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 686, 690,
 &end
#
#  40 HIS  HA     40 HIS  HD2     3.47             (#peak   142 #SUP  0.67  #QF  0.67)
 &rst
  ixpk= 142, nxpk= 0, iat= 446, 457, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
#  31 PHE  QD     36 LEU  QQD     4.21             (#peak   143 #SUP  0.93  #QF  0.75)
 &rst
  ixpk= 143, nxpk= 0, iat=  -1, 403, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 321, 329,
 &end
#
#  35 HIS  HA     35 HIS  HD2     4.25             (#peak   146 #SUP  0.34  #QF  0.34)
 &rst
  ixpk= 146, nxpk= 0, iat= 382, 393, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  45 LEU  HA     48 VAL  H       4.25             (#peak   148 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 148, nxpk= 0, iat= 523, 580, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  13 LEU  H      13 LEU  HG      4.84             (#peak   151 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 151, nxpk= 0, iat= 163, 170, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
#  36 LEU  QQD    44 ALA  H       4.00             (#peak   152 #SUP  0.69  #QF  0.69)
 &rst
  ixpk= 152, nxpk= 0, iat= 403, 511, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,  &end
#
#  36 LEU  QQD    37 CYX  H       4.31             (#peak   153 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 153, nxpk= 0, iat= 403, 416, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,  &end
#
#  16 LEU  HA     19 TYR  QD      2.97             (#peak   156 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 156, nxpk= 0, iat= 222,  -1, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
 igr2= 276, 285,
 &end
#
#  10 ILE  H      10 ILE  QD1     3.89             (#peak   157 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 157, nxpk= 0, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2= 136, 137, 138,
 &end
#
#  10 ILE  QD1    35 HIS  HE1     4.31             (#peak   158 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 158, nxpk= 0, iat=  -1, 389, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1= 136, 137, 138,
 &end
#
#  10 ILE  QD1    35 HIS  HD2     4.58             (#peak   159 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 159, nxpk= 0, iat=  -1, 393, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 136, 137, 138,
 &end
#
#  10 ILE  H      10 ILE  QG1     4.02             (#peak   160 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 160, nxpk= 0, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr2= 133, 134,
 &end
#
#  19 TYR  H      45 LEU  QD1     5.50             (#peak   161 #SUP  0.70  #QF  0.70)
 &rst
  ixpk= 161, nxpk= 0, iat= 268,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 530, 531, 532,
 &end
#
#  10 ILE  QG2    35 HIS  HE1     5.30             (#peak   162 #SUP  0.68  #QF  0.68)
 &rst
  ixpk= 162, nxpk= 0, iat=  -1, 389, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 129, 130, 131,
 &end
#
#  16 LEU  H      16 LEU  HG      3.23             (#peak   163 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 163, nxpk= 0, iat= 220, 227, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
#  45 LEU  H      45 LEU  QD2     4.26             (#peak   164 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 164, nxpk= 0, iat= 521,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 534, 535, 536,
 &end
#
#  19 TYR  QD     45 LEU  QD2     4.27             (#peak   165 #SUP  1.00)
 &rst
  ixpk= 165, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 276, 285,
 igr2= 534, 535, 536,
 &end
#
#  45 LEU  QD2    55 PHE  QD      4.66             (#peak   166 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 166, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr1= 534, 535, 536,
 igr2= 684, 692,
 &end
#
#  19 TYR  QE     45 LEU  QD2     4.67             (#peak   167 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 167, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 278, 283,
 igr2= 534, 535, 536,
 &end
#
#  45 LEU  QD2    55 PHE  QE      4.26             (#peak   168 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 168, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 534, 535, 536,
 igr2= 686, 690,
 &end
#
#  19 TYR  QD     45 LEU  QD1     4.27             (#peak   169 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 169, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 276, 285,
 igr2= 530, 531, 532,
 &end
#
#  45 LEU  QD1    55 PHE  QD      4.66             (#peak   170 #SUP  0.78  #QF  0.78)
 &rst
  ixpk= 170, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr1= 530, 531, 532,
 igr2= 684, 692,
 &end
#
#  45 LEU  QD1    55 PHE  QE      4.26             (#peak   171 #SUP  0.77  #QF  0.77)
 &rst
  ixpk= 171, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 530, 531, 532,
 igr2= 686, 690,
 &end
#
#   2 ILE  QD1    19 TYR  QE      4.43             (#peak   172 #SUP  0.70  #QF  0.23)
 &rst
  ixpk= 172, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1=  24,  25,  26,
 igr2= 278, 283,
 &end
#
#  19 TYR  QE     45 LEU  QD1     4.67             (#peak   172 #SUP  0.70  #QF  0.23)
 &rst
  ixpk= 172, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 278, 283,
 igr2= 530, 531, 532,
 &end
#
#  16 LEU  QQD    19 TYR  QE      3.43             (#peak   174 #SUP  0.68  #QF  0.68)
 &rst
  ixpk= 174, nxpk= 0, iat= 226,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2= 278, 283,
 &end
#
#  16 LEU  QQD    19 TYR  QD      3.78             (#peak   175 #SUP  0.97  #QF  0.92)
 &rst
  ixpk= 175, nxpk= 0, iat= 226,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr2= 276, 285,
 &end
#
#  16 LEU  QQD    31 PHE  QE      4.09             (#peak   175 #SUP  0.97  #QF  0.92)
 &rst
  ixpk= 175, nxpk= 0, iat= 226,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr2= 323, 327,
 &end
#
#  16 LEU  QQD    31 PHE  QD      4.35             (#peak   176 #SUP  0.90  #QF  0.49)
 &rst
  ixpk= 176, nxpk= 0, iat= 226,  -1, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,
 igr2= 321, 329,
 &end
#
#  44 ALA  H      47 LEU  QQD     4.58             (#peak   180 #SUP  0.31  #QF  0.31)
 &rst
  ixpk= 180, nxpk= 0, iat= 511, 567, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,  &end
#
#  47 LEU  H      47 LEU  QQD     4.23             (#peak   181 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 181, nxpk= 0, iat= 561, 567, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,  &end
#
#  42 VAL  QG1    43 GLU  H       4.03             (#peak   182 #SUP  0.68  #QF  0.68)
 &rst
  ixpk= 182, nxpk= 0, iat=  -1, 496, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 486, 487, 488,
 &end
#
#   2 ILE  HG13    3 VAL  H       5.18             (#peak   183 #SUP  0.95  #QF  0.23)
 &rst
  ixpk= 183, nxpk= 0, iat=  22,  30, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
#  45 LEU  H      48 VAL  QG2     5.50             (#peak   183 #SUP  0.95  #QF  0.23)
 &rst
  ixpk= 183, nxpk= 0, iat= 521,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 590, 591, 592,
 &end
#
#  17 GLU  H      48 VAL  QG1     3.72             (#peak   184 #SUP  0.68  #QF  0.54)
 &rst
  ixpk= 184, nxpk= 0, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2= 586, 587, 588,
 &end
#
#   2 ILE  QG2     3 VAL  H       4.15             (#peak   185 #SUP  0.98  #QF  0.94)
 &rst
  ixpk= 185, nxpk= 0, iat=  -1,  30, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1=  17,  18,  19,
 &end
#
#  45 LEU  H      45 LEU  QD1     4.26             (#peak   186 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 186, nxpk= 0, iat= 521,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 530, 531, 532,
 &end
#
#  45 LEU  H      45 LEU  HB3     3.86             (#peak   187 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 187, nxpk= 0, iat= 521, 526, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  45 LEU  HB3    46 TYR  H       4.11             (#peak   188 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 188, nxpk= 0, iat= 526, 540, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  13 LEU  H      16 LEU  QQD     4.53             (#peak   189 #SUP  0.37  #QF  0.37)
 &rst
  ixpk= 189, nxpk= 0, iat= 163, 226, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,  &end
#
#  45 LEU  H      45 LEU  HB2     3.86             (#peak   190 #SUP  0.81  #QF  0.66)
 &rst
  ixpk= 190, nxpk= 0, iat= 521, 525, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  45 LEU  H      45 LEU  HG      3.59             (#peak   190 #SUP  0.81  #QF  0.66)
 &rst
  ixpk= 190, nxpk= 0, iat= 521, 528, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#  45 LEU  HB2    46 TYR  H       4.11             (#peak   193 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 193, nxpk= 0, iat= 525, 540, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  13 LEU  QB     14 TYR  H       3.86             (#peak   194 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 194, nxpk= 0, iat=  -1, 182, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
 igr1= 167, 168,
 &end
#
#  55 PHE  QE     57 THR  QG2     5.07             (#peak   195 #SUP  0.77  #QF  0.77)
 &rst
  ixpk= 195, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
 igr1= 686, 690,
 igr2= 723, 724, 725,
 &end
#
#  55 PHE  QD     57 THR  QG2     4.14             (#peak   196 #SUP  0.39  #QF  0.39)
 &rst
  ixpk= 196, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 684, 692,
 igr2= 723, 724, 725,
 &end
#
#  31 PHE  QE     48 VAL  QG2     3.73             (#peak   197 #SUP  0.50  #QF  0.50)
 &rst
  ixpk= 197, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 323, 327,
 igr2= 590, 591, 592,
 &end
#
#  13 LEU  QQD    31 PHE  QE      3.56             (#peak   198 #SUP  0.45  #QF  0.45)
 &rst
  ixpk= 198, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr2= 323, 327,
 &end
#
#  13 LEU  QQD    31 PHE  QD      3.70             (#peak   199 #SUP  0.37  #QF  0.37)
 &rst
  ixpk= 199, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr2= 321, 329,
 &end
#
#  16 LEU  HB3    19 TYR  QD      4.21             (#peak   201 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 201, nxpk= 0, iat= 225,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 276, 285,
 &end
#
#  31 PHE  QE     44 ALA  QB      3.97             (#peak   202 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 202, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 323, 327,
 igr2= 515, 516, 517,
 &end
#
#  31 PHE  QD     44 ALA  QB      3.77             (#peak   203 #SUP  0.73  #QF  0.73)
 &rst
  ixpk= 203, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 321, 329,
 igr2= 515, 516, 517,
 &end
#
#  45 LEU  HB2    55 PHE  QE      4.80             (#peak   204 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 204, nxpk= 0, iat= 525,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 686, 690,
 &end
#
#  56 TYR  QE     58 PRO  QG      4.46             (#peak   206 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 206, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1= 706, 711,
 igr2= 735, 736,
 &end
#
#  17 GLU  H      17 GLU  HG3     3.96             (#peak   208 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 208, nxpk= 0, iat= 239, 247, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  48 VAL  H      48 VAL  HB      3.40             (#peak   209 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 209, nxpk= 0, iat= 580, 584, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#  18 ASN  QB     19 TYR  QE      4.70             (#peak   219 #SUP  0.81  #QF  0.81)
 &rst
  ixpk= 219, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr1= 258, 259,
 igr2= 278, 283,
 &end
#
#  54 HIS  HB2    54 HIS  HD2     3.96             (#peak   220 #SUP  0.52  #QF  0.52)
 &rst
  ixpk= 220, nxpk= 0, iat= 663, 672, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  54 HIS  HB3    54 HIS  HD2     3.96             (#peak   221 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 221, nxpk= 0, iat= 664, 672, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  19 TYR  HB3    55 PHE  QD      4.40             (#peak   223 #SUP  0.57  #QF  0.57)
 &rst
  ixpk= 223, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 684, 692,
 &end
#
#  42 VAL  HA     45 LEU  H       4.12             (#peak   224 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 224, nxpk= 0, iat= 482, 521, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#  45 LEU  H      46 TYR  QB      4.73             (#peak   225 #SUP  0.84  #QF  0.84)
 &rst
  ixpk= 225, nxpk= 0, iat= 521,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2= 544, 545,
 &end
#
#  17 GLU  H      17 GLU  HG2     3.96             (#peak   226 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 226, nxpk= 0, iat= 239, 246, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  14 TYR  QE     15 GLN  HA      4.52             (#peak   228 #SUP  0.71  #QF  0.71)
 &rst
  ixpk= 228, nxpk= 0, iat=  -1, 205, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1= 192, 197,
 &end
#
#  53 GLY  QA     54 HIS  HD2     4.21             (#peak   229 #SUP  0.45  #QF  0.45)
 &rst
  ixpk= 229, nxpk= 0, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1= 654, 655,
 &end
#
#  16 LEU  HA     19 TYR  QE      3.44             (#peak   231 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 231, nxpk= 0, iat= 222,  -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr2= 278, 283,
 &end
#
#  43 GLU  HA     46 TYR  QE      5.18             (#peak   232 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 232, nxpk= 0, iat= 498,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr2= 550, 555,
 &end
#
#  56 TYR  QE     58 PRO  HA      4.59             (#peak   235 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 235, nxpk= 0, iat=  -1, 741, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1= 706, 711,
 &end
#
#   9 SER  HA     35 HIS  HD2     4.08             (#peak   236 #SUP  0.23  #QF  0.23)
 &rst
  ixpk= 236, nxpk= 0, iat= 114, 393, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  54 HIS  HA     54 HIS  HD2     4.29             (#peak   237 #SUP  0.68  #QF  0.68)
 &rst
  ixpk= 237, nxpk= 0, iat= 661, 672, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  18 ASN  HA     20 CYX  H       4.40             (#peak   242 #SUP  0.50  #QF  0.50)
 &rst
  ixpk= 242, nxpk= 0, iat= 256, 289, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  40 HIS  HA     44 ALA  H       4.31             (#peak   243 #SUP  0.75  #QF  0.75)
 &rst
  ixpk= 243, nxpk= 0, iat= 446, 511, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  14 TYR  HA     17 GLU  H       4.17             (#peak   245 #SUP  0.72  #QF  0.72)
 &rst
  ixpk= 245, nxpk= 0, iat= 184, 239, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  43 GLU  HA     46 TYR  H       3.85             (#peak   248 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 248, nxpk= 0, iat= 498, 540, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
#  17 GLU  HA     19 TYR  H       4.15             (#peak   249 #SUP  0.57  #QF  0.57)
 &rst
  ixpk= 249, nxpk= 0, iat= 241, 268, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#   9 SER  HB2    10 ILE  H       3.77             (#peak   250 #SUP  0.81  #QF  0.81)
 &rst
  ixpk= 250, nxpk= 0, iat= 116, 123, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#  45 LEU  HA     49 CYX  H       4.47             (#peak   251 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 251, nxpk= 0, iat= 523, 596, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
#  46 TYR  H      47 LEU  QQD     5.20             (#peak   253 #SUP  0.87  #QF  0.79)
 &rst
  ixpk= 253, nxpk= 0, iat= 540, 567, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,  &end
#
#  18 ASN  H      19 TYR  H       3.92             (#peak   254 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 254, nxpk= 0, iat= 254, 268, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
#  19 TYR  H      19 TYR  QD      3.26             (#peak   255 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 255, nxpk= 0, iat= 268,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2= 276, 285,
 &end
#
#  14 TYR  H      14 TYR  QD      4.37             (#peak   256 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 256, nxpk= 0, iat= 182,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2= 190, 199,
 &end
#
#  19 TYR  H      45 LEU  QD2     5.50             (#peak   263 #SUP  0.78  #QF  0.78)
 &rst
  ixpk= 263, nxpk= 0, iat= 268,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 534, 535, 536,
 &end
#
#  16 LEU  H      48 VAL  QG1     4.61             (#peak   264 #SUP  0.53  #QF  0.53)
 &rst
  ixpk= 264, nxpk= 0, iat= 220,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2= 586, 587, 588,
 &end
#
#  15 GLN  H      16 LEU  QQD     4.60             (#peak   266 #SUP  0.38  #QF  0.38)
 &rst
  ixpk= 266, nxpk= 0, iat= 203, 226, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,  &end
#
#  13 LEU  QB     15 GLN  H       4.73             (#peak   267 #SUP  0.67  #QF  0.67)
 &rst
  ixpk= 267, nxpk= 0, iat=  -1, 203, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1= 167, 168,
 &end
#
#   2 ILE  HG12   19 TYR  QE      4.52             (#peak   268 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 268, nxpk= 0, iat=  21,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 278, 283,
 &end
#
#  16 LEU  HB2    19 TYR  QD      5.12             (#peak   269 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 269, nxpk= 0, iat= 224,  -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr2= 276, 285,
 &end
#
#  31 PHE  QD     32 VAL  HB      5.47             (#peak   270 #SUP  0.23  #QF  0.23)
 &rst
  ixpk= 270, nxpk= 0, iat=  -1, 337, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1= 321, 329,
 &end
#
#  42 VAL  H      42 VAL  HB      3.50             (#peak   271 #SUP  0.71  #QF  0.71)
 &rst
  ixpk= 271, nxpk= 0, iat= 480, 484, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  31 PHE  QE     43 GLU  QB      5.31             (#peak   272 #SUP  0.68  #QF  0.68)
 &rst
  ixpk= 272, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
 igr1= 323, 327,
 igr2= 500, 501,
 &end
#
#  42 VAL  HB     46 TYR  QD      5.27             (#peak   273 #SUP  0.93  #QF  0.51)
 &rst
  ixpk= 273, nxpk= 0, iat= 484,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr2= 548, 557,
 &end
#
#  43 GLU  QB     46 TYR  QD      5.50             (#peak   273 #SUP  0.93  #QF  0.51)
 &rst
  ixpk= 273, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 500, 501,
 igr2= 548, 557,
 &end
#
#  16 LEU  HG     19 TYR  QD      5.50             (#peak   275 #SUP  0.96  #QF  0.78)
 &rst
  ixpk= 275, nxpk= 0, iat= 227,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 276, 285,
 &end
#
#  16 LEU  HG     31 PHE  QE      5.50             (#peak   275 #SUP  0.96  #QF  0.78)
 &rst
  ixpk= 275, nxpk= 0, iat= 227,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 323, 327,
 &end
#
#  31 PHE  QE     47 LEU  HG      5.50             (#peak   275 #SUP  0.96  #QF  0.78)
 &rst
  ixpk= 275, nxpk= 0, iat=  -1, 568, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 323, 327,
 &end
#
#  16 LEU  HG     17 GLU  H       4.71             (#peak   276 #SUP  0.78  #QF  0.78)
 &rst
  ixpk= 276, nxpk= 0, iat= 227, 239, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  43 GLU  H      44 ALA  QB      4.52             (#peak   277 #SUP  0.81  #QF  0.81)
 &rst
  ixpk= 277, nxpk= 0, iat= 496,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 515, 516, 517,
 &end
#
#  42 VAL  QG2    43 GLU  H       4.03             (#peak   278 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 278, nxpk= 0, iat=  -1, 496, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 490, 491, 492,
 &end
#
#  56 TYR  QD     58 PRO  QG      4.60             (#peak   279 #SUP  0.57  #QF  0.57)
 &rst
  ixpk= 279, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 704, 713,
 igr2= 735, 736,
 &end
#
#  41 LEU  HB2    42 VAL  H       4.24             (#peak   281 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 281, nxpk= 0, iat= 465, 480, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
#  18 ASN  QB     19 TYR  QD      4.42             (#peak   283 #SUP  0.74  #QF  0.74)
 &rst
  ixpk= 283, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1= 258, 259,
 igr2= 276, 285,
 &end
#
#   2 ILE  HG12    3 VAL  H       5.18             (#peak   286 #SUP  0.61  #QF  0.61)
 &rst
  ixpk= 286, nxpk= 0, iat=  21,  30, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
#  10 ILE  QG1    35 HIS  HD2     5.12             (#peak   287 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 287, nxpk= 0, iat=  -1, 393, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 133, 134,
 &end
#
#  45 LEU  HB3    55 PHE  QE      4.80             (#peak   288 #SUP  0.48  #QF  0.48)
 &rst
  ixpk= 288, nxpk= 0, iat= 526,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 686, 690,
 &end
#
#  42 VAL  HA     46 TYR  H       4.70             (#peak   289 #SUP  0.70  #QF  0.70)
 &rst
  ixpk= 289, nxpk= 0, iat= 482, 540, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  14 TYR  HA     16 LEU  H       4.97             (#peak   290 #SUP  0.69  #QF  0.69)
 &rst
  ixpk= 290, nxpk= 0, iat= 184, 220, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
#  31 PHE  QE     44 ALA  HA      4.63             (#peak   293 #SUP  0.43  #QF  0.43)
 &rst
  ixpk= 293, nxpk= 0, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 323, 327,
 &end
#
#  13 LEU  HA     31 PHE  QE      5.50             (#peak   294 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 294, nxpk= 0, iat= 165,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 323, 327,
 &end
#
#  17 GLU  HA     20 CYX  H       4.46             (#peak   295 #SUP  0.61  #QF  0.61)
 &rst
  ixpk= 295, nxpk= 0, iat= 241, 289, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
#  56 TYR  QD     57 THR  HA      4.69             (#peak   297 #SUP  0.76  #QF  0.76)
 &rst
  ixpk= 297, nxpk= 0, iat=  -1, 719, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1= 704, 713,
 &end
#
#  17 GLU  H      18 ASN  HA      5.50             (#peak   301 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 301, nxpk= 0, iat= 239, 256, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  56 TYR  H      56 TYR  QD      4.64             (#peak   303 #SUP  0.81  #QF  0.81)
 &rst
  ixpk= 303, nxpk= 0, iat= 696,  -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr2= 704, 713,
 &end
#
#  56 TYR  QD     57 THR  H       4.65             (#peak   304 #SUP  0.95  #QF  0.36)
 &rst
  ixpk= 304, nxpk= 0, iat=  -1, 717, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 704, 713,
 &end
#
#  42 VAL  H      43 GLU  H       4.22             (#peak   305 #SUP  0.66  #QF  0.66)
 &rst
  ixpk= 305, nxpk= 0, iat= 480, 496, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#  14 TYR  QD     15 GLN  HA      3.71             (#peak   307 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 307, nxpk= 0, iat=  -1, 205, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr1= 190, 199,
 &end
#
#  16 LEU  QQD    17 GLU  H       4.44             (#peak   308 #SUP  0.84  #QF  0.61)
 &rst
  ixpk= 308, nxpk= 0, iat= 226, 239, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,  &end
#
#  16 LEU  QQD    45 LEU  H       4.66             (#peak   308 #SUP  0.84  #QF  0.61)
 &rst
  ixpk= 308, nxpk= 0, iat= 226, 521, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,  &end
#
#   2 ILE  QG2    19 TYR  QE      4.02             (#peak   310 #SUP  0.81  #QF  0.81)
 &rst
  ixpk= 310, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1=  17,  18,  19,
 igr2= 278, 283,
 &end
#
#   2 ILE  HG13   19 TYR  QE      4.52             (#peak   312 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 312, nxpk= 0, iat=  22,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 278, 283,
 &end
#
#  16 LEU  HB3    17 GLU  H       3.84             (#peak   313 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 313, nxpk= 0, iat= 225, 239, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#  10 ILE  HA     35 HIS  HD2     5.10             (#peak   317 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 317, nxpk= 0, iat= 125, 393, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
#  41 LEU  HA     45 LEU  H       4.28             (#peak   319 #SUP  0.73  #QF  0.73)
 &rst
  ixpk= 319, nxpk= 0, iat= 463, 521, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
#  41 LEU  HA     44 ALA  H       4.08             (#peak   320 #SUP  0.99  #QF  0.29)
 &rst
  ixpk= 320, nxpk= 0, iat= 463, 511, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  42 VAL  H      42 VAL  QG1     3.96             (#peak   321 #SUP  0.60  #QF  0.60)
 &rst
  ixpk= 321, nxpk= 0, iat= 480,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr2= 486, 487, 488,
 &end
#
#  42 VAL  H      42 VAL  QG2     3.96             (#peak   322 #SUP  0.98  #QF  0.97)
 &rst
  ixpk= 322, nxpk= 0, iat= 480,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr2= 490, 491, 492,
 &end
#
#  31 PHE  QD     47 LEU  QQD     4.48             (#peak   322 #SUP  0.98  #QF  0.97)
 &rst
  ixpk= 322, nxpk= 0, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
 igr1= 321, 329,
 &end
#
#  31 PHE  QE     47 LEU  QQD     3.92             (#peak   323 #SUP  0.52  #QF  0.52)
 &rst
  ixpk= 323, nxpk= 0, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
 igr1= 323, 327,
 &end
#
#  41 LEU  H      41 LEU  HB3     4.09             (#peak   324 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 324, nxpk= 0, iat= 461, 466, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#  47 LEU  H      47 LEU  HG      4.07             (#peak   325 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 325, nxpk= 0, iat= 561, 568, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  41 LEU  HB3    42 VAL  H       4.24             (#peak   331 #SUP  0.53  #QF  0.36)
 &rst
  ixpk= 331, nxpk= 0, iat= 466, 480, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
#  41 LEU  H      41 LEU  HB2     4.09             (#peak   335 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 335, nxpk= 0, iat= 461, 465, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#  57 THR  HA     58 PRO  QD      2.81             (#peak    10 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 10, nxpk= 0, iat= 719,  -1, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,
 igr2= 732, 733,
 &end
#
#  36 LEU  HA     36 LEU  QQD     3.33             (#peak    19 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 19, nxpk= 0, iat= 399, 403, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,  &end
#
#  10 ILE  HA     10 ILE  QG2     3.92             (#peak    20 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 20, nxpk= 0, iat= 125,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2= 129, 130, 131,
 &end
#
#  10 ILE  HA     10 ILE  QD1     4.13             (#peak    21 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 21, nxpk= 0, iat= 125,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 136, 137, 138,
 &end
#
#   2 ILE  QD1    19 TYR  HA      4.59             (#peak    22 #SUP  0.74  #QF  0.30)
 &rst
  ixpk= 22, nxpk= 0, iat=  -1, 270, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1=  24,  25,  26,
 &end
#
#  10 ILE  QG2    33 ASN  HA      4.79             (#peak    22 #SUP  0.74  #QF  0.30)
 &rst
  ixpk= 22, nxpk= 0, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 129, 130, 131,
 &end
#
#  42 VAL  HA     42 VAL  QG1     3.94             (#peak    24 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 24, nxpk= 0, iat= 482,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 486, 487, 488,
 &end
#
#  42 VAL  HA     42 VAL  QG2     3.94             (#peak    25 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 25, nxpk= 0, iat= 482,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 490, 491, 492,
 &end
#
#  42 VAL  HA     45 LEU  QD2     5.42             (#peak    27 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 27, nxpk= 0, iat= 482,  -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr2= 534, 535, 536,
 &end
#
#  19 TYR  HB3    45 LEU  QD2     4.91             (#peak    29 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 29, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr2= 534, 535, 536,
 &end
#
#  19 TYR  HB2    45 LEU  QD2     4.69             (#peak    30 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 30, nxpk= 0, iat= 272,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr2= 534, 535, 536,
 &end
#
#  45 LEU  HA     45 LEU  QD2     4.19             (#peak    31 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 31, nxpk= 0, iat= 523,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 534, 535, 536,
 &end
#
#   3 VAL  HA      3 VAL  QG1     3.81             (#peak    33 #SUP  0.74  #QF  0.74)
 &rst
  ixpk= 33, nxpk= 0, iat=  32,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2=  36,  37,  38,
 &end
#
#   3 VAL  HA      3 VAL  QG2     3.81             (#peak    35 #SUP  0.78  #QF  0.78)
 &rst
  ixpk= 35, nxpk= 0, iat=  32,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2=  40,  41,  42,
 &end
#
#  57 THR  QG2    58 PRO  QD      3.94             (#peak    40 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 40, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1= 723, 724, 725,
 igr2= 732, 733,
 &end
#
#  19 TYR  HB2    45 LEU  QD1     4.69             (#peak    44 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 44, nxpk= 0, iat= 272,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr2= 530, 531, 532,
 &end
#
#  19 TYR  HB3    45 LEU  QD1     4.91             (#peak    45 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 45, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr2= 530, 531, 532,
 &end
#
#  52 ARG  HB3    52 ARG  QD      4.03             (#peak    47 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 47, nxpk= 0, iat= 633,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2= 638, 639,
 &end
#
#  52 ARG  HB2    52 ARG  QD      4.03             (#peak    49 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 49, nxpk= 0, iat= 632,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2= 638, 639,
 &end
#
#  41 LEU  QD2    42 VAL  HA      5.50             (#peak    51 #SUP  0.97  #QF  0.64)
 &rst
  ixpk= 51, nxpk= 0, iat=  -1, 482, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 474, 475, 476,
 &end
#
#   6 CYX  HB2    16 LEU  QQD     5.25             (#peak    52 #SUP  0.83  #QF  0.51)
 &rst
  ixpk= 52, nxpk= 0, iat=  82, 226, r1= 1.30, r2= 1.80, r3= 7.45, r4= 7.95,  &end
#
#  41 LEU  QD1    42 VAL  HA      5.50             (#peak    52 #SUP  0.83  #QF  0.51)
 &rst
  ixpk= 52, nxpk= 0, iat=  -1, 482, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 470, 471, 472,
 &end
#
#   2 ILE  QG2    19 TYR  HB3     4.82             (#peak    53 #SUP  0.97  #QF  0.36)
 &rst
  ixpk= 53, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr1=  17,  18,  19,
 &end
#
#  57 THR  HA     57 THR  QG2     3.41             (#peak    56 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 56, nxpk= 0, iat= 719,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 723, 724, 725,
 &end
#
#  57 THR  HA     58 PRO  QG      4.06             (#peak    57 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 57, nxpk= 0, iat= 719,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 735, 736,
 &end
#
#  10 ILE  QD1    34 GLN  HA      4.54             (#peak    58 #SUP  0.61  #QF  0.61)
 &rst
  ixpk= 58, nxpk= 0, iat=  -1, 365, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1= 136, 137, 138,
 &end
#
#  16 LEU  HA     16 LEU  QQD     3.15             (#peak    61 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 61, nxpk= 0, iat= 222, 226, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#  45 LEU  HA     45 LEU  QD1     4.19             (#peak    62 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 62, nxpk= 0, iat= 523,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 530, 531, 532,
 &end
#
#   8 THR  HA      8 THR  QG2     3.33             (#peak    63 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 63, nxpk= 0, iat= 100,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2= 104, 105, 106,
 &end
#
#  12 SER  HB2    14 TYR  QB      4.90             (#peak    65 #SUP  0.89  #QF  0.33)
 &rst
  ixpk= 65, nxpk= 0, iat= 156,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2= 186, 187,
 &end
#
#  16 LEU  HA     19 TYR  HB2     5.50             (#peak    65 #SUP  0.89  #QF  0.33)
 &rst
  ixpk= 65, nxpk= 0, iat= 222, 272, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  12 SER  HB3    14 TYR  QB      4.90             (#peak    66 #SUP  0.88  #QF  0.50)
 &rst
  ixpk= 66, nxpk= 0, iat= 157,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2= 186, 187,
 &end
#
#  14 TYR  QB     15 GLN  HA      5.24             (#peak    66 #SUP  0.88  #QF  0.50)
 &rst
  ixpk= 66, nxpk= 0, iat=  -1, 205, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 186, 187,
 &end
#
#  15 GLN  HA     15 GLN  HG2     4.14             (#peak    70 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 70, nxpk= 0, iat= 205, 210, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  15 GLN  HA     15 GLN  HG3     4.14             (#peak    71 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 71, nxpk= 0, iat= 205, 211, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  32 VAL  HA     32 VAL  QQG     3.26             (#peak    73 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 73, nxpk= 0, iat= 335, 336, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
#  47 LEU  HA     47 LEU  QQD     3.32             (#peak    76 #SUP  0.41  #QF  0.41)
 &rst
  ixpk= 76, nxpk= 0, iat= 563, 567, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,  &end
#
#  13 LEU  HA     16 LEU  QQD     3.35             (#peak    77 #SUP  0.74  #QF  0.74)
 &rst
  ixpk= 77, nxpk= 0, iat= 165, 226, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
#  48 VAL  HA     48 VAL  QG1     3.32             (#peak    78 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 78, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
 igr2= 586, 587, 588,
 &end
#
#  48 VAL  HA     48 VAL  QG2     3.23             (#peak    79 #SUP  1.00)
 &rst
  ixpk= 79, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2= 590, 591, 592,
 &end
#
#  43 GLU  HA     46 TYR  QB      3.55             (#peak    94 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 94, nxpk= 0, iat= 498,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2= 544, 545,
 &end
#
#  43 GLU  HA     43 GLU  HG2     4.13             (#peak    96 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 96, nxpk= 0, iat= 498, 503, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  43 GLU  HA     43 GLU  HG3     4.13             (#peak    97 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 97, nxpk= 0, iat= 498, 504, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  17 GLU  HG2    48 VAL  QG1     4.45             (#peak    99 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 99, nxpk= 0, iat= 246,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 586, 587, 588,
 &end
#
#  36 LEU  QQD    41 LEU  HA      3.60             (#peak   103 #SUP  0.82  #QF  0.42)
 &rst
  ixpk= 103, nxpk= 0, iat= 403, 463, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
#  41 LEU  HA     41 LEU  QD2     3.97             (#peak   103 #SUP  0.82  #QF  0.42)
 &rst
  ixpk= 103, nxpk= 0, iat= 463,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2= 474, 475, 476,
 &end
#
#  13 LEU  HA     13 LEU  QQD     3.58             (#peak   106 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 106, nxpk= 0, iat= 165, 169, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
#  13 LEU  HA     16 LEU  HG      4.58             (#peak   107 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 107, nxpk= 0, iat= 165, 227, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#  13 LEU  HA     16 LEU  HB2     4.21             (#peak   108 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 108, nxpk= 0, iat= 165, 224, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  44 ALA  QB     45 LEU  HA      4.59             (#peak   112 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 112, nxpk= 0, iat=  -1, 523, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 515, 516, 517,
 &end
#
#  45 LEU  HA     48 VAL  QG2     3.68             (#peak   113 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 113, nxpk= 0, iat= 523,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 590, 591, 592,
 &end
#
#  45 LEU  HA     48 VAL  QG1     4.42             (#peak   114 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 114, nxpk= 0, iat= 523,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2= 586, 587, 588,
 &end
#
#  45 LEU  HA     48 VAL  HB      3.75             (#peak   115 #SUP  0.84  #QF  0.84)
 &rst
  ixpk= 115, nxpk= 0, iat= 523, 584, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#  52 ARG  HA     52 ARG  QG      4.04             (#peak   117 #SUP  0.52  #QF  0.52)
 &rst
  ixpk= 117, nxpk= 0, iat= 630,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2= 635, 636,
 &end
#
#  52 ARG  HA     52 ARG  QD      3.97             (#peak   119 #SUP  0.77  #QF  0.77)
 &rst
  ixpk= 119, nxpk= 0, iat= 630,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2= 638, 639,
 &end
#
#  41 LEU  HA     41 LEU  QD1     3.97             (#peak   122 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 122, nxpk= 0, iat= 463,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2= 470, 471, 472,
 &end
#
#  16 LEU  QQD    19 TYR  HB2     4.79             (#peak   124 #SUP  0.93  #QF  0.91)
 &rst
  ixpk= 124, nxpk= 0, iat= 226, 272, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,  &end
#
#   6 CYX  HB3    16 LEU  QQD     5.25             (#peak   125 #SUP  0.66  #QF  0.33)
 &rst
  ixpk= 125, nxpk= 0, iat=  83, 226, r1= 1.30, r2= 1.80, r3= 7.45, r4= 7.95,  &end
#
#  10 ILE  HB     10 ILE  QD1     3.73             (#peak   127 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 127, nxpk= 0, iat= 127,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2= 136, 137, 138,
 &end
#
#  36 LEU  HB3    36 LEU  QQD     3.63             (#peak   129 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 129, nxpk= 0, iat= 402, 403, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,  &end
#
#  16 LEU  QQD    45 LEU  HG      4.50             (#peak   133 #SUP  0.83  #QF  0.43)
 &rst
  ixpk= 133, nxpk= 0, iat= 226, 528, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,  &end
#
#  13 LEU  QB     48 VAL  QG2     4.56             (#peak   137 #SUP  0.98  #QF  0.41)
 &rst
  ixpk= 137, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1= 167, 168,
 igr2= 590, 591, 592,
 &end
#
#  16 LEU  HB3    48 VAL  QG2     4.72             (#peak   137 #SUP  0.98  #QF  0.41)
 &rst
  ixpk= 137, nxpk= 0, iat= 225,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 590, 591, 592,
 &end
#
#  13 LEU  QB     13 LEU  QQD     3.44             (#peak   138 #SUP  0.97  #QF  0.96)
 &rst
  ixpk= 138, nxpk= 0, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 167, 168,
 &end
#
#  16 LEU  HB3    16 LEU  QQD     3.03             (#peak   139 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 139, nxpk= 0, iat= 225, 226, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
#  16 LEU  QQD    44 ALA  QB      3.28             (#peak   141 #SUP  0.46  #QF  0.46)
 &rst
  ixpk= 141, nxpk= 0, iat= 226,  -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr2= 515, 516, 517,
 &end
#
#  36 LEU  QQD    44 ALA  QB      3.08             (#peak   142 #SUP  0.57  #QF  0.57)
 &rst
  ixpk= 142, nxpk= 0, iat= 403,  -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr2= 515, 516, 517,
 &end
#
#  44 ALA  QB     48 VAL  QG2     4.18             (#peak   146 #SUP  0.78  #QF  0.78)
 &rst
  ixpk= 146, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 515, 516, 517,
 igr2= 590, 591, 592,
 &end
#
#   2 ILE  QG2     2 ILE  HG13    4.05             (#peak   150 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 150, nxpk= 0, iat=  -1,  22, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr1=  17,  18,  19,
 &end
#
#   2 ILE  QG2     2 ILE  HG12    4.05             (#peak   151 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 151, nxpk= 0, iat=  -1,  21, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr1=  17,  18,  19,
 &end
#
#  16 LEU  HG     48 VAL  QG1     4.11             (#peak   159 #SUP  0.39  #QF  0.39)
 &rst
  ixpk= 159, nxpk= 0, iat= 227,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 586, 587, 588,
 &end
#
#  36 LEU  HB2    36 LEU  QQD     3.63             (#peak   163 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 163, nxpk= 0, iat= 401, 403, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,  &end
#
#  16 LEU  HB2    48 VAL  QG1     3.67             (#peak   165 #SUP  0.90  #QF  0.84)
 &rst
  ixpk= 165, nxpk= 0, iat= 224,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 586, 587, 588,
 &end
#
#  16 LEU  QQD    48 VAL  HB      4.80             (#peak   169 #SUP  0.99  #QF  0.82)
 &rst
  ixpk= 169, nxpk= 0, iat= 226, 584, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#  16 LEU  HB2    48 VAL  QG2     4.22             (#peak   171 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 171, nxpk= 0, iat= 224,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 590, 591, 592,
 &end
#
#  13 LEU  HG     48 VAL  QG2     4.73             (#peak   178 #SUP  0.44  #QF  0.44)
 &rst
  ixpk= 178, nxpk= 0, iat= 170,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr2= 590, 591, 592,
 &end
#
#  10 ILE  QG2    10 ILE  QD1     3.26             (#peak   180 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 180, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 129, 130, 131,
 igr2= 136, 137, 138,
 &end
#
#  17 GLU  HG3    48 VAL  QG1     4.45             (#peak   184 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 184, nxpk= 0, iat= 247,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 586, 587, 588,
 &end
#
#  17 GLU  HA     17 GLU  HG2     3.96             (#peak   202 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 202, nxpk= 0, iat= 241, 246, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  48 VAL  QG1    49 CYX  HA      4.79             (#peak   210 #SUP  0.81  #QF  0.81)
 &rst
  ixpk= 210, nxpk= 0, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 586, 587, 588,
 &end
#
#  16 LEU  HA     19 TYR  HB3     5.50             (#peak   216 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 216, nxpk= 0, iat= 222, 273, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  41 LEU  HA     42 VAL  HA      5.39             (#peak   217 #SUP  1.00  #QF  0.96)
 &rst
  ixpk= 217, nxpk= 0, iat= 463, 482, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
#  42 VAL  HA     43 GLU  HA      5.50             (#peak   217 #SUP  1.00  #QF  0.96)
 &rst
  ixpk= 217, nxpk= 0, iat= 482, 498, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  40 HIS  HA     43 GLU  HG2     5.50             (#peak   223 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 223, nxpk= 0, iat= 446, 503, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  40 HIS  HA     43 GLU  HG3     5.50             (#peak   224 #SUP  0.91  #QF  0.89)
 &rst
  ixpk= 224, nxpk= 0, iat= 446, 504, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  14 TYR  HA     17 GLU  HG2     5.14             (#peak   226 #SUP  0.63  #QF  0.63)
 &rst
  ixpk= 226, nxpk= 0, iat= 184, 246, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#  14 TYR  HA     17 GLU  HG3     5.14             (#peak   227 #SUP  0.77  #QF  0.77)
 &rst
  ixpk= 227, nxpk= 0, iat= 184, 247, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#  10 ILE  QD1    33 ASN  HA      5.39             (#peak   229 #SUP  0.76  #QF  0.76)
 &rst
  ixpk= 229, nxpk= 0, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr1= 136, 137, 138,
 &end
#
#  10 ILE  QD1    35 HIS  HA      4.88             (#peak   230 #SUP  0.63  #QF  0.63)
 &rst
  ixpk= 230, nxpk= 0, iat=  -1, 382, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 136, 137, 138,
 &end
#
#  41 LEU  HA     45 LEU  HG      5.36             (#peak   233 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 233, nxpk= 0, iat= 463, 528, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#   2 ILE  QG2     3 VAL  HA      5.49             (#peak   235 #SUP  0.73  #QF  0.73)
 &rst
  ixpk= 235, nxpk= 0, iat=  -1,  32, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr1=  17,  18,  19,
 &end
#
#  31 PHE  HA     36 LEU  QQD     5.29             (#peak   237 #SUP  0.59  #QF  0.59)
 &rst
  ixpk= 237, nxpk= 0, iat= 315, 403, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,  &end
#
#  46 TYR  QB     47 LEU  QQD     4.65             (#peak   240 #SUP  0.87  #QF  0.61)
 &rst
  ixpk= 240, nxpk= 0, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 7.42, r4= 7.92,
 igr1= 544, 545,
 &end
#
#  43 GLU  QB     46 TYR  QB      5.10             (#peak   241 #SUP  0.81  #QF  0.81)
 &rst
  ixpk= 241, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
 igr1= 500, 501,
 igr2= 544, 545,
 &end
#
#  43 GLU  QB     44 ALA  QB      4.54             (#peak   248 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 248, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr1= 500, 501,
 igr2= 515, 516, 517,
 &end
#
#  42 VAL  HA     45 LEU  QD1     5.42             (#peak   260 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 260, nxpk= 0, iat= 482,  -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr2= 530, 531, 532,
 &end
#
#  16 LEU  QQD    19 TYR  HB3     5.50             (#peak   261 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 261, nxpk= 0, iat= 226, 273, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,  &end
#
#   2 ILE  QD1    19 TYR  HB3     4.83             (#peak   262 #SUP  0.70  #QF  0.70)
 &rst
  ixpk= 262, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1=  24,  25,  26,
 &end
#
#  40 HIS  HA     43 GLU  QB      3.67             (#peak   267 #SUP  0.70  #QF  0.70)
 &rst
  ixpk= 267, nxpk= 0, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 500, 501,
 &end
#
#  13 LEU  QQD    14 TYR  QB      5.50             (#peak   269 #SUP  0.95  #QF  0.91)
 &rst
  ixpk= 269, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 8.37, r4= 8.87,
 igr2= 186, 187,
 &end
#
#  17 GLU  HA     48 VAL  QG1     3.57             (#peak   275 #SUP  0.70  #QF  0.70)
 &rst
  ixpk= 275, nxpk= 0, iat= 241,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr2= 586, 587, 588,
 &end
#
#  17 GLU  HA     17 GLU  HG3     3.96             (#peak   276 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 276, nxpk= 0, iat= 241, 247, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  16 LEU  QQD    48 VAL  QG2     3.62             (#peak   278 #SUP  0.78  #QF  0.78)
 &rst
  ixpk= 278, nxpk= 0, iat= 226,  -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
 igr2= 590, 591, 592,
 &end
#
#   2 ILE  QG2     2 ILE  QG1     3.18             (#peak   150)
 &rst
  ixpk= 150, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1=  17,  18,  19,
 igr2=  21,  22,
 &end
#
#   2 ILE  QG1     3 VAL  H       4.46             (#peak   286)
 &rst
  ixpk= 286, nxpk= 0, iat=  -1,  30, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1=  21,  22,
 &end
#
#   2 ILE  QG1    19 TYR  HA      5.22             (#peak   228)
 &rst
  ixpk= 228, nxpk= 0, iat=  -1, 270, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1=  21,  22,
 &end
#
#   2 ILE  QG1    19 TYR  QE      3.97             (#peak   312)
 &rst
  ixpk= 312, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr1=  21,  22,
 igr2= 278, 283,
 &end
#
#   2 ILE  QG1    45 LEU  QQD     5.28             (#peak   153)
 &rst
  ixpk= 153, nxpk= 0, iat=  -1, 527, r1= 1.30, r2= 1.80, r3= 8.13, r4= 8.63,
 igr1=  21,  22,
 &end
#
#   3 VAL  H       3 VAL  QQG     3.27             (#peak   184)
 &rst
  ixpk= 184, nxpk= 0, iat=  30,  33, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
#   6 CYX  HA     11 CYX  QB      5.31             (#peak   215)
 &rst
  ixpk= 215, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr2= 146, 147,
 &end
#
#   6 CYX  QB     11 CYX  QB      4.87             (#peak   189)
 &rst
  ixpk= 189, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1=  82,  83,
 igr2= 146, 147,
 &end
#
#   6 CYX  QB     16 LEU  QQD     4.56             (#peak    52)
 &rst
  ixpk= 52, nxpk= 0, iat=  -1, 226, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
 igr1=  82,  83,
 &end
#
#   6 CYX  QB     36 LEU  QB      4.40             (#peak   188)
 &rst
  ixpk= 188, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1=  82,  83,
 igr2= 401, 402,
 &end
#
#   6 CYX  QB     36 LEU  QQD     5.13             (#peak    51)
 &rst
  ixpk= 51, nxpk= 0, iat=  -1, 403, r1= 1.30, r2= 1.80, r3= 7.96, r4= 8.46,
 igr1=  82,  83,
 &end
#
#   6 CYX  QB     41 LEU  QQD     4.04             (#peak   100)
 &rst
  ixpk= 100, nxpk= 0, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=  82,  83,
 &end
#
#   9 SER  QB     10 ILE  H       3.30             (#peak   250)
 &rst
  ixpk= 250, nxpk= 0, iat=  -1, 123, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
 igr1= 116, 117,
 &end
#
#  10 ILE  QG2    33 ASN  QB      4.81             (#peak    89)
 &rst
  ixpk= 89, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
 igr1= 129, 130, 131,
 igr2= 353, 354,
 &end
#
#  10 ILE  QG2    34 GLN  QB      5.34             (#peak   281)
 &rst
  ixpk= 281, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
 igr1= 129, 130, 131,
 igr2= 367, 368,
 &end
#
#  10 ILE  QD1    34 GLN  QB      5.29             (#peak   255)
 &rst
  ixpk= 255, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
 igr1= 136, 137, 138,
 igr2= 367, 368,
 &end
#
#  11 CYX  QB     15 GLN  HA      5.34             (#peak   218)
 &rst
  ixpk= 218, nxpk= 0, iat=  -1, 205, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 146, 147,
 &end
#
#  11 CYX  QB     15 GLN  QG      4.26             (#peak    42)
 &rst
  ixpk= 42, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1= 146, 147,
 igr2= 210, 211,
 &end
#
#  11 CYX  QB     16 LEU  HG      4.45             (#peak   187)
 &rst
  ixpk= 187, nxpk= 0, iat=  -1, 227, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 146, 147,
 &end
#
#  11 CYX  QB     16 LEU  QQD     4.07             (#peak    41)
 &rst
  ixpk= 41, nxpk= 0, iat=  -1, 226, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
 igr1= 146, 147,
 &end
#
#  12 SER  QB     14 TYR  QD      4.59             (#peak   316)
 &rst
  ixpk= 316, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 156, 157,
 igr2= 190, 199,
 &end
#
#  13 LEU  QQD    31 PHE  QB      5.34             (#peak   269)
 &rst
  ixpk= 269, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr2= 317, 318,
 &end
#
#  14 TYR  HA     17 GLU  QB      4.08             (#peak   118)
 &rst
  ixpk= 118, nxpk= 0, iat= 184,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2= 243, 244,
 &end
#
#  14 TYR  QB     15 GLN  QB      5.34             (#peak   239)
 &rst
  ixpk= 239, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 186, 187,
 igr2= 207, 208,
 &end
#
#  14 TYR  QB     17 GLU  QB      5.34             (#peak   239)
 &rst
  ixpk= 239, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 186, 187,
 igr2= 243, 244,
 &end
#
#  14 TYR  QD     15 GLN  QB      4.64             (#peak   212)
 &rst
  ixpk= 212, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 190, 199,
 igr2= 207, 208,
 &end
#
#  14 TYR  QD     15 GLN  QG      3.91             (#peak   213)
 &rst
  ixpk= 213, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr1= 190, 199,
 igr2= 210, 211,
 &end
#
#  14 TYR  QE     15 GLN  QG      4.48             (#peak   216)
 &rst
  ixpk= 216, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr1= 192, 197,
 igr2= 210, 211,
 &end
#
#  15 GLN  H      15 GLN  QB      3.43             (#peak    68)
 &rst
  ixpk= 68, nxpk= 0, iat= 203,  -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr2= 207, 208,
 &end
#
#  15 GLN  H      15 GLN  QG      3.47             (#peak    66)
 &rst
  ixpk= 66, nxpk= 0, iat= 203,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 210, 211,
 &end
#
#  15 GLN  HA     15 GLN  QG      3.50             (#peak    70)
 &rst
  ixpk= 70, nxpk= 0, iat= 205,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 210, 211,
 &end
#
#  15 GLN  QB     15 GLN  QE2     4.23             (#peak   215)
 &rst
  ixpk= 215, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr1= 207, 208,
 igr2= 215, 216,
 &end
#
#  15 GLN  QB     16 LEU  H       3.62             (#peak    86)
 &rst
  ixpk= 86, nxpk= 0, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1= 207, 208,
 &end
#
#  15 GLN  QB     16 LEU  HA      3.99             (#peak   201)
 &rst
  ixpk= 201, nxpk= 0, iat=  -1, 222, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr1= 207, 208,
 &end
#
#  15 GLN  QB     16 LEU  QQD     4.34             (#peak   169)
 &rst
  ixpk= 169, nxpk= 0, iat=  -1, 226, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 207, 208,
 &end
#
#  15 GLN  QB     19 TYR  QE      4.96             (#peak   205)
 &rst
  ixpk= 205, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
 igr1= 207, 208,
 igr2= 278, 283,
 &end
#
#  15 GLN  QG     16 LEU  H       3.98             (#peak    84)
 &rst
  ixpk= 84, nxpk= 0, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1= 210, 211,
 &end
#
#  16 LEU  H      17 GLU  QG      5.34             (#peak    85)
 &rst
  ixpk= 85, nxpk= 0, iat= 220,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 246, 247,
 &end
#
#  16 LEU  HA     45 LEU  QQD     4.16             (#peak   287)
 &rst
  ixpk= 287, nxpk= 0, iat= 222, 527, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,  &end
#
#  16 LEU  HB2    45 LEU  QQD     4.87             (#peak   247)
 &rst
  ixpk= 247, nxpk= 0, iat= 224, 527, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,  &end
#
#  16 LEU  HB3    45 LEU  QQD     4.07             (#peak   140)
 &rst
  ixpk= 140, nxpk= 0, iat= 225, 527, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,  &end
#
#  17 GLU  H      17 GLU  QB      3.24             (#peak   210)
 &rst
  ixpk= 210, nxpk= 0, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 243, 244,
 &end
#
#  17 GLU  H      17 GLU  QG      3.31             (#peak   226)
 &rst
  ixpk= 226, nxpk= 0, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr2= 246, 247,
 &end
#
#  17 GLU  HA     17 GLU  QG      3.46             (#peak   276)
 &rst
  ixpk= 276, nxpk= 0, iat= 241,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2= 246, 247,
 &end
#
#  17 GLU  HA     20 CYX  QB      4.95             (#peak   225)
 &rst
  ixpk= 225, nxpk= 0, iat= 241,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr2= 293, 294,
 &end
#
#  17 GLU  QG     48 VAL  QG1     3.63             (#peak   184)
 &rst
  ixpk= 184, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1= 246, 247,
 igr2= 586, 587, 588,
 &end
#
#  19 TYR  H      45 LEU  QQD     4.00             (#peak   161)
 &rst
  ixpk= 161, nxpk= 0, iat= 268, 527, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,  &end
#
#  19 TYR  HB2    45 LEU  QQD     3.73             (#peak    44)
 &rst
  ixpk= 44, nxpk= 0, iat= 272, 527, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
#  19 TYR  HB3    45 LEU  QQD     3.91             (#peak    45)
 &rst
  ixpk= 45, nxpk= 0, iat= 273, 527, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,  &end
#
#  19 TYR  QD     45 LEU  QQD     3.37             (#peak   169)
 &rst
  ixpk= 169, nxpk= 0, iat=  -1, 527, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1= 276, 285,
 &end
#
#  19 TYR  QE     45 LEU  QQD     4.07             (#peak   167)
 &rst
  ixpk= 167, nxpk= 0, iat=  -1, 527, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
 igr1= 278, 283,
 &end
#
#  20 CYX  H      20 CYX  QB      3.24             (#peak    14)
 &rst
  ixpk= 14, nxpk= 0, iat= 289,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 293, 294,
 &end
#
#  20 CYX  QB     21 ASN  H       3.47             (#peak    16)
 &rst
  ixpk= 16, nxpk= 0, iat=  -1, 299, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr1= 293, 294,
 &end
#
#  21 ASN  H      21 ASN  QB      3.23             (#peak    18)
 &rst
  ixpk= 18, nxpk= 0, iat= 299,  -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
 igr2= 303, 304,
 &end
#
#  21 ASN  QB     21 ASN  QD2     3.22             (#peak   109)
 &rst
  ixpk= 109, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1= 303, 304,
 igr2= 308, 309,
 &end
#
#  31 PHE  QB     36 LEU  QQD     5.22             (#peak   123)
 &rst
  ixpk= 123, nxpk= 0, iat=  -1, 403, r1= 1.30, r2= 1.80, r3= 8.06, r4= 8.56,
 igr1= 317, 318,
 &end
#
#  31 PHE  QE     47 LEU  QB      4.52             (#peak   336)
 &rst
  ixpk= 336, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr1= 323, 327,
 igr2= 565, 566,
 &end
#
#  35 HIS  QB     35 HIS  HD2     3.25             (#peak   145)
 &rst
  ixpk= 145, nxpk= 0, iat=  -1, 393, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr1= 384, 385,
 &end
#
#  36 LEU  HA     40 HIS  QB      4.05             (#peak    92)
 &rst
  ixpk= 92, nxpk= 0, iat= 399,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2= 448, 449,
 &end
#
#  36 LEU  QB     41 LEU  HA      4.03             (#peak   195)
 &rst
  ixpk= 195, nxpk= 0, iat=  -1, 463, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1= 401, 402,
 &end
#
#  36 LEU  QB     44 ALA  QB      4.65             (#peak   257)
 &rst
  ixpk= 257, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr1= 401, 402,
 igr2= 515, 516, 517,
 &end
#
#  36 LEU  QQD    40 HIS  QB      3.80             (#peak    46)
 &rst
  ixpk= 46, nxpk= 0, iat= 403,  -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr2= 448, 449,
 &end
#
#  37 CYX  H      40 HIS  QB      4.59             (#peak   260)
 &rst
  ixpk= 260, nxpk= 0, iat= 416,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2= 448, 449,
 &end
#
#  37 CYX  QB     41 LEU  QQD     5.09             (#peak   124)
 &rst
  ixpk= 124, nxpk= 0, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 7.91, r4= 8.41,
 igr1= 420, 421,
 &end
#
#  40 HIS  HA     43 GLU  QG      4.68             (#peak   223)
 &rst
  ixpk= 223, nxpk= 0, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 503, 504,
 &end
#
#  41 LEU  H      41 LEU  QB      3.59             (#peak   335)
 &rst
  ixpk= 335, nxpk= 0, iat= 461,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr2= 465, 466,
 &end
#
#  41 LEU  HA     41 LEU  QQD     3.41             (#peak   103)
 &rst
  ixpk= 103, nxpk= 0, iat= 463, 467, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,  &end
#
#  41 LEU  HA     45 LEU  QQD     5.16             (#peak   280)
 &rst
  ixpk= 280, nxpk= 0, iat= 463, 527, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,  &end
#
#  41 LEU  QB     42 VAL  H       3.71             (#peak   281)
 &rst
  ixpk= 281, nxpk= 0, iat=  -1, 480, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr1= 465, 466,
 &end
#
#  41 LEU  QB     42 VAL  QQG     5.03             (#peak   147)
 &rst
  ixpk= 147, nxpk= 0, iat=  -1, 483, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
 igr1= 465, 466,
 &end
#
#  41 LEU  QB     45 LEU  QQD     4.98             (#peak   256)
 &rst
  ixpk= 256, nxpk= 0, iat=  -1, 527, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
 igr1= 465, 466,
 &end
#
#  41 LEU  HG     42 VAL  QQG     5.44             (#peak   147)
 &rst
  ixpk= 147, nxpk= 0, iat= 468, 483, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,  &end
#
#  41 LEU  HG     45 LEU  QQD     4.24             (#peak   131)
 &rst
  ixpk= 131, nxpk= 0, iat= 468, 527, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,  &end
#
#  41 LEU  QQD    42 VAL  H       4.70             (#peak   176)
 &rst
  ixpk= 176, nxpk= 0, iat= 467, 480, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,  &end
#
#  41 LEU  QQD    42 VAL  HA      4.84             (#peak    52)
 &rst
  ixpk= 52, nxpk= 0, iat= 467, 482, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,  &end
#
#  41 LEU  QQD    42 VAL  HB      5.44             (#peak   246)
 &rst
  ixpk= 246, nxpk= 0, iat= 467, 484, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,  &end
#
#  41 LEU  QQD    45 LEU  H       4.74             (#peak   185)
 &rst
  ixpk= 185, nxpk= 0, iat= 467, 521, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,  &end
#
#  41 LEU  QQD    45 LEU  HA      4.95             (#peak   234)
 &rst
  ixpk= 234, nxpk= 0, iat= 467, 523, r1= 1.30, r2= 1.80, r3= 7.15, r4= 7.65,  &end
#
#  41 LEU  QQD    45 LEU  HG      4.62             (#peak   133)
 &rst
  ixpk= 133, nxpk= 0, iat= 467, 528, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,  &end
#
#  42 VAL  H      42 VAL  QQG     3.09             (#peak   321)
 &rst
  ixpk= 321, nxpk= 0, iat= 480, 483, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
#  42 VAL  HA     45 LEU  QB      4.63             (#peak    28)
 &rst
  ixpk= 28, nxpk= 0, iat= 482,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr2= 525, 526,
 &end
#
#  42 VAL  HA     45 LEU  QQD     4.12             (#peak    27)
 &rst
  ixpk= 27, nxpk= 0, iat= 482, 527, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,  &end
#
#  42 VAL  QQG    43 GLU  H       3.49             (#peak   182)
 &rst
  ixpk= 182, nxpk= 0, iat= 483, 496, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,  &end
#
#  42 VAL  QQG    43 GLU  HA      3.85             (#peak   273)
 &rst
  ixpk= 273, nxpk= 0, iat= 483, 498, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#  42 VAL  QQG    43 GLU  QG      4.62             (#peak   244)
 &rst
  ixpk= 244, nxpk= 0, iat= 483,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 503, 504,
 &end
#
#  42 VAL  QQG    45 LEU  HG      5.44             (#peak   282)
 &rst
  ixpk= 282, nxpk= 0, iat= 483, 528, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,  &end
#
#  42 VAL  QQG    45 LEU  QQD     5.37             (#peak   153)
 &rst
  ixpk= 153, nxpk= 0, iat= 483, 527, r1= 1.30, r2= 1.80, r3= 9.77, r4=10.27,  &end
#
#  42 VAL  QQG    46 TYR  H       4.72             (#peak   253)
 &rst
  ixpk= 253, nxpk= 0, iat= 483, 540, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,  &end
#
#  42 VAL  QQG    46 TYR  QD      3.19             (#peak   178)
 &rst
  ixpk= 178, nxpk= 0, iat= 483,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr2= 548, 557,
 &end
#
#  42 VAL  QQG    46 TYR  QE      3.18             (#peak   179)
 &rst
  ixpk= 179, nxpk= 0, iat= 483,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr2= 550, 555,
 &end
#
#  43 GLU  H      43 GLU  QG      3.43             (#peak    30)
 &rst
  ixpk= 30, nxpk= 0, iat= 496,  -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr2= 503, 504,
 &end
#
#  43 GLU  QG     44 ALA  H       4.64             (#peak    31)
 &rst
  ixpk= 31, nxpk= 0, iat=  -1, 511, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr1= 503, 504,
 &end
#
#  43 GLU  QG     47 LEU  QQD     5.34             (#peak   243)
 &rst
  ixpk= 243, nxpk= 0, iat=  -1, 567, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
 igr1= 503, 504,
 &end
#
#  45 LEU  H      45 LEU  QB      3.05             (#peak   190)
 &rst
  ixpk= 190, nxpk= 0, iat= 521,  -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
 igr2= 525, 526,
 &end
#
#  45 LEU  H      45 LEU  QQD     3.60             (#peak   164)
 &rst
  ixpk= 164, nxpk= 0, iat= 521, 527, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
#  45 LEU  HA     45 LEU  QQD     3.09             (#peak    62)
 &rst
  ixpk= 62, nxpk= 0, iat= 523, 527, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
#  45 LEU  QB     46 TYR  H       3.56             (#peak   193)
 &rst
  ixpk= 193, nxpk= 0, iat=  -1, 540, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr1= 525, 526,
 &end
#
#  45 LEU  QB     55 PHE  QE      3.99             (#peak   204)
 &rst
  ixpk= 204, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 525, 526,
 igr2= 686, 690,
 &end
#
#  45 LEU  QQD    46 TYR  H       4.88             (#peak   262)
 &rst
  ixpk= 262, nxpk= 0, iat= 527, 540, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,  &end
#
#  45 LEU  QQD    48 VAL  HB      4.41             (#peak   170)
 &rst
  ixpk= 170, nxpk= 0, iat= 527, 584, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,  &end
#
#  45 LEU  QQD    48 VAL  QG2     4.36             (#peak   157)
 &rst
  ixpk= 157, nxpk= 0, iat= 527,  -1, r1= 1.30, r2= 1.80, r3= 7.44, r4= 7.94,
 igr2= 590, 591, 592,
 &end
#
#  45 LEU  QQD    55 PHE  QE      3.57             (#peak   168)
 &rst
  ixpk= 168, nxpk= 0, iat= 527,  -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr2= 686, 690,
 &end
#
#  47 LEU  H      47 LEU  QB      3.17             (#peak    42)
 &rst
  ixpk= 42, nxpk= 0, iat= 561,  -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
 igr2= 565, 566,
 &end
#
#  48 VAL  HB     49 CYX  QB      4.67             (#peak    50)
 &rst
  ixpk= 50, nxpk= 0, iat= 584,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 600, 601,
 &end
#
#  49 CYX  QB     50 GLY  H       4.34             (#peak    87)
 &rst
  ixpk= 87, nxpk= 0, iat=  -1, 606, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr1= 600, 601,
 &end
#
#  51 GLU  HA     51 GLU  QG      3.74             (#peak   199)
 &rst
  ixpk= 199, nxpk= 0, iat= 615,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 620, 621,
 &end
#
#  52 ARG  QB     52 ARG  QD      3.52             (#peak    49)
 &rst
  ixpk= 49, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr1= 632, 633,
 igr2= 638, 639,
 &end
#
#  54 HIS  QB     54 HIS  HD2     3.40             (#peak   221)
 &rst
  ixpk= 221, nxpk= 0, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1= 663, 664,
 &end
#
#  56 TYR  QD     58 PRO  QB      4.32             (#peak   274)
 &rst
  ixpk= 274, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 704, 713,
 igr2= 738, 739,
 &end
#
#  56 TYR  QE     58 PRO  QB      4.01             (#peak   211)
 &rst
  ixpk= 211, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 706, 711,
 igr2= 738, 739,
 &end
#
#  57 THR  HA     58 PRO  QB      5.23             (#peak   224)
 &rst
  ixpk= 224, nxpk= 0, iat= 719,  -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr2= 738, 739,
 &end
#
#  59 LYS  QB     60 THR  H       4.15             (#peak   207)
 &rst
  ixpk= 207, nxpk= 0, iat=  -1, 767, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 749, 750,
 &end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           1H       GLY   1  -4.125  -4.635   9.330
    2    H2   GLY   1           2H       GLY   1  -4.206  -3.001   9.433
    3    H3   GLY   1           3H       GLY   1  -5.184  -3.804   8.394
    4    HA2  GLY   1           HA2      GLY   1  -3.322  -4.517   7.058
    5    HA3  GLY   1           HA3      GLY   1  -3.385  -2.750   7.183
    6    H    ILE   2           H        ILE   2  -1.376  -1.956   7.385
    7    HA   ILE   2           HA       ILE   2   0.499  -3.155   9.364
    8    HB   ILE   2           HB       ILE   2   2.390  -2.498   7.945
    9   HG12  ILE   2          2HG1      ILE   2   0.976  -0.932   6.415
   10   HG13  ILE   2          3HG1      ILE   2   2.360  -1.793   5.797
   11   HG21  ILE   2          1HG2      ILE   2   0.556  -4.646   6.842
   12   HG22  ILE   2          2HG2      ILE   2   2.300  -4.516   6.550
   13   HG23  ILE   2          3HG2      ILE   2   1.697  -4.785   8.192
   14   HD11  ILE   2          3HD1      ILE   2   0.512  -1.802   4.201
   15   HD12  ILE   2          1HD1      ILE   2   0.957  -3.441   4.683
   16   HD13  ILE   2          2HD1      ILE   2  -0.512  -2.683   5.348
   17    H    VAL   3           H        VAL   3   2.094  -1.694  10.220
   18    HA   VAL   3           HA       VAL   3   0.744   0.827  10.891
   19    HB   VAL   3           HB       VAL   3   3.152  -0.500  12.180
   20   HG11  VAL   3          1HG1      VAL   3   3.117   1.909  12.692
   21   HG12  VAL   3          2HG1      VAL   3   1.398   1.809  13.138
   22   HG13  VAL   3          3HG1      VAL   3   2.634   0.980  14.110
   23   HG21  VAL   3          3HG2      VAL   3   1.120  -1.880  12.431
   24   HG22  VAL   3          1HG2      VAL   3   1.536  -1.119  13.966
   25   HG23  VAL   3          2HG2      VAL   3   0.207  -0.461  12.986
   26    H    GLU   4           H        GLU   4   4.036  -0.098   9.756
   27    HA   GLU   4           HA       GLU   4   4.941   2.645   9.726
   28    HB2  GLU   4           2HB      GLU   4   6.161   0.169   8.473
   29    HB3  GLU   4           3HB      GLU   4   6.964   1.729   8.651
   30    HG2  GLU   4           2HG      GLU   4   6.726   1.545  11.125
   31    HG3  GLU   4           3HG      GLU   4   5.992  -0.050  10.930
   32    H    GLN   5           H        GLN   5   3.578   0.595   7.239
   33    HA   GLN   5           HA       GLN   5   2.684   0.932   5.214
   34    HB2  GLN   5           2HB      GLN   5   2.296   3.686   6.416
   35    HB3  GLN   5           3HB      GLN   5   1.477   3.133   4.960
   36    HG2  GLN   5           2HG      GLN   5   0.270   1.434   6.115
   37    HG3  GLN   5           3HG      GLN   5   1.264   1.592   7.563
   38   HE21  GLN   5          2HE2      GLN   5   0.968   3.428   8.981
   39   HE22  GLN   5          1HE2      GLN   5  -0.488   4.417   8.846
   40    H    CYS   6           H        CYS   6   5.550   2.766   5.587
   41    HA   CYS   6           HA       CYS   6   6.890   3.957   4.213
   42    HB2  CYS   6           2HB      CYS   6   7.114   2.101   2.788
   43    HB3  CYS   6           3HB      CYS   6   5.567   2.382   2.012
   44    H    CYS   7           H        CYS   7   4.685   4.496   1.607
   45    HA   CYS   7           HA       CYS   7   3.640   6.336   0.859
   46    HB2  CYS   7           2HB      CYS   7   2.542   6.292   3.675
   47    HB3  CYS   7           3HB      CYS   7   1.839   7.172   2.319
   48    H    THR   8           H        THR   8   6.335   7.026   2.259
   49    HA   THR   8           HA       THR   8   5.942   9.913   2.806
   50    HB   THR   8           HB       THR   8   8.450   9.831   3.166
   51    HG1  THR   8           HG1      THR   8   9.301   7.747   3.473
   52   HG21  THR   8          1HG2      THR   8   6.775   7.942   4.881
   53   HG22  THR   8          2HG2      THR   8   8.288   8.745   5.356
   54   HG23  THR   8          3HG2      THR   8   6.835   9.710   5.047
   55    H    SER   9           H        SER   9   8.140   8.055   0.736
   56    HA   SER   9           HA       SER   9   7.555   9.842  -1.607
   57    HB2  SER   9           2HB      SER   9  10.167   8.418  -0.931
   58    HB3  SER   9           3HB      SER   9   9.818   9.253  -2.458
   59    HG   SER   9           HG       SER   9  10.962  10.583  -0.955
   60    H    ILE  10           H        ILE  10   7.749   8.622  -3.707
   61    HA   ILE  10           HA       ILE  10   5.846   6.561  -3.608
   62    HB   ILE  10           HB       ILE  10   7.708   7.129  -5.951
   63   HG12  ILE  10          2HG1      ILE  10   5.711   8.417  -6.848
   64   HG13  ILE  10          3HG1      ILE  10   5.021   8.396  -5.226
   65   HG21  ILE  10          1HG2      ILE  10   6.463   4.987  -6.131
   66   HG22  ILE  10          2HG2      ILE  10   4.941   5.849  -5.792
   67   HG23  ILE  10          3HG2      ILE  10   5.852   6.169  -7.281
   68   HD11  ILE  10          3HD1      ILE  10   7.784   9.555  -5.778
   69   HD12  ILE  10          1HD1      ILE  10   6.315  10.495  -6.053
   70   HD13  ILE  10          2HD1      ILE  10   6.672   9.920  -4.425
   71    H    CYS  11           H        CYS  11   6.039   4.536  -2.951
   72    HA   CYS  11           HA       CYS  11   8.485   3.770  -1.881
   73    HB2  CYS  11           2HB      CYS  11   5.964   2.114  -2.138
   74    HB3  CYS  11           3HB      CYS  11   7.274   1.841  -0.982
   75    H    SER  12           H        SER  12  10.179   2.723  -2.625
   76    HA   SER  12           HA       SER  12  10.222   1.104  -5.050
   77    HB2  SER  12           2HB      SER  12  12.233   1.391  -2.781
   78    HB3  SER  12           3HB      SER  12  12.521   0.527  -4.303
   79    HG   SER  12           HG       SER  12  13.304   2.692  -4.363
   80    H    LEU  13           H        LEU  13  10.612  -1.201  -5.144
   81    HA   LEU  13           HA       LEU  13   8.812  -2.662  -3.518
   82    HB2  LEU  13           2HB      LEU  13  10.980  -3.527  -5.460
   83    HB3  LEU  13           3HB      LEU  13   9.977  -4.675  -4.582
   84    HG   LEU  13           HG       LEU  13   7.921  -3.632  -5.540
   85   HD11  LEU  13          1HD1      LEU  13   9.897  -2.097  -7.280
   86   HD12  LEU  13          2HD1      LEU  13   8.184  -2.324  -7.675
   87   HD13  LEU  13          3HD1      LEU  13   8.618  -1.417  -6.234
   88   HD21  LEU  13          3HD2      LEU  13   8.184  -4.687  -7.745
   89   HD22  LEU  13          1HD2      LEU  13   9.953  -4.667  -7.559
   90   HD23  LEU  13          2HD2      LEU  13   8.948  -5.668  -6.487
   91    H    TYR  14           H        TYR  14  12.296  -2.201  -3.088
   92    HA   TYR  14           HA       TYR  14  12.817  -4.038  -0.995
   93    HB2  TYR  14           2HB      TYR  14  14.548  -2.743  -2.105
   94    HB3  TYR  14           3HB      TYR  14  13.840  -1.228  -1.562
   95    HD1  TYR  14           HD1      TYR  14  15.729  -4.242  -0.476
   96    HD2  TYR  14           HD2      TYR  14  14.206  -0.369   0.674
   97    HE1  TYR  14           HE1      TYR  14  17.114  -4.305   1.600
   98    HE2  TYR  14           HE2      TYR  14  15.557  -0.449   2.754
   99    HH   TYR  14           HH       TYR  14  17.072  -1.643   4.003
  100    H    GLN  15           H        GLN  15  11.104  -0.915  -0.872
  101    HA   GLN  15           HA       GLN  15  11.021  -0.809   2.064
  102    HB2  GLN  15           2HB      GLN  15   9.406   0.780   0.023
  103    HB3  GLN  15           3HB      GLN  15   9.579   1.127   1.740
  104    HG2  GLN  15           2HG      GLN  15  12.007   1.538   1.432
  105    HG3  GLN  15           3HG      GLN  15  11.856   1.175  -0.293
  106   HE21  GLN  15          2HE2      GLN  15  10.971   3.565   2.228
  107   HE22  GLN  15          1HE2      GLN  15  10.553   4.813   1.065
  108    H    LEU  16           H        LEU  16   8.911  -1.822  -0.602
  109    HA   LEU  16           HA       LEU  16   6.571  -2.384   1.001
  110    HB2  LEU  16           2HB      LEU  16   7.433  -3.406  -1.729
  111    HB3  LEU  16           3HB      LEU  16   5.836  -3.630  -1.042
  112    HG   LEU  16           HG       LEU  16   7.108  -0.977  -1.791
  113   HD11  LEU  16          1HD1      LEU  16   5.362  -0.910  -3.523
  114   HD12  LEU  16          2HD1      LEU  16   6.457  -2.279  -3.724
  115   HD13  LEU  16          3HD1      LEU  16   4.832  -2.541  -3.043
  116   HD21  LEU  16          3HD2      LEU  16   4.315  -1.572  -0.706
  117   HD22  LEU  16          1HD2      LEU  16   5.575  -0.607   0.102
  118   HD23  LEU  16          2HD2      LEU  16   4.830  -0.014  -1.382
  119    H    GLU  17           H        GLU  17   9.382  -4.367   0.072
  120    HA   GLU  17           HA       GLU  17   8.448  -6.881   0.943
  121    HB2  GLU  17           2HB      GLU  17  11.205  -5.669   0.725
  122    HB3  GLU  17           3HB      GLU  17  10.976  -7.283   1.403
  123    HG2  GLU  17           2HG      GLU  17   9.809  -8.031  -0.621
  124    HG3  GLU  17           3HG      GLU  17   9.986  -6.442  -1.351
  125    H    ASN  18           H        ASN  18   9.280  -4.161   2.974
  126    HA   ASN  18           HA       ASN  18   9.742  -5.481   5.456
  127    HB2  ASN  18           2HB      ASN  18   9.988  -3.010   4.941
  128    HB3  ASN  18           3HB      ASN  18   8.229  -2.889   4.879
  129   HD21  ASN  18          2HD2      ASN  18   8.028  -1.440   6.625
  130   HD22  ASN  18          1HD2      ASN  18   8.460  -1.884   8.272
  131    H    TYR  19           H        TYR  19   6.750  -4.839   3.675
  132    HA   TYR  19           HA       TYR  19   5.016  -5.862   5.838
  133    HB2  TYR  19           2HB      TYR  19   4.316  -4.796   3.101
  134    HB3  TYR  19           3HB      TYR  19   3.216  -4.985   4.452
  135    HD1  TYR  19           HD1      TYR  19   4.511  -3.791   6.745
  136    HD2  TYR  19           HD2      TYR  19   4.903  -2.597   2.618
  137    HE1  TYR  19           HE1      TYR  19   5.509  -1.647   7.454
  138    HE2  TYR  19           HE2      TYR  19   5.926  -0.457   3.329
  139    HH   TYR  19           HH       TYR  19   6.807   0.715   5.084
  140    H    CYS  20           H        CYS  20   6.467  -7.010   2.892
  141    HA   CYS  20           HA       CYS  20   4.757  -9.365   2.612
  142    HB2  CYS  20           2HB      CYS  20   7.597  -8.991   1.617
  143    HB3  CYS  20           3HB      CYS  20   6.379 -10.101   1.017
  144    H    ASN  21           H        ASN  21   7.779  -8.561   4.288
  145    HA   ASN  21           HA       ASN  21   7.690 -11.130   5.824
  146    HB2  ASN  21           2HB      ASN  21  10.093  -9.772   4.501
  147    HB3  ASN  21           3HB      ASN  21  10.209 -11.111   5.641
  148   HD21  ASN  21          2HD2      ASN  21   9.322 -13.227   5.002
  149   HD22  ASN  21          1HD2      ASN  21   9.161 -13.580   3.288
  150    H1   PHE   1           H        PHE   1   3.731   4.414  -6.334
  151    HA   PHE   1           HA       PHE   1   4.630   2.055  -5.897
  152    HB2  PHE   1           2HB      PHE   1   2.333   1.139  -6.132
  153    HB3  PHE   1           3HB      PHE   1   2.360   1.506  -7.846
  154    HD1  PHE   1           HD1      PHE   1   5.295  -0.067  -6.087
  155    HD2  PHE   1           HD2      PHE   1   1.756  -0.707  -8.477
  156    HE1  PHE   1           HE1      PHE   1   5.986  -2.401  -6.501
  157    HE2  PHE   1           HE2      PHE   1   2.451  -3.049  -8.874
  158    HZ   PHE   1           HZ       PHE   1   4.579  -3.902  -7.900
  159    H    VAL   2           H        VAL   2   3.600   3.839  -8.698
  160    HA   VAL   2           HA       VAL   2   6.342   3.710  -9.877
  161    HB   VAL   2           HB       VAL   2   3.795   3.550 -11.542
  162   HG11  VAL   2          1HG1      VAL   2   5.578   4.809 -12.690
  163   HG12  VAL   2          2HG1      VAL   2   6.737   3.502 -12.356
  164   HG13  VAL   2          3HG1      VAL   2   5.358   3.231 -13.444
  165   HG21  VAL   2          3HG2      VAL   2   4.234   1.356 -10.533
  166   HG22  VAL   2          1HG2      VAL   2   4.639   1.318 -12.248
  167   HG23  VAL   2          2HG2      VAL   2   5.937   1.437 -11.038
  168    H    ASN   3           H        ASN   3   3.173   5.348  -9.853
  169    HA   ASN   3           HA       ASN   3   4.496   8.020 -10.103
  170    HB2  ASN   3           2HB      ASN   3   1.679   7.076 -10.800
  171    HB3  ASN   3           3HB      ASN   3   2.189   8.758 -10.834
  172   HD21  ASN   3          2HD2      ASN   3   1.117   7.579 -13.096
  173   HD22  ASN   3          1HD2      ASN   3   2.397   7.452 -14.294
  174    H    GLN   4           H        GLN   4   3.152   9.767  -8.953
  175    HA   GLN   4           HA       GLN   4   2.984   9.282  -6.132
  176    HB2  GLN   4           2HB      GLN   4   1.984  11.525  -7.922
  177    HB3  GLN   4           3HB      GLN   4   1.774  11.535  -6.168
  178    HG2  GLN   4           2HG      GLN   4   4.195  11.409  -5.823
  179    HG3  GLN   4           3HG      GLN   4   4.473  11.352  -7.570
  180   HE21  GLN   4          2HE2      GLN   4   5.881  13.297  -6.567
  181   HE22  GLN   4          1HE2      GLN   4   5.088  14.859  -6.715
  182    H    HIS   5           H        HIS   5  -0.457   8.361  -5.574
  183    HA   HIS   5           HA       HIS   5   2.258   7.684  -4.835
  184    HB2  HIS   5           2HB      HIS   5   1.834  10.220  -4.180
  185    HB3  HIS   5           3HB      HIS   5   0.886   9.527  -2.882
  186    HD2  HIS   5           HD2      HIS   5   3.786  11.183  -2.788
  187    HE1  HIS   5           HE1      HIS   5   5.073   7.655  -0.800
  188    HE2  HIS   5           HE2      HIS   5   5.492  10.157  -1.085
  189    H    LEU   6           H        LEU   6   2.189   6.567  -2.666
  190    HA   LEU   6           HA       LEU   6  -0.150   4.803  -2.389
  191    HB2  LEU   6           2HB      LEU   6   2.426   4.915  -0.768
  192    HB3  LEU   6           3HB      LEU   6   1.203   3.664  -0.720
  193    HG   LEU   6           HG       LEU   6   2.988   2.737  -1.839
  194   HD11  LEU   6          1HD1      LEU   6   0.790   2.327  -2.930
  195   HD12  LEU   6          2HD1      LEU   6   1.162   3.606  -4.105
  196   HD13  LEU   6          3HD1      LEU   6   2.172   2.149  -4.017
  197   HD21  LEU   6          3HD2      LEU   6   4.156   4.900  -2.421
  198   HD22  LEU   6          1HD2      LEU   6   4.248   3.597  -3.635
  199   HD23  LEU   6          2HD2      LEU   6   3.157   4.964  -3.888
  200    H    CYS   7           H        CYS   7  -1.298   4.574  -0.480
  201    HA   CYS   7           HA       CYS   7  -2.562   5.124   1.228
  202    HB2  CYS   7           2HB      CYS   7  -0.506   7.160   2.082
  203    HB3  CYS   7           3HB      CYS   7  -1.935   6.701   2.981
  204    H    GLY   8           H        GLY   8  -4.663   7.960   0.593
  205    HA2  GLY   8           HA2      GLY   8  -4.320   5.797   2.500
  206    HA3  GLY   8           HA3      GLY   8  -5.821   6.554   1.980
  207    H    SER   9           H        SER   9  -4.503   5.700  -0.861
  208    HA   SER   9           HA       SER   9  -5.491   2.875  -0.918
  209    HB2  SER   9           2HB      SER   9  -7.063   4.561  -1.913
  210    HB3  SER   9           3HB      SER   9  -5.819   4.949  -3.113
  211    HG   SER   9           HG       SER   9  -7.388   3.334  -3.783
  212    H    HIS  10           H        HIS  10  -4.751   2.286  -3.472
  213    HA   HIS  10           HA       HIS  10  -3.135   1.318  -4.690
  214    HB2  HIS  10           2HB      HIS  10  -1.655   3.871  -4.043
  215    HB3  HIS  10           3HB      HIS  10  -1.008   2.625  -5.096
  216    HD2  HIS  10           HD2      HIS  10  -4.400   4.583  -4.941
  217    HE1  HIS  10           HE1      HIS  10  -3.227   4.263  -9.027
  218    HE2  HIS  10           HE2      HIS  10  -4.989   5.191  -7.438
  219    H    LEU  11           H        LEU  11  -1.972   2.029  -1.421
  220    HA   LEU  11           HA       LEU  11   0.433   0.580  -1.504
  221    HB2  LEU  11           2HB      LEU  11  -0.263   2.105   0.322
  222    HB3  LEU  11           3HB      LEU  11  -1.504   0.956   0.818
  223    HG   LEU  11           HG       LEU  11   0.260  -0.707   1.394
  224   HD11  LEU  11          1HD1      LEU  11   2.203   1.549   0.726
  225   HD12  LEU  11          2HD1      LEU  11   2.622   0.046   1.568
  226   HD13  LEU  11          3HD1      LEU  11   2.084  -0.020  -0.110
  227   HD21  LEU  11          3HD2      LEU  11   1.092   0.448   3.389
  228   HD22  LEU  11          1HD2      LEU  11   0.643   2.014   2.690
  229   HD23  LEU  11          2HD2      LEU  11  -0.615   0.827   3.103
  230    H    VAL  12           H        VAL  12  -2.843  -0.699  -0.693
  231    HA   VAL  12           HA       VAL  12  -1.938  -3.387  -0.275
  232    HB   VAL  12           HB       VAL  12  -4.282  -4.007  -0.455
  233   HG11  VAL  12          1HG1      VAL  12  -3.344  -3.125   1.654
  234   HG12  VAL  12          2HG1      VAL  12  -3.893  -1.493   1.208
  235   HG13  VAL  12          3HG1      VAL  12  -5.075  -2.788   1.488
  236   HG21  VAL  12          3HG2      VAL  12  -5.145  -2.505  -2.188
  237   HG22  VAL  12          1HG2      VAL  12  -6.062  -2.318  -0.697
  238   HG23  VAL  12          2HG2      VAL  12  -4.862  -1.092  -1.140
  239    H    GLU  13           H        GLU  13  -3.020  -1.679  -3.212
  240    HA   GLU  13           HA       GLU  13  -3.073  -4.022  -4.909
  241    HB2  GLU  13           2HB      GLU  13  -2.702  -1.085  -5.624
  242    HB3  GLU  13           3HB      GLU  13  -2.978  -2.397  -6.772
  243    HG2  GLU  13           2HG      GLU  13  -5.149  -2.913  -5.623
  244    HG3  GLU  13           3HG      GLU  13  -4.898  -1.520  -4.567
  245    H    ALA  14           H        ALA  14  -0.490  -1.652  -4.142
  246    HA   ALA  14           HA       ALA  14   1.529  -2.821  -5.802
  247    HB1  ALA  14           3HB      ALA  14   3.060  -1.558  -4.395
  248    HB2  ALA  14           1HB      ALA  14   1.627  -0.567  -4.719
  249    HB3  ALA  14           2HB      ALA  14   1.822  -1.347  -3.140
  250    H    LEU  15           H        LEU  15   0.668  -3.428  -2.342
  251    HA   LEU  15           HA       LEU  15   2.671  -5.438  -1.985
  252    HB2  LEU  15           2HB      LEU  15   0.137  -4.751  -0.450
  253    HB3  LEU  15           3HB      LEU  15   1.282  -5.973   0.096
  254    HG   LEU  15           HG       LEU  15   2.101  -3.081  -0.433
  255   HD11  LEU  15          1HD1      LEU  15   2.048  -2.763   1.990
  256   HD12  LEU  15          2HD1      LEU  15   0.434  -3.194   1.399
  257   HD13  LEU  15          3HD1      LEU  15   1.431  -4.413   2.219
  258   HD21  LEU  15          3HD2      LEU  15   3.949  -4.743  -0.484
  259   HD22  LEU  15          1HD2      LEU  15   4.059  -3.658   0.893
  260   HD23  LEU  15          2HD2      LEU  15   3.453  -5.315   1.114
  261    H    TYR  16           H        TYR  16  -0.778  -5.829  -2.919
  262    HA   TYR  16           HA       TYR  16  -0.821  -8.659  -2.927
  263    HB2  TYR  16           2HB      TYR  16  -2.223  -6.611  -4.679
  264    HB3  TYR  16           3HB      TYR  16  -2.519  -8.335  -4.826
  265    HD1  TYR  16           HD1      TYR  16  -2.670  -9.376  -2.126
  266    HD2  TYR  16           HD2      TYR  16  -4.210  -5.692  -3.755
  267    HE1  TYR  16           HE1      TYR  16  -4.282  -9.241  -0.271
  268    HE2  TYR  16           HE2      TYR  16  -5.881  -5.585  -1.911
  269    HH   TYR  16           HH       TYR  16  -5.906  -7.990   0.745
  270    H    LEU  17           H        LEU  17   0.722  -6.475  -5.264
  271    HA   LEU  17           HA       LEU  17   1.287  -8.704  -7.133
  272    HB2  LEU  17           2HB      LEU  17   1.896  -5.725  -7.186
  273    HB3  LEU  17           3HB      LEU  17   2.354  -6.847  -8.463
  274    HG   LEU  17           HG       LEU  17  -0.538  -6.365  -7.599
  275   HD11  LEU  17          1HD1      LEU  17   1.018  -5.237  -9.962
  276   HD12  LEU  17          2HD1      LEU  17  -0.729  -5.050  -9.673
  277   HD13  LEU  17          3HD1      LEU  17   0.427  -4.328  -8.548
  278   HD21  LEU  17          3HD2      LEU  17  -0.244  -8.544  -8.695
  279   HD22  LEU  17          1HD2      LEU  17  -1.077  -7.425  -9.773
  280   HD23  LEU  17          2HD2      LEU  17   0.647  -7.775 -10.029
  281    H    VAL  18           H        VAL  18   3.037  -6.749  -4.756
  282    HA   VAL  18           HA       VAL  18   5.668  -7.729  -5.592
  283    HB   VAL  18           HB       VAL  18   4.708  -5.916  -3.351
  284   HG11  VAL  18          1HG1      VAL  18   7.064  -5.164  -3.110
  285   HG12  VAL  18          2HG1      VAL  18   6.837  -6.822  -2.550
  286   HG13  VAL  18          3HG1      VAL  18   7.593  -6.519  -4.131
  287   HG21  VAL  18          3HG2      VAL  18   6.254  -5.387  -5.929
  288   HG22  VAL  18          1HG2      VAL  18   4.522  -5.112  -5.719
  289   HG23  VAL  18          2HG2      VAL  18   5.662  -4.172  -4.767
  290    H    CYS  19           H        CYS  19   3.471  -8.439  -2.909
  291    HA   CYS  19           HA       CYS  19   5.497  -9.975  -1.485
  292    HB2  CYS  19           2HB      CYS  19   2.565  -9.532  -0.903
  293    HB3  CYS  19           3HB      CYS  19   3.728 -10.293   0.183
  294    H    GLY  20           H        GLY  20   5.805 -11.416  -3.405
  295    HA2  GLY  20           HA2      GLY  20   5.784 -13.943  -2.661
  296    HA3  GLY  20           HA3      GLY  20   4.146 -13.895  -3.298
  297    H    GLU  21           H        GLU  21   5.809 -15.690  -4.412
  298    HA   GLU  21           HA       GLU  21   7.359 -14.730  -6.622
  299    HB2  GLU  21           2HB      GLU  21   7.411 -17.108  -7.345
  300    HB3  GLU  21           3HB      GLU  21   7.952 -16.780  -5.713
  301    HG2  GLU  21           2HG      GLU  21   6.740 -18.823  -5.684
  302    HG3  GLU  21           3HG      GLU  21   5.827 -17.629  -4.784
  303    H    ARG  22           H        ARG  22   3.969 -15.155  -6.382
  304    HA   ARG  22           HA       ARG  22   3.741 -13.846  -9.027
  305    HB2  ARG  22           2HB      ARG  22   3.131 -16.356  -9.146
  306    HB3  ARG  22           3HB      ARG  22   1.704 -15.939  -8.194
  307    HG2  ARG  22           2HG      ARG  22   1.033 -14.319 -10.014
  308    HG3  ARG  22           3HG      ARG  22   2.505 -14.737 -10.894
  309    HD2  ARG  22           2HD      ARG  22   0.671 -15.961 -11.871
  310    HD3  ARG  22           3HD      ARG  22   1.743 -17.091 -11.055
  311    HE   ARG  22           HE       ARG  22   0.068 -17.623  -9.537
  312   HH11  ARG  22          2HH1      ARG  22  -1.033 -14.790 -11.288
  313   HH12  ARG  22          1HH1      ARG  22  -2.642 -14.901 -10.627
  314   HH21  ARG  22          1HH2      ARG  22  -1.996 -17.696  -8.734
  315   HH22  ARG  22          2HH2      ARG  22  -3.164 -16.503  -9.221
  316    H    GLY  23           H        GLY  23   3.983 -12.700  -6.502
  317    HA2  GLY  23           HA2      GLY  23   2.996 -11.152  -5.070
  318    HA3  GLY  23           HA3      GLY  23   1.552 -11.184  -6.081
  319    H    DHI  24           H        DHI  24   0.416 -11.075  -4.009
  320    HA   DHI  24           HA       DHI  24   0.294 -13.567  -2.394
  321    HB2  DHI  24           2HB      DHI  24  -1.133 -14.078  -4.223
  322    HB3  DHI  24           3HB      DHI  24  -2.130 -13.794  -2.814
  323    HD2  DHI  24           HD2      DHI  24  -1.149 -12.171  -6.195
  324    HE1  DHI  24           HE1      DHI  24  -4.835 -10.391  -4.995
  325    HE2  DHI  24           HE2      DHI  24  -3.120 -10.558  -6.873
  326    H    PHE  25           H        PHE  25   1.346 -11.520  -1.220
  327    HA   PHE  25           HA       PHE  25   1.290 -10.498   0.825
  328    HB2  PHE  25           2HB      PHE  25   0.272  -8.741  -0.610
  329    HB3  PHE  25           3HB      PHE  25  -1.317  -9.322  -0.176
  330    HD1  PHE  25           HD2      PHE  25   1.787  -8.419   1.870
  331    HD2  PHE  25           HD1      PHE  25  -2.435  -7.758   1.138
  332    HE1  PHE  25           HE2      PHE  25   1.702  -6.814   3.728
  333    HE2  PHE  25           HE1      PHE  25  -2.475  -6.113   2.974
  334    HZ   PHE  25           HZ       PHE  25  -0.415  -5.639   4.284
  335    H    TYR  26           H        TYR  26  -0.819  -9.886   2.644
  336    HA   TYR  26           HA       TYR  26  -2.479 -12.279   2.962
  337    HB2  TYR  26           2HB      TYR  26  -0.558 -12.885   4.359
  338    HB3  TYR  26           3HB      TYR  26  -0.628 -11.329   5.184
  339    HD1  TYR  26           HD2      TYR  26  -2.533 -14.493   4.566
  340    HD2  TYR  26           HD1      TYR  26  -2.152 -10.966   7.033
  341    HE1  TYR  26           HE2      TYR  26  -4.256 -15.389   6.121
  342    HE2  TYR  26           HE1      TYR  26  -3.856 -11.879   8.594
  343    HH   TYR  26           HH       TYR  26  -5.462 -15.036   8.040
  344    H    THR  27           H        THR  27  -4.464 -11.792   3.799
  345    HA   THR  27           HA       THR  27  -4.893  -9.156   5.079
  346    HB   THR  27           HB       THR  27  -6.840 -10.011   2.936
  347    HG1  THR  27           HG1      THR  27  -4.461  -8.513   2.640
  348   HG21  THR  27          1HG2      THR  27  -5.986  -7.292   4.029
  349   HG22  THR  27          2HG2      THR  27  -7.302  -7.607   2.880
  350   HG23  THR  27          3HG2      THR  27  -7.440  -8.187   4.552
  351    HA   PRO  28           HA       PRO  28  -7.115 -12.222   7.502
  352    HB2  PRO  28           2HB      PRO  28  -7.712 -10.767   9.720
  353    HB3  PRO  28           3HB      PRO  28  -6.041 -11.267   9.313
  354    HG2  PRO  28           2HG      PRO  28  -7.370  -8.599   8.732
  355    HG3  PRO  28           3HG      PRO  28  -5.778  -8.898   9.505
  356    HD2  PRO  28           2HD      PRO  28  -6.022  -8.345   6.844
  357    HD3  PRO  28           3HD      PRO  28  -4.785  -9.487   7.453
  358    H    LYS  29           H        LYS  29  -9.232 -12.665   8.319
  359    HA   LYS  29           HA       LYS  29 -11.476 -10.862   7.612
  360    HB2  LYS  29           2HB      LYS  29 -11.011 -12.260   5.607
  361    HB3  LYS  29           3HB      LYS  29 -11.231 -13.722   6.575
  362    HG2  LYS  29           2HG      LYS  29 -13.590 -13.146   6.966
  363    HG3  LYS  29           3HG      LYS  29 -13.369 -11.590   6.136
  364    HD2  LYS  29           2HD      LYS  29 -12.885 -12.779   4.017
  365    HD3  LYS  29           3HD      LYS  29 -12.977 -14.331   4.855
  366    HE2  LYS  29           2HE      LYS  29 -15.037 -14.029   3.681
  367    HE3  LYS  29           3HE      LYS  29 -15.365 -13.900   5.410
  368    HZ1  LYS  29           HZ1      LYS  29 -15.070 -11.589   3.558
  369    HZ2  LYS  29           HZ2      LYS  29 -16.488 -12.160   4.123
  370    HZ3  LYS  29           HZ3      LYS  29 -15.426 -11.477   5.152
  371    H    THR  30           H        THR  30 -13.338 -11.208   8.780
  372    HA   THR  30           HA       THR  30 -13.613 -13.412  10.690
  373    HB   THR  30           HB       THR  30 -12.235 -11.716  11.884
  374    HG1  THR  30           HG1      THR  30 -14.829 -12.389  12.733
  375   HG21  THR  30          1HG2      THR  30 -14.725  -9.958  11.802
  376   HG22  THR  30          2HG2      THR  30 -13.239  -9.671  12.730
  377   HG23  THR  30          3HG2      THR  30 -13.194  -9.626  10.962
  Start of MODEL    2
    1    H1   GLY   1           1H       GLY   1  -1.171   1.195  11.290
    2    H2   GLY   1           2H       GLY   1  -2.380   2.021  10.552
    3    H3   GLY   1           3H       GLY   1  -2.744   0.809  11.591
    4    HA2  GLY   1           HA2      GLY   1  -1.680  -0.809  10.114
    5    HA3  GLY   1           HA3      GLY   1  -3.093  -0.013   9.410
    6    H    ILE   2           H        ILE   2  -1.437  -1.189   7.725
    7    HA   ILE   2           HA       ILE   2   0.770   0.248   6.672
    8    HB   ILE   2           HB       ILE   2  -1.178  -1.746   5.483
    9   HG12  ILE   2          2HG1      ILE   2   1.756  -1.993   6.266
   10   HG13  ILE   2          3HG1      ILE   2   0.458  -2.363   7.375
   11   HG21  ILE   2          1HG2      ILE   2   0.395  -2.070   3.596
   12   HG22  ILE   2          2HG2      ILE   2  -0.286  -0.463   3.565
   13   HG23  ILE   2          3HG2      ILE   2   1.373  -0.703   4.165
   14   HD11  ILE   2          3HD1      ILE   2   0.979  -3.831   4.765
   15   HD12  ILE   2          1HD1      ILE   2   1.312  -4.405   6.404
   16   HD13  ILE   2          2HD1      ILE   2  -0.365  -4.144   5.883
   17    H    VAL   3           H        VAL   3  -2.678   0.685   6.058
   18    HA   VAL   3           HA       VAL   3  -2.520   2.260   3.722
   19    HB   VAL   3           HB       VAL   3  -4.833   2.997   4.297
   20   HG11  VAL   3          1HG1      VAL   3  -4.395   0.867   3.119
   21   HG12  VAL   3          2HG1      VAL   3  -4.349   0.013   4.675
   22   HG13  VAL   3          3HG1      VAL   3  -5.846   0.794   4.131
   23   HG21  VAL   3          3HG2      VAL   3  -4.496   1.338   6.832
   24   HG22  VAL   3          1HG2      VAL   3  -4.623   3.112   6.773
   25   HG23  VAL   3          2HG2      VAL   3  -5.980   2.108   6.244
   26    H    GLU   4           H        GLU   4  -1.593   3.292   6.871
   27    HA   GLU   4           HA       GLU   4  -1.996   6.160   6.342
   28    HB2  GLU   4           2HB      GLU   4  -2.186   5.163   8.584
   29    HB3  GLU   4           3HB      GLU   4  -0.481   4.718   8.550
   30    HG2  GLU   4           2HG      GLU   4   0.185   7.061   8.561
   31    HG3  GLU   4           3HG      GLU   4  -1.474   7.585   8.258
   32    H    GLN   5           H        GLN   5   0.258   3.854   5.307
   33    HA   GLN   5           HA       GLN   5   2.361   5.878   4.650
   34    HB2  GLN   5           2HB      GLN   5   2.513   2.840   4.923
   35    HB3  GLN   5           3HB      GLN   5   3.804   3.844   4.314
   36    HG2  GLN   5           2HG      GLN   5   4.345   3.393   6.570
   37    HG3  GLN   5           3HG      GLN   5   3.876   5.087   6.489
   38   HE21  GLN   5          2HE2      GLN   5   2.110   1.944   6.886
   39   HE22  GLN   5          1HE2      GLN   5   1.153   2.496   8.255
   40    H    CYS   6           H        CYS   6   2.196   4.847   1.124
   41    HA   CYS   6           HA       CYS   6   4.197   5.627   3.181
   42    HB2  CYS   6           2HB      CYS   6   4.355   5.199   0.168
   43    HB3  CYS   6           3HB      CYS   6   5.692   5.693   1.184
   44    H    CYS   7           H        CYS   7   2.138   6.911   0.665
   45    HA   CYS   7           HA       CYS   7   1.273   8.906   0.195
   46    HB2  CYS   7           2HB      CYS   7   1.479   9.189   3.188
   47    HB3  CYS   7           3HB      CYS   7   0.327  10.014   2.141
   48    H    THR   8           H        THR   8   3.509  10.106   2.744
   49    HA   THR   8           HA       THR   8   4.137  12.530   1.209
   50    HB   THR   8           HB       THR   8   5.482  11.432   3.709
   51    HG1  THR   8           HG1      THR   8   4.016  12.715   4.829
   52   HG21  THR   8          1HG2      THR   8   5.904  13.850   4.188
   53   HG22  THR   8          2HG2      THR   8   6.729  13.305   2.726
   54   HG23  THR   8          3HG2      THR   8   5.238  14.265   2.591
   55    H    SER   9           H        SER   9   5.498   9.318   1.622
   56    HA   SER   9           HA       SER   9   8.041  10.111   0.263
   57    HB2  SER   9           2HB      SER   9   7.497   7.839   2.195
   58    HB3  SER   9           3HB      SER   9   9.058   8.228   1.449
   59    HG   SER   9           HG       SER   9   8.850   9.132   3.559
   60    H    ILE  10           H        ILE  10   9.066   8.743  -1.130
   61    HA   ILE  10           HA       ILE  10   7.586   7.079  -2.985
   62    HB   ILE  10           HB       ILE  10  10.571   7.301  -2.397
   63   HG12  ILE  10          2HG1      ILE  10   9.604   9.491  -3.107
   64   HG13  ILE  10          3HG1      ILE  10  10.835   8.848  -4.172
   65   HG21  ILE  10          1HG2      ILE  10   9.131   6.066  -4.768
   66   HG22  ILE  10          2HG2      ILE  10  10.862   6.463  -4.749
   67   HG23  ILE  10          3HG2      ILE  10  10.229   5.265  -3.621
   68   HD11  ILE  10          3HD1      ILE  10   8.913   9.889  -5.370
   69   HD12  ILE  10          1HD1      ILE  10   9.187   8.206  -5.836
   70   HD13  ILE  10          2HD1      ILE  10   7.858   8.614  -4.727
   71    H    CYS  11           H        CYS  11   7.366   4.817  -2.992
   72    HA   CYS  11           HA       CYS  11   9.090   3.293  -1.153
   73    HB2  CYS  11           2HB      CYS  11   6.120   2.882  -1.249
   74    HB3  CYS  11           3HB      CYS  11   7.285   1.637  -0.743
   75    H    SER  12           H        SER  12  10.341   2.139  -2.273
   76    HA   SER  12           HA       SER  12   9.526   0.831  -4.819
   77    HB2  SER  12           2HB      SER  12  12.224   1.212  -3.454
   78    HB3  SER  12           3HB      SER  12  11.978   0.321  -4.967
   79    HG   SER  12           HG       SER  12  11.651   3.075  -4.457
   80    H    LEU  13           H        LEU  13  10.556  -1.461  -5.081
   81    HA   LEU  13           HA       LEU  13   8.945  -3.203  -3.664
   82    HB2  LEU  13           2HB      LEU  13  11.494  -3.633  -5.260
   83    HB3  LEU  13           3HB      LEU  13  10.667  -4.976  -4.483
   84    HG   LEU  13           HG       LEU  13   8.599  -4.495  -5.726
   85   HD11  LEU  13          1HD1      LEU  13   8.797  -2.125  -6.272
   86   HD12  LEU  13          2HD1      LEU  13  10.280  -2.439  -7.220
   87   HD13  LEU  13          3HD1      LEU  13   8.708  -3.058  -7.761
   88   HD21  LEU  13          3HD2      LEU  13  11.069  -4.855  -7.469
   89   HD22  LEU  13          1HD2      LEU  13  10.246  -6.134  -6.548
   90   HD23  LEU  13          2HD2      LEU  13   9.409  -5.337  -7.888
   91    H    TYR  14           H        TYR  14  12.343  -2.457  -2.832
   92    HA   TYR  14           HA       TYR  14  12.682  -4.321  -0.705
   93    HB2  TYR  14           2HB      TYR  14  14.555  -3.177  -1.656
   94    HB3  TYR  14           3HB      TYR  14  13.852  -1.596  -1.350
   95    HD1  TYR  14           HD2      TYR  14  15.314  -4.593   0.358
   96    HD2  TYR  14           HD1      TYR  14  14.225  -0.428   0.672
   97    HE1  TYR  14           HE2      TYR  14  16.477  -4.452   2.563
   98    HE2  TYR  14           HE1      TYR  14  15.373  -0.294   2.879
   99    HH   TYR  14           HH       TYR  14  16.581  -1.417   4.471
  100    H    GLN  15           H        GLN  15  11.149  -1.108  -0.698
  101    HA   GLN  15           HA       GLN  15  10.858  -0.958   2.220
  102    HB2  GLN  15           2HB      GLN  15   9.549   0.672  -0.004
  103    HB3  GLN  15           3HB      GLN  15   9.520   1.054   1.716
  104    HG2  GLN  15           2HG      GLN  15  11.922   1.426   1.746
  105    HG3  GLN  15           3HG      GLN  15  12.073   0.841   0.076
  106   HE21  GLN  15          2HE2      GLN  15  10.477   3.502   1.954
  107   HE22  GLN  15          1HE2      GLN  15  10.414   4.563   0.549
  108    H    LEU  16           H        LEU  16   8.887  -1.838  -0.582
  109    HA   LEU  16           HA       LEU  16   6.414  -2.213   0.857
  110    HB2  LEU  16           2HB      LEU  16   7.383  -3.138  -1.856
  111    HB3  LEU  16           3HB      LEU  16   5.722  -3.321  -1.303
  112    HG   LEU  16           HG       LEU  16   7.222  -0.726  -1.748
  113   HD11  LEU  16          1HD1      LEU  16   6.627  -1.859  -3.805
  114   HD12  LEU  16          2HD1      LEU  16   4.921  -1.946  -3.288
  115   HD13  LEU  16          3HD1      LEU  16   5.700  -0.380  -3.610
  116   HD21  LEU  16          3HD2      LEU  16   5.003   0.397  -1.417
  117   HD22  LEU  16          1HD2      LEU  16   4.323  -1.164  -0.915
  118   HD23  LEU  16          2HD2      LEU  16   5.578  -0.365   0.062
  119    H    GLU  17           H        GLU  17   8.984  -4.518  -0.115
  120    HA   GLU  17           HA       GLU  17   7.841  -6.909   0.919
  121    HB2  GLU  17           2HB      GLU  17  10.678  -5.869   0.626
  122    HB3  GLU  17           3HB      GLU  17  10.381  -7.443   1.346
  123    HG2  GLU  17           2HG      GLU  17   9.151  -6.822  -1.349
  124    HG3  GLU  17           3HG      GLU  17  10.865  -7.197  -1.229
  125    H    ASN  18           H        ASN  18   9.212  -4.163   2.693
  126    HA   ASN  18           HA       ASN  18   9.547  -5.604   5.158
  127    HB2  ASN  18           2HB      ASN  18  10.709  -3.429   4.377
  128    HB3  ASN  18           3HB      ASN  18   9.236  -2.607   4.906
  129   HD21  ASN  18          2HD2      ASN  18  10.016  -1.533   6.743
  130   HD22  ASN  18          1HD2      ASN  18  10.772  -2.373   8.089
  131    H    TYR  19           H        TYR  19   6.689  -4.692   3.623
  132    HA   TYR  19           HA       TYR  19   5.103  -4.722   6.145
  133    HB2  TYR  19           2HB      TYR  19   4.271  -4.380   3.246
  134    HB3  TYR  19           3HB      TYR  19   3.202  -4.314   4.631
  135    HD1  TYR  19           HD1      TYR  19   4.051  -2.622   6.587
  136    HD2  TYR  19           HD2      TYR  19   4.962  -2.312   2.394
  137    HE1  TYR  19           HE1      TYR  19   4.458  -0.187   6.860
  138    HE2  TYR  19           HE2      TYR  19   5.433   0.119   2.667
  139    HH   TYR  19           HH       TYR  19   5.565   1.866   4.130
  140    H    CYS  20           H        CYS  20   6.404  -6.950   3.953
  141    HA   CYS  20           HA       CYS  20   4.241  -8.969   4.401
  142    HB2  CYS  20           2HB      CYS  20   6.360  -8.751   2.241
  143    HB3  CYS  20           3HB      CYS  20   5.112  -9.992   2.341
  144    H    ASN  21           H        ASN  21   7.752  -8.434   4.678
  145    HA   ASN  21           HA       ASN  21   8.545 -11.078   5.297
  146    HB2  ASN  21           2HB      ASN  21  10.605 -10.055   6.072
  147    HB3  ASN  21           3HB      ASN  21  10.057  -9.225   4.623
  148   HD21  ASN  21          2HD2      ASN  21  11.836  -7.770   5.807
  149   HD22  ASN  21          1HD2      ASN  21  11.101  -6.480   6.763
  150    H1   PHE   1           H        PHE   1   4.664   3.503 -10.049
  151    HA   PHE   1           HA       PHE   1   6.566   3.137  -8.630
  152    HB2  PHE   1           2HB      PHE   1   6.560   1.731  -6.800
  153    HB3  PHE   1           3HB      PHE   1   4.926   2.330  -6.795
  154    HD1  PHE   1           HD2      PHE   1   3.075   0.781  -7.918
  155    HD2  PHE   1           HD1      PHE   1   7.014  -0.578  -6.800
  156    HE1  PHE   1           HE2      PHE   1   2.272  -1.549  -7.922
  157    HE2  PHE   1           HE1      PHE   1   6.216  -2.913  -6.838
  158    HZ   PHE   1           HZ       PHE   1   3.841  -3.416  -7.399
  159    H    VAL   2           H        VAL   2   8.021   0.309 -10.440
  160    HA   VAL   2           HA       VAL   2   8.481   1.207  -7.766
  161    HB   VAL   2           HB       VAL   2   9.633  -0.607  -9.017
  162   HG11  VAL   2          1HG1      VAL   2  10.048   0.550 -11.169
  163   HG12  VAL   2          2HG1      VAL   2  11.226   1.608 -10.366
  164   HG13  VAL   2          3HG1      VAL   2  11.520  -0.137 -10.470
  165   HG21  VAL   2          3HG2      VAL   2  11.780  -0.354  -8.009
  166   HG22  VAL   2          1HG2      VAL   2  11.595   1.398  -7.865
  167   HG23  VAL   2          2HG2      VAL   2  10.550   0.303  -6.922
  168    H    ASN   3           H        ASN   3  10.080   2.860  -7.093
  169    HA   ASN   3           HA       ASN   3  10.669   4.994  -6.822
  170    HB2  ASN   3           2HB      ASN   3  11.088   4.983  -9.827
  171    HB3  ASN   3           3HB      ASN   3  11.733   6.172  -8.710
  172   HD21  ASN   3          2HD2      ASN   3  12.754   3.648 -10.458
  173   HD22  ASN   3          1HD2      ASN   3  14.006   3.058  -9.375
  174    H    GLN   4           H        GLN   4   7.853   4.671  -6.900
  175    HA   GLN   4           HA       GLN   4   7.190   7.537  -7.239
  176    HB2  GLN   4           2HB      GLN   4   5.428   5.272  -8.257
  177    HB3  GLN   4           3HB      GLN   4   4.810   6.852  -7.841
  178    HG2  GLN   4           2HG      GLN   4   5.041   7.191 -10.046
  179    HG3  GLN   4           3HG      GLN   4   6.607   7.783  -9.516
  180   HE21  GLN   4          2HE2      GLN   4   8.454   6.709 -10.351
  181   HE22  GLN   4          1HE2      GLN   4   8.347   5.236 -11.301
  182    H    HIS   5           H        HIS   5   5.298   8.174  -5.969
  183    HA   HIS   5           HA       HIS   5   5.213   7.115  -3.275
  184    HB2  HIS   5           2HB      HIS   5   3.430   9.083  -4.772
  185    HB3  HIS   5           3HB      HIS   5   3.307   8.726  -3.051
  186    HD2  HIS   5           HD2      HIS   5   4.862   9.990  -1.426
  187    HE1  HIS   5           HE1      HIS   5   7.484  11.850  -4.222
  188    HE2  HIS   5           HE2      HIS   5   6.809  11.727  -1.754
  189    H    LEU   6           H        LEU   6   3.621   5.990  -2.258
  190    HA   LEU   6           HA       LEU   6   1.236   4.990  -3.708
  191    HB2  LEU   6           2HB      LEU   6   3.218   3.307  -2.111
  192    HB3  LEU   6           3HB      LEU   6   1.593   2.768  -2.513
  193    HG   LEU   6           HG       LEU   6   3.680   3.482  -4.623
  194   HD11  LEU   6          1HD1      LEU   6   3.876   1.005  -4.870
  195   HD12  LEU   6          2HD1      LEU   6   4.480   1.624  -3.330
  196   HD13  LEU   6          3HD1      LEU   6   2.899   0.811  -3.400
  197   HD21  LEU   6          3HD2      LEU   6   1.339   3.581  -5.445
  198   HD22  LEU   6          1HD2      LEU   6   2.193   2.193  -6.117
  199   HD23  LEU   6          2HD2      LEU   6   1.040   1.953  -4.789
  200    H    CYS   7           H        CYS   7  -0.586   4.911  -2.333
  201    HA   CYS   7           HA       CYS   7  -0.219   5.427   0.557
  202    HB2  CYS   7           2HB      CYS   7  -0.149   7.616  -0.728
  203    HB3  CYS   7           3HB      CYS   7  -1.792   7.294  -1.246
  204    H    GLY   8           H        GLY   8  -1.951   4.730   1.816
  205    HA2  GLY   8           HA2      GLY   8  -3.900   3.603   2.349
  206    HA3  GLY   8           HA3      GLY   8  -4.620   4.504   1.024
  207    H    SER   9           H        SER   9  -5.857   3.075  -0.028
  208    HA   SER   9           HA       SER   9  -5.505   0.305  -0.302
  209    HB2  SER   9           2HB      SER   9  -6.928   2.190  -2.218
  210    HB3  SER   9           3HB      SER   9  -7.203   0.445  -2.047
  211    HG   SER   9           HG       SER   9  -8.744   1.687  -0.870
  212    H    HIS  10           H        HIS  10  -4.028   2.880  -2.292
  213    HA   HIS  10           HA       HIS  10  -3.328   1.128  -4.497
  214    HB2  HIS  10           2HB      HIS  10  -2.149   3.804  -3.659
  215    HB3  HIS  10           3HB      HIS  10  -1.850   2.978  -5.183
  216    HD2  HIS  10           HD2      HIS  10  -3.875   2.855  -6.981
  217    HE1  HIS  10           HE1      HIS  10  -6.420   5.699  -5.073
  218    HE2  HIS  10           HE2      HIS  10  -6.025   4.365  -7.207
  219    H    LEU  11           H        LEU  11  -1.755   1.862  -1.402
  220    HA   LEU  11           HA       LEU  11   0.728   0.470  -2.093
  221    HB2  LEU  11           2HB      LEU  11   0.366   2.244  -0.259
  222    HB3  LEU  11           3HB      LEU  11  -0.362   0.962   0.701
  223    HG   LEU  11           HG       LEU  11   2.492   1.012  -0.403
  224   HD11  LEU  11          1HD1      LEU  11   1.396   1.405   2.408
  225   HD12  LEU  11          2HD1      LEU  11   3.120   1.286   1.984
  226   HD13  LEU  11          3HD1      LEU  11   2.153   2.610   1.342
  227   HD21  LEU  11          3HD2      LEU  11   2.850  -0.864   1.314
  228   HD22  LEU  11          1HD2      LEU  11   1.085  -1.063   1.308
  229   HD23  LEU  11          2HD2      LEU  11   2.043  -1.277  -0.182
  230    H    VAL  12           H        VAL  12  -2.303  -0.391  -0.329
  231    HA   VAL  12           HA       VAL  12  -1.667  -3.110   0.194
  232    HB   VAL  12           HB       VAL  12  -4.356  -1.787  -0.322
  233   HG11  VAL  12          1HG1      VAL  12  -4.706  -4.149  -0.692
  234   HG12  VAL  12          2HG1      VAL  12  -3.751  -4.569   0.745
  235   HG13  VAL  12          3HG1      VAL  12  -5.320  -3.748   0.912
  236   HG21  VAL  12          3HG2      VAL  12  -3.129  -0.928   1.653
  237   HG22  VAL  12          1HG2      VAL  12  -4.542  -1.866   2.142
  238   HG23  VAL  12          2HG2      VAL  12  -2.922  -2.586   2.252
  239    H    GLU  13           H        GLU  13  -3.236  -1.741  -2.754
  240    HA   GLU  13           HA       GLU  13  -3.365  -4.206  -4.210
  241    HB2  GLU  13           2HB      GLU  13  -3.172  -1.296  -5.065
  242    HB3  GLU  13           3HB      GLU  13  -3.306  -2.606  -6.230
  243    HG2  GLU  13           2HG      GLU  13  -5.350  -2.152  -4.013
  244    HG3  GLU  13           3HG      GLU  13  -5.472  -1.449  -5.620
  245    H    ALA  14           H        ALA  14  -0.660  -1.838  -3.928
  246    HA   ALA  14           HA       ALA  14   1.035  -3.170  -5.825
  247    HB1  ALA  14           3HB      ALA  14   1.776  -1.382  -3.472
  248    HB2  ALA  14           1HB      ALA  14   2.816  -1.813  -4.835
  249    HB3  ALA  14           2HB      ALA  14   1.365  -0.831  -5.113
  250    H    LEU  15           H        LEU  15   0.543  -3.717  -2.287
  251    HA   LEU  15           HA       LEU  15   2.707  -5.620  -2.066
  252    HB2  LEU  15           2HB      LEU  15   0.162  -5.441  -0.415
  253    HB3  LEU  15           3HB      LEU  15   1.599  -6.390  -0.024
  254    HG   LEU  15           HG       LEU  15   1.413  -3.378  -0.142
  255   HD11  LEU  15          1HD1      LEU  15   0.420  -4.335   1.857
  256   HD12  LEU  15          2HD1      LEU  15   1.908  -5.260   2.176
  257   HD13  LEU  15          3HD1      LEU  15   1.921  -3.486   2.253
  258   HD21  LEU  15          3HD2      LEU  15   3.738  -3.369   0.720
  259   HD22  LEU  15          1HD2      LEU  15   3.824  -5.123   0.458
  260   HD23  LEU  15          2HD2      LEU  15   3.627  -4.007  -0.918
  261    H    TYR  16           H        TYR  16  -0.643  -6.038  -3.195
  262    HA   TYR  16           HA       TYR  16  -0.352  -8.917  -3.460
  263    HB2  TYR  16           2HB      TYR  16  -2.364  -6.940  -4.555
  264    HB3  TYR  16           3HB      TYR  16  -2.427  -8.667  -4.894
  265    HD1  TYR  16           HD2      TYR  16  -2.092 -10.230  -2.720
  266    HD2  TYR  16           HD1      TYR  16  -3.713  -6.232  -2.713
  267    HE1  TYR  16           HE2      TYR  16  -3.154 -10.668  -0.533
  268    HE2  TYR  16           HE1      TYR  16  -4.786  -6.678  -0.512
  269    HH   TYR  16           HH       TYR  16  -5.117  -8.188   1.170
  270    H    LEU  17           H        LEU  17   1.146  -6.456  -5.208
  271    HA   LEU  17           HA       LEU  17   1.680  -8.260  -7.540
  272    HB2  LEU  17           2HB      LEU  17   2.508  -5.369  -7.093
  273    HB3  LEU  17           3HB      LEU  17   2.809  -6.328  -8.531
  274    HG   LEU  17           HG       LEU  17   0.064  -5.455  -7.529
  275   HD11  LEU  17          1HD1      LEU  17   1.728  -4.519  -9.900
  276   HD12  LEU  17          2HD1      LEU  17   0.076  -3.991  -9.501
  277   HD13  LEU  17          3HD1      LEU  17   1.411  -3.607  -8.408
  278   HD21  LEU  17          3HD2      LEU  17   0.869  -6.920 -10.079
  279   HD22  LEU  17          1HD2      LEU  17  -0.118  -7.576  -8.751
  280   HD23  LEU  17          2HD2      LEU  17  -0.743  -6.251  -9.737
  281    H    VAL  18           H        VAL  18   3.331  -6.420  -4.969
  282    HA   VAL  18           HA       VAL  18   5.973  -7.392  -5.608
  283    HB   VAL  18           HB       VAL  18   4.848  -5.829  -3.248
  284   HG11  VAL  18          1HG1      VAL  18   7.774  -6.272  -3.990
  285   HG12  VAL  18          2HG1      VAL  18   7.177  -5.046  -2.851
  286   HG13  VAL  18          3HG1      VAL  18   6.970  -6.759  -2.478
  287   HG21  VAL  18          3HG2      VAL  18   6.377  -5.039  -5.766
  288   HG22  VAL  18          1HG2      VAL  18   4.678  -4.691  -5.426
  289   HG23  VAL  18          2HG2      VAL  18   5.926  -3.930  -4.450
  290    H    CYS  19           H        CYS  19   3.577  -8.355  -3.201
  291    HA   CYS  19           HA       CYS  19   5.383 -10.496  -2.185
  292    HB2  CYS  19           2HB      CYS  19   2.891  -9.392  -0.873
  293    HB3  CYS  19           3HB      CYS  19   4.133 -10.421  -0.164
  294    H    GLY  20           H        GLY  20   3.112 -10.316  -4.519
  295    HA2  GLY  20           HA2      GLY  20   1.900 -11.912  -5.657
  296    HA3  GLY  20           HA3      GLY  20   2.718 -13.125  -4.678
  297    H    GLU  21           H        GLU  21   1.187 -14.472  -3.942
  298    HA   GLU  21           HA       GLU  21  -1.564 -13.675  -3.455
  299    HB2  GLU  21           2HB      GLU  21  -0.099 -16.297  -2.968
  300    HB3  GLU  21           3HB      GLU  21  -1.845 -16.066  -2.817
  301    HG2  GLU  21           2HG      GLU  21  -1.957 -15.375  -5.210
  302    HG3  GLU  21           3HG      GLU  21  -0.232 -15.705  -5.378
  303    H    ARG  22           H        ARG  22   1.139 -13.437  -1.434
  304    HA   ARG  22           HA       ARG  22  -0.050 -14.009   1.151
  305    HB2  ARG  22           2HB      ARG  22   2.386 -13.962   0.619
  306    HB3  ARG  22           3HB      ARG  22   2.296 -12.211   0.399
  307    HG2  ARG  22           2HG      ARG  22   1.818 -11.856   2.738
  308    HG3  ARG  22           3HG      ARG  22   1.557 -13.595   3.010
  309    HD2  ARG  22           2HD      ARG  22   3.919 -14.068   2.456
  310    HD3  ARG  22           3HD      ARG  22   4.185 -12.372   2.062
  311    HE   ARG  22           HE       ARG  22   4.516 -11.910   4.282
  312   HH11  ARG  22          2HH2      ARG  22   2.880 -15.022   4.267
  313   HH12  ARG  22          1HH2      ARG  22   3.144 -15.233   5.975
  314   HH21  ARG  22          1HH1      ARG  22   4.832 -12.243   6.335
  315   HH22  ARG  22          2HH1      ARG  22   4.221 -13.673   7.146
  316    H    GLY  23           H        GLY  23  -1.116 -12.662   2.571
  317    HA2  GLY  23           HA2      GLY  23  -1.969  -9.945   1.681
  318    HA3  GLY  23           HA3      GLY  23  -3.155 -11.236   1.752
  319    H    DHI  24           H        DHI  24  -4.176  -9.601   3.129
  320    HA   DHI  24           HA       DHI  24  -3.575 -10.071   5.998
  321    HB2  DHI  24           2HB      DHI  24  -5.794 -10.617   5.303
  322    HB3  DHI  24           3HB      DHI  24  -5.839  -9.242   6.401
  323    HD2  DHI  24           HD2      DHI  24  -6.707 -10.316   2.909
  324    HE1  DHI  24           HE1      DHI  24  -7.621  -6.146   3.016
  325    HE2  DHI  24           HE2      DHI  24  -7.879  -8.289   1.659
  326    H    PHE  25           H        PHE  25  -3.421  -7.485   3.679
  327    HA   PHE  25           HA       PHE  25  -1.876  -5.924   5.495
  328    HB2  PHE  25           2HB      PHE  25  -2.846  -5.219   2.724
  329    HB3  PHE  25           3HB      PHE  25  -1.498  -4.475   3.577
  330    HD1  PHE  25           HD2      PHE  25   0.166  -6.494   4.638
  331    HD2  PHE  25           HD1      PHE  25  -2.115  -6.622   0.974
  332    HE1  PHE  25           HE2      PHE  25   1.691  -8.216   3.754
  333    HE2  PHE  25           HE1      PHE  25  -0.566  -8.335   0.081
  334    HZ   PHE  25           HZ       PHE  25   1.331  -9.152   1.465
  335    H    TYR  26           H        TYR  26  -5.225  -5.907   5.356
  336    HA   TYR  26           HA       TYR  26  -5.970  -3.205   5.768
  337    HB2  TYR  26           2HB      TYR  26  -7.590  -4.958   5.581
  338    HB3  TYR  26           3HB      TYR  26  -6.911  -5.831   6.952
  339    HD1  TYR  26           HD2      TYR  26  -8.162  -2.315   6.308
  340    HD2  TYR  26           HD1      TYR  26  -8.224  -5.798   8.857
  341    HE1  TYR  26           HE2      TYR  26  -9.705  -1.149   7.866
  342    HE2  TYR  26           HE1      TYR  26  -9.802  -4.647  10.391
  343    HH   TYR  26           HH       TYR  26 -10.992  -2.735  10.824
  344    H    THR  27           H        THR  27  -4.493  -5.483   8.065
  345    HA   THR  27           HA       THR  27  -3.600  -5.208  10.165
  346    HB   THR  27           HB       THR  27  -1.644  -3.641  10.095
  347    HG1  THR  27           HG1      THR  27  -2.543  -3.221   7.436
  348   HG21  THR  27          1HG2      THR  27  -0.449  -4.887   8.365
  349   HG22  THR  27          2HG2      THR  27  -1.461  -5.966   9.335
  350   HG23  THR  27          3HG2      THR  27  -1.981  -5.495   7.708
  351    HA   PRO  28           HA       PRO  28  -6.239  -1.689  11.610
  352    HB2  PRO  28           2HB      PRO  28  -7.730  -2.993  13.516
  353    HB3  PRO  28           3HB      PRO  28  -8.120  -2.990  11.770
  354    HG2  PRO  28           2HG      PRO  28  -6.605  -5.100  13.342
  355    HG3  PRO  28           3HG      PRO  28  -7.962  -5.341  12.196
  356    HD2  PRO  28           2HD      PRO  28  -5.367  -5.656  11.445
  357    HD3  PRO  28           3HD      PRO  28  -6.565  -4.948  10.328
  358    H    LYS  29           H        LYS  29  -4.841  -0.908  14.857
  359    HA   LYS  29           HA       LYS  29  -7.313  -0.469  13.385
  360    HB2  LYS  29           2HB      LYS  29  -7.489   1.556  14.647
  361    HB3  LYS  29           3HB      LYS  29  -7.018   0.233  15.711
  362    HG2  LYS  29           2HG      LYS  29  -4.632   1.029  15.594
  363    HG3  LYS  29           3HG      LYS  29  -5.160   2.404  14.618
  364    HD2  LYS  29           2HD      LYS  29  -6.088   1.790  17.459
  365    HD3  LYS  29           3HD      LYS  29  -4.834   2.957  17.014
  366    HE2  LYS  29           2HE      LYS  29  -6.505   4.236  15.672
  367    HE3  LYS  29           3HE      LYS  29  -7.766   3.098  16.170
  368    HZ1  LYS  29           HZ1      LYS  29  -7.753   5.071  17.580
  369    HZ2  LYS  29           HZ2      LYS  29  -7.364   3.769  18.480
  370    HZ3  LYS  29           HZ3      LYS  29  -6.203   4.823  18.019
  371    H    THR  30           H        THR  30  -7.814   1.435  12.180
  372    HA   THR  30           HA       THR  30  -5.645   2.419  10.368
  373    HB   THR  30           HB       THR  30  -7.320   2.386   8.540
  374    HG1  THR  30           HG1      THR  30  -9.132   2.228  10.016
  375   HG21  THR  30          1HG2      THR  30  -6.872  -0.383   9.735
  376   HG22  THR  30          2HG2      THR  30  -7.122   0.035   8.030
  377   HG23  THR  30          3HG2      THR  30  -5.636   0.537   8.854
  Start of MODEL    3
    1    H1   GLY   1           1H       GLY   1   2.996  -4.961  13.599
    2    H2   GLY   1           2H       GLY   1   2.733  -6.474  13.020
    3    H3   GLY   1           3H       GLY   1   3.885  -5.522  12.340
    4    HA2  GLY   1           HA2      GLY   1   1.889  -5.654  10.962
    5    HA3  GLY   1           HA3      GLY   1   0.992  -4.949  12.319
    6    H    ILE   2           H        ILE   2   1.078  -3.781   9.761
    7    HA   ILE   2           HA       ILE   2   3.100  -1.651   9.697
    8    HB   ILE   2           HB       ILE   2   0.870  -2.535   7.855
    9   HG12  ILE   2          2HG1      ILE   2   2.687  -2.717   6.208
   10   HG13  ILE   2          3HG1      ILE   2   3.853  -2.084   7.367
   11   HG21  ILE   2          1HG2      ILE   2   1.493  -0.714   6.288
   12   HG22  ILE   2          2HG2      ILE   2   0.750  -0.084   7.750
   13   HG23  ILE   2          3HG2      ILE   2   2.518   0.008   7.538
   14   HD11  ILE   2          3HD1      ILE   2   3.934  -4.570   6.982
   15   HD12  ILE   2          1HD1      ILE   2   3.763  -4.108   8.675
   16   HD13  ILE   2          2HD1      ILE   2   2.348  -4.697   7.760
   17    H    VAL   3           H        VAL   3   2.890   0.385  10.312
   18    HA   VAL   3           HA       VAL   3   0.252   1.424  11.277
   19    HB   VAL   3           HB       VAL   3   1.418   2.537  13.124
   20   HG11  VAL   3          1HG1      VAL   3   1.749   0.608  14.538
   21   HG12  VAL   3          2HG1      VAL   3   0.374   0.316  13.459
   22   HG13  VAL   3          3HG1      VAL   3   1.941  -0.458  13.135
   23   HG21  VAL   3          3HG2      VAL   3   3.884   0.921  12.331
   24   HG22  VAL   3          1HG2      VAL   3   3.707   2.683  12.150
   25   HG23  VAL   3          2HG2      VAL   3   3.696   1.952  13.760
   26    H    GLU   4           H        GLU   4   2.386   1.934   8.883
   27    HA   GLU   4           HA       GLU   4   1.696   4.774   8.596
   28    HB2  GLU   4           2HB      GLU   4   3.842   4.751   9.875
   29    HB3  GLU   4           3HB      GLU   4   4.579   3.777   8.608
   30    HG2  GLU   4           2HG      GLU   4   5.271   6.097   8.434
   31    HG3  GLU   4           3HG      GLU   4   4.363   5.635   7.010
   32    H    GLN   5           H        GLN   5   1.924   5.534   6.425
   33    HA   GLN   5           HA       GLN   5   2.102   3.380   4.343
   34    HB2  GLN   5           2HB      GLN   5   0.010   5.590   4.563
   35    HB3  GLN   5           3HB      GLN   5   0.232   4.523   3.186
   36    HG2  GLN   5           2HG      GLN   5  -1.530   3.523   4.331
   37    HG3  GLN   5           3HG      GLN   5  -0.136   2.542   4.753
   38   HE21  GLN   5          2HE2      GLN   5  -1.273   1.747   6.656
   39   HE22  GLN   5          1HE2      GLN   5  -1.511   2.797   8.045
   40    H    CYS   6           H        CYS   6   2.526   4.102   2.182
   41    HA   CYS   6           HA       CYS   6   4.579   6.176   2.068
   42    HB2  CYS   6           2HB      CYS   6   5.118   4.080   1.239
   43    HB3  CYS   6           3HB      CYS   6   3.680   3.937   0.273
   44    H    CYS   7           H        CYS   7   2.340   7.361   2.695
   45    HA   CYS   7           HA       CYS   7   1.502   9.129   0.456
   46    HB2  CYS   7           2HB      CYS   7   0.812   8.821   3.384
   47    HB3  CYS   7           3HB      CYS   7   0.738  10.415   2.679
   48    H    THR   8           H        THR   8   2.121  11.357   0.550
   49    HA   THR   8           HA       THR   8   3.434  13.155   0.689
   50    HB   THR   8           HB       THR   8   4.272  12.181   3.427
   51    HG1  THR   8           HG1      THR   8   2.476  13.352   4.107
   52   HG21  THR   8          1HG2      THR   8   4.414  14.613   3.923
   53   HG22  THR   8          2HG2      THR   8   5.581  14.132   2.687
   54   HG23  THR   8          3HG2      THR   8   4.088  14.976   2.213
   55    H    SER   9           H        SER   9   5.489  10.434   1.857
   56    HA   SER   9           HA       SER   9   7.660  11.392   0.037
   57    HB2  SER   9           2HB      SER   9   9.189   9.996   1.368
   58    HB3  SER   9           3HB      SER   9   8.464  11.320   2.285
   59    HG   SER   9           HG       SER   9   8.435   9.347   3.461
   60    H    ILE  10           H        ILE  10   8.781   9.815  -1.193
   61    HA   ILE  10           HA       ILE  10   6.938   7.696  -2.185
   62    HB   ILE  10           HB       ILE  10   9.236   9.024  -3.653
   63   HG12  ILE  10          2HG1      ILE  10   6.230   9.531  -3.794
   64   HG13  ILE  10          3HG1      ILE  10   7.427  10.649  -3.139
   65   HG21  ILE  10          1HG2      ILE  10   8.641   6.723  -4.460
   66   HG22  ILE  10          2HG2      ILE  10   6.950   7.249  -4.649
   67   HG23  ILE  10          3HG2      ILE  10   8.242   7.955  -5.642
   68   HD11  ILE  10          3HD1      ILE  10   6.838  11.439  -5.291
   69   HD12  ILE  10          1HD1      ILE  10   8.487  10.792  -5.402
   70   HD13  ILE  10          2HD1      ILE  10   7.102   9.862  -6.040
   71    H    CYS  11           H        CYS  11   7.447   5.627  -2.143
   72    HA   CYS  11           HA       CYS  11   9.810   4.838  -0.579
   73    HB2  CYS  11           2HB      CYS  11   8.408   2.745  -0.250
   74    HB3  CYS  11           3HB      CYS  11   7.803   4.233   0.461
   75    H    SER  12           H        SER  12  10.937   2.935  -0.920
   76    HA   SER  12           HA       SER  12  11.349   2.030  -3.718
   77    HB2  SER  12           2HB      SER  12  13.321   2.441  -2.353
   78    HB3  SER  12           3HB      SER  12  12.736   1.323  -1.105
   79    HG   SER  12           HG       SER  12  14.304   0.461  -2.678
   80    H    LEU  13           H        LEU  13  11.139  -0.182  -4.330
   81    HA   LEU  13           HA       LEU  13   8.885  -1.646  -3.274
   82    HB2  LEU  13           2HB      LEU  13  11.115  -2.333  -5.222
   83    HB3  LEU  13           3HB      LEU  13   9.930  -3.519  -4.691
   84    HG   LEU  13           HG       LEU  13   8.079  -2.088  -5.539
   85   HD11  LEU  13          1HD1      LEU  13   8.659  -0.358  -7.273
   86   HD12  LEU  13          2HD1      LEU  13   9.051   0.138  -5.629
   87   HD13  LEU  13          3HD1      LEU  13  10.344  -0.423  -6.723
   88   HD21  LEU  13          3HD2      LEU  13   9.007  -3.953  -6.854
   89   HD22  LEU  13          1HD2      LEU  13   8.457  -2.638  -7.900
   90   HD23  LEU  13          2HD2      LEU  13  10.196  -2.852  -7.589
   91    H    TYR  14           H        TYR  14  12.294  -1.610  -2.392
   92    HA   TYR  14           HA       TYR  14  12.456  -4.038  -0.897
   93    HB2  TYR  14           2HB      TYR  14  14.402  -2.666  -1.385
   94    HB3  TYR  14           3HB      TYR  14  13.722  -1.298  -0.512
   95    HD1  TYR  14           HD1      TYR  14  15.147  -4.723  -0.109
   96    HD2  TYR  14           HD2      TYR  14  13.893  -1.104   1.884
   97    HE1  TYR  14           HE1      TYR  14  16.178  -5.531   2.010
   98    HE2  TYR  14           HE2      TYR  14  14.904  -1.924   4.007
   99    HH   TYR  14           HH       TYR  14  16.580  -5.090   4.222
  100    H    GLN  15           H        GLN  15  10.921  -0.920  -0.095
  101    HA   GLN  15           HA       GLN  15  10.508  -1.542   2.729
  102    HB2  GLN  15           2HB      GLN  15   9.129   0.503   0.943
  103    HB3  GLN  15           3HB      GLN  15   9.005   0.404   2.700
  104    HG2  GLN  15           2HG      GLN  15  11.416   0.820   2.946
  105    HG3  GLN  15           3HG      GLN  15  11.622   0.821   1.189
  106   HE21  GLN  15          1HE2      GLN  15   9.761   2.598   3.761
  107   HE22  GLN  15          2HE2      GLN  15   9.878   4.130   2.909
  108    H    LEU  16           H        LEU  16   8.638  -1.869  -0.262
  109    HA   LEU  16           HA       LEU  16   6.228  -2.836   0.963
  110    HB2  LEU  16           2HB      LEU  16   7.275  -3.419  -1.833
  111    HB3  LEU  16           3HB      LEU  16   5.609  -3.602  -1.288
  112    HG   LEU  16           HG       LEU  16   7.204  -1.071  -1.676
  113   HD11  LEU  16          1HD1      LEU  16   6.397  -2.044  -3.736
  114   HD12  LEU  16          2HD1      LEU  16   4.742  -2.147  -3.084
  115   HD13  LEU  16          3HD1      LEU  16   5.501  -0.567  -3.391
  116   HD21  LEU  16          3HD2      LEU  16   4.343  -1.364  -0.649
  117   HD22  LEU  16          1HD2      LEU  16   5.723  -0.686   0.248
  118   HD23  LEU  16          2HD2      LEU  16   5.086   0.171  -1.155
  119    H    GLU  17           H        GLU  17   9.124  -4.537  -0.332
  120    HA   GLU  17           HA       GLU  17   8.252  -7.192   0.370
  121    HB2  GLU  17           2HB      GLU  17  11.039  -5.997   0.043
  122    HB3  GLU  17           3HB      GLU  17  10.731  -7.709   0.345
  123    HG2  GLU  17           2HG      GLU  17   9.370  -7.843  -1.723
  124    HG3  GLU  17           3HG      GLU  17   9.732  -6.152  -2.073
  125    H    ASN  18           H        ASN  18   9.938  -4.694   2.306
  126    HA   ASN  18           HA       ASN  18  10.278  -6.370   4.610
  127    HB2  ASN  18           2HB      ASN  18  11.532  -4.258   4.164
  128    HB3  ASN  18           3HB      ASN  18  10.053  -3.333   4.427
  129   HD21  ASN  18          2HD2      ASN  18  12.382  -5.534   6.033
  130   HD22  ASN  18          1HD2      ASN  18  12.014  -4.949   7.649
  131    H    TYR  19           H        TYR  19   7.463  -4.471   3.483
  132    HA   TYR  19           HA       TYR  19   5.929  -4.877   5.920
  133    HB2  TYR  19           2HB      TYR  19   5.020  -4.322   3.086
  134    HB3  TYR  19           3HB      TYR  19   3.987  -4.227   4.485
  135    HD1  TYR  19           HD1      TYR  19   6.212  -2.763   6.295
  136    HD2  TYR  19           HD2      TYR  19   4.621  -2.082   2.341
  137    HE1  TYR  19           HE1      TYR  19   6.882  -0.390   6.427
  138    HE2  TYR  19           HE2      TYR  19   5.373   0.263   2.437
  139    HH   TYR  19           HH       TYR  19   6.996   1.629   5.340
  140    H    CYS  20           H        CYS  20   6.221  -6.673   2.854
  141    HA   CYS  20           HA       CYS  20   4.338  -8.757   3.458
  142    HB2  CYS  20           2HB      CYS  20   5.289  -8.218   1.225
  143    HB3  CYS  20           3HB      CYS  20   6.865  -8.768   1.774
  144    H    ASN  21           H        ASN  21   7.732  -8.284   4.336
  145    HA   ASN  21           HA       ASN  21   7.762 -10.783   5.982
  146    HB2  ASN  21           2HB      ASN  21  10.031  -9.063   4.879
  147    HB3  ASN  21           3HB      ASN  21  10.239 -10.458   5.934
  148   HD21  ASN  21          2HD2      ASN  21   9.332  -9.440   2.676
  149   HD22  ASN  21          1HD2      ASN  21   9.464 -11.060   1.977
  150    H1   PHE   1           H        PHE   1   7.839   0.854  -9.863
  151    HA   PHE   1           HA       PHE   1   5.049   0.752 -10.469
  152    HB2  PHE   1           2HB      PHE   1   5.751   1.572  -7.622
  153    HB3  PHE   1           3HB      PHE   1   4.184   1.808  -8.380
  154    HD1  PHE   1           HD2      PHE   1   2.811  -0.204  -9.123
  155    HD2  PHE   1           HD1      PHE   1   6.324  -0.552  -6.650
  156    HE1  PHE   1           HE2      PHE   1   2.138  -2.507  -8.487
  157    HE2  PHE   1           HE1      PHE   1   5.663  -2.856  -6.036
  158    HZ   PHE   1           HZ       PHE   1   3.571  -3.847  -6.954
  159    H    VAL   2           H        VAL   2   4.035   2.950 -10.451
  160    HA   VAL   2           HA       VAL   2   5.721   4.895 -11.743
  161    HB   VAL   2           HB       VAL   2   2.900   5.185 -10.629
  162   HG11  VAL   2          1HG1      VAL   2   4.414   6.896 -12.660
  163   HG12  VAL   2          2HG1      VAL   2   2.687   7.044 -12.265
  164   HG13  VAL   2          3HG1      VAL   2   3.893   7.399 -11.033
  165   HG21  VAL   2          3HG2      VAL   2   2.197   4.840 -12.988
  166   HG22  VAL   2          1HG2      VAL   2   3.884   4.515 -13.442
  167   HG23  VAL   2          2HG2      VAL   2   3.015   3.416 -12.349
  168    H    ASN   3           H        ASN   3   6.690   6.718 -10.993
  169    HA   ASN   3           HA       ASN   3   7.240   6.890  -8.147
  170    HB2  ASN   3           2HB      ASN   3   8.890   7.045 -10.088
  171    HB3  ASN   3           3HB      ASN   3   8.286   8.675 -10.377
  172   HD21  ASN   3          2HD2      ASN   3   8.433  10.173  -8.398
  173   HD22  ASN   3          1HD2      ASN   3   9.890   9.987  -7.415
  174    H    GLN   4           H        GLN   4   4.693   7.337  -8.129
  175    HA   GLN   4           HA       GLN   4   4.285  10.213  -7.492
  176    HB2  GLN   4           2HB      GLN   4   2.489   8.568  -9.322
  177    HB3  GLN   4           3HB      GLN   4   2.060  10.138  -8.629
  178    HG2  GLN   4           2HG      GLN   4   3.976  11.199  -9.775
  179    HG3  GLN   4           3HG      GLN   4   4.384   9.662 -10.535
  180   HE21  GLN   4          2HE2      GLN   4   4.060  11.517 -12.354
  181   HE22  GLN   4          1HE2      GLN   4   2.472  11.434 -13.105
  182    H    HIS   5           H        HIS   5   4.842   8.336  -5.661
  183    HA   HIS   5           HA       HIS   5   4.277   7.536  -3.627
  184    HB2  HIS   5           2HB      HIS   5   1.710   9.127  -3.912
  185    HB3  HIS   5           3HB      HIS   5   2.389   8.501  -2.429
  186    HD2  HIS   5           HD2      HIS   5   4.187   9.924  -1.197
  187    HE1  HIS   5           HE1      HIS   5   4.817  12.943  -4.142
  188    HE2  HIS   5           HE2      HIS   5   5.315  12.252  -1.741
  189    H    LEU   6           H        LEU   6   2.891   6.169  -2.290
  190    HA   LEU   6           HA       LEU   6   0.888   4.500  -3.709
  191    HB2  LEU   6           2HB      LEU   6   3.384   3.427  -2.333
  192    HB3  LEU   6           3HB      LEU   6   1.966   2.449  -2.673
  193    HG   LEU   6           HG       LEU   6   3.664   3.805  -4.812
  194   HD11  LEU   6          1HD1      LEU   6   3.535   0.911  -3.879
  195   HD12  LEU   6          2HD1      LEU   6   4.457   1.513  -5.275
  196   HD13  LEU   6          3HD1      LEU   6   4.890   2.034  -3.639
  197   HD21  LEU   6          3HD2      LEU   6   2.440   2.248  -6.343
  198   HD22  LEU   6          1HD2      LEU   6   1.394   1.764  -4.992
  199   HD23  LEU   6          2HD2      LEU   6   1.361   3.431  -5.605
  200    H    CYS   7           H        CYS   7  -0.786   5.225  -2.468
  201    HA   CYS   7           HA       CYS   7  -0.706   4.611   0.433
  202    HB2  CYS   7           2HB      CYS   7   0.111   6.985  -0.120
  203    HB3  CYS   7           3HB      CYS   7  -1.549   7.331  -0.597
  204    H    GLY   8           H        GLY   8  -2.814   4.470   1.421
  205    HA2  GLY   8           HA2      GLY   8  -4.992   3.669   1.453
  206    HA3  GLY   8           HA3      GLY   8  -5.295   4.610  -0.010
  207    H    SER   9           H        SER   9  -6.436   3.088  -1.194
  208    HA   SER   9           HA       SER   9  -6.019   0.330  -1.362
  209    HB2  SER   9           2HB      SER   9  -7.022   2.151  -3.585
  210    HB3  SER   9           3HB      SER   9  -7.351   0.418  -3.410
  211    HG   SER   9           HG       SER   9  -8.514   0.863  -1.515
  212    H    HIS  10           H        HIS  10  -4.323   2.866  -3.236
  213    HA   HIS  10           HA       HIS  10  -3.124   1.140  -5.176
  214    HB2  HIS  10           2HB      HIS  10  -2.134   3.786  -4.035
  215    HB3  HIS  10           3HB      HIS  10  -1.536   3.010  -5.498
  216    HD2  HIS  10           HD2      HIS  10  -3.000   3.190  -7.713
  217    HE1  HIS  10           HE1      HIS  10  -6.112   5.670  -6.172
  218    HE2  HIS  10           HE2      HIS  10  -5.115   4.657  -8.287
  219    H    LEU  11           H        LEU  11  -2.154   1.882  -1.837
  220    HA   LEU  11           HA       LEU  11   0.459   0.607  -2.061
  221    HB2  LEU  11           2HB      LEU  11  -0.092   2.361  -0.386
  222    HB3  LEU  11           3HB      LEU  11  -1.245   1.275   0.374
  223    HG   LEU  11           HG       LEU  11   0.565  -0.261   1.017
  224   HD11  LEU  11          1HD1      LEU  11   2.437   1.789  -0.249
  225   HD12  LEU  11          2HD1      LEU  11   2.938   0.445   0.799
  226   HD13  LEU  11          3HD1      LEU  11   2.212   0.103  -0.771
  227   HD21  LEU  11          3HD2      LEU  11   1.637   1.210   2.674
  228   HD22  LEU  11          1HD2      LEU  11   1.109   2.639   1.747
  229   HD23  LEU  11          2HD2      LEU  11  -0.090   1.570   2.512
  230    H    VAL  12           H        VAL  12  -2.808  -0.415  -1.053
  231    HA   VAL  12           HA       VAL  12  -2.074  -3.071  -0.204
  232    HB   VAL  12           HB       VAL  12  -4.758  -2.173  -1.319
  233   HG11  VAL  12          1HG1      VAL  12  -5.647  -4.016   0.079
  234   HG12  VAL  12          2HG1      VAL  12  -4.566  -4.601  -1.185
  235   HG13  VAL  12          3HG1      VAL  12  -3.985  -4.494   0.492
  236   HG21  VAL  12          3HG2      VAL  12  -3.736  -2.168   1.560
  237   HG22  VAL  12          1HG2      VAL  12  -4.142  -0.731   0.597
  238   HG23  VAL  12          2HG2      VAL  12  -5.414  -1.859   1.062
  239    H    GLU  13           H        GLU  13  -3.269  -1.815  -3.373
  240    HA   GLU  13           HA       GLU  13  -3.062  -4.321  -4.756
  241    HB2  GLU  13           2HB      GLU  13  -2.994  -1.436  -5.719
  242    HB3  GLU  13           3HB      GLU  13  -2.958  -2.829  -6.809
  243    HG2  GLU  13           2HG      GLU  13  -5.099  -3.645  -5.890
  244    HG3  GLU  13           3HG      GLU  13  -5.179  -2.269  -4.795
  245    H    ALA  14           H        ALA  14  -0.596  -1.706  -4.320
  246    HA   ALA  14           HA       ALA  14   1.423  -2.994  -5.872
  247    HB1  ALA  14           3HB      ALA  14   2.969  -1.528  -4.637
  248    HB2  ALA  14           1HB      ALA  14   1.536  -0.644  -5.180
  249    HB3  ALA  14           2HB      ALA  14   1.688  -1.129  -3.473
  250    H    LEU  15           H        LEU  15   0.612  -3.322  -2.372
  251    HA   LEU  15           HA       LEU  15   2.680  -5.273  -1.880
  252    HB2  LEU  15           2HB      LEU  15   0.188  -4.420  -0.355
  253    HB3  LEU  15           3HB      LEU  15   1.221  -5.715   0.209
  254    HG   LEU  15           HG       LEU  15   2.378  -2.982  -0.443
  255   HD11  LEU  15          1HD1      LEU  15   1.327  -3.953   2.246
  256   HD12  LEU  15          2HD1      LEU  15   2.229  -2.449   1.951
  257   HD13  LEU  15          3HD1      LEU  15   0.619  -2.671   1.251
  258   HD21  LEU  15          3HD2      LEU  15   3.308  -5.216   1.418
  259   HD22  LEU  15          1HD2      LEU  15   3.940  -4.950  -0.213
  260   HD23  LEU  15          2HD2      LEU  15   4.168  -3.721   1.016
  261    H    TYR  16           H        TYR  16  -0.678  -5.659  -3.006
  262    HA   TYR  16           HA       TYR  16  -0.790  -8.501  -2.780
  263    HB2  TYR  16           2HB      TYR  16  -2.077  -6.549  -4.716
  264    HB3  TYR  16           3HB      TYR  16  -2.352  -8.275  -4.785
  265    HD1  TYR  16           HD2      TYR  16  -2.040  -7.440  -1.314
  266    HD2  TYR  16           HD1      TYR  16  -4.733  -7.170  -4.674
  267    HE1  TYR  16           HE2      TYR  16  -3.937  -7.497   0.222
  268    HE2  TYR  16           HE1      TYR  16  -6.667  -7.166  -3.102
  269    HH   TYR  16           HH       TYR  16  -6.236  -7.437   0.449
  270    H    LEU  17           H        LEU  17   0.580  -6.413  -5.358
  271    HA   LEU  17           HA       LEU  17   1.471  -8.607  -7.029
  272    HB2  LEU  17           2HB      LEU  17   1.770  -5.611  -6.949
  273    HB3  LEU  17           3HB      LEU  17   2.976  -6.527  -7.842
  274    HG   LEU  17           HG       LEU  17   1.287  -7.564  -9.236
  275   HD11  LEU  17          1HD1      LEU  17  -0.680  -7.615  -7.755
  276   HD12  LEU  17          2HD1      LEU  17  -0.773  -5.840  -7.811
  277   HD13  LEU  17          3HD1      LEU  17  -1.048  -6.800  -9.277
  278   HD21  LEU  17          3HD2      LEU  17   0.946  -4.541  -9.099
  279   HD22  LEU  17          1HD2      LEU  17   2.294  -5.392  -9.888
  280   HD23  LEU  17          2HD2      LEU  17   0.647  -5.573 -10.516
  281    H    VAL  18           H        VAL  18   3.210  -6.509  -4.677
  282    HA   VAL  18           HA       VAL  18   5.772  -7.740  -5.141
  283    HB   VAL  18           HB       VAL  18   4.718  -5.951  -2.924
  284   HG11  VAL  18          1HG1      VAL  18   7.120  -5.461  -2.401
  285   HG12  VAL  18          2HG1      VAL  18   6.620  -7.081  -1.910
  286   HG13  VAL  18          3HG1      VAL  18   7.589  -6.856  -3.388
  287   HG21  VAL  18          3HG2      VAL  18   6.030  -4.260  -4.103
  288   HG22  VAL  18          1HG2      VAL  18   6.619  -5.470  -5.265
  289   HG23  VAL  18          2HG2      VAL  18   4.904  -5.020  -5.232
  290    H    CYS  19           H        CYS  19   3.320  -8.316  -2.629
  291    HA   CYS  19           HA       CYS  19   4.964 -10.388  -1.364
  292    HB2  CYS  19           2HB      CYS  19   3.380  -8.669  -0.270
  293    HB3  CYS  19           3HB      CYS  19   2.081  -9.749  -0.749
  294    H    GLY  20           H        GLY  20   2.850 -10.349  -4.010
  295    HA2  GLY  20           HA2      GLY  20   2.926 -12.082  -5.575
  296    HA3  GLY  20           HA3      GLY  20   3.164 -13.276  -4.311
  297    H    GLU  21           H        GLU  21   1.130 -12.549  -6.627
  298    HA   GLU  21           HA       GLU  21  -1.455 -12.253  -5.586
  299    HB2  GLU  21           2HB      GLU  21  -0.652 -11.948  -7.938
  300    HB3  GLU  21           3HB      GLU  21  -0.602 -13.704  -8.124
  301    HG2  GLU  21           2HG      GLU  21  -3.057 -13.805  -7.759
  302    HG3  GLU  21           3HG      GLU  21  -3.093 -12.058  -7.495
  303    H    ARG  22           H        ARG  22   0.466 -15.170  -5.678
  304    HA   ARG  22           HA       ARG  22  -1.617 -17.145  -5.402
  305    HB2  ARG  22           2HB      ARG  22   0.783 -17.462  -6.114
  306    HB3  ARG  22           3HB      ARG  22   1.230 -17.363  -4.401
  307    HG2  ARG  22           2HG      ARG  22  -0.223 -19.290  -3.891
  308    HG3  ARG  22           3HG      ARG  22  -0.813 -19.339  -5.560
  309    HD2  ARG  22           2HD      ARG  22   2.079 -19.698  -4.728
  310    HD3  ARG  22           3HD      ARG  22   0.933 -21.031  -4.987
  311    HE   ARG  22           HE       ARG  22   0.864 -19.518  -7.340
  312   HH11  ARG  22          1HH1      ARG  22   3.305 -21.407  -5.684
  313   HH12  ARG  22          2HH1      ARG  22   4.160 -21.767  -7.159
  314   HH21  ARG  22          1HH2      ARG  22   2.005 -20.007  -9.184
  315   HH22  ARG  22          2HH2      ARG  22   3.434 -20.994  -9.086
  316    H    GLY  23           H        GLY  23  -0.120 -15.009  -3.046
  317    HA2  GLY  23           HA2      GLY  23  -1.671 -16.321  -0.817
  318    HA3  GLY  23           HA3      GLY  23  -0.069 -15.614  -0.627
  319    H    DHI  24           H        DHI  24  -1.005 -13.274  -2.438
  320    HA   DHI  24           HA       DHI  24  -2.882 -11.804  -0.682
  321    HB2  DHI  24           2HB      DHI  24  -2.489  -9.977  -2.301
  322    HB3  DHI  24           3HB      DHI  24  -1.353 -10.990  -3.183
  323    HD2  DHI  24           HD2      DHI  24  -4.357 -13.019  -2.135
  324    HE1  DHI  24           HE1      DHI  24  -5.318 -11.573  -6.028
  325    HE2  DHI  24           HE2      DHI  24  -5.990 -13.201  -4.189
  326    H    PHE  25           H        PHE  25  -2.230  -9.626   0.116
  327    HA   PHE  25           HA       PHE  25   0.569  -9.274   0.935
  328    HB2  PHE  25           2HB      PHE  25  -0.735  -7.298   0.583
  329    HB3  PHE  25           3HB      PHE  25  -2.009  -7.870   1.652
  330    HD1  PHE  25           HD1      PHE  25   1.757  -7.255   1.881
  331    HD2  PHE  25           HD2      PHE  25  -2.139  -6.794   3.702
  332    HE1  PHE  25           HE1      PHE  25   2.764  -6.032   3.738
  333    HE2  PHE  25           HE2      PHE  25  -1.097  -5.553   5.576
  334    HZ   PHE  25           HZ       PHE  25   1.361  -5.170   5.605
  335    H    TYR  26           H        TYR  26   1.394  -9.565   3.011
  336    HA   TYR  26           HA       TYR  26  -0.110 -11.210   4.973
  337    HB2  TYR  26           2HB      TYR  26   0.955 -12.783   3.397
  338    HB3  TYR  26           3HB      TYR  26   2.510 -11.995   3.638
  339    HD1  TYR  26           HD1      TYR  26  -0.214 -13.808   5.477
  340    HD2  TYR  26           HD2      TYR  26   3.967 -12.721   5.381
  341    HE1  TYR  26           HE1      TYR  26   0.225 -15.302   7.419
  342    HE2  TYR  26           HE2      TYR  26   4.406 -14.248   7.291
  343    HH   TYR  26           HH       TYR  26   3.515 -15.764   8.772
  344    H    THR  27           H        THR  27   0.738 -11.158   7.057
  345    HA   THR  27           HA       THR  27   3.212  -9.619   7.581
  346    HB   THR  27           HB       THR  27   2.169  -8.648   9.645
  347    HG1  THR  27           HG1      THR  27   0.263  -9.981   9.583
  348   HG21  THR  27          1HG2      THR  27   0.951  -7.693   7.024
  349   HG22  THR  27          2HG2      THR  27   1.134  -6.753   8.518
  350   HG23  THR  27          3HG2      THR  27   2.572  -7.279   7.619
  351    HA   PRO  28           HA       PRO  28   3.644 -13.437   9.889
  352    HB2  PRO  28           2HB      PRO  28   6.195 -13.164  10.842
  353    HB3  PRO  28           3HB      PRO  28   5.813 -13.485   9.126
  354    HG2  PRO  28           2HG      PRO  28   6.426 -10.819  10.431
  355    HG3  PRO  28           3HG      PRO  28   7.098 -11.504   8.912
  356    HD2  PRO  28           2HD      PRO  28   5.028  -9.721   8.922
  357    HD3  PRO  28           3HD      PRO  28   5.135 -11.041   7.716
  358    H    LYS  29           H        LYS  29   3.786 -10.301  11.400
  359    HA   LYS  29           HA       LYS  29   2.742 -11.443  13.921
  360    HB2  LYS  29           2HB      LYS  29   5.214 -11.230  14.194
  361    HB3  LYS  29           3HB      LYS  29   5.093  -9.497  13.867
  362    HG2  LYS  29           2HG      LYS  29   3.644  -9.217  15.862
  363    HG3  LYS  29           3HG      LYS  29   3.713 -10.955  16.177
  364    HD2  LYS  29           2HD      LYS  29   6.111  -9.064  16.179
  365    HD3  LYS  29           3HD      LYS  29   5.225  -9.593  17.617
  366    HE2  LYS  29           2HE      LYS  29   5.797 -11.965  17.093
  367    HE3  LYS  29           3HE      LYS  29   6.737 -11.422  15.697
  368    HZ1  LYS  29           HZ1      LYS  29   8.173 -10.181  17.228
  369    HZ2  LYS  29           HZ2      LYS  29   7.308 -10.688  18.519
  370    HZ3  LYS  29           HZ3      LYS  29   8.156 -11.762  17.633
  371    H    THR  30           H        THR  30   1.168 -10.245  14.802
  372    HA   THR  30           HA       THR  30   0.153  -7.875  13.394
  373    HB   THR  30           HB       THR  30  -1.732  -8.079  15.053
  374    HG1  THR  30           HG1      THR  30  -0.490  -9.277  16.581
  375   HG21  THR  30          1HG2      THR  30  -1.118 -10.539  13.352
  376   HG22  THR  30          2HG2      THR  30  -2.714 -10.042  13.955
  377   HG23  THR  30          3HG2      THR  30  -1.864  -9.032  12.776
  Start of MODEL    4
    1    H1   GLY   1           1H       GLY   1  -3.181  -8.504   9.142
    2    H2   GLY   1           2H       GLY   1  -4.261  -7.808  10.167
    3    H3   GLY   1           3H       GLY   1  -4.739  -8.311   8.680
    4    HA2  GLY   1           HA2      GLY   1  -3.309  -6.678   7.618
    5    HA3  GLY   1           HA3      GLY   1  -4.538  -5.929   8.658
    6    H    ILE   2           H        ILE   2  -1.777  -5.046   7.803
    7    HA   ILE   2           HA       ILE   2  -0.199  -5.010  10.262
    8    HB   ILE   2           HB       ILE   2   1.307  -3.495   9.002
    9   HG12  ILE   2          2HG1      ILE   2  -0.518  -2.696   7.343
   10   HG13  ILE   2          3HG1      ILE   2   1.141  -2.896   6.829
   11   HG21  ILE   2          1HG2      ILE   2   1.712  -5.850   9.243
   12   HG22  ILE   2          2HG2      ILE   2   0.699  -6.221   7.838
   13   HG23  ILE   2          3HG2      ILE   2   2.224  -5.325   7.633
   14   HD11  ILE   2          3HD1      ILE   2  -0.410  -3.671   5.115
   15   HD12  ILE   2          1HD1      ILE   2   0.618  -4.993   5.676
   16   HD13  ILE   2          2HD1      ILE   2  -1.077  -4.887   6.209
   17    H    VAL   3           H        VAL   3   0.512  -3.172  11.373
   18    HA   VAL   3           HA       VAL   3  -1.682  -1.284  11.874
   19    HB   VAL   3           HB       VAL   3  -0.513  -0.759  13.964
   20   HG11  VAL   3          1HG1      VAL   3  -2.118  -2.635  13.859
   21   HG12  VAL   3          2HG1      VAL   3  -0.783  -3.759  13.521
   22   HG13  VAL   3          3HG1      VAL   3  -0.849  -2.892  15.068
   23   HG21  VAL   3          3HG2      VAL   3   1.551  -2.854  13.140
   24   HG22  VAL   3          1HG2      VAL   3   1.842  -1.103  13.224
   25   HG23  VAL   3          2HG2      VAL   3   1.449  -2.007  14.692
   26    H    GLU   4           H        GLU   4   0.845  -1.078   9.826
   27    HA   GLU   4           HA       GLU   4   0.937   1.877   9.940
   28    HB2  GLU   4           2HB      GLU   4   3.337   1.964   9.746
   29    HB3  GLU   4           3HB      GLU   4   2.888   1.117  11.224
   30    HG2  GLU   4           2HG      GLU   4   3.312  -1.076  10.043
   31    HG3  GLU   4           3HG      GLU   4   3.869  -0.167   8.635
   32    H    GLN   5           H        GLN   5   1.811   2.845   7.957
   33    HA   GLN   5           HA       GLN   5   1.608   1.188   5.498
   34    HB2  GLN   5           2HB      GLN   5   0.036   3.735   6.066
   35    HB3  GLN   5           3HB      GLN   5   0.161   2.984   4.482
   36    HG2  GLN   5           2HG      GLN   5  -1.089   1.606   6.905
   37    HG3  GLN   5           3HG      GLN   5  -1.978   2.546   5.721
   38   HE21  GLN   5          2HE2      GLN   5   0.047  -0.419   6.056
   39   HE22  GLN   5          1HE2      GLN   5  -0.660  -1.193   4.635
   40    H    CYS   6           H        CYS   6   2.463   2.233   3.611
   41    HA   CYS   6           HA       CYS   6   4.956   3.579   4.217
   42    HB2  CYS   6           2HB      CYS   6   4.104   1.756   2.319
   43    HB3  CYS   6           3HB      CYS   6   4.270   3.217   1.361
   44    H    CYS   7           H        CYS   7   5.773   5.382   3.020
   45    HA   CYS   7           HA       CYS   7   5.931   7.492   2.556
   46    HB2  CYS   7           2HB      CYS   7   4.869   8.236   0.752
   47    HB3  CYS   7           3HB      CYS   7   4.096   6.666   0.757
   48    H    THR   8           H        THR   8   4.478   9.959   4.717
   49    HA   THR   8           HA       THR   8   5.898   9.720   2.143
   50    HB   THR   8           HB       THR   8   6.581  12.090   2.731
   51    HG1  THR   8           HG1      THR   8   5.365  13.081   4.346
   52   HG21  THR   8          1HG2      THR   8   3.587  11.513   2.613
   53   HG22  THR   8          2HG2      THR   8   4.390  13.038   2.178
   54   HG23  THR   8          3HG2      THR   8   4.685  11.580   1.216
   55    H    SER   9           H        SER   9   9.274   9.667   3.477
   56    HA   SER   9           HA       SER   9   7.820  10.972   1.288
   57    HB2  SER   9           2HB      SER   9  10.707  10.067   1.568
   58    HB3  SER   9           3HB      SER   9  10.057  11.137   0.309
   59    HG   SER   9           HG       SER   9  11.025  12.304   2.039
   60    H    ILE  10           H        ILE  10   9.198   9.937  -0.924
   61    HA   ILE  10           HA       ILE  10   7.461   7.944  -1.862
   62    HB   ILE  10           HB       ILE  10  10.223   8.813  -2.796
   63   HG12  ILE  10          2HG1      ILE  10   7.437   9.469  -3.864
   64   HG13  ILE  10          3HG1      ILE  10   8.339  10.507  -2.763
   65   HG21  ILE  10          1HG2      ILE  10   8.198   7.085  -4.287
   66   HG22  ILE  10          2HG2      ILE  10   9.675   7.787  -4.989
   67   HG23  ILE  10          3HG2      ILE  10   9.808   6.573  -3.738
   68   HD11  ILE  10          3HD1      ILE  10   9.135   9.846  -5.613
   69   HD12  ILE  10          1HD1      ILE  10   8.575  11.388  -4.959
   70   HD13  ILE  10          2HD1      ILE  10  10.148  10.740  -4.453
   71    H    CYS  11           H        CYS  11   7.343   5.806  -1.735
   72    HA   CYS  11           HA       CYS  11   9.478   4.248  -0.388
   73    HB2  CYS  11           2HB      CYS  11   6.555   3.664  -0.948
   74    HB3  CYS  11           3HB      CYS  11   7.697   2.453  -0.378
   75    H    SER  12           H        SER  12   9.984   2.112  -1.180
   76    HA   SER  12           HA       SER  12  10.064   1.802  -4.149
   77    HB2  SER  12           2HB      SER  12  12.141   2.880  -3.366
   78    HB3  SER  12           3HB      SER  12  12.401   1.560  -2.213
   79    HG   SER  12           HG       SER  12  13.567   1.345  -4.225
   80    H    LEU  13           H        LEU  13  11.046  -0.458  -4.625
   81    HA   LEU  13           HA       LEU  13   9.232  -2.478  -3.786
   82    HB2  LEU  13           2HB      LEU  13  12.018  -2.620  -5.007
   83    HB3  LEU  13           3HB      LEU  13  10.981  -4.028  -4.812
   84    HG   LEU  13           HG       LEU  13  10.210  -1.587  -6.473
   85   HD11  LEU  13          1HD1      LEU  13  11.290  -4.294  -7.357
   86   HD12  LEU  13          2HD1      LEU  13  10.731  -2.985  -8.422
   87   HD13  LEU  13          3HD1      LEU  13  12.171  -2.751  -7.421
   88   HD21  LEU  13          3HD2      LEU  13   8.549  -3.189  -7.454
   89   HD22  LEU  13          1HD2      LEU  13   8.992  -4.373  -6.209
   90   HD23  LEU  13          2HD2      LEU  13   8.238  -2.826  -5.754
   91    H    TYR  14           H        TYR  14  12.488  -1.725  -2.493
   92    HA   TYR  14           HA       TYR  14  12.689  -3.927  -0.684
   93    HB2  TYR  14           2HB      TYR  14  14.607  -2.582  -1.234
   94    HB3  TYR  14           3HB      TYR  14  13.824  -1.109  -0.674
   95    HD1  TYR  14           HD1      TYR  14  15.273  -4.363   0.478
   96    HD2  TYR  14           HD2      TYR  14  13.879  -0.440   1.619
   97    HE1  TYR  14           HE1      TYR  14  16.189  -4.700   2.770
   98    HE2  TYR  14           HE2      TYR  14  14.769  -0.784   3.907
   99    HH   TYR  14           HH       TYR  14  16.465  -3.806   4.864
  100    H    GLN  15           H        GLN  15  11.058  -0.769  -0.296
  101    HA   GLN  15           HA       GLN  15  10.447  -1.144   2.541
  102    HB2  GLN  15           2HB      GLN  15   9.181   0.690   0.463
  103    HB3  GLN  15           3HB      GLN  15   8.876   0.746   2.190
  104    HG2  GLN  15           2HG      GLN  15  11.637   1.156   0.963
  105    HG3  GLN  15           3HG      GLN  15  10.510   2.465   1.325
  106   HE21  GLN  15          2HE2      GLN  15   9.820   2.731   3.669
  107   HE22  GLN  15          1HE2      GLN  15  10.982   2.245   4.895
  108    H    LEU  16           H        LEU  16   8.774  -1.732  -0.543
  109    HA   LEU  16           HA       LEU  16   6.317  -2.699   0.607
  110    HB2  LEU  16           2HB      LEU  16   7.594  -3.370  -2.055
  111    HB3  LEU  16           3HB      LEU  16   5.940  -3.767  -1.581
  112    HG   LEU  16           HG       LEU  16   7.135  -1.026  -2.007
  113   HD11  LEU  16          1HD1      LEU  16   5.559  -0.875  -3.868
  114   HD12  LEU  16          2HD1      LEU  16   6.662  -2.229  -4.058
  115   HD13  LEU  16          3HD1      LEU  16   4.984  -2.523  -3.531
  116   HD21  LEU  16          3HD2      LEU  16   4.283  -1.733  -1.193
  117   HD22  LEU  16          1HD2      LEU  16   5.458  -0.825  -0.212
  118   HD23  LEU  16          2HD2      LEU  16   4.836  -0.125  -1.704
  119    H    GLU  17           H        GLU  17   9.289  -4.496  -0.382
  120    HA   GLU  17           HA       GLU  17   8.356  -7.079   0.410
  121    HB2  GLU  17           2HB      GLU  17  11.142  -5.886   0.165
  122    HB3  GLU  17           3HB      GLU  17  10.861  -7.565   0.632
  123    HG2  GLU  17           2HG      GLU  17   9.596  -7.967  -1.452
  124    HG3  GLU  17           3HG      GLU  17   9.907  -6.316  -1.975
  125    H    ASN  18           H        ASN  18   9.517  -4.433   2.447
  126    HA   ASN  18           HA       ASN  18   9.982  -6.088   4.785
  127    HB2  ASN  18           2HB      ASN  18   9.803  -3.131   4.248
  128    HB3  ASN  18           3HB      ASN  18   9.589  -3.694   5.895
  129   HD21  ASN  18          1HD2      ASN  18  11.920  -3.765   3.154
  130   HD22  ASN  18          2HD2      ASN  18  13.298  -4.020   4.213
  131    H    TYR  19           H        TYR  19   7.024  -5.293   3.250
  132    HA   TYR  19           HA       TYR  19   5.415  -5.728   5.695
  133    HB2  TYR  19           2HB      TYR  19   4.660  -5.280   2.805
  134    HB3  TYR  19           3HB      TYR  19   3.497  -5.586   4.070
  135    HD1  TYR  19           HD2      TYR  19   3.142  -3.979   5.934
  136    HD2  TYR  19           HD1      TYR  19   5.745  -3.095   2.628
  137    HE1  TYR  19           HE2      TYR  19   3.143  -1.564   6.577
  138    HE2  TYR  19           HE1      TYR  19   5.758  -0.689   3.264
  139    HH   TYR  19           HH       TYR  19   5.071   0.864   4.799
  140    H    CYS  20           H        CYS  20   7.155  -7.809   3.699
  141    HA   CYS  20           HA       CYS  20   5.585 -10.069   4.769
  142    HB2  CYS  20           2HB      CYS  20   5.972 -11.321   2.665
  143    HB3  CYS  20           3HB      CYS  20   4.713 -10.103   2.654
  144    H    ASN  21           H        ASN  21   6.939 -10.557   6.263
  145    HA   ASN  21           HA       ASN  21   9.822 -10.868   5.971
  146    HB2  ASN  21           2HB      ASN  21   8.734 -10.218   8.108
  147    HB3  ASN  21           3HB      ASN  21   7.889 -11.769   8.160
  148   HD21  ASN  21          2HD2      ASN  21  11.150 -10.267   8.243
  149   HD22  ASN  21          1HD2      ASN  21  11.888 -11.614   9.096
  150    H1   PHE   1           H        PHE   1   6.627   3.783  -9.409
  151    HA   PHE   1           HA       PHE   1   5.428   2.078  -8.197
  152    HB2  PHE   1           2HB      PHE   1   5.083   0.847 -10.370
  153    HB3  PHE   1           3HB      PHE   1   6.665   0.114 -10.163
  154    HD1  PHE   1           HD2      PHE   1   7.047  -1.538  -8.312
  155    HD2  PHE   1           HD1      PHE   1   3.150   0.126  -9.109
  156    HE1  PHE   1           HE2      PHE   1   5.994  -3.364  -6.999
  157    HE2  PHE   1           HE1      PHE   1   2.101  -1.703  -7.802
  158    HZ   PHE   1           HZ       PHE   1   3.525  -3.455  -6.743
  159    H    VAL   2           H        VAL   2   8.701   1.517  -9.447
  160    HA   VAL   2           HA       VAL   2   9.815   0.981  -6.748
  161    HB   VAL   2           HB       VAL   2  10.663  -0.181  -8.775
  162   HG11  VAL   2          1HG1      VAL   2  11.892   2.500  -9.542
  163   HG12  VAL   2          2HG1      VAL   2  12.171   0.936 -10.327
  164   HG13  VAL   2          3HG1      VAL   2  10.572   1.683 -10.410
  165   HG21  VAL   2          3HG2      VAL   2  12.809   1.478  -7.413
  166   HG22  VAL   2          1HG2      VAL   2  12.051   0.025  -6.734
  167   HG23  VAL   2          2HG2      VAL   2  13.001  -0.087  -8.224
  168    H    ASN   3           H        ASN   3   8.959   3.643  -8.682
  169    HA   ASN   3           HA       ASN   3  10.114   5.573  -6.787
  170    HB2  ASN   3           2HB      ASN   3  11.739   5.304  -8.704
  171    HB3  ASN   3           3HB      ASN   3  10.461   5.787  -9.821
  172   HD21  ASN   3          1HD2      ASN   3  12.307   6.919  -6.939
  173   HD22  ASN   3          2HD2      ASN   3  12.210   8.614  -7.390
  174    H    GLN   4           H        GLN   4   9.126   7.761  -7.170
  175    HA   GLN   4           HA       GLN   4   7.343   9.073  -6.937
  176    HB2  GLN   4           2HB      GLN   4   5.904   7.454  -9.053
  177    HB3  GLN   4           3HB      GLN   4   5.450   9.035  -8.430
  178    HG2  GLN   4           2HG      GLN   4   7.602   9.985  -9.271
  179    HG3  GLN   4           3HG      GLN   4   8.004   8.413  -9.974
  180   HE21  GLN   4          2HE2      GLN   4   6.457   7.530 -11.664
  181   HE22  GLN   4          1HE2      GLN   4   5.608   8.710 -12.656
  182    H    HIS   5           H        HIS   5   5.245   9.319  -5.963
  183    HA   HIS   5           HA       HIS   5   5.062   7.661  -3.699
  184    HB2  HIS   5           2HB      HIS   5   2.953   9.590  -4.731
  185    HB3  HIS   5           3HB      HIS   5   3.151   9.032  -3.072
  186    HD2  HIS   5           HD2      HIS   5   4.940  10.309  -1.555
  187    HE1  HIS   5           HE1      HIS   5   6.451  12.991  -4.503
  188    HE2  HIS   5           HE2      HIS   5   6.423  12.436  -2.020
  189    H    LEU   6           H        LEU   6   3.834   5.999  -3.074
  190    HA   LEU   6           HA       LEU   6   1.946   4.769  -5.032
  191    HB2  LEU   6           2HB      LEU   6   4.460   3.888  -4.455
  192    HB3  LEU   6           3HB      LEU   6   3.582   3.094  -3.157
  193    HG   LEU   6           HG       LEU   6   2.056   2.080  -4.949
  194   HD11  LEU   6          1HD1      LEU   6   2.440   3.643  -6.810
  195   HD12  LEU   6          2HD1      LEU   6   4.180   3.308  -6.773
  196   HD13  LEU   6          3HD1      LEU   6   3.030   2.046  -7.274
  197   HD21  LEU   6          3HD2      LEU   6   3.890   0.815  -3.964
  198   HD22  LEU   6          1HD2      LEU   6   3.792   0.453  -5.696
  199   HD23  LEU   6          2HD2      LEU   6   5.053   1.545  -5.094
  200    H    CYS   7           H        CYS   7   1.571   6.423  -2.467
  201    HA   CYS   7           HA       CYS   7   0.028   4.549  -0.758
  202    HB2  CYS   7           2HB      CYS   7   0.303   6.355   0.937
  203    HB3  CYS   7           3HB      CYS   7   1.796   5.623   0.375
  204    H    GLY   8           H        GLY   8  -1.880   5.531   0.371
  205    HA2  GLY   8           HA2      GLY   8  -3.987   6.555   0.321
  206    HA3  GLY   8           HA3      GLY   8  -3.563   7.397  -1.169
  207    H    SER   9           H        SER   9  -4.644   4.371   0.209
  208    HA   SER   9           HA       SER   9  -5.722   2.538  -0.460
  209    HB2  SER   9           2HB      SER   9  -6.776   4.241  -2.728
  210    HB3  SER   9           3HB      SER   9  -7.442   2.696  -2.173
  211    HG   SER   9           HG       SER   9  -8.527   4.506  -1.246
  212    H    HIS  10           H        HIS  10  -3.665   3.801  -3.033
  213    HA   HIS  10           HA       HIS  10  -3.690   1.380  -4.614
  214    HB2  HIS  10           2HB      HIS  10  -3.160   3.670  -5.445
  215    HB3  HIS  10           3HB      HIS  10  -1.662   3.645  -4.513
  216    HD2  HIS  10           HD2      HIS  10  -3.256   1.084  -7.038
  217    HE1  HIS  10           HE1      HIS  10   0.774   1.776  -8.246
  218    HE2  HIS  10           HE2      HIS  10  -1.359   0.486  -8.767
  219    H    LEU  11           H        LEU  11  -1.942   2.189  -1.707
  220    HA   LEU  11           HA       LEU  11   0.395   0.695  -2.111
  221    HB2  LEU  11           2HB      LEU  11   0.094   2.322  -0.301
  222    HB3  LEU  11           3HB      LEU  11  -1.098   1.276   0.476
  223    HG   LEU  11           HG       LEU  11   0.651  -0.438   0.883
  224   HD11  LEU  11          1HD1      LEU  11   2.207  -0.012  -0.972
  225   HD12  LEU  11          2HD1      LEU  11   2.555   1.613  -0.343
  226   HD13  LEU  11          3HD1      LEU  11   3.046   0.163   0.568
  227   HD21  LEU  11          3HD2      LEU  11   0.190   1.344   2.531
  228   HD22  LEU  11          1HD2      LEU  11   1.860   0.759   2.592
  229   HD23  LEU  11          2HD2      LEU  11   1.479   2.332   1.813
  230    H    VAL  12           H        VAL  12  -2.754  -0.510  -0.763
  231    HA   VAL  12           HA       VAL  12  -1.733  -3.136  -0.223
  232    HB   VAL  12           HB       VAL  12  -4.047  -3.829  -0.067
  233   HG11  VAL  12          1HG1      VAL  12  -4.651  -2.459   1.852
  234   HG12  VAL  12          2HG1      VAL  12  -2.902  -2.744   1.834
  235   HG13  VAL  12          3HG1      VAL  12  -3.550  -1.171   1.321
  236   HG21  VAL  12          3HG2      VAL  12  -5.146  -2.478  -1.812
  237   HG22  VAL  12          1HG2      VAL  12  -5.916  -2.259  -0.242
  238   HG23  VAL  12          2HG2      VAL  12  -4.835  -1.003  -0.867
  239    H    GLU  13           H        GLU  13  -3.143  -1.689  -3.141
  240    HA   GLU  13           HA       GLU  13  -3.293  -4.159  -4.645
  241    HB2  GLU  13           2HB      GLU  13  -3.044  -1.299  -5.662
  242    HB3  GLU  13           3HB      GLU  13  -3.487  -2.716  -6.613
  243    HG2  GLU  13           2HG      GLU  13  -5.485  -3.044  -5.124
  244    HG3  GLU  13           3HG      GLU  13  -5.085  -1.534  -4.301
  245    H    ALA  14           H        ALA  14  -0.702  -1.722  -4.222
  246    HA   ALA  14           HA       ALA  14   1.180  -3.013  -5.992
  247    HB1  ALA  14           3HB      ALA  14   1.612  -1.156  -3.607
  248    HB2  ALA  14           1HB      ALA  14   2.823  -1.584  -4.825
  249    HB3  ALA  14           2HB      ALA  14   1.382  -0.661  -5.298
  250    H    LEU  15           H        LEU  15   0.569  -3.323  -2.461
  251    HA   LEU  15           HA       LEU  15   2.661  -5.247  -1.997
  252    HB2  LEU  15           2HB      LEU  15   0.106  -4.542  -0.500
  253    HB3  LEU  15           3HB      LEU  15   1.240  -5.749   0.082
  254    HG   LEU  15           HG       LEU  15   1.986  -2.831  -0.398
  255   HD11  LEU  15          1HD1      LEU  15   0.385  -3.096   1.466
  256   HD12  LEU  15          2HD1      LEU  15   1.427  -4.341   2.192
  257   HD13  LEU  15          3HD1      LEU  15   1.998  -2.663   2.057
  258   HD21  LEU  15          3HD2      LEU  15   3.938  -4.263  -0.594
  259   HD22  LEU  15          1HD2      LEU  15   3.981  -3.447   0.965
  260   HD23  LEU  15          2HD2      LEU  15   3.486  -5.153   0.868
  261    H    TYR  16           H        TYR  16  -0.719  -5.687  -3.075
  262    HA   TYR  16           HA       TYR  16  -0.698  -8.527  -2.928
  263    HB2  TYR  16           2HB      TYR  16  -2.194  -6.671  -4.779
  264    HB3  TYR  16           3HB      TYR  16  -2.514  -8.395  -4.621
  265    HD1  TYR  16           HD1      TYR  16  -1.918  -8.074  -1.350
  266    HD2  TYR  16           HD2      TYR  16  -4.616  -6.358  -4.266
  267    HE1  TYR  16           HE1      TYR  16  -3.505  -7.611   0.418
  268    HE2  TYR  16           HE2      TYR  16  -6.235  -5.863  -2.437
  269    HH   TYR  16           HH       TYR  16  -5.567  -6.714   0.983
  270    H    LEU  17           H        LEU  17   1.053  -6.482  -5.125
  271    HA   LEU  17           HA       LEU  17   1.631  -8.732  -6.988
  272    HB2  LEU  17           2HB      LEU  17   2.565  -5.838  -6.993
  273    HB3  LEU  17           3HB      LEU  17   2.925  -7.033  -8.229
  274    HG   LEU  17           HG       LEU  17   0.129  -6.014  -7.557
  275   HD11  LEU  17          1HD1      LEU  17   0.290  -4.826  -9.700
  276   HD12  LEU  17          2HD1      LEU  17   1.557  -4.293  -8.586
  277   HD13  LEU  17          3HD1      LEU  17   1.959  -5.405  -9.913
  278   HD21  LEU  17          3HD2      LEU  17  -0.517  -7.110  -9.689
  279   HD22  LEU  17          1HD2      LEU  17   1.111  -7.813  -9.815
  280   HD23  LEU  17          2HD2      LEU  17   0.025  -8.283  -8.486
  281    H    VAL  18           H        VAL  18   3.300  -6.678  -4.585
  282    HA   VAL  18           HA       VAL  18   5.874  -7.987  -5.054
  283    HB   VAL  18           HB       VAL  18   5.009  -5.872  -3.050
  284   HG11  VAL  18          1HG1      VAL  18   7.460  -5.342  -2.916
  285   HG12  VAL  18          2HG1      VAL  18   7.041  -6.885  -2.171
  286   HG13  VAL  18          3HG1      VAL  18   7.804  -6.850  -3.781
  287   HG21  VAL  18          3HG2      VAL  18   4.834  -5.126  -5.375
  288   HG22  VAL  18          1HG2      VAL  18   6.245  -4.377  -4.634
  289   HG23  VAL  18          2HG2      VAL  18   6.460  -5.749  -5.734
  290    H    CYS  19           H        CYS  19   3.425  -8.170  -2.522
  291    HA   CYS  19           HA       CYS  19   4.961 -10.316  -1.113
  292    HB2  CYS  19           2HB      CYS  19   2.972  -8.237  -0.170
  293    HB3  CYS  19           3HB      CYS  19   3.422  -9.625   0.806
  294    H    GLY  20           H        GLY  20   2.331  -9.984  -3.191
  295    HA2  GLY  20           HA2      GLY  20   0.809 -11.627  -3.898
  296    HA3  GLY  20           HA3      GLY  20   1.231 -12.643  -2.526
  297    H    GLU  21           H        GLU  21  -1.355 -12.544  -3.107
  298    HA   GLU  21           HA       GLU  21  -2.760 -10.289  -1.909
  299    HB2  GLU  21           2HB      GLU  21  -4.775 -11.401  -2.597
  300    HB3  GLU  21           3HB      GLU  21  -3.627 -11.311  -3.918
  301    HG2  GLU  21           2HG      GLU  21  -3.843 -13.843  -2.242
  302    HG3  GLU  21           3HG      GLU  21  -5.029 -13.487  -3.485
  303    H    ARG  22           H        ARG  22  -1.488 -13.102  -0.517
  304    HA   ARG  22           HA       ARG  22  -2.850 -12.556   2.035
  305    HB2  ARG  22           2HB      ARG  22  -4.271 -14.254   0.824
  306    HB3  ARG  22           3HB      ARG  22  -2.891 -15.364   0.820
  307    HG2  ARG  22           2HG      ARG  22  -2.885 -15.420   3.264
  308    HG3  ARG  22           3HG      ARG  22  -4.113 -14.138   3.324
  309    HD2  ARG  22           2HD      ARG  22  -5.761 -15.645   2.338
  310    HD3  ARG  22           3HD      ARG  22  -4.541 -16.934   2.215
  311    HE   ARG  22           HE       ARG  22  -4.346 -16.367   4.831
  312   HH11  ARG  22          1HH1      ARG  22  -7.317 -16.992   3.041
  313   HH12  ARG  22          2HH1      ARG  22  -8.164 -17.397   4.521
  314   HH21  ARG  22          1HH2      ARG  22  -5.547 -16.776   6.599
  315   HH22  ARG  22          2HH2      ARG  22  -7.206 -17.330   6.408
  316    H    GLY  23           H        GLY  23  -1.763 -13.452   3.880
  317    HA2  GLY  23           HA2      GLY  23   0.015 -14.312   5.076
  318    HA3  GLY  23           HA3      GLY  23   0.880 -14.706   3.595
  319    H    DHI  24           H        DHI  24   2.047 -13.563   5.881
  320    HA   DHI  24           HA       DHI  24   3.381 -11.239   4.744
  321    HB2  DHI  24           2HB      DHI  24   4.887 -11.474   6.679
  322    HB3  DHI  24           3HB      DHI  24   3.819 -12.692   7.374
  323    HD2  DHI  24           HD2      DHI  24   4.025 -15.162   6.451
  324    HE1  DHI  24           HE1      DHI  24   6.958 -14.486   3.428
  325    HE2  DHI  24           HE2      DHI  24   5.650 -16.269   4.693
  326    H    PHE  25           H        PHE  25   0.782 -10.477   5.125
  327    HA   PHE  25           HA       PHE  25   0.988  -8.195   6.868
  328    HB2  PHE  25           2HB      PHE  25  -1.590  -9.122   5.624
  329    HB3  PHE  25           3HB      PHE  25  -1.040  -7.484   5.912
  330    HD1  PHE  25           HD1      PHE  25   1.506  -7.205   4.545
  331    HD2  PHE  25           HD2      PHE  25  -1.956  -9.509   3.389
  332    HE1  PHE  25           HE1      PHE  25   2.190  -7.053   2.162
  333    HE2  PHE  25           HE2      PHE  25  -1.271  -9.348   1.015
  334    HZ   PHE  25           HZ       PHE  25   0.790  -8.125   0.392
  335    H    TYR  26           H        TYR  26   0.535 -11.180   7.910
  336    HA   TYR  26           HA       TYR  26  -0.636 -12.457   9.296
  337    HB2  TYR  26           2HB      TYR  26   0.088 -10.993  11.050
  338    HB3  TYR  26           3HB      TYR  26  -1.259  -9.895  10.768
  339    HD1  TYR  26           HD2      TYR  26  -0.636 -13.557  11.485
  340    HD2  TYR  26           HD1      TYR  26  -3.186 -10.129  12.095
  341    HE1  TYR  26           HE2      TYR  26  -2.051 -14.880  13.056
  342    HE2  TYR  26           HE1      TYR  26  -4.559 -11.435  13.706
  343    HH   TYR  26           HH       TYR  26  -4.853 -13.446  14.771
  344    H    THR  27           H        THR  27  -2.120 -13.483   8.209
  345    HA   THR  27           HA       THR  27  -4.830 -12.274   7.825
  346    HB   THR  27           HB       THR  27  -4.845 -13.503   5.612
  347    HG1  THR  27           HG1      THR  27  -2.921 -14.744   6.116
  348   HG21  THR  27          1HG2      THR  27  -4.507 -11.036   5.771
  349   HG22  THR  27          2HG2      THR  27  -2.751 -11.305   5.861
  350   HG23  THR  27          3HG2      THR  27  -3.652 -11.767   4.402
  351    HA   PRO  28           HA       PRO  28  -5.220 -16.374   9.869
  352    HB2  PRO  28           2HB      PRO  28  -6.736 -15.733  12.011
  353    HB3  PRO  28           3HB      PRO  28  -5.020 -15.241  11.893
  354    HG2  PRO  28           2HG      PRO  28  -7.470 -13.589  11.153
  355    HG3  PRO  28           3HG      PRO  28  -6.145 -13.132  12.267
  356    HD2  PRO  28           2HD      PRO  28  -6.135 -12.389   9.648
  357    HD3  PRO  28           3HD      PRO  28  -4.622 -12.844  10.490
  358    H    LYS  29           H        LYS  29  -7.560 -14.458   8.283
  359    HA   LYS  29           HA       LYS  29 -10.009 -15.444   9.141
  360    HB2  LYS  29           2HB      LYS  29  -9.670 -13.418   7.782
  361    HB3  LYS  29           3HB      LYS  29  -9.209 -14.401   6.395
  362    HG2  LYS  29           2HG      LYS  29 -11.448 -13.584   6.107
  363    HG3  LYS  29           3HG      LYS  29 -11.493 -15.336   6.269
  364    HD2  LYS  29           2HD      LYS  29 -12.182 -15.066   8.672
  365    HD3  LYS  29           3HD      LYS  29 -12.187 -13.313   8.461
  366    HE2  LYS  29           2HE      LYS  29 -13.892 -15.299   6.880
  367    HE3  LYS  29           3HE      LYS  29 -14.442 -14.439   8.319
  368    HZ1  LYS  29           HZ1      LYS  29 -14.096 -12.338   7.124
  369    HZ2  LYS  29           HZ2      LYS  29 -13.629 -13.138   5.775
  370    HZ3  LYS  29           HZ3      LYS  29 -15.154 -13.287   6.327
  371    H    THR  30           H        THR  30 -11.258 -17.166   8.855
  372    HA   THR  30           HA       THR  30 -10.329 -19.475   7.290
  373    HB   THR  30           HB       THR  30 -12.306 -20.595   8.410
  374    HG1  THR  30           HG1      THR  30 -13.165 -19.497  10.180
  375   HG21  THR  30          1HG2      THR  30 -11.161 -20.782  10.575
  376   HG22  THR  30          2HG2      THR  30  -9.986 -20.800   9.252
  377   HG23  THR  30          3HG2      THR  30 -10.199 -19.327  10.223
  Start of MODEL    5
    1    H1   GLY   1           1H       GLY   1   3.463  -1.430  11.841
    2    H2   GLY   1           2H       GLY   1   2.379  -2.234  12.772
    3    H3   GLY   1           3H       GLY   1   1.999  -0.767  12.150
    4    HA2  GLY   1           HA2      GLY   1   2.453  -3.232  10.592
    5    HA3  GLY   1           HA3      GLY   1   0.874  -2.490  10.910
    6    H    ILE   2           H        ILE   2   0.553  -2.351   8.611
    7    HA   ILE   2           HA       ILE   2   2.291  -0.667   6.962
    8    HB   ILE   2           HB       ILE   2  -0.429  -1.913   6.379
    9   HG12  ILE   2          2HG1      ILE   2   0.999  -3.271   4.723
   10   HG13  ILE   2          3HG1      ILE   2   2.404  -2.702   5.587
   11   HG21  ILE   2          1HG2      ILE   2   1.506  -0.463   4.512
   12   HG22  ILE   2          2HG2      ILE   2   0.063  -1.362   4.003
   13   HG23  ILE   2          3HG2      ILE   2  -0.125   0.087   4.973
   14   HD11  ILE   2          3HD1      ILE   2   1.774  -3.988   7.555
   15   HD12  ILE   2          1HD1      ILE   2   0.142  -4.283   6.893
   16   HD13  ILE   2          2HD1      ILE   2   1.565  -5.032   6.152
   17    H    VAL   3           H        VAL   3   2.003   1.428   6.415
   18    HA   VAL   3           HA       VAL   3  -0.456   2.885   7.248
   19    HB   VAL   3           HB       VAL   3   0.873   4.891   7.749
   20   HG11  VAL   3          1HG1      VAL   3   1.576   4.243   9.983
   21   HG12  VAL   3          2HG1      VAL   3   0.071   3.406   9.560
   22   HG13  VAL   3          3HG1      VAL   3   1.618   2.530   9.519
   23   HG21  VAL   3          3HG2      VAL   3   2.987   4.371   6.558
   24   HG22  VAL   3          1HG2      VAL   3   3.264   4.758   8.260
   25   HG23  VAL   3          2HG2      VAL   3   3.319   3.069   7.722
   26    H    GLU   4           H        GLU   4  -1.107   4.549   5.880
   27    HA   GLU   4           HA       GLU   4  -0.747   3.941   3.119
   28    HB2  GLU   4           2HB      GLU   4  -2.152   6.226   4.551
   29    HB3  GLU   4           3HB      GLU   4  -2.274   5.937   2.816
   30    HG2  GLU   4           3HG      GLU   4  -3.200   3.681   3.225
   31    HG3  GLU   4           2HG      GLU   4  -3.100   3.941   4.968
   32    H    GLN   5           H        GLN   5   1.316   5.783   4.948
   33    HA   GLN   5           HA       GLN   5   1.708   8.091   3.279
   34    HB2  GLN   5           2HB      GLN   5   3.256   7.077   5.691
   35    HB3  GLN   5           3HB      GLN   5   3.425   8.679   4.951
   36    HG2  GLN   5           2HG      GLN   5   1.037   9.164   5.438
   37    HG3  GLN   5           3HG      GLN   5   0.885   7.603   6.250
   38   HE21  GLN   5          2HE2      GLN   5   0.164   9.573   7.845
   39   HE22  GLN   5          1HE2      GLN   5   1.441   9.991   8.980
   40    H    CYS   6           H        CYS   6   2.154   5.973   1.606
   41    HA   CYS   6           HA       CYS   6   4.991   5.539   1.111
   42    HB2  CYS   6           2HB      CYS   6   2.486   4.570   0.131
   43    HB3  CYS   6           3HB      CYS   6   3.355   5.206  -1.248
   44    H    CYS   7           H        CYS   7   3.091   8.286   0.727
   45    HA   CYS   7           HA       CYS   7   4.630   9.488  -1.487
   46    HB2  CYS   7           2HB      CYS   7   2.231  10.275   0.163
   47    HB3  CYS   7           3HB      CYS   7   3.149  11.507  -0.687
   48    H    THR   8           H        THR   8   6.472   8.709   0.062
   49    HA   THR   8           HA       THR   8   7.003  10.024   2.443
   50    HB   THR   8           HB       THR   8   9.273   8.854   0.871
   51    HG1  THR   8           HG1      THR   8   8.464   6.787   1.412
   52   HG21  THR   8          1HG2      THR   8   8.250   8.429   3.711
   53   HG22  THR   8          2HG2      THR   8   9.723   7.718   3.011
   54   HG23  THR   8          3HG2      THR   8   9.616   9.467   3.246
   55    H    SER   9           H        SER   9   9.064  12.627   0.081
   56    HA   SER   9           HA       SER   9   6.976  11.304  -1.312
   57    HB2  SER   9           2HB      SER   9   8.125  12.221  -3.305
   58    HB3  SER   9           3HB      SER   9   7.738  13.400  -2.045
   59    HG   SER   9           HG       SER   9   9.869  13.672  -2.856
   60    H    ILE  10           H        ILE  10   7.045   9.798  -2.934
   61    HA   ILE  10           HA       ILE  10   7.311   7.688  -3.672
   62    HB   ILE  10           HB       ILE  10   9.983   8.934  -4.355
   63   HG12  ILE  10          2HG1      ILE  10   7.298   8.802  -5.826
   64   HG13  ILE  10          3HG1      ILE  10   7.953  10.229  -5.022
   65   HG21  ILE  10          1HG2      ILE  10   9.959   7.320  -6.293
   66   HG22  ILE  10          2HG2      ILE  10  10.128   6.509  -4.756
   67   HG23  ILE  10          3HG2      ILE  10   8.552   6.521  -5.555
   68   HD11  ILE  10          3HD1      ILE  10   9.912  10.164  -6.579
   69   HD12  ILE  10          1HD1      ILE  10   9.032   8.925  -7.520
   70   HD13  ILE  10          2HD1      ILE  10   8.339  10.539  -7.306
   71    H    CYS  11           H        CYS  11   7.036   6.322  -1.997
   72    HA   CYS  11           HA       CYS  11   9.296   4.929  -0.792
   73    HB2  CYS  11           2HB      CYS  11   7.672   3.296  -0.138
   74    HB3  CYS  11           3HB      CYS  11   6.967   4.893   0.100
   75    H    SER  12           H        SER  12   9.492   2.490  -1.353
   76    HA   SER  12           HA       SER  12   9.474   1.981  -4.287
   77    HB2  SER  12           2HB      SER  12  11.910   1.708  -2.477
   78    HB3  SER  12           3HB      SER  12  11.792   1.096  -4.135
   79    HG   SER  12           HG       SER  12  11.654   3.810  -3.280
   80    H    LEU  13           H        LEU  13   9.875  -0.273  -4.827
   81    HA   LEU  13           HA       LEU  13   8.293  -2.146  -3.506
   82    HB2  LEU  13           2HB      LEU  13   9.087  -2.172  -5.813
   83    HB3  LEU  13           3HB      LEU  13  10.724  -2.571  -5.308
   84    HG   LEU  13           HG       LEU  13   8.417  -4.385  -4.553
   85   HD11  LEU  13          1HD1      LEU  13   8.722  -5.619  -6.676
   86   HD12  LEU  13          2HD1      LEU  13   8.146  -3.973  -6.966
   87   HD13  LEU  13          3HD1      LEU  13   9.857  -4.371  -7.240
   88   HD21  LEU  13          3HD2      LEU  13  10.127  -6.167  -4.828
   89   HD22  LEU  13          1HD2      LEU  13  11.333  -4.942  -5.274
   90   HD23  LEU  13          2HD2      LEU  13  10.645  -4.981  -3.636
   91    H    TYR  14           H        TYR  14  11.770  -1.560  -2.954
   92    HA   TYR  14           HA       TYR  14  12.291  -3.654  -1.096
   93    HB2  TYR  14           2HB      TYR  14  14.051  -2.421  -2.136
   94    HB3  TYR  14           3HB      TYR  14  13.446  -0.884  -1.526
   95    HD1  TYR  14           HD1      TYR  14  15.249  -3.999  -0.615
   96    HD2  TYR  14           HD2      TYR  14  13.861  -0.146   0.753
   97    HE1  TYR  14           HE1      TYR  14  16.661  -4.211   1.426
   98    HE2  TYR  14           HE2      TYR  14  15.242  -0.377   2.808
   99    HH   TYR  14           HH       TYR  14  17.312  -3.251   3.402
  100    H    GLN  15           H        GLN  15  10.599  -0.573  -0.608
  101    HA   GLN  15           HA       GLN  15  10.670  -0.747   2.331
  102    HB2  GLN  15           2HB      GLN  15   8.967   1.044   0.573
  103    HB3  GLN  15           3HB      GLN  15   9.216   1.160   2.315
  104    HG2  GLN  15           2HG      GLN  15  11.698   1.464   1.884
  105    HG3  GLN  15           3HG      GLN  15  11.340   1.535   0.157
  106   HE21  GLN  15          2HE2      GLN  15  12.605   3.696   0.763
  107   HE22  GLN  15          1HE2      GLN  15  11.538   5.052   1.093
  108    H    LEU  16           H        LEU  16   8.510  -1.616  -0.330
  109    HA   LEU  16           HA       LEU  16   6.280  -2.369   1.374
  110    HB2  LEU  16           2HB      LEU  16   6.888  -3.070  -1.525
  111    HB3  LEU  16           3HB      LEU  16   5.369  -3.398  -0.703
  112    HG   LEU  16           HG       LEU  16   6.556  -0.751  -1.495
  113   HD11  LEU  16          1HD1      LEU  16   3.928  -2.126  -2.156
  114   HD12  LEU  16          2HD1      LEU  16   4.415  -0.511  -2.712
  115   HD13  LEU  16          3HD1      LEU  16   5.335  -1.927  -3.230
  116   HD21  LEU  16          3HD2      LEU  16   4.469   0.301  -0.510
  117   HD22  LEU  16          1HD2      LEU  16   4.129  -1.248   0.290
  118   HD23  LEU  16          2HD2      LEU  16   5.586  -0.313   0.709
  119    H    GLU  17           H        GLU  17   8.899  -4.252  -0.212
  120    HA   GLU  17           HA       GLU  17   7.790  -6.762   0.373
  121    HB2  GLU  17           2HB      GLU  17   9.739  -7.760  -0.407
  122    HB3  GLU  17           3HB      GLU  17   9.401  -6.326  -1.361
  123    HG2  GLU  17           2HG      GLU  17  11.562  -5.996  -1.128
  124    HG3  GLU  17           3HG      GLU  17  11.086  -5.171   0.344
  125    H    ASN  18           H        ASN  18   9.330  -4.676   2.577
  126    HA   ASN  18           HA       ASN  18  10.175  -6.442   4.653
  127    HB2  ASN  18           2HB      ASN  18  10.675  -4.041   4.588
  128    HB3  ASN  18           3HB      ASN  18   8.960  -3.638   4.645
  129   HD21  ASN  18          2HD2      ASN  18   7.942  -3.481   6.659
  130   HD22  ASN  18          1HD2      ASN  18   8.783  -3.828   8.160
  131    H    TYR  19           H        TYR  19   6.917  -5.456   3.625
  132    HA   TYR  19           HA       TYR  19   5.652  -6.346   6.113
  133    HB2  TYR  19           2HB      TYR  19   4.558  -5.234   3.513
  134    HB3  TYR  19           3HB      TYR  19   3.579  -5.582   4.915
  135    HD1  TYR  19           HD1      TYR  19   4.659  -4.535   7.235
  136    HD2  TYR  19           HD2      TYR  19   5.015  -2.949   3.239
  137    HE1  TYR  19           HE1      TYR  19   4.886  -2.239   8.162
  138    HE2  TYR  19           HE2      TYR  19   5.208  -0.653   4.168
  139    HH   TYR  19           HH       TYR  19   5.088  -0.012   7.697
  140    H    CYS  20           H        CYS  20   6.649  -8.111   3.409
  141    HA   CYS  20           HA       CYS  20   4.302  -9.645   2.905
  142    HB2  CYS  20           2HB      CYS  20   7.203 -10.303   2.303
  143    HB3  CYS  20           3HB      CYS  20   5.792 -11.070   1.584
  144    H    ASN  21           H        ASN  21   6.215  -9.895   5.656
  145    HA   ASN  21           HA       ASN  21   6.386 -11.420   7.356
  146    HB2  ASN  21           2HB      ASN  21   4.024 -10.660   7.376
  147    HB3  ASN  21           3HB      ASN  21   3.571 -12.040   6.381
  148   HD21  ASN  21          2HD2      ASN  21   2.095 -12.071   8.397
  149   HD22  ASN  21          1HD2      ASN  21   2.663 -13.109   9.711
  150    H1   PHE   1           H        PHE   1   5.485  -1.907 -11.121
  151    HA   PHE   1           HA       PHE   1   6.054   0.798 -11.678
  152    HB2  PHE   1           2HB      PHE   1   5.199   1.070  -9.213
  153    HB3  PHE   1           3HB      PHE   1   4.131   0.554 -10.498
  154    HD1  PHE   1           HD2      PHE   1   6.062  -0.666  -7.526
  155    HD2  PHE   1           HD1      PHE   1   2.983  -1.528 -10.423
  156    HE1  PHE   1           HE2      PHE   1   5.382  -2.647  -6.214
  157    HE2  PHE   1           HE1      PHE   1   2.290  -3.501  -9.091
  158    HZ   PHE   1           HZ       PHE   1   3.496  -4.078  -6.996
  159    H    VAL   2           H        VAL   2   7.485  -1.241  -9.201
  160    HA   VAL   2           HA       VAL   2   9.209  -1.176  -7.823
  161    HB   VAL   2           HB       VAL   2  10.826   0.196  -9.960
  162   HG11  VAL   2          1HG1      VAL   2  11.440  -2.068  -7.992
  163   HG12  VAL   2          2HG1      VAL   2  12.579  -1.326  -9.136
  164   HG13  VAL   2          3HG1      VAL   2  11.950  -0.383  -7.785
  165   HG21  VAL   2          3HG2      VAL   2  11.192  -2.078 -10.924
  166   HG22  VAL   2          1HG2      VAL   2   9.902  -2.713  -9.880
  167   HG23  VAL   2          2HG2      VAL   2   9.537  -1.517 -11.146
  168    H    ASN   3           H        ASN   3   9.235   2.168  -9.170
  169    HA   ASN   3           HA       ASN   3   9.818   3.251  -6.444
  170    HB2  ASN   3           2HB      ASN   3  11.390   4.043  -8.935
  171    HB3  ASN   3           3HB      ASN   3  11.666   4.571  -7.280
  172   HD21  ASN   3          2HD2      ASN   3  12.402   2.746  -5.714
  173   HD22  ASN   3          1HD2      ASN   3  13.476   1.563  -6.452
  174    H    GLN   4           H        GLN   4   7.504   3.930  -6.598
  175    HA   GLN   4           HA       GLN   4   7.285   6.594  -7.773
  176    HB2  GLN   4           2HB      GLN   4   5.351   6.218  -9.160
  177    HB3  GLN   4           3HB      GLN   4   6.670   5.203  -9.707
  178    HG2  GLN   4           2HG      GLN   4   5.647   3.239  -8.589
  179    HG3  GLN   4           3HG      GLN   4   4.322   4.257  -8.008
  180   HE21  GLN   4          2HE2      GLN   4   2.637   4.878  -9.488
  181   HE22  GLN   4          1HE2      GLN   4   2.597   4.241 -11.124
  182    H    HIS   5           H        HIS   5   4.850   7.374  -7.466
  183    HA   HIS   5           HA       HIS   5   4.357   7.476  -4.639
  184    HB2  HIS   5           2HB      HIS   5   2.690   8.489  -6.975
  185    HB3  HIS   5           3HB      HIS   5   2.527   8.982  -5.295
  186    HD2  HIS   5           HD2      HIS   5   4.329  10.718  -4.317
  187    HE1  HIS   5           HE1      HIS   5   6.176  11.655  -8.046
  188    HE2  HIS   5           HE2      HIS   5   5.940  12.358  -5.611
  189    H    LEU   6           H        LEU   6   4.116   5.017  -4.501
  190    HA   LEU   6           HA       LEU   6   1.524   3.856  -5.198
  191    HB2  LEU   6           2HB      LEU   6   3.769   2.800  -3.449
  192    HB3  LEU   6           3HB      LEU   6   2.409   1.856  -4.043
  193    HG   LEU   6           HG       LEU   6   4.492   3.166  -5.844
  194   HD11  LEU   6          1HD1      LEU   6   5.472   1.003  -6.108
  195   HD12  LEU   6          2HD1      LEU   6   5.441   1.392  -4.386
  196   HD13  LEU   6          3HD1      LEU   6   4.249   0.252  -5.056
  197   HD21  LEU   6          3HD2      LEU   6   2.371   2.804  -7.018
  198   HD22  LEU   6          1HD2      LEU   6   3.564   1.615  -7.556
  199   HD23  LEU   6          2HD2      LEU   6   2.295   1.135  -6.417
  200    H    CYS   7           H        CYS   7   0.837   6.044  -3.854
  201    HA   CYS   7           HA       CYS   7   0.747   5.633  -0.962
  202    HB2  CYS   7           2HB      CYS   7  -0.423   7.957  -2.490
  203    HB3  CYS   7           3HB      CYS   7   0.198   7.922  -0.838
  204    H    GLY   8           H        GLY   8  -1.135   5.682   0.377
  205    HA2  GLY   8           HA2      GLY   8  -3.297   5.098   0.981
  206    HA3  GLY   8           HA3      GLY   8  -3.798   5.956  -0.471
  207    H    SER   9           H        SER   9  -5.175   4.720  -1.627
  208    HA   SER   9           HA       SER   9  -5.578   1.947  -1.392
  209    HB2  SER   9           2HB      SER   9  -6.206   3.712  -3.790
  210    HB3  SER   9           3HB      SER   9  -6.967   2.160  -3.386
  211    HG   SER   9           HG       SER   9  -8.228   3.954  -2.688
  212    H    HIS  10           H        HIS  10  -3.250   3.618  -3.502
  213    HA   HIS  10           HA       HIS  10  -2.745   1.315  -5.211
  214    HB2  HIS  10           2HB      HIS  10  -1.137   3.843  -4.695
  215    HB3  HIS  10           3HB      HIS  10  -0.763   2.642  -5.925
  216    HD2  HIS  10           HD2      HIS  10  -2.340   2.493  -8.091
  217    HE1  HIS  10           HE1      HIS  10  -4.636   6.008  -7.336
  218    HE2  HIS  10           HE2      HIS  10  -4.075   4.224  -9.065
  219    H    LEU  11           H        LEU  11  -1.760   2.077  -1.979
  220    HA   LEU  11           HA       LEU  11   0.795   0.759  -2.006
  221    HB2  LEU  11           2HB      LEU  11  -0.294   2.528  -0.394
  222    HB3  LEU  11           3HB      LEU  11  -0.921   1.134   0.469
  223    HG   LEU  11           HG       LEU  11   2.031   1.639  -0.153
  224   HD11  LEU  11          1HD1      LEU  11   2.216   2.360   2.170
  225   HD12  LEU  11          2HD1      LEU  11   1.003   3.351   1.347
  226   HD13  LEU  11          3HD1      LEU  11   0.486   2.044   2.435
  227   HD21  LEU  11          3HD2      LEU  11   1.706  -0.714   0.294
  228   HD22  LEU  11          1HD2      LEU  11   2.404   0.017   1.733
  229   HD23  LEU  11          2HD2      LEU  11   0.668  -0.360   1.698
  230    H    VAL  12           H        VAL  12  -2.477  -0.319  -0.884
  231    HA   VAL  12           HA       VAL  12  -1.622  -2.993  -0.287
  232    HB   VAL  12           HB       VAL  12  -4.016  -3.527  -0.238
  233   HG11  VAL  12          1HG1      VAL  12  -3.272  -0.994   1.272
  234   HG12  VAL  12          2HG1      VAL  12  -4.517  -2.175   1.732
  235   HG13  VAL  12          3HG1      VAL  12  -2.810  -2.649   1.731
  236   HG21  VAL  12          3HG2      VAL  12  -4.936  -1.973  -1.933
  237   HG22  VAL  12          1HG2      VAL  12  -5.723  -1.784  -0.368
  238   HG23  VAL  12          2HG2      VAL  12  -4.519  -0.594  -0.888
  239    H    GLU  13           H        GLU  13  -3.029  -1.534  -3.229
  240    HA   GLU  13           HA       GLU  13  -3.204  -3.943  -4.768
  241    HB2  GLU  13           2HB      GLU  13  -2.712  -1.048  -5.566
  242    HB3  GLU  13           3HB      GLU  13  -2.916  -2.338  -6.745
  243    HG2  GLU  13           2HG      GLU  13  -5.002  -1.660  -4.627
  244    HG3  GLU  13           3HG      GLU  13  -4.983  -0.980  -6.251
  245    H    ALA  14           H        ALA  14  -0.407  -1.744  -4.234
  246    HA   ALA  14           HA       ALA  14   1.375  -3.254  -5.929
  247    HB1  ALA  14           3HB      ALA  14   1.775  -0.912  -5.378
  248    HB2  ALA  14           1HB      ALA  14   1.932  -1.308  -3.653
  249    HB3  ALA  14           2HB      ALA  14   3.122  -1.921  -4.821
  250    H    LEU  15           H        LEU  15   0.806  -3.303  -2.352
  251    HA   LEU  15           HA       LEU  15   2.761  -5.251  -1.702
  252    HB2  LEU  15           2HB      LEU  15   0.114  -4.429  -0.470
  253    HB3  LEU  15           3HB      LEU  15   1.024  -5.756   0.219
  254    HG   LEU  15           HG       LEU  15   2.232  -2.995  -0.158
  255   HD11  LEU  15          1HD1      LEU  15   1.835  -2.725   2.281
  256   HD12  LEU  15          2HD1      LEU  15   0.310  -2.875   1.389
  257   HD13  LEU  15          3HD1      LEU  15   0.940  -4.261   2.305
  258   HD21  LEU  15          3HD2      LEU  15   3.880  -3.786   1.458
  259   HD22  LEU  15          1HD2      LEU  15   3.042  -5.341   1.613
  260   HD23  LEU  15          2HD2      LEU  15   3.850  -4.914   0.102
  261    H    TYR  16           H        TYR  16  -0.611  -5.753  -2.762
  262    HA   TYR  16           HA       TYR  16  -0.699  -8.560  -2.437
  263    HB2  TYR  16           2HB      TYR  16  -2.129  -6.704  -4.354
  264    HB3  TYR  16           3HB      TYR  16  -2.552  -8.400  -4.124
  265    HD1  TYR  16           HD1      TYR  16  -1.666  -7.510  -0.864
  266    HD2  TYR  16           HD2      TYR  16  -4.705  -6.678  -3.826
  267    HE1  TYR  16           HE1      TYR  16  -3.221  -6.954   0.911
  268    HE2  TYR  16           HE2      TYR  16  -6.283  -6.073  -2.004
  269    HH   TYR  16           HH       TYR  16  -6.600  -5.872   0.262
  270    H    LEU  17           H        LEU  17   1.083  -6.750  -4.772
  271    HA   LEU  17           HA       LEU  17   1.528  -9.123  -6.540
  272    HB2  LEU  17           2HB      LEU  17   2.023  -6.155  -6.990
  273    HB3  LEU  17           3HB      LEU  17   2.400  -7.430  -8.143
  274    HG   LEU  17           HG       LEU  17  -0.420  -6.785  -7.150
  275   HD11  LEU  17          1HD1      LEU  17   0.494  -4.951  -8.477
  276   HD12  LEU  17          2HD1      LEU  17   0.974  -6.085  -9.765
  277   HD13  LEU  17          3HD1      LEU  17  -0.746  -5.815  -9.392
  278   HD21  LEU  17          3HD2      LEU  17  -0.238  -9.117  -7.895
  279   HD22  LEU  17          1HD2      LEU  17  -1.136  -8.167  -9.080
  280   HD23  LEU  17          2HD2      LEU  17   0.560  -8.596  -9.398
  281    H    VAL  18           H        VAL  18   3.256  -6.592  -4.686
  282    HA   VAL  18           HA       VAL  18   5.926  -7.511  -5.147
  283    HB   VAL  18           HB       VAL  18   4.655  -5.906  -2.895
  284   HG11  VAL  18          1HG1      VAL  18   6.701  -6.777  -1.913
  285   HG12  VAL  18          2HG1      VAL  18   7.627  -6.374  -3.376
  286   HG13  VAL  18          3HG1      VAL  18   6.953  -5.087  -2.355
  287   HG21  VAL  18          3HG2      VAL  18   6.370  -5.168  -5.304
  288   HG22  VAL  18          1HG2      VAL  18   4.644  -4.863  -5.123
  289   HG23  VAL  18          2HG2      VAL  18   5.784  -4.027  -4.068
  290    H    CYS  19           H        CYS  19   3.542  -8.427  -2.683
  291    HA   CYS  19           HA       CYS  19   5.357 -10.477  -1.566
  292    HB2  CYS  19           2HB      CYS  19   2.520  -9.736  -0.800
  293    HB3  CYS  19           3HB      CYS  19   3.617 -10.779   0.100
  294    H    GLY  20           H        GLY  20   3.615 -10.497  -4.316
  295    HA2  GLY  20           HA2      GLY  20   3.005 -12.168  -5.745
  296    HA3  GLY  20           HA3      GLY  20   3.560 -13.349  -4.560
  297    H    GLU  21           H        GLU  21   1.460 -12.040  -2.626
  298    HA   GLU  21           HA       GLU  21  -1.115 -12.793  -3.810
  299    HB2  GLU  21           2HB      GLU  21  -1.685 -14.410  -2.100
  300    HB3  GLU  21           3HB      GLU  21  -0.259 -14.952  -2.976
  301    HG2  GLU  21           2HG      GLU  21   1.192 -14.196  -1.101
  302    HG3  GLU  21           3HG      GLU  21  -0.231 -13.629  -0.224
  303    H    ARG  22           H        ARG  22  -2.942 -12.310  -2.357
  304    HA   ARG  22           HA       ARG  22  -2.543  -9.791  -0.973
  305    HB2  ARG  22           2HB      ARG  22  -4.820  -9.487  -0.996
  306    HB3  ARG  22           3HB      ARG  22  -4.491 -10.329  -2.496
  307    HG2  ARG  22           2HG      ARG  22  -5.685 -11.531   0.050
  308    HG3  ARG  22           3HG      ARG  22  -6.558 -11.076  -1.407
  309    HD2  ARG  22           2HD      ARG  22  -5.313 -12.796  -2.697
  310    HD3  ARG  22           3HD      ARG  22  -4.500 -13.305  -1.194
  311    HE   ARG  22           HE       ARG  22  -7.270 -13.357  -0.689
  312   HH11  ARG  22          1HH1      ARG  22  -5.069 -15.141  -2.759
  313   HH12  ARG  22          2HH1      ARG  22  -6.068 -16.568  -2.731
  314   HH21  ARG  22          1HH2      ARG  22  -8.487 -15.209  -0.705
  315   HH22  ARG  22          2HH2      ARG  22  -7.948 -16.598  -1.603
  316    H    GLY  23           H        GLY  23  -2.236 -12.883   0.213
  317    HA2  GLY  23           HA2      GLY  23  -3.209 -12.349   2.950
  318    HA3  GLY  23           HA3      GLY  23  -2.472 -13.831   2.357
  319    H    DHI  24           H        DHI  24  -1.816 -12.735   4.791
  320    HA   DHI  24           HA       DHI  24   1.087 -12.101   4.412
  321    HB2  DHI  24           2HB      DHI  24   1.510 -13.653   6.277
  322    HB3  DHI  24           3HB      DHI  24  -0.212 -14.023   6.368
  323    HD2  DHI  24           HD2      DHI  24  -1.234 -15.595   4.419
  324    HE1  DHI  24           HE1      DHI  24   2.398 -16.399   2.332
  325    HE2  DHI  24           HE2      DHI  24  -0.076 -16.971   2.492
  326    H    PHE  25           H        PHE  25  -1.070 -10.183   5.008
  327    HA   PHE  25           HA       PHE  25   0.557  -8.660   6.829
  328    HB2  PHE  25           2HB      PHE  25  -2.051  -7.815   5.543
  329    HB3  PHE  25           3HB      PHE  25  -0.721  -6.787   6.057
  330    HD1  PHE  25           HD1      PHE  25   1.595  -7.185   4.857
  331    HD2  PHE  25           HD2      PHE  25  -2.194  -8.527   3.294
  332    HE1  PHE  25           HE1      PHE  25   2.607  -7.429   2.607
  333    HE2  PHE  25           HE2      PHE  25  -1.176  -8.776   1.052
  334    HZ   PHE  25           HZ       PHE  25   1.221  -8.230   0.694
  335    H    TYR  26           H        TYR  26  -2.010 -10.650   7.557
  336    HA   TYR  26           HA       TYR  26  -3.641 -10.881   9.068
  337    HB2  TYR  26           2HB      TYR  26  -1.885 -10.874  10.701
  338    HB3  TYR  26           3HB      TYR  26  -1.922  -9.119  10.817
  339    HD1  TYR  26           HD1      TYR  26  -4.202 -12.108  11.189
  340    HD2  TYR  26           HD2      TYR  26  -3.263  -8.093  12.455
  341    HE1  TYR  26           HE1      TYR  26  -5.919 -12.269  12.987
  342    HE2  TYR  26           HE2      TYR  26  -4.937  -8.277  14.288
  343    HH   TYR  26           HH       TYR  26  -6.502  -9.605  15.315
  344    H    THR  27           H        THR  27  -5.375 -10.150   8.089
  345    HA   THR  27           HA       THR  27  -6.244  -7.319   8.510
  346    HB   THR  27           HB       THR  27  -7.400  -7.532   6.303
  347    HG1  THR  27           HG1      THR  27  -7.370  -9.773   6.091
  348   HG21  THR  27          1HG2      THR  27  -4.376  -7.900   6.179
  349   HG22  THR  27          2HG2      THR  27  -5.409  -7.166   4.939
  350   HG23  THR  27          3HG2      THR  27  -5.216  -6.368   6.511
  351    HA   PRO  28           HA       PRO  28  -9.331 -10.212  10.416
  352    HB2  PRO  28           2HB      PRO  28  -9.730  -8.944  12.790
  353    HB3  PRO  28           3HB      PRO  28  -8.287  -9.961  12.472
  354    HG2  PRO  28           2HG      PRO  28  -8.515  -6.938  12.189
  355    HG3  PRO  28           3HG      PRO  28  -7.296  -7.860  13.122
  356    HD2  PRO  28           2HD      PRO  28  -6.783  -7.019  10.603
  357    HD3  PRO  28           3HD      PRO  28  -6.239  -8.636  11.143
  358    H    LYS  29           H        LYS  29 -11.575  -9.923  10.946
  359    HA   LYS  29           HA       LYS  29 -12.886  -7.333  10.400
  360    HB2  LYS  29           2HB      LYS  29 -14.380  -8.235   8.708
  361    HB3  LYS  29           3HB      LYS  29 -12.704  -8.352   8.179
  362    HG2  LYS  29           2HG      LYS  29 -12.680 -10.774   8.771
  363    HG3  LYS  29           3HG      LYS  29 -14.367 -10.655   9.309
  364    HD2  LYS  29           2HD      LYS  29 -15.049  -9.974   7.022
  365    HD3  LYS  29           3HD      LYS  29 -13.359 -10.100   6.483
  366    HE2  LYS  29           2HE      LYS  29 -13.341 -12.505   7.112
  367    HE3  LYS  29           3HE      LYS  29 -15.018 -12.379   7.656
  368    HZ1  LYS  29           HZ1      LYS  29 -14.099 -11.934   4.864
  369    HZ2  LYS  29           HZ2      LYS  29 -14.886 -13.259   5.397
  370    HZ3  LYS  29           HZ3      LYS  29 -15.650 -11.819   5.369
  371    H    THR  30           H        THR  30 -15.170  -7.323  10.883
  372    HA   THR  30           HA       THR  30 -15.794  -8.651  13.399
  373    HB   THR  30           HB       THR  30 -17.980  -7.394  13.148
  374    HG1  THR  30           HG1      THR  30 -17.813  -7.200  10.849
  375   HG21  THR  30          1HG2      THR  30 -16.972  -5.211  13.635
  376   HG22  THR  30          2HG2      THR  30 -16.084  -6.503  14.458
  377   HG23  THR  30          3HG2      THR  30 -15.409  -5.758  12.993
  Start of MODEL    6
    1    H1   GLY   1           1H       GLY   1  -2.601  -5.130  11.826
    2    H2   GLY   1           2H       GLY   1  -1.412  -5.193  12.955
    3    H3   GLY   1           3H       GLY   1  -2.681  -4.173  13.150
    4    HA2  GLY   1           HA2      GLY   1  -0.739  -2.937  12.469
    5    HA3  GLY   1           HA3      GLY   1  -0.632  -3.974  11.035
    6    H    ILE   2           H        ILE   2  -2.459  -0.867  10.005
    7    HA   ILE   2           HA       ILE   2   0.171  -1.426  11.246
    8    HB   ILE   2           HB       ILE   2   0.169  -2.456   8.985
    9   HG12  ILE   2          2HG1      ILE   2   2.176  -1.407   8.045
   10   HG13  ILE   2          3HG1      ILE   2   2.010  -0.037   9.131
   11   HG21  ILE   2          1HG2      ILE   2   0.092  -1.090   6.956
   12   HG22  ILE   2          2HG2      ILE   2  -1.433  -0.962   7.840
   13   HG23  ILE   2          3HG2      ILE   2  -0.248   0.361   7.910
   14   HD11  ILE   2          3HD1      ILE   2   2.437  -2.934   9.998
   15   HD12  ILE   2          1HD1      ILE   2   3.699  -1.693   9.890
   16   HD13  ILE   2          2HD1      ILE   2   2.402  -1.520  11.080
   17    H    VAL   3           H        VAL   3   1.480   0.415  11.553
   18    HA   VAL   3           HA       VAL   3  -0.094   2.796  12.093
   19    HB   VAL   3           HB       VAL   3   1.922   3.644  13.195
   20   HG11  VAL   3          1HG1      VAL   3   2.005   2.012  14.992
   21   HG12  VAL   3          2HG1      VAL   3   0.345   2.167  14.397
   22   HG13  VAL   3          3HG1      VAL   3   1.322   0.753  13.945
   23   HG21  VAL   3          3HG2      VAL   3   3.280   1.043  12.343
   24   HG22  VAL   3          1HG2      VAL   3   3.684   2.670  11.747
   25   HG23  VAL   3          2HG2      VAL   3   3.927   2.268  13.448
   26    H    GLU   4           H        GLU   4   1.895   1.957   9.412
   27    HA   GLU   4           HA       GLU   4   1.519   4.621   8.249
   28    HB2  GLU   4           3HB      GLU   4   3.842   4.956   7.650
   29    HB3  GLU   4           2HB      GLU   4   3.659   4.886   9.399
   30    HG2  GLU   4           2HG      GLU   4   4.434   2.469   9.319
   31    HG3  GLU   4           3HG      GLU   4   4.762   2.689   7.600
   32    H    GLN   5           H        GLN   5   1.680   4.672   5.978
   33    HA   GLN   5           HA       GLN   5   1.878   2.081   4.523
   34    HB2  GLN   5           2HB      GLN   5  -0.565   3.910   4.515
   35    HB3  GLN   5           3HB      GLN   5  -0.303   2.552   3.417
   36    HG2  GLN   5           2HG      GLN   5  -0.198   1.016   5.399
   37    HG3  GLN   5           3HG      GLN   5  -0.664   2.378   6.429
   38   HE21  GLN   5          1HE2      GLN   5  -1.816   0.037   4.045
   39   HE22  GLN   5          2HE2      GLN   5  -3.505   0.514   4.169
   40    H    CYS   6           H        CYS   6   3.900   3.702   4.234
   41    HA   CYS   6           HA       CYS   6   5.167   4.959   2.843
   42    HB2  CYS   6           2HB      CYS   6   3.362   3.643   0.809
   43    HB3  CYS   6           3HB      CYS   6   4.897   4.415   0.427
   44    H    CYS   7           H        CYS   7   2.618   6.404   3.739
   45    HA   CYS   7           HA       CYS   7   1.891   8.209   1.642
   46    HB2  CYS   7           2HB      CYS   7   1.598   8.373   4.662
   47    HB3  CYS   7           3HB      CYS   7   0.776   9.430   3.523
   48    H    THR   8           H        THR   8   4.520   8.350   3.959
   49    HA   THR   8           HA       THR   8   5.060  11.228   3.338
   50    HB   THR   8           HB       THR   8   6.089  11.270   5.611
   51    HG1  THR   8           HG1      THR   8   5.637   9.526   6.970
   52   HG21  THR   8          1HG2      THR   8   3.191  10.317   5.646
   53   HG22  THR   8          2HG2      THR   8   4.017  11.301   6.873
   54   HG23  THR   8          3HG2      THR   8   3.718  11.971   5.260
   55    H    SER   9           H        SER   9   6.439   8.172   2.792
   56    HA   SER   9           HA       SER   9   9.064   9.402   2.182
   57    HB2  SER   9           2HB      SER   9   9.219   8.480   4.478
   58    HB3  SER   9           3HB      SER   9   8.827   6.869   3.839
   59    HG   SER   9           HG       SER   9  11.109   7.277   4.037
   60    H    ILE  10           H        ILE  10  10.403   8.086   0.849
   61    HA   ILE  10           HA       ILE  10   8.816   6.921  -1.338
   62    HB   ILE  10           HB       ILE  10  11.802   7.445  -1.176
   63   HG12  ILE  10          2HG1      ILE  10  10.536   9.564  -0.993
   64   HG13  ILE  10          3HG1      ILE  10  11.480   9.441  -2.460
   65   HG21  ILE  10          1HG2      ILE  10  11.337   5.785  -2.892
   66   HG22  ILE  10          2HG2      ILE  10   9.994   6.750  -3.533
   67   HG23  ILE  10          3HG2      ILE  10  11.665   7.329  -3.682
   68   HD11  ILE  10          3HD1      ILE  10   8.473   8.962  -2.330
   69   HD12  ILE  10          1HD1      ILE  10   9.262  10.469  -2.837
   70   HD13  ILE  10          2HD1      ILE  10   9.475   9.004  -3.800
   71    H    CYS  11           H        CYS  11   8.071   4.966  -0.521
   72    HA   CYS  11           HA       CYS  11   9.854   2.869   0.364
   73    HB2  CYS  11           2HB      CYS  11   7.034   2.730  -0.702
   74    HB3  CYS  11           3HB      CYS  11   7.932   1.389   0.010
   75    H    SER  12           H        SER  12  11.375   2.041  -0.906
   76    HA   SER  12           HA       SER  12  11.093   1.430  -3.756
   77    HB2  SER  12           2HB      SER  12  13.152   0.062  -3.324
   78    HB3  SER  12           3HB      SER  12  13.314   1.766  -2.869
   79    HG   SER  12           HG       SER  12  14.114   0.224  -1.302
   80    H    LEU  13           H        LEU  13  11.140  -0.905  -4.505
   81    HA   LEU  13           HA       LEU  13   8.895  -2.325  -3.478
   82    HB2  LEU  13           2HB      LEU  13  11.135  -3.042  -5.387
   83    HB3  LEU  13           3HB      LEU  13   9.961  -4.245  -4.867
   84    HG   LEU  13           HG       LEU  13   8.095  -2.833  -5.693
   85   HD11  LEU  13          1HD1      LEU  13   8.588  -1.041  -7.350
   86   HD12  LEU  13          2HD1      LEU  13   9.036  -0.591  -5.709
   87   HD13  LEU  13          3HD1      LEU  13  10.297  -1.090  -6.870
   88   HD21  LEU  13          3HD2      LEU  13   9.063  -4.645  -7.059
   89   HD22  LEU  13          1HD2      LEU  13   8.480  -3.315  -8.071
   90   HD23  LEU  13          2HD2      LEU  13  10.223  -3.498  -7.767
   91    H    TYR  14           H        TYR  14  12.328  -2.651  -2.650
   92    HA   TYR  14           HA       TYR  14  12.198  -4.979  -1.004
   93    HB2  TYR  14           2HB      TYR  14  14.313  -4.026  -1.587
   94    HB3  TYR  14           3HB      TYR  14  13.863  -2.441  -0.968
   95    HD1  TYR  14           HD1      TYR  14  14.550  -5.967   0.124
   96    HD2  TYR  14           HD2      TYR  14  14.305  -1.809   1.258
   97    HE1  TYR  14           HE1      TYR  14  15.476  -6.522   2.377
   98    HE2  TYR  14           HE2      TYR  14  15.240  -2.364   3.501
   99    HH   TYR  14           HH       TYR  14  15.999  -4.022   4.891
  100    H    GLN  15           H        GLN  15  11.312  -1.580  -0.297
  101    HA   GLN  15           HA       GLN  15  10.773  -2.070   2.537
  102    HB2  GLN  15           2HB      GLN  15   9.933   0.236   0.739
  103    HB3  GLN  15           3HB      GLN  15   9.702   0.162   2.485
  104    HG2  GLN  15           2HG      GLN  15  12.121   0.025   2.855
  105    HG3  GLN  15           3HG      GLN  15  12.399  -0.060   1.115
  106   HE21  GLN  15          1HE2      GLN  15  12.983   1.827   0.147
  107   HE22  GLN  15          2HE2      GLN  15  12.490   3.432   0.720
  108    H    LEU  16           H        LEU  16   8.871  -1.972  -0.448
  109    HA   LEU  16           HA       LEU  16   6.313  -2.405   0.779
  110    HB2  LEU  16           2HB      LEU  16   7.189  -3.220  -1.996
  111    HB3  LEU  16           3HB      LEU  16   5.535  -3.135  -1.406
  112    HG   LEU  16           HG       LEU  16   7.451  -0.811  -1.783
  113   HD11  LEU  16          1HD1      LEU  16   6.609  -1.573  -3.885
  114   HD12  LEU  16          2HD1      LEU  16   4.933  -1.583  -3.273
  115   HD13  LEU  16          3HD1      LEU  16   5.817  -0.056  -3.479
  116   HD21  LEU  16          3HD2      LEU  16   4.541  -0.691  -0.889
  117   HD22  LEU  16          1HD2      LEU  16   5.947  -0.333   0.142
  118   HD23  LEU  16          2HD2      LEU  16   5.587   0.690  -1.246
  119    H    GLU  17           H        GLU  17   8.820  -4.771  -0.242
  120    HA   GLU  17           HA       GLU  17   7.338  -7.100   0.603
  121    HB2  GLU  17           2HB      GLU  17  10.336  -6.630   0.373
  122    HB3  GLU  17           3HB      GLU  17   9.601  -8.174   0.794
  123    HG2  GLU  17           2HG      GLU  17   8.338  -8.152  -1.356
  124    HG3  GLU  17           3HG      GLU  17   9.187  -6.672  -1.808
  125    H    ASN  18           H        ASN  18   9.337  -4.793   2.499
  126    HA   ASN  18           HA       ASN  18   9.473  -6.448   4.842
  127    HB2  ASN  18           2HB      ASN  18   9.600  -3.407   4.637
  128    HB3  ASN  18           3HB      ASN  18   9.989  -4.348   6.066
  129   HD21  ASN  18          1HD2      ASN  18  11.620  -6.415   5.137
  130   HD22  ASN  18          2HD2      ASN  18  13.053  -5.660   4.455
  131    H    TYR  19           H        TYR  19   6.843  -4.347   3.691
  132    HA   TYR  19           HA       TYR  19   5.302  -4.553   6.169
  133    HB2  TYR  19           2HB      TYR  19   4.401  -4.036   3.321
  134    HB3  TYR  19           3HB      TYR  19   3.359  -3.964   4.730
  135    HD1  TYR  19           HD1      TYR  19   3.717  -2.205   6.500
  136    HD2  TYR  19           HD2      TYR  19   5.811  -2.198   2.748
  137    HE1  TYR  19           HE1      TYR  19   4.275   0.210   6.813
  138    HE2  TYR  19           HE2      TYR  19   6.434   0.180   3.077
  139    HH   TYR  19           HH       TYR  19   6.248   2.024   4.432
  140    H    CYS  20           H        CYS  20   5.419  -6.435   3.112
  141    HA   CYS  20           HA       CYS  20   3.251  -8.178   3.657
  142    HB2  CYS  20           2HB      CYS  20   4.370  -7.805   1.454
  143    HB3  CYS  20           3HB      CYS  20   5.750  -8.743   2.037
  144    H    ASN  21           H        ASN  21   6.715  -8.524   4.419
  145    HA   ASN  21           HA       ASN  21   7.911  -9.973   5.709
  146    HB2  ASN  21           2HB      ASN  21   6.741  -8.506   7.329
  147    HB3  ASN  21           3HB      ASN  21   5.449  -9.697   7.478
  148   HD21  ASN  21          1HD2      ASN  21   6.418  -9.135   9.814
  149   HD22  ASN  21          2HD2      ASN  21   7.587 -10.327  10.367
  150    H1   PHE   1           H        PHE   1   4.005   0.106 -10.795
  151    HA   PHE   1           HA       PHE   1   1.770   1.261 -10.706
  152    HB2  PHE   1           2HB      PHE   1   3.834   2.326  -8.746
  153    HB3  PHE   1           3HB      PHE   1   2.095   2.269  -8.511
  154    HD1  PHE   1           HD1      PHE   1   1.025  -0.195  -8.927
  155    HD2  PHE   1           HD2      PHE   1   5.096   0.615  -7.748
  156    HE1  PHE   1           HE1      PHE   1   1.238  -2.511  -8.069
  157    HE2  PHE   1           HE2      PHE   1   5.287  -1.694  -6.837
  158    HZ   PHE   1           HZ       PHE   1   3.362  -3.270  -7.038
  159    H    VAL   2           H        VAL   2   3.262   4.975 -11.581
  160    HA   VAL   2           HA       VAL   2   5.177   2.924 -10.536
  161    HB   VAL   2           HB       VAL   2   6.899   3.993 -11.862
  162   HG11  VAL   2          1HG1      VAL   2   4.556   3.114 -13.590
  163   HG12  VAL   2          2HG1      VAL   2   6.263   3.183 -14.076
  164   HG13  VAL   2          3HG1      VAL   2   5.755   2.054 -12.814
  165   HG21  VAL   2          3HG2      VAL   2   5.947   6.278 -12.092
  166   HG22  VAL   2          1HG2      VAL   2   6.403   5.584 -13.652
  167   HG23  VAL   2          2HG2      VAL   2   4.694   5.639 -13.181
  168    H    ASN   3           H        ASN   3   7.141   3.872  -9.577
  169    HA   ASN   3           HA       ASN   3   8.120   4.959  -7.837
  170    HB2  ASN   3           2HB      ASN   3   6.890   7.389  -9.189
  171    HB3  ASN   3           3HB      ASN   3   8.253   7.405  -8.069
  172   HD21  ASN   3          2HD2      ASN   3   8.463   8.529 -10.607
  173   HD22  ASN   3          1HD2      ASN   3   9.606   7.552 -11.515
  174    H    GLN   4           H        GLN   4   6.942   7.531  -6.666
  175    HA   GLN   4           HA       GLN   4   4.888   6.411  -4.849
  176    HB2  GLN   4           2HB      GLN   4   7.684   7.385  -4.126
  177    HB3  GLN   4           3HB      GLN   4   6.423   7.294  -2.922
  178    HG2  GLN   4           2HG      GLN   4   7.547   4.947  -4.512
  179    HG3  GLN   4           3HG      GLN   4   7.885   5.330  -2.844
  180   HE21  GLN   4          2HE2      GLN   4   7.040   2.815  -3.281
  181   HE22  GLN   4          1HE2      GLN   4   5.339   2.632  -2.830
  182    H    HIS   5           H        HIS   5   3.901   9.849  -4.228
  183    HA   HIS   5           HA       HIS   5   4.378   7.385  -2.649
  184    HB2  HIS   5           2HB      HIS   5   2.915   9.946  -1.988
  185    HB3  HIS   5           3HB      HIS   5   3.250   8.616  -0.887
  186    HD2  HIS   5           HD2      HIS   5   5.527   8.686   0.398
  187    HE1  HIS   5           HE1      HIS   5   7.454  11.826  -1.743
  188    HE2  HIS   5           HE2      HIS   5   7.603  10.310   0.287
  189    H    LEU   6           H        LEU   6   3.125   5.706  -2.802
  190    HA   LEU   6           HA       LEU   6   0.220   5.915  -3.434
  191    HB2  LEU   6           2HB      LEU   6   2.127   3.585  -2.977
  192    HB3  LEU   6           3HB      LEU   6   0.378   3.407  -2.965
  193    HG   LEU   6           HG       LEU   6   0.219   4.211  -5.283
  194   HD11  LEU   6          1HD1      LEU   6   2.213   5.568  -5.588
  195   HD12  LEU   6          2HD1      LEU   6   3.263   4.179  -5.219
  196   HD13  LEU   6          3HD1      LEU   6   2.287   4.207  -6.702
  197   HD21  LEU   6          3HD2      LEU   6   2.164   1.896  -4.895
  198   HD22  LEU   6          1HD2      LEU   6   0.400   1.798  -4.718
  199   HD23  LEU   6          2HD2      LEU   6   1.103   2.163  -6.295
  200    H    CYS   7           H        CYS   7  -1.315   5.824  -1.831
  201    HA   CYS   7           HA       CYS   7  -0.501   5.466   1.003
  202    HB2  CYS   7           2HB      CYS   7   0.115   7.749   0.457
  203    HB3  CYS   7           3HB      CYS   7  -1.482   8.081  -0.180
  204    H    GLY   8           H        GLY   8  -3.376   7.322   0.245
  205    HA2  GLY   8           HA2      GLY   8  -5.083   5.452   1.604
  206    HA3  GLY   8           HA3      GLY   8  -5.574   6.929   0.771
  207    H    SER   9           H        SER   9  -4.097   5.504  -1.660
  208    HA   SER   9           HA       SER   9  -5.971   3.338  -2.326
  209    HB2  SER   9           2HB      SER   9  -6.924   5.511  -3.248
  210    HB3  SER   9           3HB      SER   9  -5.496   5.598  -4.301
  211    HG   SER   9           HG       SER   9  -7.318   4.536  -5.282
  212    H    HIS  10           H        HIS  10  -5.245   2.215  -4.277
  213    HA   HIS  10           HA       HIS  10  -3.819   0.794  -5.260
  214    HB2  HIS  10           2HB      HIS  10  -1.960   3.173  -5.460
  215    HB3  HIS  10           3HB      HIS  10  -1.921   1.719  -6.450
  216    HD2  HIS  10           HD2      HIS  10  -4.590   1.289  -7.692
  217    HE1  HIS  10           HE1      HIS  10  -4.940   5.464  -8.498
  218    HE2  HIS  10           HE2      HIS  10  -5.832   3.152  -9.084
  219    H    LEU  11           H        LEU  11  -2.266   2.327  -2.484
  220    HA   LEU  11           HA       LEU  11   0.095   0.867  -2.360
  221    HB2  LEU  11           2HB      LEU  11  -0.562   2.810  -0.971
  222    HB3  LEU  11           3HB      LEU  11  -1.674   1.822  -0.061
  223    HG   LEU  11           HG       LEU  11   0.520   2.435   1.005
  224   HD11  LEU  11          1HD1      LEU  11   0.813   0.403   2.213
  225   HD12  LEU  11          2HD1      LEU  11  -0.913   0.596   1.853
  226   HD13  LEU  11          3HD1      LEU  11   0.071  -0.560   0.932
  227   HD21  LEU  11          3HD2      LEU  11   2.523   1.161   0.545
  228   HD22  LEU  11          1HD2      LEU  11   1.724   0.276  -0.763
  229   HD23  LEU  11          2HD2      LEU  11   2.019   2.026  -0.915
  230    H    VAL  12           H        VAL  12  -3.048  -0.132  -0.891
  231    HA   VAL  12           HA       VAL  12  -2.058  -2.555   0.218
  232    HB   VAL  12           HB       VAL  12  -4.391  -3.171   0.496
  233   HG11  VAL  12          1HG1      VAL  12  -3.322  -1.512   2.025
  234   HG12  VAL  12          2HG1      VAL  12  -4.024  -0.202   1.050
  235   HG13  VAL  12          3HG1      VAL  12  -5.083  -1.337   1.911
  236   HG21  VAL  12          3HG2      VAL  12  -6.240  -1.719  -0.235
  237   HG22  VAL  12          1HG2      VAL  12  -5.114  -0.724  -1.177
  238   HG23  VAL  12          2HG2      VAL  12  -5.401  -2.425  -1.616
  239    H    GLU  13           H        GLU  13  -3.149  -1.867  -3.043
  240    HA   GLU  13           HA       GLU  13  -3.167  -4.696  -3.875
  241    HB2  GLU  13           2HB      GLU  13  -3.072  -2.143  -5.537
  242    HB3  GLU  13           3HB      GLU  13  -3.300  -3.781  -6.152
  243    HG2  GLU  13           2HG      GLU  13  -5.405  -3.979  -4.839
  244    HG3  GLU  13           3HG      GLU  13  -5.203  -2.321  -4.265
  245    H    ALA  14           H        ALA  14  -0.921  -1.906  -4.105
  246    HA   ALA  14           HA       ALA  14   1.093  -3.140  -5.620
  247    HB1  ALA  14           3HB      ALA  14   1.337  -0.949  -3.515
  248    HB2  ALA  14           1HB      ALA  14   2.522  -1.319  -4.777
  249    HB3  ALA  14           2HB      ALA  14   0.915  -0.721  -5.228
  250    H    LEU  15           H        LEU  15   0.629  -3.275  -2.051
  251    HA   LEU  15           HA       LEU  15   3.167  -4.479  -1.473
  252    HB2  LEU  15           2HB      LEU  15   0.470  -4.815  -0.050
  253    HB3  LEU  15           3HB      LEU  15   2.011  -5.353   0.598
  254    HG   LEU  15           HG       LEU  15   1.211  -2.463   0.102
  255   HD11  LEU  15          1HD1      LEU  15   0.104  -3.527   2.027
  256   HD12  LEU  15          2HD1      LEU  15   1.690  -4.035   2.655
  257   HD13  LEU  15          3HD1      LEU  15   1.281  -2.309   2.552
  258   HD21  LEU  15          3HD2      LEU  15   3.766  -3.625   1.229
  259   HD22  LEU  15          1HD2      LEU  15   3.591  -2.650  -0.244
  260   HD23  LEU  15          2HD2      LEU  15   3.298  -1.912   1.336
  261    H    TYR  16           H        TYR  16   0.025  -6.015  -2.260
  262    HA   TYR  16           HA       TYR  16   1.120  -8.700  -2.145
  263    HB2  TYR  16           2HB      TYR  16  -1.460  -7.591  -3.278
  264    HB3  TYR  16           3HB      TYR  16  -1.090  -9.317  -3.138
  265    HD1  TYR  16           HD1      TYR  16   0.042  -9.798  -0.583
  266    HD2  TYR  16           HD2      TYR  16  -2.984  -6.901  -1.628
  267    HE1  TYR  16           HE1      TYR  16  -0.632  -9.657   1.787
  268    HE2  TYR  16           HE2      TYR  16  -3.686  -6.792   0.756
  269    HH   TYR  16           HH       TYR  16  -1.981  -8.653   3.300
  270    H    LEU  17           H        LEU  17   0.605  -6.384  -4.824
  271    HA   LEU  17           HA       LEU  17   1.315  -8.214  -6.936
  272    HB2  LEU  17           2HB      LEU  17   1.374  -5.187  -6.671
  273    HB3  LEU  17           3HB      LEU  17   1.809  -6.005  -8.164
  274    HG   LEU  17           HG       LEU  17  -0.906  -6.395  -6.828
  275   HD11  LEU  17          1HD1      LEU  17  -1.779  -4.816  -8.503
  276   HD12  LEU  17          2HD1      LEU  17  -0.617  -4.026  -7.429
  277   HD13  LEU  17          3HD1      LEU  17  -0.126  -4.492  -9.076
  278   HD21  LEU  17          3HD2      LEU  17  -1.581  -7.151  -9.080
  279   HD22  LEU  17          1HD2      LEU  17   0.089  -6.954  -9.654
  280   HD23  LEU  17          2HD2      LEU  17  -0.302  -8.174  -8.421
  281    H    VAL  18           H        VAL  18   3.315  -6.201  -4.798
  282    HA   VAL  18           HA       VAL  18   5.831  -6.870  -6.142
  283    HB   VAL  18           HB       VAL  18   5.170  -5.579  -3.471
  284   HG11  VAL  18          1HG1      VAL  18   7.900  -5.995  -4.759
  285   HG12  VAL  18          2HG1      VAL  18   7.566  -4.842  -3.450
  286   HG13  VAL  18          3HG1      VAL  18   7.351  -6.568  -3.165
  287   HG21  VAL  18          3HG2      VAL  18   4.666  -4.293  -5.567
  288   HG22  VAL  18          1HG2      VAL  18   5.885  -3.550  -4.551
  289   HG23  VAL  18          2HG2      VAL  18   6.367  -4.429  -6.031
  290    H    CYS  19           H        CYS  19   4.203  -7.979  -3.141
  291    HA   CYS  19           HA       CYS  19   6.337  -9.757  -2.413
  292    HB2  CYS  19           2HB      CYS  19   4.712  -8.578  -0.925
  293    HB3  CYS  19           3HB      CYS  19   3.453  -9.689  -1.464
  294    H    GLY  20           H        GLY  20   3.317 -10.289  -4.204
  295    HA2  GLY  20           HA2      GLY  20   2.691 -12.076  -5.555
  296    HA3  GLY  20           HA3      GLY  20   4.048 -13.042  -4.985
  297    H    GLU  21           H        GLU  21   0.859 -13.009  -5.035
  298    HA   GLU  21           HA       GLU  21  -0.906 -13.860  -3.936
  299    HB2  GLU  21           2HB      GLU  21   1.188 -15.596  -2.578
  300    HB3  GLU  21           3HB      GLU  21  -0.543 -15.819  -2.435
  301    HG2  GLU  21           2HG      GLU  21   0.123 -17.343  -4.068
  302    HG3  GLU  21           3HG      GLU  21  -0.730 -16.061  -4.912
  303    H    ARG  22           H        ARG  22  -1.987 -14.369  -1.775
  304    HA   ARG  22           HA       ARG  22  -1.879 -11.901  -0.198
  305    HB2  ARG  22           2HB      ARG  22  -3.966 -12.866  -1.116
  306    HB3  ARG  22           3HB      ARG  22  -3.744 -14.309  -0.140
  307    HG2  ARG  22           2HG      ARG  22  -5.454 -12.785   0.754
  308    HG3  ARG  22           3HG      ARG  22  -4.170 -13.098   1.903
  309    HD2  ARG  22           2HD      ARG  22  -4.886 -10.729   1.934
  310    HD3  ARG  22           3HD      ARG  22  -3.192 -10.913   1.534
  311    HE   ARG  22           HE       ARG  22  -3.553  -9.926  -0.498
  312   HH11  ARG  22          2HH2      ARG  22  -6.729 -10.842   0.676
  313   HH12  ARG  22          1HH2      ARG  22  -7.539 -10.022  -0.630
  314   HH21  ARG  22          1HH1      ARG  22  -4.646  -8.962  -2.152
  315   HH22  ARG  22          2HH1      ARG  22  -6.385  -8.982  -2.181
  316    H    GLY  23           H        GLY  23  -0.541 -15.035   0.251
  317    HA2  GLY  23           HA2      GLY  23  -0.708 -15.357   3.073
  318    HA3  GLY  23           HA3      GLY  23   0.532 -16.056   2.036
  319    H    DHI  24           H        DHI  24   0.156 -14.222   4.689
  320    HA   DHI  24           HA       DHI  24   2.241 -12.202   4.146
  321    HB2  DHI  24           2HB      DHI  24   3.467 -14.092   5.102
  322    HB3  DHI  24           3HB      DHI  24   3.481 -12.677   6.146
  323    HD2  DHI  24           HD2      DHI  24   1.780 -16.150   5.877
  324    HE1  DHI  24           HE1      DHI  24   1.583 -14.967   9.974
  325    HE2  DHI  24           HE2      DHI  24   1.110 -16.859   8.335
  326    H    PHE  25           H        PHE  25   2.225 -10.425   5.521
  327    HA   PHE  25           HA       PHE  25   0.335  -9.737   7.513
  328    HB2  PHE  25           2HB      PHE  25   2.189  -8.351   7.210
  329    HB3  PHE  25           3HB      PHE  25   2.005  -8.319   5.467
  330    HD1  PHE  25           HD1      PHE  25   0.233  -7.082   8.558
  331    HD2  PHE  25           HD2      PHE  25   1.206  -6.443   4.403
  332    HE1  PHE  25           HE1      PHE  25  -0.863  -4.854   8.633
  333    HE2  PHE  25           HE2      PHE  25   0.167  -4.202   4.496
  334    HZ   PHE  25           HZ       PHE  25  -0.897  -3.407   6.608
  335    H    TYR  26           H        TYR  26  -1.633  -8.752   7.514
  336    HA   TYR  26           HA       TYR  26  -3.319  -8.874   5.043
  337    HB2  TYR  26           2HB      TYR  26  -4.067 -10.407   6.713
  338    HB3  TYR  26           3HB      TYR  26  -3.968  -9.184   7.976
  339    HD1  TYR  26           HD2      TYR  26  -5.707  -9.949   4.734
  340    HD2  TYR  26           HD1      TYR  26  -5.835  -7.815   8.485
  341    HE1  TYR  26           HE2      TYR  26  -8.034  -9.216   4.243
  342    HE2  TYR  26           HE1      TYR  26  -8.166  -7.104   8.007
  343    HH   TYR  26           HH       TYR  26  -9.938  -7.224   6.545
  344    H    THR  27           H        THR  27  -3.904  -6.967   4.172
  345    HA   THR  27           HA       THR  27  -3.782  -4.457   5.694
  346    HB   THR  27           HB       THR  27  -4.579  -3.426   3.577
  347    HG1  THR  27           HG1      THR  27  -5.589  -5.349   2.770
  348   HG21  THR  27          1HG2      THR  27  -2.493  -3.826   2.301
  349   HG22  THR  27          2HG2      THR  27  -2.186  -3.549   4.026
  350   HG23  THR  27          3HG2      THR  27  -2.108  -5.197   3.356
  351    HA   PRO  28           HA       PRO  28  -8.207  -5.022   6.659
  352    HB2  PRO  28           2HB      PRO  28  -8.513  -3.081   8.540
  353    HB3  PRO  28           3HB      PRO  28  -7.666  -4.624   8.873
  354    HG2  PRO  28           2HG      PRO  28  -6.440  -1.947   8.144
  355    HG3  PRO  28           3HG      PRO  28  -5.979  -3.059   9.476
  356    HD2  PRO  28           2HD      PRO  28  -4.679  -3.011   7.064
  357    HD3  PRO  28           3HD      PRO  28  -4.886  -4.517   8.009
  358    H    LYS  29           H        LYS  29 -10.142  -3.799   6.353
  359    HA   LYS  29           HA       LYS  29 -10.000  -1.202   4.938
  360    HB2  LYS  29           2HB      LYS  29  -9.803  -2.926   3.178
  361    HB3  LYS  29           3HB      LYS  29 -11.232  -3.746   3.794
  362    HG2  LYS  29           2HG      LYS  29 -11.802  -2.546   1.804
  363    HG3  LYS  29           3HG      LYS  29 -12.637  -1.808   3.163
  364    HD2  LYS  29           2HD      LYS  29 -10.837  -0.018   3.214
  365    HD3  LYS  29           3HD      LYS  29 -10.133  -0.739   1.766
  366    HE2  LYS  29           2HE      LYS  29 -12.979   0.351   2.022
  367    HE3  LYS  29           3HE      LYS  29 -11.615   1.253   1.358
  368    HZ1  LYS  29           HZ1      LYS  29 -11.430  -0.436  -0.397
  369    HZ2  LYS  29           HZ2      LYS  29 -12.724  -1.245   0.195
  370    HZ3  LYS  29           HZ3      LYS  29 -12.907   0.255  -0.413
  371    H    THR  30           H        THR  30 -11.716   0.058   5.244
  372    HA   THR  30           HA       THR  30 -13.411   1.040   6.375
  373    HB   THR  30           HB       THR  30 -15.018  -1.372   5.508
  374    HG1  THR  30           HG1      THR  30 -15.215  -0.202   3.580
  375   HG21  THR  30          1HG2      THR  30 -16.798   0.333   5.189
  376   HG22  THR  30          2HG2      THR  30 -16.282   0.302   6.877
  377   HG23  THR  30          3HG2      THR  30 -15.712   1.599   5.808
  Start of MODEL    7
    1    H1   GLY   1           1H       GLY   1  -2.814  -2.792  14.400
    2    H2   GLY   1           2H       GLY   1  -2.681  -1.162  14.440
    3    H3   GLY   1           3H       GLY   1  -4.108  -1.856  14.031
    4    HA2  GLY   1           HA2      GLY   1  -3.177  -2.771  12.017
    5    HA3  GLY   1           HA3      GLY   1  -3.018  -1.006  12.063
    6    H    ILE   2           H        ILE   2  -1.325  -1.583  10.411
    7    HA   ILE   2           HA       ILE   2   1.136  -2.808  11.284
    8    HB   ILE   2           HB       ILE   2   0.336  -2.904   8.973
    9   HG12  ILE   2          2HG1      ILE   2   2.405  -2.444   7.764
   10   HG13  ILE   2          3HG1      ILE   2   3.042  -1.519   9.119
   11   HG21  ILE   2          1HG2      ILE   2   0.558  -0.992   7.439
   12   HG22  ILE   2          2HG2      ILE   2  -0.628  -0.657   8.705
   13   HG23  ILE   2          3HG2      ILE   2   0.992   0.065   8.789
   14   HD11  ILE   2          3HD1      ILE   2   3.079  -3.573  10.513
   15   HD12  ILE   2          1HD1      ILE   2   2.315  -4.486   9.190
   16   HD13  ILE   2          2HD1      ILE   2   3.953  -3.831   8.998
   17    H    VAL   3           H        VAL   3   3.140  -1.893  11.733
   18    HA   VAL   3           HA       VAL   3   2.939   0.533  13.314
   19    HB   VAL   3           HB       VAL   3   5.243  -0.013  14.032
   20   HG11  VAL   3          1HG1      VAL   3   3.319  -2.373  14.145
   21   HG12  VAL   3          2HG1      VAL   3   4.663  -2.037  15.255
   22   HG13  VAL   3          3HG1      VAL   3   3.275  -0.939  15.193
   23   HG21  VAL   3          3HG2      VAL   3   6.313  -2.095  13.387
   24   HG22  VAL   3          1HG2      VAL   3   5.001  -2.495  12.268
   25   HG23  VAL   3          2HG2      VAL   3   6.068  -1.113  11.939
   26    H    GLU   4           H        GLU   4   3.910   0.093  10.095
   27    HA   GLU   4           HA       GLU   4   4.988   2.853   9.938
   28    HB2  GLU   4           2HB      GLU   4   6.350   0.389   8.764
   29    HB3  GLU   4           3HB      GLU   4   6.725   2.053   8.309
   30    HG2  GLU   4           2HG      GLU   4   7.393   2.545  10.648
   31    HG3  GLU   4           3HG      GLU   4   7.084   0.863  11.088
   32    H    GLN   5           H        GLN   5   4.833   3.738   7.735
   33    HA   GLN   5           HA       GLN   5   3.203   2.246   5.793
   34    HB2  GLN   5           2HB      GLN   5   1.414   3.763   5.669
   35    HB3  GLN   5           3HB      GLN   5   1.570   3.313   7.354
   36    HG2  GLN   5           2HG      GLN   5   2.439   5.960   6.100
   37    HG3  GLN   5           3HG      GLN   5   1.015   5.683   7.079
   38   HE21  GLN   5          2HE2      GLN   5   4.542   6.068   7.171
   39   HE22  GLN   5          1HE2      GLN   5   4.602   6.330   8.916
   40    H    CYS   6           H        CYS   6   3.332   2.938   3.698
   41    HA   CYS   6           HA       CYS   6   5.526   4.792   3.039
   42    HB2  CYS   6           2HB      CYS   6   4.179   2.476   1.762
   43    HB3  CYS   6           3HB      CYS   6   4.711   3.736   0.663
   44    H    CYS   7           H        CYS   7   2.541   5.579   3.769
   45    HA   CYS   7           HA       CYS   7   1.252   6.653   1.596
   46    HB2  CYS   7           2HB      CYS   7   1.348   7.619   4.481
   47    HB3  CYS   7           3HB      CYS   7   0.145   8.156   3.317
   48    H    THR   8           H        THR   8   4.082   8.099   3.061
   49    HA   THR   8           HA       THR   8   3.638  10.771   1.928
   50    HB   THR   8           HB       THR   8   5.946  11.166   2.906
   51    HG1  THR   8           HG1      THR   8   6.704   9.578   4.301
   52   HG21  THR   8          1HG2      THR   8   3.869  11.707   4.154
   53   HG22  THR   8          2HG2      THR   8   3.850  10.064   4.833
   54   HG23  THR   8          3HG2      THR   8   5.177  11.180   5.227
   55    H    SER   9           H        SER   9   4.888   7.864   0.603
   56    HA   SER   9           HA       SER   9   6.503   9.356  -1.433
   57    HB2  SER   9           2HB      SER   9   7.412   6.961   0.201
   58    HB3  SER   9           3HB      SER   9   8.275   7.626  -1.195
   59    HG   SER   9           HG       SER   9   9.084   8.433   0.806
   60    H    ILE  10           H        ILE  10   6.983   8.247  -3.348
   61    HA   ILE  10           HA       ILE  10   5.157   6.038  -4.132
   62    HB   ILE  10           HB       ILE  10   7.224   7.378  -5.901
   63   HG12  ILE  10          2HG1      ILE  10   4.345   8.243  -5.428
   64   HG13  ILE  10          3HG1      ILE  10   5.798   9.173  -5.070
   65   HG21  ILE  10          1HG2      ILE  10   4.603   5.953  -6.582
   66   HG22  ILE  10          2HG2      ILE  10   5.859   6.477  -7.711
   67   HG23  ILE  10          3HG2      ILE  10   6.185   5.157  -6.595
   68   HD11  ILE  10          3HD1      ILE  10   4.866  10.074  -7.057
   69   HD12  ILE  10          1HD1      ILE  10   6.343   9.210  -7.518
   70   HD13  ILE  10          2HD1      ILE  10   4.741   8.488  -7.826
   71    H    CYS  11           H        CYS  11   6.243   4.873  -2.297
   72    HA   CYS  11           HA       CYS  11   8.939   4.253  -2.089
   73    HB2  CYS  11           2HB      CYS  11   6.447   2.721  -1.299
   74    HB3  CYS  11           3HB      CYS  11   8.044   2.090  -0.962
   75    H    SER  12           H        SER  12  10.323   2.634  -2.710
   76    HA   SER  12           HA       SER  12   9.798   1.151  -5.184
   77    HB2  SER  12           2HB      SER  12  12.169   1.119  -3.279
   78    HB3  SER  12           3HB      SER  12  12.102   0.308  -4.855
   79    HG   SER  12           HG       SER  12  13.104   2.381  -4.974
   80    H    LEU  13           H        LEU  13   9.991  -1.199  -5.383
   81    HA   LEU  13           HA       LEU  13   8.358  -2.600  -3.584
   82    HB2  LEU  13           2HB      LEU  13   8.790  -4.533  -4.796
   83    HB3  LEU  13           3HB      LEU  13   8.657  -3.194  -5.925
   84    HG   LEU  13           HG       LEU  13  11.238  -4.602  -5.083
   85   HD11  LEU  13          1HD1      LEU  13   9.634  -4.733  -7.669
   86   HD12  LEU  13          2HD1      LEU  13  11.173  -5.563  -7.343
   87   HD13  LEU  13          3HD1      LEU  13   9.723  -6.006  -6.431
   88   HD21  LEU  13          3HD2      LEU  13  11.811  -2.329  -5.791
   89   HD22  LEU  13          1HD2      LEU  13  12.238  -3.455  -7.070
   90   HD23  LEU  13          2HD2      LEU  13  10.763  -2.481  -7.228
   91    H    TYR  14           H        TYR  14  11.885  -2.394  -3.525
   92    HA   TYR  14           HA       TYR  14  12.492  -4.358  -1.571
   93    HB2  TYR  14           2HB      TYR  14  14.197  -3.189  -2.830
   94    HB3  TYR  14           3HB      TYR  14  13.666  -1.627  -2.221
   95    HD1  TYR  14           HD2      TYR  14  15.425  -4.780  -1.316
   96    HD2  TYR  14           HD1      TYR  14  14.334  -0.797  -0.053
   97    HE1  TYR  14           HE2      TYR  14  17.012  -4.945   0.606
   98    HE2  TYR  14           HE1      TYR  14  15.882  -0.977   1.877
   99    HH   TYR  14           HH       TYR  14  17.423  -2.282   2.973
  100    H    GLN  15           H        GLN  15  10.904  -1.231  -1.217
  101    HA   GLN  15           HA       GLN  15  11.282  -1.127   1.717
  102    HB2  GLN  15           2HB      GLN  15   9.566   0.655  -0.053
  103    HB3  GLN  15           3HB      GLN  15  10.033   0.942   1.619
  104    HG2  GLN  15           2HG      GLN  15  12.425   1.085   0.919
  105    HG3  GLN  15           3HG      GLN  15  11.935   0.834  -0.763
  106   HE21  GLN  15          2HE2      GLN  15  11.630   3.136   1.997
  107   HE22  GLN  15          1HE2      GLN  15  11.252   4.502   0.959
  108    H    LEU  16           H        LEU  16   8.823  -2.049  -0.651
  109    HA   LEU  16           HA       LEU  16   6.624  -2.253   1.217
  110    HB2  LEU  16           2HB      LEU  16   6.971  -3.680  -1.451
  111    HB3  LEU  16           3HB      LEU  16   5.491  -3.486  -0.537
  112    HG   LEU  16           HG       LEU  16   6.992  -1.445  -2.161
  113   HD11  LEU  16          1HD1      LEU  16   5.160  -2.843  -3.121
  114   HD12  LEU  16          2HD1      LEU  16   4.038  -2.086  -1.976
  115   HD13  LEU  16          3HD1      LEU  16   4.893  -1.101  -3.193
  116   HD21  LEU  16          3HD2      LEU  16   5.448   0.322  -1.284
  117   HD22  LEU  16          1HD2      LEU  16   4.901  -0.803  -0.024
  118   HD23  LEU  16          2HD2      LEU  16   6.582  -0.220  -0.054
  119    H    GLU  17           H        GLU  17   9.131  -4.563   0.234
  120    HA   GLU  17           HA       GLU  17   8.036  -6.911   1.364
  121    HB2  GLU  17           2HB      GLU  17  10.925  -6.009   1.078
  122    HB3  GLU  17           3HB      GLU  17  10.455  -7.616   1.645
  123    HG2  GLU  17           2HG      GLU  17   9.182  -8.001  -0.452
  124    HG3  GLU  17           3HG      GLU  17   9.709  -6.434  -1.060
  125    H    ASN  18           H        ASN  18   9.248  -4.122   3.087
  126    HA   ASN  18           HA       ASN  18   9.788  -5.211   5.664
  127    HB2  ASN  18           2HB      ASN  18  10.219  -2.858   4.848
  128    HB3  ASN  18           3HB      ASN  18   8.476  -2.575   4.869
  129   HD21  ASN  18          2HD2      ASN  18   8.477  -0.943   6.398
  130   HD22  ASN  18          1HD2      ASN  18   9.009  -1.167   8.063
  131    H    TYR  19           H        TYR  19   6.729  -4.637   3.983
  132    HA   TYR  19           HA       TYR  19   5.073  -5.142   6.368
  133    HB2  TYR  19           2HB      TYR  19   4.262  -4.691   3.488
  134    HB3  TYR  19           3HB      TYR  19   3.222  -4.573   4.892
  135    HD1  TYR  19           HD1      TYR  19   4.588  -2.923   6.815
  136    HD2  TYR  19           HD2      TYR  19   4.650  -2.574   2.519
  137    HE1  TYR  19           HE1      TYR  19   5.225  -0.542   7.014
  138    HE2  TYR  19           HE2      TYR  19   5.301  -0.182   2.722
  139    HH   TYR  19           HH       TYR  19   5.856   1.364   5.901
  140    H    CYS  20           H        CYS  20   6.732  -7.129   4.306
  141    HA   CYS  20           HA       CYS  20   4.680  -9.308   4.310
  142    HB2  CYS  20           2HB      CYS  20   7.083  -9.051   2.488
  143    HB3  CYS  20           3HB      CYS  20   5.668 -10.084   2.300
  144    H    ASN  21           H        ASN  21   8.072  -8.533   5.066
  145    HA   ASN  21           HA       ASN  21   8.972 -11.183   5.625
  146    HB2  ASN  21           2HB      ASN  21  10.416  -9.227   5.112
  147    HB3  ASN  21           3HB      ASN  21   9.963  -8.483   6.646
  148   HD21  ASN  21          2HD2      ASN  21  12.504  -8.582   6.585
  149   HD22  ASN  21          1HD2      ASN  21  13.182  -9.993   7.387
  150    H1   PHE   1           H        PHE   1   7.674   2.619  -6.131
  151    HA   PHE   1           HA       PHE   1   7.461   0.917  -8.521
  152    HB2  PHE   1           2HB      PHE   1   8.033  -0.006  -6.290
  153    HB3  PHE   1           3HB      PHE   1   6.473   0.532  -5.675
  154    HD1  PHE   1           HD2      PHE   1   8.047  -1.743  -8.216
  155    HD2  PHE   1           HD1      PHE   1   4.561  -0.797  -5.865
  156    HE1  PHE   1           HE2      PHE   1   6.983  -3.875  -8.923
  157    HE2  PHE   1           HE1      PHE   1   3.495  -2.911  -6.574
  158    HZ   PHE   1           HZ       PHE   1   4.711  -4.459  -8.120
  159    H    VAL   2           H        VAL   2   5.338  -0.120  -8.969
  160    HA   VAL   2           HA       VAL   2   3.456   1.764  -9.957
  161    HB   VAL   2           HB       VAL   2   3.215  -1.249  -9.579
  162   HG11  VAL   2          1HG1      VAL   2   1.678   0.547 -11.508
  163   HG12  VAL   2          2HG1      VAL   2   1.558  -1.214 -11.363
  164   HG13  VAL   2          3HG1      VAL   2   0.993  -0.195 -10.041
  165   HG21  VAL   2          3HG2      VAL   2   4.158   0.392 -11.971
  166   HG22  VAL   2          1HG2      VAL   2   5.157  -0.692 -10.977
  167   HG23  VAL   2          2HG2      VAL   2   3.868  -1.361 -11.974
  168    H    ASN   3           H        ASN   3   1.029   2.076  -7.304
  169    HA   ASN   3           HA       ASN   3   2.881   3.663  -8.862
  170    HB2  ASN   3           2HB      ASN   3   1.581   2.688 -10.720
  171    HB3  ASN   3           3HB      ASN   3   0.066   3.079  -9.904
  172   HD21  ASN   3          2HD2      ASN   3   3.016   4.600 -11.331
  173   HD22  ASN   3          1HD2      ASN   3   2.167   6.060 -11.805
  174    H    GLN   4           H        GLN   4   2.399   5.928  -8.641
  175    HA   GLN   4           HA       GLN   4   1.970   7.761  -7.415
  176    HB2  GLN   4           2HB      GLN   4  -0.373   7.178  -8.246
  177    HB3  GLN   4           3HB      GLN   4  -0.711   6.593  -6.616
  178    HG2  GLN   4           2HG      GLN   4  -0.360   8.839  -5.702
  179    HG3  GLN   4           3HG      GLN   4   0.228   9.421  -7.267
  180   HE21  GLN   4          2HE2      GLN   4  -2.699   8.012  -5.659
  181   HE22  GLN   4          1HE2      GLN   4  -3.823   8.867  -6.707
  182    H    HIS   5           H        HIS   5   1.400   8.575  -5.049
  183    HA   HIS   5           HA       HIS   5   3.250   7.367  -3.316
  184    HB2  HIS   5           2HB      HIS   5   0.976   9.264  -2.619
  185    HB3  HIS   5           3HB      HIS   5   2.412   8.947  -1.639
  186    HD2  HIS   5           HD2      HIS   5   4.460  10.506  -2.076
  187    HE1  HIS   5           HE1      HIS   5   3.483  11.947  -5.963
  188    HE2  HIS   5           HE2      HIS   5   5.143  12.121  -4.038
  189    H    LEU   6           H        LEU   6   3.177   5.697  -1.934
  190    HA   LEU   6           HA       LEU   6   0.818   4.020  -2.322
  191    HB2  LEU   6           2HB      LEU   6   3.584   3.404  -1.261
  192    HB3  LEU   6           3HB      LEU   6   2.299   2.213  -1.461
  193    HG   LEU   6           HG       LEU   6   3.575   3.837  -3.703
  194   HD11  LEU   6          1HD1      LEU   6   4.440   1.652  -4.436
  195   HD12  LEU   6          2HD1      LEU   6   5.028   2.078  -2.832
  196   HD13  LEU   6          3HD1      LEU   6   3.716   0.887  -3.001
  197   HD21  LEU   6          3HD2      LEU   6   1.420   1.670  -3.785
  198   HD22  LEU   6          1HD2      LEU   6   1.255   3.358  -4.330
  199   HD23  LEU   6          2HD2      LEU   6   2.313   2.262  -5.202
  200    H    CYS   7           H        CYS   7  -0.677   4.971  -1.100
  201    HA   CYS   7           HA       CYS   7  -0.696   4.136   1.766
  202    HB2  CYS   7           2HB      CYS   7  -0.765   6.712   1.036
  203    HB3  CYS   7           3HB      CYS   7  -2.436   6.348   0.672
  204    H    GLY   8           H        GLY   8  -2.831   3.419   2.538
  205    HA2  GLY   8           HA2      GLY   8  -4.799   2.200   2.383
  206    HA3  GLY   8           HA3      GLY   8  -5.224   3.471   1.242
  207    H    SER   9           H        SER   9  -6.154   2.608  -0.522
  208    HA   SER   9           HA       SER   9  -5.945  -0.119  -1.325
  209    HB2  SER   9           2HB      SER   9  -7.175   0.653  -3.354
  210    HB3  SER   9           3HB      SER   9  -7.920   1.120  -1.816
  211    HG   SER   9           HG       SER   9  -7.855   2.863  -3.321
  212    H    HIS  10           H        HIS  10  -4.098   2.753  -2.443
  213    HA   HIS  10           HA       HIS  10  -2.833   1.418  -4.677
  214    HB2  HIS  10           2HB      HIS  10  -1.860   3.772  -3.000
  215    HB3  HIS  10           3HB      HIS  10  -1.151   3.224  -4.511
  216    HD2  HIS  10           HD2      HIS  10  -2.351   3.849  -6.787
  217    HE1  HIS  10           HE1      HIS  10  -5.479   6.253  -5.160
  218    HE2  HIS  10           HE2      HIS  10  -4.318   5.526  -7.309
  219    H    LEU  11           H        LEU  11  -1.952   1.729  -1.226
  220    HA   LEU  11           HA       LEU  11   0.548   0.299  -1.463
  221    HB2  LEU  11           2HB      LEU  11  -0.005   1.828   0.394
  222    HB3  LEU  11           3HB      LEU  11  -1.275   0.742   0.937
  223    HG   LEU  11           HG       LEU  11   0.379  -0.975   1.504
  224   HD11  LEU  11          1HD1      LEU  11   2.478   1.057   0.622
  225   HD12  LEU  11          2HD1      LEU  11   2.802  -0.449   1.505
  226   HD13  LEU  11          3HD1      LEU  11   2.165  -0.525  -0.137
  227   HD21  LEU  11          3HD2      LEU  11   1.095   1.767   2.619
  228   HD22  LEU  11          1HD2      LEU  11  -0.235   0.726   3.176
  229   HD23  LEU  11          2HD2      LEU  11   1.442   0.198   3.385
  230    H    VAL  12           H        VAL  12  -2.793  -0.755  -0.702
  231    HA   VAL  12           HA       VAL  12  -2.181  -3.526  -0.261
  232    HB   VAL  12           HB       VAL  12  -4.715  -2.091  -1.105
  233   HG11  VAL  12          1HG1      VAL  12  -4.363  -5.044  -0.472
  234   HG12  VAL  12          2HG1      VAL  12  -5.926  -4.197  -0.493
  235   HG13  VAL  12          3HG1      VAL  12  -4.990  -4.339  -1.980
  236   HG21  VAL  12          3HG2      VAL  12  -5.399  -2.555   1.194
  237   HG22  VAL  12          1HG2      VAL  12  -3.916  -3.487   1.488
  238   HG23  VAL  12          2HG2      VAL  12  -3.835  -1.735   1.223
  239    H    GLU  13           H        GLU  13  -3.212  -1.861  -3.307
  240    HA   GLU  13           HA       GLU  13  -3.002  -4.149  -5.018
  241    HB2  GLU  13           2HB      GLU  13  -2.534  -1.179  -5.503
  242    HB3  GLU  13           3HB      GLU  13  -2.386  -2.366  -6.786
  243    HG2  GLU  13           2HG      GLU  13  -4.932  -2.022  -5.130
  244    HG3  GLU  13           3HG      GLU  13  -4.621  -1.168  -6.637
  245    H    ALA  14           H        ALA  14  -0.498  -1.716  -4.130
  246    HA   ALA  14           HA       ALA  14   1.548  -2.868  -5.695
  247    HB1  ALA  14           3HB      ALA  14   3.020  -1.448  -4.373
  248    HB2  ALA  14           1HB      ALA  14   1.547  -0.572  -4.789
  249    HB3  ALA  14           2HB      ALA  14   1.761  -1.216  -3.142
  250    H    LEU  15           H        LEU  15   0.629  -3.538  -2.283
  251    HA   LEU  15           HA       LEU  15   2.740  -5.463  -1.882
  252    HB2  LEU  15           2HB      LEU  15   0.159  -4.780  -0.432
  253    HB3  LEU  15           3HB      LEU  15   1.172  -6.124   0.087
  254    HG   LEU  15           HG       LEU  15   2.306  -3.320  -0.214
  255   HD11  LEU  15          1HD1      LEU  15   1.289  -4.638   2.338
  256   HD12  LEU  15          2HD1      LEU  15   2.045  -3.039   2.185
  257   HD13  LEU  15          3HD1      LEU  15   0.451  -3.338   1.468
  258   HD21  LEU  15          3HD2      LEU  15   3.918  -5.259  -0.152
  259   HD22  LEU  15          1HD2      LEU  15   4.049  -4.212   1.248
  260   HD23  LEU  15          2HD2      LEU  15   3.199  -5.759   1.387
  261    H    TYR  16           H        TYR  16  -0.586  -5.854  -3.182
  262    HA   TYR  16           HA       TYR  16  -0.345  -8.733  -3.318
  263    HB2  TYR  16           2HB      TYR  16  -2.080  -6.714  -4.743
  264    HB3  TYR  16           3HB      TYR  16  -2.042  -8.391  -5.262
  265    HD1  TYR  16           HD1      TYR  16  -2.095 -10.140  -3.125
  266    HD2  TYR  16           HD2      TYR  16  -3.963  -6.257  -3.366
  267    HE1  TYR  16           HE1      TYR  16  -3.700 -10.809  -1.367
  268    HE2  TYR  16           HE2      TYR  16  -5.619  -6.959  -1.641
  269    HH   TYR  16           HH       TYR  16  -6.347  -8.656  -0.269
  270    H    LEU  17           H        LEU  17   0.777  -6.139  -5.518
  271    HA   LEU  17           HA       LEU  17   1.700  -7.984  -7.558
  272    HB2  LEU  17           2HB      LEU  17   2.423  -5.102  -6.930
  273    HB3  LEU  17           3HB      LEU  17   3.020  -5.980  -8.334
  274    HG   LEU  17           HG       LEU  17   0.058  -5.492  -7.818
  275   HD11  LEU  17          1HD1      LEU  17   1.259  -3.362  -8.139
  276   HD12  LEU  17          2HD1      LEU  17   2.009  -3.995  -9.620
  277   HD13  LEU  17          3HD1      LEU  17   0.251  -3.742  -9.541
  278   HD21  LEU  17          3HD2      LEU  17  -0.157  -6.031 -10.223
  279   HD22  LEU  17          1HD2      LEU  17   1.576  -6.415 -10.294
  280   HD23  LEU  17          2HD2      LEU  17   0.473  -7.403  -9.308
  281    H    VAL  18           H        VAL  18   3.389  -6.461  -4.777
  282    HA   VAL  18           HA       VAL  18   5.939  -7.710  -5.497
  283    HB   VAL  18           HB       VAL  18   5.106  -6.089  -3.063
  284   HG11  VAL  18          1HG1      VAL  18   7.906  -6.880  -3.985
  285   HG12  VAL  18          2HG1      VAL  18   7.523  -5.718  -2.693
  286   HG13  VAL  18          3HG1      VAL  18   7.116  -7.417  -2.490
  287   HG21  VAL  18          3HG2      VAL  18   5.030  -4.806  -5.152
  288   HG22  VAL  18          1HG2      VAL  18   6.439  -4.310  -4.221
  289   HG23  VAL  18          2HG2      VAL  18   6.633  -5.391  -5.616
  290    H    CYS  19           H        CYS  19   3.470  -8.332  -3.017
  291    HA   CYS  19           HA       CYS  19   4.969 -10.766  -2.118
  292    HB2  CYS  19           2HB      CYS  19   3.287  -8.821  -0.518
  293    HB3  CYS  19           3HB      CYS  19   4.121 -10.239   0.116
  294    H    GLY  20           H        GLY  20   2.031  -9.925  -3.614
  295    HA2  GLY  20           HA2      GLY  20   0.406 -12.048  -2.335
  296    HA3  GLY  20           HA3      GLY  20  -0.061 -10.992  -3.667
  297    H    GLU  21           H        GLU  21   2.187 -11.511  -5.371
  298    HA   GLU  21           HA       GLU  21   1.975 -14.414  -6.051
  299    HB2  GLU  21           2HB      GLU  21   0.359 -13.061  -7.347
  300    HB3  GLU  21           3HB      GLU  21   1.697 -12.132  -8.029
  301    HG2  GLU  21           2HG      GLU  21   2.639 -14.242  -8.992
  302    HG3  GLU  21           3HG      GLU  21   1.325 -15.159  -8.256
  303    H    ARG  22           H        ARG  22   5.565 -14.077  -6.088
  304    HA   ARG  22           HA       ARG  22   3.303 -14.679  -4.321
  305    HB2  ARG  22           2HB      ARG  22   3.379 -16.354  -6.334
  306    HB3  ARG  22           3HB      ARG  22   4.864 -16.955  -5.622
  307    HG2  ARG  22           2HG      ARG  22   3.029 -18.390  -4.988
  308    HG3  ARG  22           3HG      ARG  22   3.580 -17.545  -3.538
  309    HD2  ARG  22           2HD      ARG  22   1.725 -15.900  -3.845
  310    HD3  ARG  22           3HD      ARG  22   1.166 -16.796  -5.265
  311    HE   ARG  22           HE       ARG  22   1.127 -18.712  -3.329
  312   HH11  ARG  22          1HH2      ARG  22  -0.233 -15.456  -3.372
  313   HH12  ARG  22          2HH2      ARG  22  -1.532 -15.907  -2.300
  314   HH21  ARG  22          2HH1      ARG  22  -0.567 -19.187  -1.962
  315   HH22  ARG  22          1HH1      ARG  22  -1.707 -17.952  -1.522
  316    H    GLY  23           H        GLY  23   5.746 -15.153  -1.762
  317    HA2  GLY  23           HA2      GLY  23   3.074 -14.201  -2.275
  318    HA3  GLY  23           HA3      GLY  23   3.089 -15.939  -1.960
  319    H    DHI  24           H        DHI  24   1.662 -14.489  -0.312
  320    HA   DHI  24           HA       DHI  24   3.204 -14.403   2.252
  321    HB2  DHI  24           2HB      DHI  24   1.428 -15.752   3.280
  322    HB3  DHI  24           3HB      DHI  24   0.592 -15.862   1.732
  323    HD2  DHI  24           HD2      DHI  24   1.499 -17.644  -0.021
  324    HE1  DHI  24           HE1      DHI  24   4.672 -19.263   2.328
  325    HE2  DHI  24           HE2      DHI  24   3.312 -19.555   0.196
  326    H    PHE  25           H        PHE  25   1.791 -12.223   0.473
  327    HA   PHE  25           HA       PHE  25   0.579 -10.792   2.745
  328    HB2  PHE  25           2HB      PHE  25   2.019  -9.534   1.317
  329    HB3  PHE  25           3HB      PHE  25   1.098  -9.988  -0.120
  330    HD1  PHE  25           HD1      PHE  25   0.988  -7.952   3.024
  331    HD2  PHE  25           HD2      PHE  25  -0.912  -8.841  -0.753
  332    HE1  PHE  25           HE1      PHE  25  -0.561  -6.040   3.340
  333    HE2  PHE  25           HE2      PHE  25  -2.430  -6.903  -0.443
  334    HZ   PHE  25           HZ       PHE  25  -2.271  -5.514   1.610
  335    H    TYR  26           H        TYR  26  -1.493 -10.365   3.115
  336    HA   TYR  26           HA       TYR  26  -3.562 -10.514   1.079
  337    HB2  TYR  26           2HB      TYR  26  -3.521 -12.870   1.803
  338    HB3  TYR  26           3HB      TYR  26  -3.659 -12.378   3.487
  339    HD1  TYR  26           HD2      TYR  26  -5.413 -12.285   0.182
  340    HD2  TYR  26           HD1      TYR  26  -5.826 -11.953   4.469
  341    HE1  TYR  26           HE2      TYR  26  -7.883 -12.239  -0.059
  342    HE2  TYR  26           HE1      TYR  26  -8.298 -11.947   4.224
  343    HH   TYR  26           HH       TYR  26  -9.905 -12.145   1.022
  344    H    THR  27           H        THR  27  -5.211  -9.148   1.536
  345    HA   THR  27           HA       THR  27  -5.813  -8.385   4.315
  346    HB   THR  27           HB       THR  27  -6.282  -6.005   3.595
  347    HG1  THR  27           HG1      THR  27  -5.961  -6.468   1.326
  348   HG21  THR  27          1HG2      THR  27  -4.388  -6.541   5.063
  349   HG22  THR  27          2HG2      THR  27  -3.361  -6.836   3.644
  350   HG23  THR  27          3HG2      THR  27  -4.006  -5.211   3.954
  351    HA   PRO  28           HA       PRO  28  -9.751  -9.306   2.406
  352    HB2  PRO  28           2HB      PRO  28 -11.397  -9.273   4.564
  353    HB3  PRO  28           3HB      PRO  28 -10.093 -10.471   4.373
  354    HG2  PRO  28           2HG      PRO  28  -9.998  -7.889   5.965
  355    HG3  PRO  28           3HG      PRO  28  -9.535  -9.540   6.497
  356    HD2  PRO  28           2HD      PRO  28  -7.708  -7.725   5.562
  357    HD3  PRO  28           3HD      PRO  28  -7.543  -9.486   5.284
  358    H    LYS  29           H        LYS  29  -9.219  -7.107   1.341
  359    HA   LYS  29           HA       LYS  29 -11.123  -4.916   2.046
  360    HB2  LYS  29           2HB      LYS  29  -8.966  -5.059  -0.092
  361    HB3  LYS  29           3HB      LYS  29  -9.916  -3.639   0.314
  362    HG2  LYS  29           2HG      LYS  29  -7.866  -4.993   2.124
  363    HG3  LYS  29           3HG      LYS  29  -7.656  -3.522   1.193
  364    HD2  LYS  29           2HD      LYS  29  -8.039  -2.651   3.267
  365    HD3  LYS  29           3HD      LYS  29  -9.661  -2.576   2.574
  366    HE2  LYS  29           2HE      LYS  29 -10.223  -4.712   3.783
  367    HE3  LYS  29           3HE      LYS  29  -8.584  -4.753   4.438
  368    HZ1  LYS  29           HZ1      LYS  29 -10.158  -3.777   6.013
  369    HZ2  LYS  29           HZ2      LYS  29  -9.061  -2.650   5.578
  370    HZ3  LYS  29           HZ3      LYS  29 -10.573  -2.605   4.960
  371    H    THR  30           H        THR  30 -12.406  -3.942   0.459
  372    HA   THR  30           HA       THR  30 -14.251  -3.956  -0.851
  373    HB   THR  30           HB       THR  30 -12.538  -5.424  -2.865
  374    HG1  THR  30           HG1      THR  30 -11.768  -3.368  -3.357
  375   HG21  THR  30          1HG2      THR  30 -14.895  -4.986  -3.581
  376   HG22  THR  30          2HG2      THR  30 -14.705  -3.277  -3.140
  377   HG23  THR  30          3HG2      THR  30 -13.754  -3.974  -4.471
  Start of MODEL    8
    1    H1   GLY   1           1H       GLY   1  -2.867  -3.836   9.591
    2    H2   GLY   1           2H       GLY   1  -3.436  -4.583   8.254
    3    H3   GLY   1           3H       GLY   1  -1.912  -4.908   8.796
    4    HA2  GLY   1           HA2      GLY   1  -1.705  -3.506   6.903
    5    HA3  GLY   1           HA3      GLY   1  -2.880  -2.384   7.623
    6    H    ILE   2           H        ILE   2   0.113  -2.213   6.843
    7    HA   ILE   2           HA       ILE   2   1.435  -1.506   9.334
    8    HB   ILE   2           HB       ILE   2   3.228  -0.634   8.022
    9   HG12  ILE   2          2HG1      ILE   2   2.066   0.379   6.105
   10   HG13  ILE   2          3HG1      ILE   2   3.455  -0.597   5.694
   11   HG21  ILE   2          1HG2      ILE   2   3.106  -2.974   8.571
   12   HG22  ILE   2          2HG2      ILE   2   2.292  -3.334   7.035
   13   HG23  ILE   2          3HG2      ILE   2   3.961  -2.717   7.041
   14   HD11  ILE   2          3HD1      ILE   2   1.961  -2.429   4.911
   15   HD12  ILE   2          1HD1      ILE   2   0.549  -1.395   5.269
   16   HD13  ILE   2          2HD1      ILE   2   1.724  -0.905   4.047
   17    H    VAL   3           H        VAL   3   2.331   0.626   9.785
   18    HA   VAL   3           HA       VAL   3   0.177   2.529   9.867
   19    HB   VAL   3           HB       VAL   3   1.696   3.937  11.206
   20   HG11  VAL   3          1HG1      VAL   3   1.731   1.017  12.074
   21   HG12  VAL   3          2HG1      VAL   3   1.893   2.446  13.113
   22   HG13  VAL   3          3HG1      VAL   3   0.368   2.142  12.265
   23   HG21  VAL   3          3HG2      VAL   3   3.915   3.153  11.859
   24   HG22  VAL   3          1HG2      VAL   3   3.791   1.755  10.776
   25   HG23  VAL   3          2HG2      VAL   3   3.861   3.402  10.110
   26    H    GLU   4           H        GLU   4   2.641   2.106   7.576
   27    HA   GLU   4           HA       GLU   4   2.718   4.913   6.691
   28    HB2  GLU   4           2HB      GLU   4   4.765   3.526   6.766
   29    HB3  GLU   4           3HB      GLU   4   4.065   2.416   5.588
   30    HG2  GLU   4           2HG      GLU   4   5.696   3.982   4.583
   31    HG3  GLU   4           3HG      GLU   4   4.100   4.118   3.866
   32    H    GLN   5           H        GLN   5   2.017   5.657   4.707
   33    HA   GLN   5           HA       GLN   5   0.140   3.957   3.123
   34    HB2  GLN   5           2HB      GLN   5  -0.950   5.597   4.747
   35    HB3  GLN   5           3HB      GLN   5  -0.338   6.891   3.713
   36    HG2  GLN   5           2HG      GLN   5  -1.675   5.993   1.816
   37    HG3  GLN   5           3HG      GLN   5  -2.162   4.613   2.799
   38   HE21  GLN   5          2HE2      GLN   5  -4.332   5.697   1.875
   39   HE22  GLN   5          1HE2      GLN   5  -5.059   6.820   3.016
   40    H    CYS   6           H        CYS   6   3.008   5.661   3.059
   41    HA   CYS   6           HA       CYS   6   4.379   6.475   1.475
   42    HB2  CYS   6           2HB      CYS   6   2.795   4.632  -0.325
   43    HB3  CYS   6           3HB      CYS   6   4.348   5.357  -0.737
   44    H    CYS   7           H        CYS   7   2.627   8.235   2.209
   45    HA   CYS   7           HA       CYS   7   1.152   9.364  -0.091
   46    HB2  CYS   7           2HB      CYS   7   0.240   8.693   2.297
   47    HB3  CYS   7           3HB      CYS   7   0.893  10.253   2.781
   48    H    THR   8           H        THR   8   3.569  10.413   2.298
   49    HA   THR   8           HA       THR   8   3.939  12.993   0.820
   50    HB   THR   8           HB       THR   8   5.065  12.182   3.520
   51    HG1  THR   8           HG1      THR   8   3.428  13.479   4.347
   52   HG21  THR   8          1HG2      THR   8   5.373  14.636   3.804
   53   HG22  THR   8          2HG2      THR   8   6.332  14.016   2.456
   54   HG23  THR   8          3HG2      THR   8   4.820  14.894   2.133
   55    H    SER   9           H        SER   9   5.713  10.115   1.991
   56    HA   SER   9           HA       SER   9   8.005  10.750   0.221
   57    HB2  SER   9           2HB      SER   9   9.146   8.926   1.461
   58    HB3  SER   9           3HB      SER   9   8.646  10.284   2.482
   59    HG   SER   9           HG       SER   9   8.121   8.264   3.434
   60    H    ILE  10           H        ILE  10   8.887   9.148  -1.117
   61    HA   ILE  10           HA       ILE  10   6.828   7.447  -2.438
   62    HB   ILE  10           HB       ILE  10   9.441   8.620  -3.453
   63   HG12  ILE  10          2HG1      ILE  10   6.518   9.213  -4.127
   64   HG13  ILE  10          3HG1      ILE  10   7.560  10.229  -3.135
   65   HG21  ILE  10          1HG2      ILE  10   9.033   6.420  -4.515
   66   HG22  ILE  10          2HG2      ILE  10   7.377   6.918  -4.916
   67   HG23  ILE  10          3HG2      ILE  10   8.770   7.719  -5.665
   68   HD11  ILE  10          3HD1      ILE  10   7.890   9.730  -6.102
   69   HD12  ILE  10          1HD1      ILE  10   7.404  11.218  -5.283
   70   HD13  ILE  10          2HD1      ILE  10   9.057  10.605  -5.078
   71    H    CYS  11           H        CYS  11   6.932   5.308  -2.321
   72    HA   CYS  11           HA       CYS  11   9.075   4.127  -0.664
   73    HB2  CYS  11           2HB      CYS  11   6.301   3.216  -1.447
   74    HB3  CYS  11           3HB      CYS  11   7.408   2.258  -0.473
   75    H    SER  12           H        SER  12  10.704   3.058  -1.544
   76    HA   SER  12           HA       SER  12  10.760   1.835  -4.158
   77    HB2  SER  12           2HB      SER  12  12.479   1.296  -1.706
   78    HB3  SER  12           3HB      SER  12  12.837   0.791  -3.369
   79    HG   SER  12           HG       SER  12  13.915   2.743  -2.803
   80    H    LEU  13           H        LEU  13  10.826  -0.504  -4.623
   81    HA   LEU  13           HA       LEU  13   8.714  -1.977  -3.394
   82    HB2  LEU  13           2HB      LEU  13  11.035  -3.028  -5.048
   83    HB3  LEU  13           3HB      LEU  13   9.542  -3.891  -4.690
   84    HG   LEU  13           HG       LEU  13   9.821  -1.395  -6.407
   85   HD11  LEU  13          1HD1      LEU  13   8.980  -4.238  -7.089
   86   HD12  LEU  13          2HD1      LEU  13   9.090  -2.868  -8.219
   87   HD13  LEU  13          3HD1      LEU  13  10.557  -3.503  -7.456
   88   HD21  LEU  13          3HD2      LEU  13   7.311  -2.944  -5.666
   89   HD22  LEU  13          1HD2      LEU  13   7.666  -1.247  -5.256
   90   HD23  LEU  13          2HD2      LEU  13   7.408  -1.711  -6.938
   91    H    TYR  14           H        TYR  14  12.119  -1.848  -2.548
   92    HA   TYR  14           HA       TYR  14  12.394  -4.000  -0.756
   93    HB2  TYR  14           2HB      TYR  14  14.260  -2.611  -1.324
   94    HB3  TYR  14           3HB      TYR  14  13.443  -1.150  -0.784
   95    HD1  TYR  14           HD1      TYR  14  15.049  -4.306   0.417
   96    HD2  TYR  14           HD2      TYR  14  13.499  -0.420   1.490
   97    HE1  TYR  14           HE1      TYR  14  16.024  -4.538   2.704
   98    HE2  TYR  14           HE2      TYR  14  14.452  -0.658   3.762
   99    HH   TYR  14           HH       TYR  14  15.659  -1.987   5.199
  100    H    GLN  15           H        GLN  15  10.634  -0.914  -0.239
  101    HA   GLN  15           HA       GLN  15  10.210  -1.323   2.625
  102    HB2  GLN  15           2HB      GLN  15   8.717   0.366   0.564
  103    HB3  GLN  15           3HB      GLN  15   8.358   0.356   2.274
  104    HG2  GLN  15           2HG      GLN  15  11.034   1.148   1.076
  105    HG3  GLN  15           3HG      GLN  15   9.770   2.270   1.594
  106   HE21  GLN  15          2HE2      GLN  15   8.959   1.604   4.078
  107   HE22  GLN  15          1HE2      GLN  15  10.339   1.473   5.157
  108    H    LEU  16           H        LEU  16   8.342  -1.973  -0.326
  109    HA   LEU  16           HA       LEU  16   6.043  -3.008   1.029
  110    HB2  LEU  16           2HB      LEU  16   6.924  -3.726  -1.785
  111    HB3  LEU  16           3HB      LEU  16   5.296  -3.787  -1.127
  112    HG   LEU  16           HG       LEU  16   6.978  -1.398  -1.879
  113   HD11  LEU  16          1HD1      LEU  16   5.706  -2.419  -3.677
  114   HD12  LEU  16          2HD1      LEU  16   4.206  -2.308  -2.728
  115   HD13  LEU  16          3HD1      LEU  16   5.030  -0.836  -3.296
  116   HD21  LEU  16          3HD2      LEU  16   5.087   0.068  -1.120
  117   HD22  LEU  16          1HD2      LEU  16   4.345  -1.354  -0.344
  118   HD23  LEU  16          2HD2      LEU  16   5.905  -0.720   0.226
  119    H    GLU  17           H        GLU  17   8.960  -4.626  -0.265
  120    HA   GLU  17           HA       GLU  17   8.262  -7.294   0.565
  121    HB2  GLU  17           2HB      GLU  17  10.957  -5.944   0.127
  122    HB3  GLU  17           3HB      GLU  17  10.765  -7.657   0.513
  123    HG2  GLU  17           2HG      GLU  17   9.363  -7.964  -1.516
  124    HG3  GLU  17           3HG      GLU  17   9.628  -6.277  -1.951
  125    H    ASN  18           H        ASN  18   9.858  -4.620   2.361
  126    HA   ASN  18           HA       ASN  18  10.343  -6.188   4.721
  127    HB2  ASN  18           2HB      ASN  18  11.510  -4.065   4.155
  128    HB3  ASN  18           3HB      ASN  18  10.007  -3.173   4.398
  129   HD21  ASN  18          2HD2      ASN  18  12.407  -5.246   6.080
  130   HD22  ASN  18          1HD2      ASN  18  12.069  -4.566   7.664
  131    H    TYR  19           H        TYR  19   7.424  -4.488   3.583
  132    HA   TYR  19           HA       TYR  19   5.974  -4.909   6.100
  133    HB2  TYR  19           2HB      TYR  19   4.853  -4.358   3.359
  134    HB3  TYR  19           3HB      TYR  19   4.040  -4.122   4.890
  135    HD1  TYR  19           HD1      TYR  19   6.534  -2.679   6.275
  136    HD2  TYR  19           HD2      TYR  19   4.467  -2.157   2.520
  137    HE1  TYR  19           HE1      TYR  19   7.309  -0.320   6.158
  138    HE2  TYR  19           HE2      TYR  19   5.268   0.164   2.389
  139    HH   TYR  19           HH       TYR  19   6.449   1.841   3.435
  140    H    CYS  20           H        CYS  20   6.300  -6.634   3.002
  141    HA   CYS  20           HA       CYS  20   4.395  -8.719   3.473
  142    HB2  CYS  20           2HB      CYS  20   5.413  -8.106   1.290
  143    HB3  CYS  20           3HB      CYS  20   6.973  -8.677   1.868
  144    H    ASN  21           H        ASN  21   7.855  -8.461   4.271
  145    HA   ASN  21           HA       ASN  21   9.285  -9.649   5.526
  146    HB2  ASN  21           2HB      ASN  21   7.830  -8.473   7.179
  147    HB3  ASN  21           3HB      ASN  21   6.870  -9.941   7.351
  148   HD21  ASN  21          1HD2      ASN  21   7.568  -9.519   9.680
  149   HD22  ASN  21          2HD2      ASN  21   9.100 -10.230  10.171
  150    H1   PHE   1           H        PHE   1   4.322   0.143 -10.467
  151    HA   PHE   1           HA       PHE   1   3.590   2.779  -9.629
  152    HB2  PHE   1           2HB      PHE   1   2.574   1.566  -7.671
  153    HB3  PHE   1           3HB      PHE   1   2.054   1.067  -9.264
  154    HD1  PHE   1           HD2      PHE   1   4.509   0.102  -6.559
  155    HD2  PHE   1           HD1      PHE   1   1.996  -1.209  -9.810
  156    HE1  PHE   1           HE2      PHE   1   4.980  -2.266  -5.982
  157    HE2  PHE   1           HE1      PHE   1   2.453  -3.568  -9.207
  158    HZ   PHE   1           HZ       PHE   1   3.965  -4.104  -7.305
  159    H    VAL   2           H        VAL   2   6.564   1.514  -9.304
  160    HA   VAL   2           HA       VAL   2   7.202   2.282  -6.558
  161    HB   VAL   2           HB       VAL   2   8.266   0.421  -7.839
  162   HG11  VAL   2          1HG1      VAL   2   9.868   2.592  -9.251
  163   HG12  VAL   2          2HG1      VAL   2  10.095   0.839  -9.370
  164   HG13  VAL   2          3HG1      VAL   2   8.624   1.576 -10.015
  165   HG21  VAL   2          3HG2      VAL   2  10.225   2.455  -6.720
  166   HG22  VAL   2          1HG2      VAL   2   9.269   1.274  -5.792
  167   HG23  VAL   2          2HG2      VAL   2  10.508   0.726  -6.943
  168    H    ASN   3           H        ASN   3   7.039   4.027  -9.531
  169    HA   ASN   3           HA       ASN   3   9.186   5.887  -9.016
  170    HB2  ASN   3           2HB      ASN   3   8.446   5.090 -11.257
  171    HB3  ASN   3           3HB      ASN   3   6.903   5.921 -11.041
  172   HD21  ASN   3          2HD2      ASN   3  10.460   6.534 -11.147
  173   HD22  ASN   3          1HD2      ASN   3  10.280   8.133 -11.851
  174    H    GLN   4           H        GLN   4   5.963   5.853  -7.862
  175    HA   GLN   4           HA       GLN   4   6.036   8.711  -7.067
  176    HB2  GLN   4           2HB      GLN   4   4.052   9.274  -8.132
  177    HB3  GLN   4           3HB      GLN   4   4.943   8.380  -9.341
  178    HG2  GLN   4           2HG      GLN   4   2.439   7.612  -7.857
  179    HG3  GLN   4           3HG      GLN   4   2.724   7.651  -9.581
  180   HE21  GLN   4          2HE2      GLN   4   2.431   5.617  -6.911
  181   HE22  GLN   4          1HE2      GLN   4   3.354   4.239  -7.502
  182    H    HIS   5           H        HIS   5   3.917   9.209  -5.764
  183    HA   HIS   5           HA       HIS   5   3.863   7.625  -3.385
  184    HB2  HIS   5           2HB      HIS   5   1.871   9.682  -4.411
  185    HB3  HIS   5           3HB      HIS   5   2.040   9.152  -2.741
  186    HD2  HIS   5           HD2      HIS   5   4.327   9.940  -1.418
  187    HE1  HIS   5           HE1      HIS   5   5.595  12.822  -4.281
  188    HE2  HIS   5           HE2      HIS   5   5.886  12.004  -1.880
  189    H    LEU   6           H        LEU   6   2.043   6.492  -2.436
  190    HA   LEU   6           HA       LEU   6   0.357   5.036  -4.446
  191    HB2  LEU   6           2HB      LEU   6   1.689   3.736  -2.051
  192    HB3  LEU   6           3HB      LEU   6   0.675   2.990  -3.271
  193    HG   LEU   6           HG       LEU   6   2.559   3.938  -4.943
  194   HD11  LEU   6          1HD1      LEU   6   4.798   3.633  -3.976
  195   HD12  LEU   6          2HD1      LEU   6   3.971   4.936  -3.123
  196   HD13  LEU   6          3HD1      LEU   6   4.096   3.328  -2.372
  197   HD21  LEU   6          3HD2      LEU   6   2.815   1.404  -3.274
  198   HD22  LEU   6          1HD2      LEU   6   1.854   1.614  -4.760
  199   HD23  LEU   6          2HD2      LEU   6   3.617   1.720  -4.831
  200    H    CYS   7           H        CYS   7  -0.348   7.325  -2.861
  201    HA   CYS   7           HA       CYS   7  -2.166   6.315  -0.743
  202    HB2  CYS   7           2HB      CYS   7  -0.312   7.851  -0.263
  203    HB3  CYS   7           3HB      CYS   7  -1.039   9.070  -1.318
  204    H    GLY   8           H        GLY   8  -4.291   7.014  -0.538
  205    HA2  GLY   8           HA2      GLY   8  -6.262   8.165  -1.186
  206    HA3  GLY   8           HA3      GLY   8  -5.619   8.420  -2.793
  207    H    SER   9           H        SER   9  -6.889   4.605  -2.898
  208    HA   SER   9           HA       SER   9  -4.062   5.199  -2.375
  209    HB2  SER   9           2HB      SER   9  -5.673   3.285  -0.639
  210    HB3  SER   9           3HB      SER   9  -3.917   3.533  -0.590
  211    HG   SER   9           HG       SER   9  -5.999   5.265   0.200
  212    H    HIS  10           H        HIS  10  -2.668   3.647  -2.972
  213    HA   HIS  10           HA       HIS  10  -3.699   1.343  -4.599
  214    HB2  HIS  10           2HB      HIS  10  -2.908   3.286  -5.954
  215    HB3  HIS  10           3HB      HIS  10  -1.331   3.168  -5.174
  216    HD2  HIS  10           HD2      HIS  10  -3.703   0.980  -7.382
  217    HE1  HIS  10           HE1      HIS  10   0.290  -0.303  -8.141
  218    HE2  HIS  10           HE2      HIS  10  -2.148  -0.605  -8.805
  219    H    LEU  11           H        LEU  11  -1.615   2.327  -2.019
  220    HA   LEU  11           HA       LEU  11   0.534   0.656  -2.197
  221    HB2  LEU  11           2HB      LEU  11   0.132   2.451  -0.521
  222    HB3  LEU  11           3HB      LEU  11  -1.006   1.403   0.324
  223    HG   LEU  11           HG       LEU  11   0.827  -0.179   0.862
  224   HD11  LEU  11          1HD1      LEU  11   2.362   0.117  -0.999
  225   HD12  LEU  11          2HD1      LEU  11   2.571   1.842  -0.614
  226   HD13  LEU  11          3HD1      LEU  11   3.192   0.596   0.486
  227   HD21  LEU  11          3HD2      LEU  11   0.310   1.695   2.389
  228   HD22  LEU  11          1HD2      LEU  11   2.017   1.236   2.450
  229   HD23  LEU  11          2HD2      LEU  11   1.532   2.689   1.554
  230    H    VAL  12           H        VAL  12  -2.701  -0.406  -1.070
  231    HA   VAL  12           HA       VAL  12  -1.840  -3.005  -0.183
  232    HB   VAL  12           HB       VAL  12  -4.219  -3.569  -0.222
  233   HG11  VAL  12          1HG1      VAL  12  -3.177  -2.422   1.707
  234   HG12  VAL  12          2HG1      VAL  12  -3.665  -0.852   1.027
  235   HG13  VAL  12          3HG1      VAL  12  -4.895  -2.028   1.535
  236   HG21  VAL  12          3HG2      VAL  12  -5.072  -2.290  -2.138
  237   HG22  VAL  12          1HG2      VAL  12  -5.936  -1.859  -0.666
  238   HG23  VAL  12          2HG2      VAL  12  -4.707  -0.759  -1.308
  239    H    GLU  13           H        GLU  13  -2.949  -1.805  -3.342
  240    HA   GLU  13           HA       GLU  13  -3.026  -4.441  -4.616
  241    HB2  GLU  13           3HB      GLU  13  -2.746  -1.661  -5.834
  242    HB3  GLU  13           2HB      GLU  13  -3.032  -3.141  -6.731
  243    HG2  GLU  13           2HG      GLU  13  -4.937  -1.927  -4.672
  244    HG3  GLU  13           3HG      GLU  13  -5.079  -1.774  -6.415
  245    H    ALA  14           H        ALA  14  -0.670  -1.748  -4.460
  246    HA   ALA  14           HA       ALA  14   1.443  -2.964  -5.915
  247    HB1  ALA  14           3HB      ALA  14   1.472  -1.006  -3.576
  248    HB2  ALA  14           1HB      ALA  14   2.843  -1.343  -4.639
  249    HB3  ALA  14           2HB      ALA  14   1.376  -0.604  -5.306
  250    H    LEU  15           H        LEU  15   0.555  -3.291  -2.442
  251    HA   LEU  15           HA       LEU  15   2.784  -4.972  -1.776
  252    HB2  LEU  15           2HB      LEU  15   0.165  -4.221  -0.481
  253    HB3  LEU  15           3HB      LEU  15   1.006  -5.630   0.146
  254    HG   LEU  15           HG       LEU  15   2.471  -2.996  -0.231
  255   HD11  LEU  15          1HD1      LEU  15   0.995  -3.963   2.250
  256   HD12  LEU  15          2HD1      LEU  15   2.075  -2.552   2.161
  257   HD13  LEU  15          3HD1      LEU  15   0.553  -2.567   1.254
  258   HD21  LEU  15          3HD2      LEU  15   2.943  -5.334   1.677
  259   HD22  LEU  15          1HD2      LEU  15   3.761  -5.174   0.117
  260   HD23  LEU  15          2HD2      LEU  15   4.011  -3.956   1.356
  261    H    TYR  16           H        TYR  16  -0.588  -5.866  -2.781
  262    HA   TYR  16           HA       TYR  16  -0.046  -8.686  -2.666
  263    HB2  TYR  16           2HB      TYR  16  -2.009  -7.053  -4.298
  264    HB3  TYR  16           3HB      TYR  16  -1.943  -8.814  -4.356
  265    HD1  TYR  16           HD1      TYR  16  -1.662  -9.834  -1.749
  266    HD2  TYR  16           HD2      TYR  16  -3.845  -6.326  -2.996
  267    HE1  TYR  16           HE1      TYR  16  -3.045  -9.957   0.311
  268    HE2  TYR  16           HE2      TYR  16  -5.255  -6.479  -0.957
  269    HH   TYR  16           HH       TYR  16  -5.677  -7.617   0.991
  270    H    LEU  17           H        LEU  17   0.477  -6.322  -5.326
  271    HA   LEU  17           HA       LEU  17   1.454  -8.306  -7.175
  272    HB2  LEU  17           2HB      LEU  17   1.672  -5.281  -7.045
  273    HB3  LEU  17           3HB      LEU  17   2.275  -6.224  -8.404
  274    HG   LEU  17           HG       LEU  17  -0.638  -6.308  -7.485
  275   HD11  LEU  17          1HD1      LEU  17   0.006  -4.041  -8.273
  276   HD12  LEU  17          2HD1      LEU  17   0.560  -4.755  -9.809
  277   HD13  LEU  17          3HD1      LEU  17  -1.152  -4.841  -9.346
  278   HD21  LEU  17          3HD2      LEU  17  -0.006  -8.288  -8.788
  279   HD22  LEU  17          1HD2      LEU  17  -1.041  -7.230  -9.747
  280   HD23  LEU  17          2HD2      LEU  17   0.711  -7.256 -10.046
  281    H    VAL  18           H        VAL  18   3.005  -7.059  -4.434
  282    HA   VAL  18           HA       VAL  18   5.719  -7.907  -5.397
  283    HB   VAL  18           HB       VAL  18   4.791  -6.149  -3.104
  284   HG11  VAL  18          1HG1      VAL  18   7.629  -7.118  -3.626
  285   HG12  VAL  18          2HG1      VAL  18   7.185  -5.760  -2.570
  286   HG13  VAL  18          3HG1      VAL  18   6.660  -7.395  -2.158
  287   HG21  VAL  18          3HG2      VAL  18   6.196  -4.493  -4.255
  288   HG22  VAL  18          1HG2      VAL  18   6.643  -5.693  -5.487
  289   HG23  VAL  18          2HG2      VAL  18   4.966  -5.128  -5.353
  290    H    CYS  19           H        CYS  19   3.361  -8.475  -2.822
  291    HA   CYS  19           HA       CYS  19   5.043 -10.507  -1.544
  292    HB2  CYS  19           2HB      CYS  19   3.785  -8.605  -0.425
  293    HB3  CYS  19           3HB      CYS  19   2.299  -9.477  -0.773
  294    H    GLY  20           H        GLY  20   2.067 -10.520  -3.500
  295    HA2  GLY  20           HA2      GLY  20   2.133 -13.146  -4.313
  296    HA3  GLY  20           HA3      GLY  20   1.243 -13.224  -2.794
  297    H    GLU  21           H        GLU  21   0.892 -12.932  -6.068
  298    HA   GLU  21           HA       GLU  21  -1.071 -10.894  -6.378
  299    HB2  GLU  21           2HB      GLU  21   0.420 -11.868  -8.137
  300    HB3  GLU  21           3HB      GLU  21  -0.562 -13.338  -8.122
  301    HG2  GLU  21           2HG      GLU  21  -2.544 -11.996  -8.831
  302    HG3  GLU  21           3HG      GLU  21  -1.550 -10.536  -8.822
  303    H    ARG  22           H        ARG  22  -1.423 -14.321  -5.628
  304    HA   ARG  22           HA       ARG  22  -4.388 -14.192  -5.641
  305    HB2  ARG  22           2HB      ARG  22  -2.977 -16.105  -6.637
  306    HB3  ARG  22           3HB      ARG  22  -2.682 -16.608  -4.971
  307    HG2  ARG  22           2HG      ARG  22  -5.161 -16.870  -4.650
  308    HG3  ARG  22           3HG      ARG  22  -5.424 -16.262  -6.287
  309    HD2  ARG  22           2HD      ARG  22  -5.605 -18.673  -6.321
  310    HD3  ARG  22           3HD      ARG  22  -4.174 -18.184  -7.216
  311    HE   ARG  22           HE       ARG  22  -2.804 -19.229  -5.658
  312   HH11  ARG  22          2HH1      ARG  22  -6.033 -19.184  -4.291
  313   HH12  ARG  22          1HH1      ARG  22  -5.600 -20.284  -3.010
  314   HH21  ARG  22          1HH2      ARG  22  -2.325 -20.618  -4.003
  315   HH22  ARG  22          2HH2      ARG  22  -3.554 -21.071  -2.859
  316    H    GLY  23           H        GLY  23  -3.013 -12.535  -3.819
  317    HA2  GLY  23           HA2      GLY  23  -3.259 -11.834  -1.599
  318    HA3  GLY  23           HA3      GLY  23  -4.015 -13.365  -1.169
  319    H    DHI  24           H        DHI  24  -2.379 -12.631   0.641
  320    HA   DHI  24           HA       DHI  24   0.305 -13.893   0.237
  321    HB2  DHI  24           2HB      DHI  24  -0.035 -15.197   2.297
  322    HB3  DHI  24           3HB      DHI  24  -1.665 -14.550   2.460
  323    HD2  DHI  24           HD2      DHI  24  -3.571 -15.616   0.912
  324    HE1  DHI  24           HE1      DHI  24  -1.194 -18.600  -0.997
  325    HE2  DHI  24           HE2      DHI  24  -3.567 -17.737  -0.651
  326    H    PHE  25           H        PHE  25  -0.664 -11.011   0.693
  327    HA   PHE  25           HA       PHE  25   1.203 -10.229   2.799
  328    HB2  PHE  25           2HB      PHE  25   0.919  -8.703   0.967
  329    HB3  PHE  25           3HB      PHE  25  -0.829  -8.692   1.157
  330    HD1  PHE  25           HD1      PHE  25   2.339  -7.801   3.003
  331    HD2  PHE  25           HD2      PHE  25  -1.879  -7.051   2.495
  332    HE1  PHE  25           HE1      PHE  25   2.468  -5.938   4.633
  333    HE2  PHE  25           HE2      PHE  25  -1.735  -5.170   4.108
  334    HZ   PHE  25           HZ       PHE  25   0.443  -4.613   5.183
  335    H    TYR  26           H        TYR  26   0.835 -10.003   4.893
  336    HA   TYR  26           HA       TYR  26  -1.698  -9.029   5.900
  337    HB2  TYR  26           2HB      TYR  26  -2.153 -11.454   6.008
  338    HB3  TYR  26           3HB      TYR  26  -0.653 -11.715   6.891
  339    HD1  TYR  26           HD1      TYR  26  -3.915  -9.853   7.057
  340    HD2  TYR  26           HD2      TYR  26  -0.645 -11.580   9.291
  341    HE1  TYR  26           HE1      TYR  26  -5.115  -9.395   9.192
  342    HE2  TYR  26           HE2      TYR  26  -1.864 -11.156  11.406
  343    HH   TYR  26           HH       TYR  26  -3.789 -10.361  12.376
  344    H    THR  27           H        THR  27  -1.439  -7.861   7.736
  345    HA   THR  27           HA       THR  27   0.913  -8.224   9.456
  346    HB   THR  27           HB       THR  27   1.091  -5.690   9.740
  347    HG1  THR  27           HG1      THR  27  -0.002  -5.784   7.129
  348   HG21  THR  27          1HG2      THR  27   2.722  -5.449   7.969
  349   HG22  THR  27          2HG2      THR  27   2.833  -7.086   8.623
  350   HG23  THR  27          3HG2      THR  27   2.026  -6.807   7.066
  351    HA   PRO  28           HA       PRO  28  -2.654  -7.833  12.102
  352    HB2  PRO  28           2HB      PRO  28  -1.588  -8.424  14.537
  353    HB3  PRO  28           3HB      PRO  28  -1.769  -9.639  13.235
  354    HG2  PRO  28           2HG      PRO  28   0.714  -8.060  13.960
  355    HG3  PRO  28           3HG      PRO  28   0.564  -9.821  13.661
  356    HD2  PRO  28           2HD      PRO  28   1.392  -8.048  11.735
  357    HD3  PRO  28           3HD      PRO  28   0.449  -9.518  11.345
  358    H    LYS  29           H        LYS  29  -2.682  -4.687  13.887
  359    HA   LYS  29           HA       LYS  29  -4.272  -7.092  13.278
  360    HB2  LYS  29           2HB      LYS  29  -4.724  -5.541  15.173
  361    HB3  LYS  29           3HB      LYS  29  -5.117  -4.265  14.016
  362    HG2  LYS  29           2HG      LYS  29  -6.994  -5.613  13.141
  363    HG3  LYS  29           3HG      LYS  29  -6.575  -6.945  14.226
  364    HD2  LYS  29           2HD      LYS  29  -7.438  -4.150  15.104
  365    HD3  LYS  29           3HD      LYS  29  -8.504  -5.557  14.987
  366    HE2  LYS  29           2HE      LYS  29  -7.098  -6.760  16.659
  367    HE3  LYS  29           3HE      LYS  29  -6.073  -5.328  16.818
  368    HZ1  LYS  29           HZ1      LYS  29  -8.026  -4.097  17.602
  369    HZ2  LYS  29           HZ2      LYS  29  -8.972  -5.422  17.461
  370    HZ3  LYS  29           HZ3      LYS  29  -7.763  -5.394  18.555
  371    H    THR  30           H        THR  30  -5.836  -7.210  11.652
  372    HA   THR  30           HA       THR  30  -5.221  -6.937   9.082
  373    HB   THR  30           HB       THR  30  -8.078  -6.484  10.002
  374    HG1  THR  30           HG1      THR  30  -8.160  -8.710  10.272
  375   HG21  THR  30          1HG2      THR  30  -8.595  -7.953   8.072
  376   HG22  THR  30          2HG2      THR  30  -7.729  -6.505   7.545
  377   HG23  THR  30          3HG2      THR  30  -6.865  -8.052   7.675
  Start of MODEL    9
    1    H1   GLY   1           1H       GLY   1  -6.530  -1.082   6.654
    2    H2   GLY   1           2H       GLY   1  -7.671  -0.743   5.528
    3    H3   GLY   1           3H       GLY   1  -7.305  -2.304   5.885
    4    HA2  GLY   1           HA2      GLY   1  -6.341  -1.630   3.759
    5    HA3  GLY   1           HA3      GLY   1  -5.443  -0.376   4.631
    6    H    ILE   2           H        ILE   2  -3.619  -0.962   5.841
    7    HA   ILE   2           HA       ILE   2  -2.988  -3.763   6.368
    8    HB   ILE   2           HB       ILE   2  -2.099  -3.449   4.116
    9   HG12  ILE   2          2HG1      ILE   2   0.209  -4.116   4.384
   10   HG13  ILE   2          3HG1      ILE   2   0.228  -3.595   6.059
   11   HG21  ILE   2          1HG2      ILE   2  -0.386  -1.219   5.277
   12   HG22  ILE   2          2HG2      ILE   2  -0.207  -1.926   3.664
   13   HG23  ILE   2          3HG2      ILE   2  -1.683  -1.043   4.075
   14   HD11  ILE   2          3HD1      ILE   2  -1.491  -5.846   4.920
   15   HD12  ILE   2          1HD1      ILE   2   0.039  -6.047   5.802
   16   HD13  ILE   2          2HD1      ILE   2  -1.384  -5.398   6.636
   17    H    VAL   3           H        VAL   3  -1.055  -3.935   7.809
   18    HA   VAL   3           HA       VAL   3  -1.757  -2.585  10.135
   19    HB   VAL   3           HB       VAL   3  -0.838  -4.869   9.892
   20   HG11  VAL   3          1HG1      VAL   3   1.555  -5.290   9.896
   21   HG12  VAL   3          2HG1      VAL   3   1.125  -4.383   8.442
   22   HG13  VAL   3          3HG1      VAL   3   1.911  -3.557   9.806
   23   HG21  VAL   3          3HG2      VAL   3  -1.027  -3.794  12.116
   24   HG22  VAL   3          1HG2      VAL   3   0.267  -4.999  12.016
   25   HG23  VAL   3          2HG2      VAL   3   0.670  -3.274  11.988
   26    H    GLU   4           H        GLU   4   0.645  -1.475   7.878
   27    HA   GLU   4           HA       GLU   4   1.242   0.817   9.638
   28    HB2  GLU   4           2HB      GLU   4   3.166  -1.294   9.090
   29    HB3  GLU   4           3HB      GLU   4   3.712   0.178   8.308
   30    HG2  GLU   4           2HG      GLU   4   2.863   0.061  11.234
   31    HG3  GLU   4           3HG      GLU   4   4.508  -0.232  10.683
   32    H    GLN   5           H        GLN   5   2.037   2.696   8.516
   33    HA   GLN   5           HA       GLN   5   0.810   2.803   5.816
   34    HB2  GLN   5           2HB      GLN   5   0.217   4.333   7.873
   35    HB3  GLN   5           3HB      GLN   5   1.656   5.229   7.381
   36    HG2  GLN   5           2HG      GLN   5   0.497   5.156   4.977
   37    HG3  GLN   5           3HG      GLN   5  -0.950   4.771   5.890
   38   HE21  GLN   5          1HE2      GLN   5   1.442   7.273   5.135
   39   HE22  GLN   5          2HE2      GLN   5   0.578   8.581   5.943
   40    H    CYS   6           H        CYS   6   1.831   3.320   3.999
   41    HA   CYS   6           HA       CYS   6   4.704   3.953   3.845
   42    HB2  CYS   6           2HB      CYS   6   3.817   2.537   2.153
   43    HB3  CYS   6           3HB      CYS   6   2.444   3.598   1.865
   44    H    CYS   7           H        CYS   7   5.376   5.873   2.696
   45    HA   CYS   7           HA       CYS   7   5.783   7.964   2.453
   46    HB2  CYS   7           2HB      CYS   7   4.527   9.044   0.895
   47    HB3  CYS   7           3HB      CYS   7   4.242   7.348   0.623
   48    H    THR   8           H        THR   8   4.804  10.751   4.459
   49    HA   THR   8           HA       THR   8   5.933  10.460   1.847
   50    HB   THR   8           HB       THR   8   6.865  12.137   4.210
   51    HG1  THR   8           HG1      THR   8   4.945  12.775   2.221
   52   HG21  THR   8          1HG2      THR   8   8.441  12.327   2.348
   53   HG22  THR   8          2HG2      THR   8   7.105  12.681   1.217
   54   HG23  THR   8          3HG2      THR   8   7.511  13.814   2.521
   55    H    SER   9           H        SER   9   9.169   8.905   2.471
   56    HA   SER   9           HA       SER   9   7.648  10.581   0.539
   57    HB2  SER   9           2HB      SER   9   9.760  10.650  -0.669
   58    HB3  SER   9           3HB      SER   9   9.976  11.176   1.002
   59    HG   SER   9           HG       SER   9  11.616   9.713   0.392
   60    H    ILE  10           H        ILE  10   9.109   9.142  -1.666
   61    HA   ILE  10           HA       ILE  10   7.017   7.269  -2.382
   62    HB   ILE  10           HB       ILE  10   9.694   7.971  -3.657
   63   HG12  ILE  10          2HG1      ILE  10   6.855   8.777  -4.430
   64   HG13  ILE  10          3HG1      ILE  10   7.982   9.809  -3.550
   65   HG21  ILE  10          1HG2      ILE  10   8.965   6.852  -5.695
   66   HG22  ILE  10          2HG2      ILE  10   8.946   5.682  -4.387
   67   HG23  ILE  10          3HG2      ILE  10   7.425   6.401  -4.965
   68   HD11  ILE  10          3HD1      ILE  10   7.974  10.512  -5.815
   69   HD12  ILE  10          1HD1      ILE  10   9.537   9.725  -5.513
   70   HD13  ILE  10          2HD1      ILE  10   8.257   8.875  -6.422
   71    H    CYS  11           H        CYS  11   6.859   5.205  -1.659
   72    HA   CYS  11           HA       CYS  11   8.970   4.161  -0.009
   73    HB2  CYS  11           2HB      CYS  11   6.303   2.992  -0.856
   74    HB3  CYS  11           3HB      CYS  11   7.365   2.296   0.372
   75    H    SER  12           H        SER  12   7.646   3.051  -3.139
   76    HA   SER  12           HA       SER  12   8.346   1.564  -4.683
   77    HB2  SER  12           2HB      SER  12  10.355   3.080  -4.617
   78    HB3  SER  12           3HB      SER  12  11.168   1.842  -3.636
   79    HG   SER  12           HG       SER  12  11.536   1.646  -5.934
   80    H    LEU  13           H        LEU  13   9.477  -0.527  -5.134
   81    HA   LEU  13           HA       LEU  13   8.271  -2.592  -3.670
   82    HB2  LEU  13           2HB      LEU  13   8.996  -2.625  -6.006
   83    HB3  LEU  13           3HB      LEU  13  10.688  -2.641  -5.523
   84    HG   LEU  13           HG       LEU  13   8.854  -4.854  -4.561
   85   HD11  LEU  13          1HD1      LEU  13   8.418  -4.675  -6.987
   86   HD12  LEU  13          2HD1      LEU  13  10.162  -4.740  -7.313
   87   HD13  LEU  13          3HD1      LEU  13   9.324  -6.144  -6.610
   88   HD21  LEU  13          3HD2      LEU  13  10.896  -6.240  -4.823
   89   HD22  LEU  13          1HD2      LEU  13  11.789  -4.824  -5.417
   90   HD23  LEU  13          2HD2      LEU  13  11.204  -4.888  -3.744
   91    H    TYR  14           H        TYR  14  11.612  -1.382  -3.416
   92    HA   TYR  14           HA       TYR  14  12.766  -3.303  -1.740
   93    HB2  TYR  14           2HB      TYR  14  14.059  -1.580  -2.812
   94    HB3  TYR  14           3HB      TYR  14  13.162  -0.302  -2.003
   95    HD1  TYR  14           HD2      TYR  14  15.675  -3.012  -1.481
   96    HD2  TYR  14           HD1      TYR  14  13.697   0.427   0.212
   97    HE1  TYR  14           HE2      TYR  14  17.285  -3.020   0.421
   98    HE2  TYR  14           HE1      TYR  14  15.270   0.385   2.142
   99    HH   TYR  14           HH       TYR  14  17.912  -2.036   2.392
  100    H    GLN  15           H        GLN  15  10.591  -0.637  -0.797
  101    HA   GLN  15           HA       GLN  15  10.947  -1.267   2.097
  102    HB2  GLN  15           2HB      GLN  15   9.185   0.803   0.739
  103    HB3  GLN  15           3HB      GLN  15   9.381   0.575   2.484
  104    HG2  GLN  15           2HG      GLN  15  11.846   0.994   2.224
  105    HG3  GLN  15           3HG      GLN  15  11.566   1.333   0.515
  106   HE21  GLN  15          2HE2      GLN  15  12.684   3.446   1.285
  107   HE22  GLN  15          1HE2      GLN  15  11.604   4.693   1.892
  108    H    LEU  16           H        LEU  16   8.607  -1.673  -0.516
  109    HA   LEU  16           HA       LEU  16   6.431  -2.640   1.074
  110    HB2  LEU  16           2HB      LEU  16   7.152  -3.267  -1.799
  111    HB3  LEU  16           3HB      LEU  16   5.664  -3.762  -1.015
  112    HG   LEU  16           HG       LEU  16   6.551  -1.058  -1.918
  113   HD11  LEU  16          1HD1      LEU  16   4.257  -0.990  -2.817
  114   HD12  LEU  16          2HD1      LEU  16   5.163  -2.392  -3.397
  115   HD13  LEU  16          3HD1      LEU  16   3.937  -2.589  -2.121
  116   HD21  LEU  16          3HD2      LEU  16   4.385  -1.499   0.180
  117   HD22  LEU  16          1HD2      LEU  16   5.870  -0.535   0.378
  118   HD23  LEU  16          2HD2      LEU  16   4.619   0.007  -0.737
  119    H    GLU  17           H        GLU  17   9.331  -4.350  -0.040
  120    HA   GLU  17           HA       GLU  17   8.564  -7.000   0.563
  121    HB2  GLU  17           2HB      GLU  17  11.244  -5.594   0.772
  122    HB3  GLU  17           3HB      GLU  17  11.039  -7.316   1.101
  123    HG2  GLU  17           2HG      GLU  17  10.071  -7.647  -1.166
  124    HG3  GLU  17           3HG      GLU  17  10.384  -5.958  -1.540
  125    H    ASN  18           H        ASN  18   9.174  -4.412   2.913
  126    HA   ASN  18           HA       ASN  18   9.709  -6.176   5.143
  127    HB2  ASN  18           2HB      ASN  18   8.799  -3.267   5.007
  128    HB3  ASN  18           3HB      ASN  18   9.217  -4.100   6.497
  129   HD21  ASN  18          1HD2      ASN  18  11.465  -5.038   6.661
  130   HD22  ASN  18          2HD2      ASN  18  12.738  -4.156   5.833
  131    H    TYR  19           H        TYR  19   6.711  -5.248   3.602
  132    HA   TYR  19           HA       TYR  19   4.929  -5.971   5.822
  133    HB2  TYR  19           2HB      TYR  19   4.529  -5.554   2.861
  134    HB3  TYR  19           3HB      TYR  19   3.220  -5.908   3.973
  135    HD1  TYR  19           HD2      TYR  19   5.651  -3.333   2.916
  136    HD2  TYR  19           HD1      TYR  19   2.449  -4.288   5.619
  137    HE1  TYR  19           HE2      TYR  19   5.289  -0.901   3.326
  138    HE2  TYR  19           HE1      TYR  19   2.082  -1.867   6.039
  139    HH   TYR  19           HH       TYR  19   2.641   0.252   5.448
  140    H    CYS  20           H        CYS  20   6.711  -7.761   3.400
  141    HA   CYS  20           HA       CYS  20   4.810  -9.937   3.173
  142    HB2  CYS  20           2HB      CYS  20   7.674  -9.890   2.214
  143    HB3  CYS  20           3HB      CYS  20   6.332 -10.841   1.612
  144    H    ASN  21           H        ASN  21   6.955  -9.283   5.602
  145    HA   ASN  21           HA       ASN  21   8.231 -11.739   6.217
  146    HB2  ASN  21           2HB      ASN  21   8.766  -9.511   7.188
  147    HB3  ASN  21           3HB      ASN  21   7.238  -9.528   8.072
  148   HD21  ASN  21          2HD2      ASN  21   9.136  -9.129   9.748
  149   HD22  ASN  21          1HD2      ASN  21   9.674 -10.594  10.556
  150    H1   PHE   1           H        PHE   1   8.640  -0.345 -11.532
  151    HA   PHE   1           HA       PHE   1   5.817  -0.649 -11.067
  152    HB2  PHE   1           2HB      PHE   1   7.559   0.247  -8.785
  153    HB3  PHE   1           3HB      PHE   1   6.061   1.112  -9.030
  154    HD1  PHE   1           HD2      PHE   1   3.852  -0.040  -8.991
  155    HD2  PHE   1           HD1      PHE   1   7.516  -2.028  -7.882
  156    HE1  PHE   1           HE2      PHE   1   2.543  -1.819  -7.854
  157    HE2  PHE   1           HE1      PHE   1   6.204  -3.812  -6.767
  158    HZ   PHE   1           HZ       PHE   1   3.722  -3.706  -6.735
  159    H    VAL   2           H        VAL   2   4.614   1.304 -11.163
  160    HA   VAL   2           HA       VAL   2   5.536   3.427 -12.902
  161    HB   VAL   2           HB       VAL   2   3.417   4.568 -12.051
  162   HG11  VAL   2          1HG1      VAL   2   3.510   3.322 -14.166
  163   HG12  VAL   2          2HG1      VAL   2   3.143   1.809 -13.309
  164   HG13  VAL   2          3HG1      VAL   2   1.941   3.117 -13.369
  165   HG21  VAL   2          3HG2      VAL   2   1.766   3.331 -10.851
  166   HG22  VAL   2          1HG2      VAL   2   2.734   1.849 -10.860
  167   HG23  VAL   2          2HG2      VAL   2   3.250   3.238  -9.883
  168    H    ASN   3           H        ASN   3   5.911   5.623 -12.380
  169    HA   ASN   3           HA       ASN   3   7.492   5.935  -9.943
  170    HB2  ASN   3           2HB      ASN   3   7.033   7.783 -12.312
  171    HB3  ASN   3           3HB      ASN   3   8.132   8.108 -10.971
  172   HD21  ASN   3          2HD2      ASN   3   9.070   8.074 -13.585
  173   HD22  ASN   3          1HD2      ASN   3  10.139   6.686 -13.748
  174    H    GLN   4           H        GLN   4   5.308   5.572  -8.790
  175    HA   GLN   4           HA       GLN   4   4.697   8.182  -7.566
  176    HB2  GLN   4           2HB      GLN   4   2.351   7.843  -7.383
  177    HB3  GLN   4           3HB      GLN   4   2.803   7.739  -9.081
  178    HG2  GLN   4           2HG      GLN   4   2.680   5.235  -8.922
  179    HG3  GLN   4           3HG      GLN   4   2.172   5.384  -7.239
  180   HE21  GLN   4          2HE2      GLN   4   0.125   4.290  -7.737
  181   HE22  GLN   4          1HE2      GLN   4  -1.116   5.158  -8.636
  182    H    HIS   5           H        HIS   5   3.573   7.811  -5.400
  183    HA   HIS   5           HA       HIS   5   5.618   6.773  -3.893
  184    HB2  HIS   5           2HB      HIS   5   2.825   7.574  -3.022
  185    HB3  HIS   5           3HB      HIS   5   4.203   7.373  -1.938
  186    HD2  HIS   5           HD2      HIS   5   5.460   9.538  -1.395
  187    HE1  HIS   5           HE1      HIS   5   4.794  11.732  -4.984
  188    HE2  HIS   5           HE2      HIS   5   5.862  11.809  -2.675
  189    H    LEU   6           H        LEU   6   3.035   4.833  -4.975
  190    HA   LEU   6           HA       LEU   6   2.063   2.892  -4.370
  191    HB2  LEU   6           2HB      LEU   6   4.570   2.099  -2.886
  192    HB3  LEU   6           3HB      LEU   6   3.338   1.064  -3.597
  193    HG   LEU   6           HG       LEU   6   5.403   2.746  -5.062
  194   HD11  LEU   6          1HD1      LEU   6   6.298   0.633  -5.802
  195   HD12  LEU   6          2HD1      LEU   6   6.154   0.590  -4.032
  196   HD13  LEU   6          3HD1      LEU   6   4.971  -0.260  -5.046
  197   HD21  LEU   6          3HD2      LEU   6   3.213   1.003  -6.260
  198   HD22  LEU   6          1HD2      LEU   6   3.355   2.773  -6.411
  199   HD23  LEU   6          2HD2      LEU   6   4.571   1.736  -7.150
  200    H    CYS   7           H        CYS   7   1.243   4.970  -2.976
  201    HA   CYS   7           HA       CYS   7   1.073   4.175  -0.104
  202    HB2  CYS   7           2HB      CYS   7   2.535   6.147  -0.771
  203    HB3  CYS   7           3HB      CYS   7   1.049   6.997  -1.202
  204    H    GLY   8           H        GLY   8  -0.851   5.118   1.053
  205    HA2  GLY   8           HA2      GLY   8  -3.143   5.263   1.339
  206    HA3  GLY   8           HA3      GLY   8  -3.187   6.064  -0.234
  207    H    SER   9           H        SER   9  -4.880   5.094  -1.287
  208    HA   SER   9           HA       SER   9  -5.728   2.410  -1.095
  209    HB2  SER   9           2HB      SER   9  -5.967   4.261  -3.498
  210    HB3  SER   9           3HB      SER   9  -6.975   2.844  -3.145
  211    HG   SER   9           HG       SER   9  -7.976   4.811  -2.487
  212    H    HIS  10           H        HIS  10  -3.043   3.713  -3.003
  213    HA   HIS  10           HA       HIS  10  -2.880   1.358  -4.741
  214    HB2  HIS  10           2HB      HIS  10  -2.331   3.716  -5.444
  215    HB3  HIS  10           3HB      HIS  10  -0.897   3.634  -4.421
  216    HD2  HIS  10           HD2      HIS  10  -2.337   1.088  -7.046
  217    HE1  HIS  10           HE1      HIS  10   1.696   1.926  -8.135
  218    HE2  HIS  10           HE2      HIS  10  -0.374   0.566  -8.718
  219    H    LEU  11           H        LEU  11  -1.727   2.059  -1.565
  220    HA   LEU  11           HA       LEU  11   0.732   0.602  -1.542
  221    HB2  LEU  11           2HB      LEU  11   0.067   2.126   0.246
  222    HB3  LEU  11           3HB      LEU  11  -1.339   1.136   0.623
  223    HG   LEU  11           HG       LEU  11   0.052  -0.669   1.460
  224   HD11  LEU  11          1HD1      LEU  11   2.431   1.121   0.820
  225   HD12  LEU  11          2HD1      LEU  11   2.489  -0.361   1.795
  226   HD13  LEU  11          3HD1      LEU  11   2.071  -0.449   0.079
  227   HD21  LEU  11          3HD2      LEU  11   0.950   0.499   3.439
  228   HD22  LEU  11          1HD2      LEU  11   0.822   2.052   2.582
  229   HD23  LEU  11          2HD2      LEU  11  -0.641   1.128   2.981
  230    H    VAL  12           H        VAL  12  -2.594  -0.529  -0.682
  231    HA   VAL  12           HA       VAL  12  -1.760  -3.239  -0.279
  232    HB   VAL  12           HB       VAL  12  -4.135  -3.762  -0.276
  233   HG11  VAL  12          1HG1      VAL  12  -2.988  -2.901   1.746
  234   HG12  VAL  12          2HG1      VAL  12  -3.478  -1.248   1.313
  235   HG13  VAL  12          3HG1      VAL  12  -4.706  -2.465   1.714
  236   HG21  VAL  12          3HG2      VAL  12  -5.859  -2.027  -0.411
  237   HG22  VAL  12          1HG2      VAL  12  -4.652  -0.824  -0.894
  238   HG23  VAL  12          2HG2      VAL  12  -5.035  -2.197  -1.959
  239    H    GLU  13           H        GLU  13  -2.915  -1.536  -3.160
  240    HA   GLU  13           HA       GLU  13  -3.206  -3.876  -4.828
  241    HB2  GLU  13           2HB      GLU  13  -2.633  -0.976  -5.561
  242    HB3  GLU  13           3HB      GLU  13  -3.020  -2.260  -6.713
  243    HG2  GLU  13           2HG      GLU  13  -5.190  -2.639  -5.509
  244    HG3  GLU  13           3HG      GLU  13  -4.841  -1.239  -4.495
  245    H    ALA  14           H        ALA  14  -0.387  -1.658  -4.281
  246    HA   ALA  14           HA       ALA  14   1.388  -3.144  -5.976
  247    HB1  ALA  14           3HB      ALA  14   1.923  -1.288  -3.619
  248    HB2  ALA  14           1HB      ALA  14   3.101  -1.791  -4.856
  249    HB3  ALA  14           2HB      ALA  14   1.711  -0.791  -5.312
  250    H    LEU  15           H        LEU  15   0.604  -3.443  -2.470
  251    HA   LEU  15           HA       LEU  15   2.577  -5.463  -1.948
  252    HB2  LEU  15           2HB      LEU  15   0.009  -4.652  -0.553
  253    HB3  LEU  15           3HB      LEU  15   1.052  -5.929   0.062
  254    HG   LEU  15           HG       LEU  15   2.066  -3.091  -0.421
  255   HD11  LEU  15          1HD1      LEU  15   1.883  -2.789   2.007
  256   HD12  LEU  15          2HD1      LEU  15   0.283  -3.120   1.318
  257   HD13  LEU  15          3HD1      LEU  15   1.167  -4.402   2.178
  258   HD21  LEU  15          3HD2      LEU  15   3.821  -4.833  -0.365
  259   HD22  LEU  15          1HD2      LEU  15   3.878  -3.824   1.082
  260   HD23  LEU  15          2HD2      LEU  15   3.149  -5.446   1.149
  261    H    TYR  16           H        TYR  16  -0.756  -5.807  -3.195
  262    HA   TYR  16           HA       TYR  16  -0.704  -8.683  -3.165
  263    HB2  TYR  16           2HB      TYR  16  -2.318  -6.591  -4.594
  264    HB3  TYR  16           3HB      TYR  16  -2.344  -8.225  -5.226
  265    HD1  TYR  16           HD1      TYR  16  -2.645 -10.165  -3.444
  266    HD2  TYR  16           HD2      TYR  16  -3.975  -6.092  -2.935
  267    HE1  TYR  16           HE1      TYR  16  -4.234 -10.905  -1.686
  268    HE2  TYR  16           HE2      TYR  16  -5.574  -6.838  -1.177
  269    HH   TYR  16           HH       TYR  16  -5.809 -10.274  -0.166
  270    H    LEU  17           H        LEU  17   1.240  -6.554  -5.027
  271    HA   LEU  17           HA       LEU  17   1.943  -8.746  -6.938
  272    HB2  LEU  17           2HB      LEU  17   2.770  -5.828  -6.941
  273    HB3  LEU  17           3HB      LEU  17   3.182  -7.027  -8.156
  274    HG   LEU  17           HG       LEU  17   0.360  -6.028  -7.553
  275   HD11  LEU  17          1HD1      LEU  17   2.220  -5.476  -9.900
  276   HD12  LEU  17          2HD1      LEU  17   0.545  -4.902  -9.725
  277   HD13  LEU  17          3HD1      LEU  17   1.793  -4.329  -8.610
  278   HD21  LEU  17          3HD2      LEU  17  -0.250  -7.191  -9.660
  279   HD22  LEU  17          1HD2      LEU  17   1.384  -7.885  -9.745
  280   HD23  LEU  17          2HD2      LEU  17   0.285  -8.325  -8.418
  281    H    VAL  18           H        VAL  18   3.433  -6.561  -4.497
  282    HA   VAL  18           HA       VAL  18   6.040  -7.798  -4.756
  283    HB   VAL  18           HB       VAL  18   4.955  -5.889  -2.651
  284   HG11  VAL  18          1HG1      VAL  18   6.920  -6.992  -1.711
  285   HG12  VAL  18          2HG1      VAL  18   7.816  -6.779  -3.232
  286   HG13  VAL  18          3HG1      VAL  18   7.380  -5.376  -2.241
  287   HG21  VAL  18          3HG2      VAL  18   6.345  -4.251  -3.977
  288   HG22  VAL  18          1HG2      VAL  18   6.617  -5.525  -5.180
  289   HG23  VAL  18          2HG2      VAL  18   4.982  -4.905  -4.885
  290    H    CYS  19           H        CYS  19   3.467  -8.120  -2.279
  291    HA   CYS  19           HA       CYS  19   4.970 -10.370  -1.029
  292    HB2  CYS  19           2HB      CYS  19   2.410  -9.018  -0.124
  293    HB3  CYS  19           3HB      CYS  19   3.353 -10.214   0.759
  294    H    GLY  20           H        GLY  20   1.989  -9.719  -2.841
  295    HA2  GLY  20           HA2      GLY  20   0.795 -12.296  -2.373
  296    HA3  GLY  20           HA3      GLY  20   0.252 -11.076  -3.513
  297    H    GLU  21           H        GLU  21   3.515 -12.079  -4.085
  298    HA   GLU  21           HA       GLU  21   2.676 -14.098  -6.127
  299    HB2  GLU  21           2HB      GLU  21   2.937 -11.810  -7.105
  300    HB3  GLU  21           3HB      GLU  21   4.652 -11.872  -6.685
  301    HG2  GLU  21           2HG      GLU  21   4.879 -13.944  -8.088
  302    HG3  GLU  21           3HG      GLU  21   3.161 -13.863  -8.461
  303    H    ARG  22           H        ARG  22   5.243 -15.947  -4.372
  304    HA   ARG  22           HA       ARG  22   2.299 -15.482  -4.596
  305    HB2  ARG  22           2HB      ARG  22   3.137 -17.669  -5.285
  306    HB3  ARG  22           3HB      ARG  22   3.912 -17.901  -3.721
  307    HG2  ARG  22           2HG      ARG  22   1.844 -19.173  -3.857
  308    HG3  ARG  22           3HG      ARG  22   1.718 -17.948  -2.598
  309    HD2  ARG  22           2HD      ARG  22   0.391 -16.505  -4.110
  310    HD3  ARG  22           3HD      ARG  22   0.555 -17.682  -5.413
  311    HE   ARG  22           HE       ARG  22  -1.174 -17.827  -3.028
  312   HH11  ARG  22          1HH1      ARG  22   0.082 -19.709  -5.713
  313   HH12  ARG  22          2HH1      ARG  22  -1.172 -20.909  -5.566
  314   HH21  ARG  22          1HH2      ARG  22  -2.732 -19.394  -2.905
  315   HH22  ARG  22          2HH2      ARG  22  -2.716 -20.731  -4.018
  316    H    GLY  23           H        GLY  23   4.669 -16.306  -2.066
  317    HA2  GLY  23           HA2      GLY  23   4.689 -15.896   0.228
  318    HA3  GLY  23           HA3      GLY  23   4.543 -14.265  -0.395
  319    H    DHI  24           H        DHI  24   2.970 -13.115   0.259
  320    HA   DHI  24           HA       DHI  24   1.220 -12.211   1.214
  321    HB2  DHI  24           2HB      DHI  24  -0.119 -13.571   2.996
  322    HB3  DHI  24           3HB      DHI  24   1.235 -14.683   2.916
  323    HD2  DHI  24           HD2      DHI  24   3.379 -13.973   4.291
  324    HE1  DHI  24           HE1      DHI  24   2.207 -10.000   5.321
  325    HE2  DHI  24           HE2      DHI  24   3.917 -11.837   5.754
  326    H    PHE  25           H        PHE  25  -1.924 -12.941  -0.228
  327    HA   PHE  25           HA       PHE  25  -0.630 -11.401   1.930
  328    HB2  PHE  25           2HB      PHE  25   0.371 -10.465  -0.119
  329    HB3  PHE  25           3HB      PHE  25  -1.223 -10.259  -0.826
  330    HD1  PHE  25           HD1      PHE  25   0.803  -9.210   2.204
  331    HD2  PHE  25           HD2      PHE  25  -2.313  -8.189  -0.598
  332    HE1  PHE  25           HE1      PHE  25   0.560  -6.988   3.270
  333    HE2  PHE  25           HE2      PHE  25  -2.543  -5.965   0.460
  334    HZ   PHE  25           HZ       PHE  25  -1.128  -5.369   2.419
  335    H    TYR  26           H        TYR  26  -2.040  -9.929   2.951
  336    HA   TYR  26           HA       TYR  26  -4.954 -10.236   2.453
  337    HB2  TYR  26           2HB      TYR  26  -4.443 -12.076   3.934
  338    HB3  TYR  26           3HB      TYR  26  -3.484 -11.037   4.985
  339    HD1  TYR  26           HD1      TYR  26  -6.970 -11.480   3.647
  340    HD2  TYR  26           HD2      TYR  26  -4.491  -9.933   6.827
  341    HE1  TYR  26           HE1      TYR  26  -9.004 -10.855   4.928
  342    HE2  TYR  26           HE2      TYR  26  -6.535  -9.328   8.119
  343    HH   TYR  26           HH       TYR  26  -9.837  -9.935   6.866
  344    H    THR  27           H        THR  27  -6.129  -8.501   2.982
  345    HA   THR  27           HA       THR  27  -4.799  -6.156   4.237
  346    HB   THR  27           HB       THR  27  -6.694  -4.874   3.246
  347    HG1  THR  27           HG1      THR  27  -7.679  -5.958   1.427
  348   HG21  THR  27          1HG2      THR  27  -5.774  -4.877   0.985
  349   HG22  THR  27          2HG2      THR  27  -4.458  -5.030   2.166
  350   HG23  THR  27          3HG2      THR  27  -5.002  -6.457   1.259
  351    HA   PRO  28           HA       PRO  28  -7.680  -7.093   7.683
  352    HB2  PRO  28           2HB      PRO  28  -6.657  -5.270   9.483
  353    HB3  PRO  28           3HB      PRO  28  -5.991  -6.911   9.221
  354    HG2  PRO  28           2HG      PRO  28  -5.050  -4.302   7.983
  355    HG3  PRO  28           3HG      PRO  28  -4.061  -5.569   8.781
  356    HD2  PRO  28           2HD      PRO  28  -4.278  -5.493   6.102
  357    HD3  PRO  28           3HD      PRO  28  -4.336  -7.059   6.948
  358    H    LYS  29           H        LYS  29  -9.582  -6.151   8.093
  359    HA   LYS  29           HA       LYS  29 -10.081  -3.270   7.426
  360    HB2  LYS  29           2HB      LYS  29 -11.811  -5.705   6.839
  361    HB3  LYS  29           3HB      LYS  29 -12.522  -4.130   7.109
  362    HG2  LYS  29           2HG      LYS  29 -12.393  -4.226   4.817
  363    HG3  LYS  29           3HG      LYS  29 -11.069  -3.174   5.285
  364    HD2  LYS  29           2HD      LYS  29 -10.375  -4.601   3.475
  365    HD3  LYS  29           3HD      LYS  29  -9.474  -5.068   4.913
  366    HE2  LYS  29           2HE      LYS  29 -11.034  -6.973   5.272
  367    HE3  LYS  29           3HE      LYS  29 -11.981  -6.467   3.864
  368    HZ1  LYS  29           HZ1      LYS  29  -9.140  -7.328   3.804
  369    HZ2  LYS  29           HZ2      LYS  29 -10.408  -8.241   3.301
  370    HZ3  LYS  29           HZ3      LYS  29  -9.993  -6.880   2.492
  371    H    THR  30           H        THR  30 -11.726  -2.243   8.654
  372    HA   THR  30           HA       THR  30 -11.591  -2.746  11.510
  373    HB   THR  30           HB       THR  30 -13.247  -0.824  11.597
  374    HG1  THR  30           HG1      THR  30 -14.020  -1.152   9.443
  375   HG21  THR  30          1HG2      THR  30 -11.573   0.862  10.980
  376   HG22  THR  30          2HG2      THR  30 -10.811  -0.486  11.842
  377   HG23  THR  30          3HG2      THR  30 -10.642  -0.353  10.078
  Start of MODEL   10
    1    H1   GLY   1           1H       GLY   1  -5.981  -5.583   8.530
    2    H2   GLY   1           2H       GLY   1  -6.394  -4.192   9.287
    3    H3   GLY   1           3H       GLY   1  -7.320  -4.756   8.056
    4    HA2  GLY   1           HA2      GLY   1  -5.560  -4.394   6.466
    5    HA3  GLY   1           HA3      GLY   1  -5.982  -2.891   7.310
    6    H    ILE   2           H        ILE   2  -3.486  -3.322   6.036
    7    HA   ILE   2           HA       ILE   2  -1.485  -4.315   7.783
    8    HB   ILE   2           HB       ILE   2  -1.354  -4.124   5.300
    9   HG12  ILE   2          2HG1      ILE   2   1.028  -3.591   5.121
   10   HG13  ILE   2          3HG1      ILE   2   1.031  -2.921   6.751
   11   HG21  ILE   2          1HG2      ILE   2  -0.601  -2.067   4.236
   12   HG22  ILE   2          2HG2      ILE   2  -2.150  -1.783   5.043
   13   HG23  ILE   2          3HG2      ILE   2  -0.642  -1.205   5.780
   14   HD11  ILE   2          3HD1      ILE   2   1.924  -5.267   6.588
   15   HD12  ILE   2          1HD1      ILE   2   0.549  -5.148   7.693
   16   HD13  ILE   2          2HD1      ILE   2   0.325  -5.818   6.057
   17    H    VAL   3           H        VAL   3   0.136  -3.322   9.007
   18    HA   VAL   3           HA       VAL   3  -1.093  -1.629  10.897
   19    HB   VAL   3           HB       VAL   3   1.854  -2.374  10.793
   20   HG11  VAL   3          1HG1      VAL   3   1.680  -2.317  13.270
   21   HG12  VAL   3          2HG1      VAL   3   1.342  -0.739  12.566
   22   HG13  VAL   3          3HG1      VAL   3  -0.001  -1.755  13.137
   23   HG21  VAL   3          3HG2      VAL   3  -0.514  -3.967  11.870
   24   HG22  VAL   3          1HG2      VAL   3   0.588  -4.445  10.555
   25   HG23  VAL   3          2HG2      VAL   3   1.191  -4.338  12.202
   26    H    GLU   4           H        GLU   4   1.332  -0.823   8.462
   27    HA   GLU   4           HA       GLU   4   1.071   2.077   9.080
   28    HB2  GLU   4           2HB      GLU   4   3.681   0.559   8.666
   29    HB3  GLU   4           3HB      GLU   4   3.549   2.306   8.589
   30    HG2  GLU   4           2HG      GLU   4   2.966   0.583  11.033
   31    HG3  GLU   4           3HG      GLU   4   4.426   1.513  10.745
   32    H    GLN   5           H        GLN   5   1.873   3.441   7.225
   33    HA   GLN   5           HA       GLN   5   1.863   2.083   4.625
   34    HB2  GLN   5           2HB      GLN   5   0.092   3.569   3.707
   35    HB3  GLN   5           3HB      GLN   5  -0.484   2.371   4.864
   36    HG2  GLN   5           2HG      GLN   5  -0.711   4.052   6.604
   37    HG3  GLN   5           3HG      GLN   5   0.024   5.285   5.582
   38   HE21  GLN   5          2HE2      GLN   5  -2.455   5.826   6.679
   39   HE22  GLN   5          1HE2      GLN   5  -3.662   5.767   5.402
   40    H    CYS   6           H        CYS   6   2.667   3.147   2.913
   41    HA   CYS   6           HA       CYS   6   4.605   5.252   3.375
   42    HB2  CYS   6           2HB      CYS   6   3.675   3.841   0.853
   43    HB3  CYS   6           3HB      CYS   6   5.095   4.873   0.982
   44    H    CYS   7           H        CYS   7   2.776   6.696   4.188
   45    HA   CYS   7           HA       CYS   7   1.216   8.004   2.048
   46    HB2  CYS   7           2HB      CYS   7   0.273   7.099   4.263
   47    HB3  CYS   7           3HB      CYS   7   1.014   8.502   5.025
   48    H    THR   8           H        THR   8   3.587   8.960   4.545
   49    HA   THR   8           HA       THR   8   3.984  11.597   3.196
   50    HB   THR   8           HB       THR   8   5.405  12.087   5.196
   51    HG1  THR   8           HG1      THR   8   5.180  10.694   6.964
   52   HG21  THR   8          1HG2      THR   8   2.543  11.262   5.871
   53   HG22  THR   8          2HG2      THR   8   3.552  12.428   6.755
   54   HG23  THR   8          3HG2      THR   8   3.019  12.793   5.105
   55    H    SER   9           H        SER   9   5.553   8.510   3.832
   56    HA   SER   9           HA       SER   9   8.060   9.324   2.505
   57    HB2  SER   9           2HB      SER   9   8.793   7.027   3.172
   58    HB3  SER   9           3HB      SER   9   8.363   8.096   4.514
   59    HG   SER   9           HG       SER   9   7.453   6.004   4.764
   60    H    ILE  10           H        ILE  10   8.921   8.238   0.757
   61    HA   ILE  10           HA       ILE  10   6.985   6.921  -1.102
   62    HB   ILE  10           HB       ILE  10   9.584   8.410  -1.625
   63   HG12  ILE  10          2HG1      ILE  10   6.671   9.026  -2.330
   64   HG13  ILE  10          3HG1      ILE  10   7.607   9.811  -1.059
   65   HG21  ILE  10          1HG2      ILE  10   9.077   8.054  -4.038
   66   HG22  ILE  10          2HG2      ILE  10   9.400   6.538  -3.216
   67   HG23  ILE  10          3HG2      ILE  10   7.723   6.997  -3.583
   68   HD11  ILE  10          3HD1      ILE  10   7.543  11.296  -2.888
   69   HD12  ILE  10          1HD1      ILE  10   9.198  10.667  -2.773
   70   HD13  ILE  10          2HD1      ILE  10   8.085  10.064  -4.035
   71    H    CYS  11           H        CYS  11   7.315   4.865  -1.756
   72    HA   CYS  11           HA       CYS  11   9.537   3.371  -0.407
   73    HB2  CYS  11           2HB      CYS  11   6.601   2.738  -0.709
   74    HB3  CYS  11           3HB      CYS  11   7.798   1.588  -0.129
   75    H    SER  12           H        SER  12  10.926   2.772  -1.926
   76    HA   SER  12           HA       SER  12  10.290   1.592  -4.481
   77    HB2  SER  12           2HB      SER  12  12.705   1.139  -2.679
   78    HB3  SER  12           3HB      SER  12  12.591   0.750  -4.407
   79    HG   SER  12           HG       SER  12  13.645   2.759  -4.037
   80    H    LEU  13           H        LEU  13  10.651  -0.796  -4.968
   81    HA   LEU  13           HA       LEU  13   8.880  -2.383  -3.451
   82    HB2  LEU  13           2HB      LEU  13  10.943  -3.035  -5.570
   83    HB3  LEU  13           3HB      LEU  13  10.083  -4.314  -4.721
   84    HG   LEU  13           HG       LEU  13   7.902  -3.342  -5.401
   85   HD11  LEU  13          1HD1      LEU  13   9.601  -1.516  -7.143
   86   HD12  LEU  13          2HD1      LEU  13   7.863  -1.790  -7.361
   87   HD13  LEU  13          3HD1      LEU  13   8.434  -1.022  -5.882
   88   HD21  LEU  13          3HD2      LEU  13   8.028  -4.138  -7.724
   89   HD22  LEU  13          1HD2      LEU  13   9.803  -4.014  -7.683
   90   HD23  LEU  13          2HD2      LEU  13   8.960  -5.190  -6.648
   91    H    TYR  14           H        TYR  14  12.413  -2.149  -3.111
   92    HA   TYR  14           HA       TYR  14  12.859  -4.221  -1.230
   93    HB2  TYR  14           2HB      TYR  14  14.668  -3.013  -2.278
   94    HB3  TYR  14           3HB      TYR  14  14.110  -1.478  -1.628
   95    HD1  TYR  14           HD1      TYR  14  15.730  -4.715  -0.747
   96    HD2  TYR  14           HD2      TYR  14  14.635  -0.768   0.614
   97    HE1  TYR  14           HE1      TYR  14  17.145  -5.018   1.281
   98    HE2  TYR  14           HE2      TYR  14  16.018  -1.085   2.654
   99    HH   TYR  14           HH       TYR  14  17.886  -4.096   3.244
  100    H    GLN  15           H        GLN  15  11.442  -0.992  -0.714
  101    HA   GLN  15           HA       GLN  15  11.437  -1.244   2.224
  102    HB2  GLN  15           2HB      GLN  15  10.042   0.774   0.419
  103    HB3  GLN  15           3HB      GLN  15  10.183   0.879   2.164
  104    HG2  GLN  15           2HG      GLN  15  12.523   0.959   0.204
  105    HG3  GLN  15           3HG      GLN  15  11.755   2.361   0.929
  106   HE21  GLN  15          2HE2      GLN  15  14.422   2.233   1.306
  107   HE22  GLN  15          1HE2      GLN  15  14.774   1.748   2.958
  108    H    LEU  16           H        LEU  16   9.131  -1.524  -0.483
  109    HA   LEU  16           HA       LEU  16   6.778  -2.059   1.064
  110    HB2  LEU  16           2HB      LEU  16   7.566  -2.950  -1.729
  111    HB3  LEU  16           3HB      LEU  16   5.949  -3.111  -1.064
  112    HG   LEU  16           HG       LEU  16   7.412  -0.529  -1.662
  113   HD11  LEU  16          1HD1      LEU  16   6.577  -1.714  -3.641
  114   HD12  LEU  16          2HD1      LEU  16   4.948  -1.777  -2.927
  115   HD13  LEU  16          3HD1      LEU  16   5.681  -0.217  -3.360
  116   HD21  LEU  16          3HD2      LEU  16   5.964  -0.152   0.292
  117   HD22  LEU  16          1HD2      LEU  16   5.240   0.589  -1.135
  118   HD23  LEU  16          2HD2      LEU  16   4.612  -0.962  -0.535
  119    H    GLU  17           H        GLU  17   9.359  -4.277  -0.017
  120    HA   GLU  17           HA       GLU  17   8.091  -6.697   0.682
  121    HB2  GLU  17           2HB      GLU  17  10.989  -5.860   0.499
  122    HB3  GLU  17           3HB      GLU  17  10.553  -7.474   1.065
  123    HG2  GLU  17           2HG      GLU  17   9.279  -7.911  -0.987
  124    HG3  GLU  17           3HG      GLU  17   9.670  -6.315  -1.608
  125    H    ASN  18           H        ASN  18   9.175  -4.257   2.921
  126    HA   ASN  18           HA       ASN  18   9.520  -5.934   5.235
  127    HB2  ASN  18           2HB      ASN  18  10.223  -3.537   5.053
  128    HB3  ASN  18           3HB      ASN  18   8.523  -3.057   5.021
  129   HD21  ASN  18          2HD2      ASN  18  10.994  -4.695   7.052
  130   HD22  ASN  18          1HD2      ASN  18  10.195  -4.296   8.564
  131    H    TYR  19           H        TYR  19   6.622  -4.707   3.579
  132    HA   TYR  19           HA       TYR  19   4.781  -5.472   5.706
  133    HB2  TYR  19           2HB      TYR  19   4.285  -4.684   2.827
  134    HB3  TYR  19           3HB      TYR  19   3.057  -4.846   4.065
  135    HD1  TYR  19           HD1      TYR  19   3.497  -3.405   6.293
  136    HD2  TYR  19           HD2      TYR  19   5.062  -2.513   2.382
  137    HE1  TYR  19           HE1      TYR  19   3.671  -1.000   6.907
  138    HE2  TYR  19           HE2      TYR  19   5.287  -0.118   3.011
  139    HH   TYR  19           HH       TYR  19   5.017   1.448   4.662
  140    H    CYS  20           H        CYS  20   6.478  -7.396   3.489
  141    HA   CYS  20           HA       CYS  20   4.420  -9.481   3.270
  142    HB2  CYS  20           2HB      CYS  20   7.387  -9.839   2.870
  143    HB3  CYS  20           3HB      CYS  20   6.067 -10.789   2.222
  144    H    ASN  21           H        ASN  21   6.556  -8.391   5.717
  145    HA   ASN  21           HA       ASN  21   7.369  -9.182   7.670
  146    HB2  ASN  21           2HB      ASN  21   4.919  -8.953   8.081
  147    HB3  ASN  21           3HB      ASN  21   4.722 -10.676   7.740
  148   HD21  ASN  21          2HD2      ASN  21   3.756 -10.163  10.060
  149   HD22  ASN  21          1HD2      ASN  21   4.876 -10.513  11.371
  150    H1   PHE   1           H        PHE   1   3.570   1.684  -9.378
  151    HA   PHE   1           HA       PHE   1   3.429   3.906  -7.613
  152    HB2  PHE   1           2HB      PHE   1   3.007   2.177  -5.876
  153    HB3  PHE   1           3HB      PHE   1   1.989   2.070  -7.291
  154    HD1  PHE   1           HD2      PHE   1   5.135   0.568  -5.828
  155    HD2  PHE   1           HD1      PHE   1   1.679  -0.005  -8.350
  156    HE1  PHE   1           HE2      PHE   1   5.715  -1.828  -6.092
  157    HE2  PHE   1           HE1      PHE   1   2.250  -2.401  -8.587
  158    HZ   PHE   1           HZ       PHE   1   4.281  -3.318  -7.474
  159    H    VAL   2           H        VAL   2   6.211   2.303  -8.584
  160    HA   VAL   2           HA       VAL   2   7.688   2.042  -6.176
  161    HB   VAL   2           HB       VAL   2   8.122   0.863  -8.288
  162   HG11  VAL   2          1HG1      VAL   2   7.904   2.751  -9.897
  163   HG12  VAL   2          2HG1      VAL   2   9.438   3.418  -9.294
  164   HG13  VAL   2          3HG1      VAL   2   9.403   1.842 -10.101
  165   HG21  VAL   2          3HG2      VAL   2  10.606   2.339  -7.342
  166   HG22  VAL   2          1HG2      VAL   2   9.865   0.931  -6.547
  167   HG23  VAL   2          2HG2      VAL   2  10.530   0.777  -8.179
  168    H    ASN   3           H        ASN   3   7.229   4.901  -8.129
  169    HA   ASN   3           HA       ASN   3   9.382   6.350  -6.654
  170    HB2  ASN   3           2HB      ASN   3   9.644   5.917  -9.124
  171    HB3  ASN   3           3HB      ASN   3   8.228   6.929  -9.410
  172   HD21  ASN   3          2HD2      ASN   3  11.424   7.045  -7.697
  173   HD22  ASN   3          1HD2      ASN   3  11.748   8.703  -8.177
  174    H    GLN   4           H        GLN   4   6.381   6.018  -5.945
  175    HA   GLN   4           HA       GLN   4   5.883   8.858  -5.267
  176    HB2  GLN   4           2HB      GLN   4   3.582   8.768  -6.109
  177    HB3  GLN   4           3HB      GLN   4   4.759   8.582  -7.402
  178    HG2  GLN   4           2HG      GLN   4   4.362   6.129  -7.433
  179    HG3  GLN   4           3HG      GLN   4   3.201   6.291  -6.110
  180   HE21  GLN   4          2HE2      GLN   4   3.819   7.282  -9.534
  181   HE22  GLN   4          1HE2      GLN   4   2.113   7.476  -9.908
  182    H    HIS   5           H        HIS   5   3.974   9.095  -3.787
  183    HA   HIS   5           HA       HIS   5   4.033   7.261  -1.550
  184    HB2  HIS   5           2HB      HIS   5   2.010   9.432  -2.232
  185    HB3  HIS   5           3HB      HIS   5   2.272   8.693  -0.653
  186    HD2  HIS   5           HD2      HIS   5   4.485   9.424   0.708
  187    HE1  HIS   5           HE1      HIS   5   5.680  12.622  -1.832
  188    HE2  HIS   5           HE2      HIS   5   6.027  11.535   0.457
  189    H    LEU   6           H        LEU   6   2.344   5.899  -0.790
  190    HA   LEU   6           HA       LEU   6   0.578   4.809  -2.961
  191    HB2  LEU   6           2HB      LEU   6   1.967   3.228  -0.773
  192    HB3  LEU   6           3HB      LEU   6   0.927   2.626  -2.051
  193    HG   LEU   6           HG       LEU   6   2.755   3.719  -3.659
  194   HD11  LEU   6          1HD1      LEU   6   5.020   3.366  -2.775
  195   HD12  LEU   6          2HD1      LEU   6   4.202   4.570  -1.778
  196   HD13  LEU   6          3HD1      LEU   6   4.362   2.902  -1.191
  197   HD21  LEU   6          3HD2      LEU   6   3.055   1.060  -2.189
  198   HD22  LEU   6          1HD2      LEU   6   2.085   1.360  -3.646
  199   HD23  LEU   6          2HD2      LEU   6   3.848   1.488  -3.718
  200    H    CYS   7           H        CYS   7   0.139   6.634  -0.396
  201    HA   CYS   7           HA       CYS   7  -1.185   5.378   1.605
  202    HB2  CYS   7           2HB      CYS   7  -0.551   7.831   1.165
  203    HB3  CYS   7           3HB      CYS   7  -2.168   8.024   0.525
  204    H    GLY   8           H        GLY   8  -3.131   4.511   2.120
  205    HA2  GLY   8           HA2      GLY   8  -5.319   3.744   1.895
  206    HA3  GLY   8           HA3      GLY   8  -5.553   4.802   0.508
  207    H    SER   9           H        SER   9  -6.378   3.437  -1.003
  208    HA   SER   9           HA       SER   9  -6.050   0.687  -1.122
  209    HB2  SER   9           2HB      SER   9  -6.789   2.506  -3.440
  210    HB3  SER   9           3HB      SER   9  -7.197   0.787  -3.259
  211    HG   SER   9           HG       SER   9  -8.928   2.164  -2.619
  212    H    HIS  10           H        HIS  10  -4.076   3.100  -2.872
  213    HA   HIS  10           HA       HIS  10  -2.970   1.358  -4.810
  214    HB2  HIS  10           2HB      HIS  10  -1.764   3.843  -3.539
  215    HB3  HIS  10           3HB      HIS  10  -1.187   3.067  -5.011
  216    HD2  HIS  10           HD2      HIS  10  -2.548   3.480  -7.260
  217    HE1  HIS  10           HE1      HIS  10  -5.484   6.156  -5.700
  218    HE2  HIS  10           HE2      HIS  10  -4.506   5.155  -7.828
  219    H    LEU  11           H        LEU  11  -1.979   1.817  -1.424
  220    HA   LEU  11           HA       LEU  11   0.499   0.402  -1.658
  221    HB2  LEU  11           2HB      LEU  11  -0.007   1.950   0.191
  222    HB3  LEU  11           3HB      LEU  11  -1.303   0.893   0.747
  223    HG   LEU  11           HG       LEU  11   0.353  -0.865   1.275
  224   HD11  LEU  11          1HD1      LEU  11   2.782  -0.298   1.299
  225   HD12  LEU  11          2HD1      LEU  11   2.140  -0.398  -0.340
  226   HD13  LEU  11          3HD1      LEU  11   2.436   1.193   0.404
  227   HD21  LEU  11          3HD2      LEU  11   1.405   0.261   3.172
  228   HD22  LEU  11          1HD2      LEU  11   1.053   1.843   2.424
  229   HD23  LEU  11          2HD2      LEU  11  -0.273   0.787   2.969
  230    H    VAL  12           H        VAL  12  -2.785  -0.787  -0.601
  231    HA   VAL  12           HA       VAL  12  -1.802  -3.476  -0.276
  232    HB   VAL  12           HB       VAL  12  -4.123  -4.140  -0.148
  233   HG11  VAL  12          1HG1      VAL  12  -3.554  -1.638   1.482
  234   HG12  VAL  12          2HG1      VAL  12  -4.660  -2.958   1.913
  235   HG13  VAL  12          3HG1      VAL  12  -2.917  -3.257   1.829
  236   HG21  VAL  12          3HG2      VAL  12  -5.208  -2.550  -1.726
  237   HG22  VAL  12          1HG2      VAL  12  -5.973  -2.568  -0.135
  238   HG23  VAL  12          2HG2      VAL  12  -4.892  -1.235  -0.565
  239    H    GLU  13           H        GLU  13  -3.314  -1.763  -3.026
  240    HA   GLU  13           HA       GLU  13  -3.405  -4.011  -4.808
  241    HB2  GLU  13           2HB      GLU  13  -3.120  -1.024  -5.297
  242    HB3  GLU  13           3HB      GLU  13  -3.217  -2.207  -6.602
  243    HG2  GLU  13           2HG      GLU  13  -5.393  -3.016  -5.760
  244    HG3  GLU  13           3HG      GLU  13  -5.344  -1.848  -4.446
  245    H    ALA  14           H        ALA  14  -0.686  -1.743  -4.102
  246    HA   ALA  14           HA       ALA  14   1.154  -2.985  -5.938
  247    HB1  ALA  14           3HB      ALA  14   1.501  -0.732  -5.039
  248    HB2  ALA  14           1HB      ALA  14   1.629  -1.376  -3.388
  249    HB3  ALA  14           2HB      ALA  14   2.856  -1.788  -4.595
  250    H    LEU  15           H        LEU  15   0.529  -3.527  -2.420
  251    HA   LEU  15           HA       LEU  15   2.597  -5.493  -2.173
  252    HB2  LEU  15           2HB      LEU  15   0.216  -4.787  -0.437
  253    HB3  LEU  15           3HB      LEU  15   1.443  -5.961   0.038
  254    HG   LEU  15           HG       LEU  15   2.100  -3.059  -0.659
  255   HD11  LEU  15          1HD1      LEU  15   0.655  -3.232   1.358
  256   HD12  LEU  15          2HD1      LEU  15   1.827  -4.358   2.068
  257   HD13  LEU  15          3HD1      LEU  15   2.296  -2.682   1.737
  258   HD21  LEU  15          3HD2      LEU  15   3.728  -5.256   0.656
  259   HD22  LEU  15          1HD2      LEU  15   4.029  -4.521  -0.931
  260   HD23  LEU  15          2HD2      LEU  15   4.205  -3.551   0.526
  261    H    TYR  16           H        TYR  16  -0.829  -5.931  -3.056
  262    HA   TYR  16           HA       TYR  16  -0.731  -8.795  -3.027
  263    HB2  TYR  16           2HB      TYR  16  -2.416  -6.794  -4.541
  264    HB3  TYR  16           3HB      TYR  16  -2.564  -8.520  -4.834
  265    HD1  TYR  16           HD1      TYR  16  -2.597  -9.983  -2.508
  266    HD2  TYR  16           HD2      TYR  16  -4.108  -5.985  -3.083
  267    HE1  TYR  16           HE1      TYR  16  -4.067 -10.249  -0.529
  268    HE2  TYR  16           HE2      TYR  16  -5.564  -6.245  -1.087
  269    HH   TYR  16           HH       TYR  16  -6.123  -7.560   0.674
  270    H    LEU  17           H        LEU  17   1.039  -6.657  -5.032
  271    HA   LEU  17           HA       LEU  17   1.657  -8.843  -6.986
  272    HB2  LEU  17           2HB      LEU  17   2.251  -5.864  -7.142
  273    HB3  LEU  17           3HB      LEU  17   2.637  -7.064  -8.365
  274    HG   LEU  17           HG       LEU  17  -0.193  -6.301  -7.503
  275   HD11  LEU  17          1HD1      LEU  17   0.957  -4.483  -8.682
  276   HD12  LEU  17          2HD1      LEU  17   1.392  -5.591 -10.005
  277   HD13  LEU  17          3HD1      LEU  17  -0.314  -5.188  -9.691
  278   HD21  LEU  17          3HD2      LEU  17  -0.124  -8.604  -8.358
  279   HD22  LEU  17          1HD2      LEU  17  -0.883  -7.536  -9.541
  280   HD23  LEU  17          2HD2      LEU  17   0.796  -8.068  -9.784
  281    H    VAL  18           H        VAL  18   3.189  -6.472  -4.792
  282    HA   VAL  18           HA       VAL  18   5.878  -7.415  -5.260
  283    HB   VAL  18           HB       VAL  18   4.722  -5.601  -3.114
  284   HG11  VAL  18          1HG1      VAL  18   6.883  -6.384  -2.288
  285   HG12  VAL  18          2HG1      VAL  18   7.636  -6.086  -3.874
  286   HG13  VAL  18          3HG1      VAL  18   7.057  -4.732  -2.886
  287   HG21  VAL  18          3HG2      VAL  18   6.220  -5.002  -5.702
  288   HG22  VAL  18          1HG2      VAL  18   4.489  -4.761  -5.448
  289   HG23  VAL  18          2HG2      VAL  18   5.635  -3.802  -4.520
  290    H    CYS  19           H        CYS  19   3.541  -8.042  -2.636
  291    HA   CYS  19           HA       CYS  19   5.331 -10.159  -1.524
  292    HB2  CYS  19           2HB      CYS  19   2.732  -9.024  -0.468
  293    HB3  CYS  19           3HB      CYS  19   3.749 -10.228   0.321
  294    H    GLY  20           H        GLY  20   2.681  -9.822  -3.689
  295    HA2  GLY  20           HA2      GLY  20   1.534 -11.460  -4.904
  296    HA3  GLY  20           HA3      GLY  20   2.345 -12.712  -3.971
  297    H    GLU  21           H        GLU  21   0.410 -13.881  -3.717
  298    HA   GLU  21           HA       GLU  21  -1.993 -12.823  -2.539
  299    HB2  GLU  21           2HB      GLU  21  -2.720 -15.115  -2.396
  300    HB3  GLU  21           3HB      GLU  21  -1.950 -14.823  -3.952
  301    HG2  GLU  21           2HG      GLU  21   0.152 -15.899  -3.069
  302    HG3  GLU  21           3HG      GLU  21  -0.698 -16.256  -1.564
  303    H    ARG  22           H        ARG  22  -2.951 -13.656  -0.464
  304    HA   ARG  22           HA       ARG  22  -1.380 -12.792   1.772
  305    HB2  ARG  22           2HB      ARG  22  -3.947 -14.426   1.786
  306    HB3  ARG  22           3HB      ARG  22  -3.252 -13.549   3.156
  307    HG2  ARG  22           2HG      ARG  22  -3.517 -11.401   1.890
  308    HG3  ARG  22           3HG      ARG  22  -4.288 -12.308   0.572
  309    HD2  ARG  22           2HD      ARG  22  -6.003 -13.130   2.185
  310    HD3  ARG  22           3HD      ARG  22  -5.308 -12.071   3.427
  311    HE   ARG  22           HE       ARG  22  -5.777 -10.308   1.387
  312   HH11  ARG  22          2HH2      ARG  22  -7.929 -12.585   2.972
  313   HH12  ARG  22          1HH2      ARG  22  -9.348 -11.675   2.523
  314   HH21  ARG  22          2HH1      ARG  22  -7.580  -9.260   0.822
  315   HH22  ARG  22          1HH1      ARG  22  -9.155  -9.808   1.347
  316    H    GLY  23           H        GLY  23  -0.078 -13.827   3.172
  317    HA2  GLY  23           HA2      GLY  23   0.123 -16.463   3.977
  318    HA3  GLY  23           HA3      GLY  23   0.851 -16.494   2.373
  319    H    DHI  24           H        DHI  24   3.687 -14.398   3.597
  320    HA   DHI  24           HA       DHI  24   1.716 -14.346   1.343
  321    HB2  DHI  24           2HB      DHI  24   3.718 -14.186  -0.132
  322    HB3  DHI  24           3HB      DHI  24   4.724 -14.631   1.248
  323    HD2  DHI  24           HD2      DHI  24   1.734 -16.012  -0.844
  324    HE1  DHI  24           HE1      DHI  24   3.756 -19.390   0.804
  325    HE2  DHI  24           HE2      DHI  24   1.870 -18.647  -0.738
  326    H    PHE  25           H        PHE  25   1.080 -12.361   0.764
  327    HA   PHE  25           HA       PHE  25   2.246  -9.973   2.049
  328    HB2  PHE  25           2HB      PHE  25   0.764  -9.857   0.023
  329    HB3  PHE  25           3HB      PHE  25  -0.549 -10.494   0.986
  330    HD1  PHE  25           HD1      PHE  25   1.545  -8.023   2.794
  331    HD2  PHE  25           HD2      PHE  25  -1.703  -8.486  -0.005
  332    HE1  PHE  25           HE1      PHE  25   0.665  -5.829   3.455
  333    HE2  PHE  25           HE2      PHE  25  -2.520  -6.221   0.582
  334    HZ   PHE  25           HZ       PHE  25  -1.357  -4.903   2.353
  335    H    TYR  26           H        TYR  26   1.809  -9.332   4.161
  336    HA   TYR  26           HA       TYR  26   1.208 -11.443   5.974
  337    HB2  TYR  26           2HB      TYR  26   2.926  -9.788   6.355
  338    HB3  TYR  26           3HB      TYR  26   1.750  -8.482   6.303
  339    HD1  TYR  26           HD1      TYR  26   1.851 -11.766   8.194
  340    HD2  TYR  26           HD2      TYR  26   1.571  -7.464   8.355
  341    HE1  TYR  26           HE1      TYR  26   1.509 -11.877  10.654
  342    HE2  TYR  26           HE2      TYR  26   1.279  -7.573  10.817
  343    HH   TYR  26           HH       TYR  26   1.105  -8.934  12.667
  344    H    THR  27           H        THR  27  -0.582  -8.460   5.263
  345    HA   THR  27           HA       THR  27  -2.635  -7.683   5.872
  346    HB   THR  27           HB       THR  27  -4.496  -9.090   5.019
  347    HG1  THR  27           HG1      THR  27  -3.543 -11.121   5.567
  348   HG21  THR  27          1HG2      THR  27  -3.784  -9.085   2.711
  349   HG22  THR  27          2HG2      THR  27  -3.120  -7.656   3.516
  350   HG23  THR  27          3HG2      THR  27  -2.076  -9.060   3.190
  351    HA   PRO  28           HA       PRO  28  -3.206  -9.666  10.004
  352    HB2  PRO  28           2HB      PRO  28  -2.670  -7.539  11.618
  353    HB3  PRO  28           3HB      PRO  28  -1.390  -8.554  10.889
  354    HG2  PRO  28           2HG      PRO  28  -2.457  -5.899   9.898
  355    HG3  PRO  28           3HG      PRO  28  -0.749  -6.391  10.095
  356    HD2  PRO  28           2HD      PRO  28  -2.066  -6.514   7.691
  357    HD3  PRO  28           3HD      PRO  28  -0.802  -7.690   8.140
  358    H    LYS  29           H        LYS  29  -4.856  -9.357  11.552
  359    HA   LYS  29           HA       LYS  29  -7.039  -7.404  10.972
  360    HB2  LYS  29           2HB      LYS  29  -7.353 -10.422  11.301
  361    HB3  LYS  29           3HB      LYS  29  -8.682  -9.259  11.325
  362    HG2  LYS  29           2HG      LYS  29  -8.135  -8.565   9.000
  363    HG3  LYS  29           3HG      LYS  29  -6.803  -9.726   8.968
  364    HD2  LYS  29           2HD      LYS  29  -8.667 -10.679   7.804
  365    HD3  LYS  29           3HD      LYS  29  -8.405 -11.592   9.296
  366    HE2  LYS  29           2HE      LYS  29 -10.271 -10.355  10.380
  367    HE3  LYS  29           3HE      LYS  29 -10.503  -9.402   8.908
  368    HZ1  LYS  29           HZ1      LYS  29 -10.846 -12.350   9.103
  369    HZ2  LYS  29           HZ2      LYS  29 -12.059 -11.263   9.021
  370    HZ3  LYS  29           HZ3      LYS  29 -11.066 -11.469   7.744
  371    H    THR  30           H        THR  30  -8.524  -7.113  12.701
  372    HA   THR  30           HA       THR  30  -7.278  -7.070  15.344
  373    HB   THR  30           HB       THR  30  -8.558  -5.169  14.479
  374    HG1  THR  30           HG1      THR  30  -8.294  -5.415  16.677
  375   HG21  THR  30          1HG2      THR  30 -11.066  -6.837  14.936
  376   HG22  THR  30          2HG2      THR  30 -10.981  -5.120  14.501
  377   HG23  THR  30          3HG2      THR  30 -10.439  -6.345  13.345
  Start of MODEL   11
    1    H1   GLY   1           1H       GLY   1   5.583   1.495  10.439
    2    H2   GLY   1           2H       GLY   1   5.078   0.689  11.775
    3    H3   GLY   1           3H       GLY   1   5.481  -0.139  10.420
    4    HA2  GLY   1           HA2      GLY   1   3.090  -0.068  10.644
    5    HA3  GLY   1           HA3      GLY   1   3.189   1.702  10.702
    6    H    ILE   2           H        ILE   2   1.709   0.076   8.802
    7    HA   ILE   2           HA       ILE   2   3.137   0.264   6.234
    8    HB   ILE   2           HB       ILE   2   0.266  -0.570   6.758
    9   HG12  ILE   2          2HG1      ILE   2   2.840  -2.198   6.659
   10   HG13  ILE   2          3HG1      ILE   2   1.720  -2.060   8.006
   11   HG21  ILE   2          1HG2      ILE   2   0.420  -1.638   4.537
   12   HG22  ILE   2          2HG2      ILE   2   0.728   0.069   4.395
   13   HG23  ILE   2          3HG2      ILE   2   2.093  -1.071   4.361
   14   HD11  ILE   2          3HD1      ILE   2   1.278  -3.565   5.415
   15   HD12  ILE   2          1HD1      ILE   2   1.409  -4.202   7.058
   16   HD13  ILE   2          2HD1      ILE   2  -0.016  -3.243   6.605
   17    H    VAL   3           H        VAL   3   2.527   1.617   4.517
   18    HA   VAL   3           HA       VAL   3   2.059   3.547   3.481
   19    HB   VAL   3           HB       VAL   3  -0.180   4.149   5.427
   20   HG11  VAL   3          1HG1      VAL   3  -1.181   5.285   3.471
   21   HG12  VAL   3          2HG1      VAL   3   0.356   6.008   3.914
   22   HG13  VAL   3          3HG1      VAL   3   0.276   4.910   2.515
   23   HG21  VAL   3          3HG2      VAL   3  -0.623   1.905   4.566
   24   HG22  VAL   3          1HG2      VAL   3  -1.686   3.046   3.764
   25   HG23  VAL   3          2HG2      VAL   3  -0.257   2.432   2.904
   26    H    GLU   4           H        GLU   4   2.641   3.794   6.929
   27    HA   GLU   4           HA       GLU   4   3.594   6.502   6.991
   28    HB2  GLU   4           2HB      GLU   4   4.553   4.051   8.522
   29    HB3  GLU   4           3HB      GLU   4   5.011   5.711   8.886
   30    HG2  GLU   4           2HG      GLU   4   2.170   4.599   9.009
   31    HG3  GLU   4           3HG      GLU   4   3.239   4.836  10.382
   32    H    GLN   5           H        GLN   5   5.516   7.412   6.470
   33    HA   GLN   5           HA       GLN   5   7.167   7.954   5.091
   34    HB2  GLN   5           2HB      GLN   5   8.534   6.409   6.415
   35    HB3  GLN   5           3HB      GLN   5   8.154   5.093   5.293
   36    HG2  GLN   5           2HG      GLN   5   9.212   6.357   3.437
   37    HG3  GLN   5           3HG      GLN   5   9.582   7.681   4.544
   38   HE21  GLN   5          2HE2      GLN   5  11.717   6.740   3.217
   39   HE22  GLN   5          1HE2      GLN   5  12.699   5.745   4.281
   40    H    CYS   6           H        CYS   6   5.914   4.774   3.949
   41    HA   CYS   6           HA       CYS   6   6.233   5.557   1.156
   42    HB2  CYS   6           2HB      CYS   6   4.918   3.102   2.350
   43    HB3  CYS   6           3HB      CYS   6   5.350   3.347   0.660
   44    H    CYS   7           H        CYS   7   4.931   7.492   1.856
   45    HA   CYS   7           HA       CYS   7   2.894   7.615  -0.045
   46    HB2  CYS   7           2HB      CYS   7   1.376   6.666   1.596
   47    HB3  CYS   7           3HB      CYS   7   1.881   7.829   2.816
   48    H    THR   8           H        THR   8   4.206   9.187   2.904
   49    HA   THR   8           HA       THR   8   4.124  11.883   1.806
   50    HB   THR   8           HB       THR   8   5.750  12.317   3.717
   51    HG1  THR   8           HG1      THR   8   5.950  10.662   5.217
   52   HG21  THR   8          1HG2      THR   8   3.122  10.944   4.448
   53   HG22  THR   8          2HG2      THR   8   4.043  12.079   5.461
   54   HG23  THR   8          3HG2      THR   8   3.300  12.643   3.955
   55    H    SER   9           H        SER   9   6.432   9.223   1.731
   56    HA   SER   9           HA       SER   9   8.171  10.740  -0.173
   57    HB2  SER   9           2HB      SER   9   8.982   8.715   1.949
   58    HB3  SER   9           3HB      SER   9  10.057   9.374   0.705
   59    HG   SER   9           HG       SER   9  10.231  10.525   2.684
   60    H    ILE  10           H        ILE  10   9.394   9.345  -1.636
   61    HA   ILE  10           HA       ILE  10   7.768   7.145  -2.755
   62    HB   ILE  10           HB       ILE  10  10.351   8.387  -3.783
   63   HG12  ILE  10          2HG1      ILE  10   7.459   8.922  -4.598
   64   HG13  ILE  10          3HG1      ILE  10   8.478  10.025  -3.673
   65   HG21  ILE  10          1HG2      ILE  10   9.752   7.289  -5.917
   66   HG22  ILE  10          2HG2      ILE  10   9.930   6.087  -4.656
   67   HG23  ILE  10          3HG2      ILE  10   8.302   6.590  -5.167
   68   HD11  ILE  10          3HD1      ILE  10   8.395  10.808  -5.904
   69   HD12  ILE  10          1HD1      ILE  10  10.038  10.220  -5.579
   70   HD13  ILE  10          2HD1      ILE  10   8.912   9.252  -6.562
   71    H    CYS  11           H        CYS  11   8.342   5.000  -2.674
   72    HA   CYS  11           HA       CYS  11  10.597   4.318  -0.852
   73    HB2  CYS  11           2HB      CYS  11   7.824   3.191  -1.169
   74    HB3  CYS  11           3HB      CYS  11   9.126   2.235  -0.469
   75    H    SER  12           H        SER  12  11.834   2.507  -1.098
   76    HA   SER  12           HA       SER  12  12.695   2.191  -3.826
   77    HB2  SER  12           2HB      SER  12  14.680   1.177  -2.808
   78    HB3  SER  12           3HB      SER  12  14.221   2.679  -1.991
   79    HG   SER  12           HG       SER  12  14.713   1.006  -0.508
   80    H    LEU  13           H        LEU  13  10.215   0.660  -3.232
   81    HA   LEU  13           HA       LEU  13   9.163  -1.266  -3.426
   82    HB2  LEU  13           2HB      LEU  13  10.429  -1.004  -5.599
   83    HB3  LEU  13           3HB      LEU  13  11.540  -2.240  -5.043
   84    HG   LEU  13           HG       LEU  13   9.816  -2.912  -6.654
   85   HD11  LEU  13          1HD1      LEU  13   9.286  -5.065  -5.718
   86   HD12  LEU  13          2HD1      LEU  13  10.909  -4.603  -5.179
   87   HD13  LEU  13          3HD1      LEU  13   9.524  -4.484  -4.067
   88   HD21  LEU  13          3HD2      LEU  13   7.801  -2.774  -4.400
   89   HD22  LEU  13          1HD2      LEU  13   7.931  -1.573  -5.711
   90   HD23  LEU  13          2HD2      LEU  13   7.546  -3.258  -6.090
   91    H    TYR  14           H        TYR  14  12.526  -2.013  -2.486
   92    HA   TYR  14           HA       TYR  14  12.149  -4.388  -0.997
   93    HB2  TYR  14           2HB      TYR  14  14.341  -3.544  -1.392
   94    HB3  TYR  14           3HB      TYR  14  13.951  -1.965  -0.725
   95    HD1  TYR  14           HD2      TYR  14  14.403  -5.565   0.239
   96    HD2  TYR  14           HD1      TYR  14  14.306  -1.451   1.550
   97    HE1  TYR  14           HE2      TYR  14  15.189  -6.263   2.504
   98    HE2  TYR  14           HE1      TYR  14  15.090  -2.152   3.809
   99    HH   TYR  14           HH       TYR  14  15.712  -3.903   5.152
  100    H    GLN  15           H        GLN  15  11.374  -1.026  -0.085
  101    HA   GLN  15           HA       GLN  15  10.723  -1.575   2.666
  102    HB2  GLN  15           2HB      GLN  15   9.739   0.639   0.835
  103    HB3  GLN  15           3HB      GLN  15   9.614   0.627   2.599
  104    HG2  GLN  15           2HG      GLN  15  12.101   0.504   2.773
  105    HG3  GLN  15           3HG      GLN  15  12.213   0.532   1.013
  106   HE21  GLN  15          2HE2      GLN  15  11.242   2.528   3.846
  107   HE22  GLN  15          1HE2      GLN  15  11.461   4.047   2.989
  108    H    LEU  16           H        LEU  16   8.889  -1.920  -0.311
  109    HA   LEU  16           HA       LEU  16   6.340  -2.325   1.082
  110    HB2  LEU  16           2HB      LEU  16   7.056  -3.186  -1.743
  111    HB3  LEU  16           3HB      LEU  16   5.460  -3.180  -1.016
  112    HG   LEU  16           HG       LEU  16   7.141  -0.851  -1.923
  113   HD11  LEU  16          1HD1      LEU  16   5.182  -0.316  -3.258
  114   HD12  LEU  16          2HD1      LEU  16   5.686  -1.981  -3.557
  115   HD13  LEU  16          3HD1      LEU  16   4.274  -1.660  -2.525
  116   HD21  LEU  16          3HD2      LEU  16   4.611  -0.701  -0.211
  117   HD22  LEU  16          1HD2      LEU  16   6.225  -0.110   0.251
  118   HD23  LEU  16          2HD2      LEU  16   5.346   0.676  -1.062
  119    H    GLU  17           H        GLU  17   8.891  -4.450  -0.355
  120    HA   GLU  17           HA       GLU  17   7.824  -6.932   0.527
  121    HB2  GLU  17           2HB      GLU  17  10.455  -5.876  -0.354
  122    HB3  GLU  17           3HB      GLU  17  10.600  -7.196   0.801
  123    HG2  GLU  17           2HG      GLU  17   8.921  -7.323  -1.730
  124    HG3  GLU  17           3HG      GLU  17  10.579  -7.887  -1.595
  125    H    ASN  18           H        ASN  18   9.721  -4.538   2.391
  126    HA   ASN  18           HA       ASN  18  10.163  -6.084   4.682
  127    HB2  ASN  18           2HB      ASN  18  11.169  -3.853   4.100
  128    HB3  ASN  18           3HB      ASN  18   9.643  -3.087   4.571
  129   HD21  ASN  18          2HD2      ASN  18  12.185  -5.304   5.871
  130   HD22  ASN  18          1HD2      ASN  18  12.067  -4.664   7.502
  131    H    TYR  19           H        TYR  19   7.081  -4.741   3.662
  132    HA   TYR  19           HA       TYR  19   5.764  -4.994   6.242
  133    HB2  TYR  19           2HB      TYR  19   4.672  -4.880   3.413
  134    HB3  TYR  19           3HB      TYR  19   3.692  -4.751   4.840
  135    HD1  TYR  19           HD2      TYR  19   5.521  -2.893   6.532
  136    HD2  TYR  19           HD1      TYR  19   4.315  -2.773   2.396
  137    HE1  TYR  19           HE2      TYR  19   5.775  -0.436   6.525
  138    HE2  TYR  19           HE1      TYR  19   4.550  -0.300   2.402
  139    HH   TYR  19           HH       TYR  19   5.531   1.515   5.325
  140    H    CYS  20           H        CYS  20   6.760  -7.335   3.918
  141    HA   CYS  20           HA       CYS  20   5.117  -9.452   5.272
  142    HB2  CYS  20           2HB      CYS  20   6.142  -9.231   2.419
  143    HB3  CYS  20           3HB      CYS  20   5.478 -10.701   3.123
  144    H    ASN  21           H        ASN  21   8.355  -8.417   4.508
  145    HA   ASN  21           HA       ASN  21   9.523 -11.092   5.165
  146    HB2  ASN  21           2HB      ASN  21   9.347 -10.450   2.744
  147    HB3  ASN  21           3HB      ASN  21  10.348  -9.040   3.061
  148   HD21  ASN  21          2HD2      ASN  21  11.230 -10.553   1.134
  149   HD22  ASN  21          1HD2      ASN  21  12.612 -11.527   1.667
  150    H1   PHE   1           H        PHE   1   5.150   4.332  -7.501
  151    HA   PHE   1           HA       PHE   1   4.625   2.065  -6.843
  152    HB2  PHE   1           2HB      PHE   1   3.872   1.728  -9.321
  153    HB3  PHE   1           3HB      PHE   1   5.495   1.129  -9.589
  154    HD1  PHE   1           HD2      PHE   1   6.221  -0.741  -7.631
  155    HD2  PHE   1           HD1      PHE   1   2.219   0.140  -8.993
  156    HE1  PHE   1           HE2      PHE   1   5.467  -2.952  -6.862
  157    HE2  PHE   1           HE1      PHE   1   1.489  -2.107  -8.274
  158    HZ   PHE   1           HZ       PHE   1   3.114  -3.674  -7.218
  159    H    VAL   2           H        VAL   2   7.302   2.847  -9.030
  160    HA   VAL   2           HA       VAL   2   9.290   2.007  -6.944
  161    HB   VAL   2           HB       VAL   2  10.815   1.221  -8.668
  162   HG11  VAL   2          1HG1      VAL   2   9.764  -0.885  -9.157
  163   HG12  VAL   2          2HG1      VAL   2   9.223  -0.356  -7.555
  164   HG13  VAL   2          3HG1      VAL   2   8.142  -0.199  -8.956
  165   HG21  VAL   2          3HG2      VAL   2  10.050   2.516 -10.634
  166   HG22  VAL   2          1HG2      VAL   2  10.080   0.784 -10.971
  167   HG23  VAL   2          2HG2      VAL   2   8.531   1.588 -10.662
  168    H    ASN   3           H        ASN   3   8.384   4.400  -9.309
  169    HA   ASN   3           HA       ASN   3  10.559   6.172  -8.315
  170    HB2  ASN   3           2HB      ASN   3  11.016   5.127 -10.611
  171    HB3  ASN   3           3HB      ASN   3   9.631   6.039 -11.211
  172   HD21  ASN   3          2HD2      ASN   3  11.031   7.192 -12.679
  173   HD22  ASN   3          1HD2      ASN   3  12.141   8.416 -12.076
  174    H    GLN   4           H        GLN   4   7.506   5.788  -7.897
  175    HA   GLN   4           HA       GLN   4   6.904   8.598  -7.546
  176    HB2  GLN   4           2HB      GLN   4   4.778   8.621  -8.708
  177    HB3  GLN   4           3HB      GLN   4   6.095   8.324  -9.841
  178    HG2  GLN   4           2HG      GLN   4   5.535   5.889  -9.836
  179    HG3  GLN   4           3HG      GLN   4   4.196   6.211  -8.725
  180   HE21  GLN   4          2HE2      GLN   4   3.361   4.938 -10.857
  181   HE22  GLN   4          1HE2      GLN   4   2.617   6.024 -12.024
  182    H    HIS   5           H        HIS   5   5.046   8.913  -6.150
  183    HA   HIS   5           HA       HIS   5   5.168   7.229  -3.912
  184    HB2  HIS   5           2HB      HIS   5   2.979   9.237  -4.551
  185    HB3  HIS   5           3HB      HIS   5   3.488   8.699  -2.955
  186    HD2  HIS   5           HD2      HIS   5   5.428  10.055  -1.805
  187    HE1  HIS   5           HE1      HIS   5   6.575  12.514  -5.089
  188    HE2  HIS   5           HE2      HIS   5   6.867  12.118  -2.591
  189    H    LEU   6           H        LEU   6   3.620   6.032  -2.792
  190    HA   LEU   6           HA       LEU   6   1.175   5.105  -4.205
  191    HB2  LEU   6           2HB      LEU   6   2.710   3.342  -2.264
  192    HB3  LEU   6           3HB      LEU   6   1.329   2.950  -3.263
  193    HG   LEU   6           HG       LEU   6   3.023   3.376  -5.281
  194   HD11  LEU   6          1HD1      LEU   6   4.871   2.653  -2.945
  195   HD12  LEU   6          2HD1      LEU   6   5.315   2.568  -4.656
  196   HD13  LEU   6          3HD1      LEU   6   4.966   4.130  -3.928
  197   HD21  LEU   6          3HD2      LEU   6   3.068   0.937  -3.450
  198   HD22  LEU   6          1HD2      LEU   6   1.917   1.259  -4.765
  199   HD23  LEU   6          2HD2      LEU   6   3.619   0.955  -5.139
  200    H    CYS   7           H        CYS   7  -0.670   5.075  -2.808
  201    HA   CYS   7           HA       CYS   7  -0.264   5.555   0.092
  202    HB2  CYS   7           2HB      CYS   7  -1.880   7.367  -1.729
  203    HB3  CYS   7           3HB      CYS   7  -2.000   7.386   0.021
  204    H    GLY   8           H        GLY   8  -1.860   4.693   1.362
  205    HA2  GLY   8           HA2      GLY   8  -3.650   3.373   1.982
  206    HA3  GLY   8           HA3      GLY   8  -4.541   4.402   0.866
  207    H    SER   9           H        SER   9  -5.756   3.269  -0.485
  208    HA   SER   9           HA       SER   9  -5.812   0.543  -0.965
  209    HB2  SER   9           2HB      SER   9  -6.633   2.723  -2.911
  210    HB3  SER   9           3HB      SER   9  -7.220   1.049  -2.876
  211    HG   SER   9           HG       SER   9  -8.661   2.494  -1.814
  212    H    HIS  10           H        HIS  10  -3.969   2.995  -2.858
  213    HA   HIS  10           HA       HIS  10  -3.219   1.167  -4.971
  214    HB2  HIS  10           2HB      HIS  10  -3.291   3.611  -5.250
  215    HB3  HIS  10           3HB      HIS  10  -1.987   3.799  -4.076
  216    HD2  HIS  10           HD2      HIS  10  -2.540   2.031  -7.529
  217    HE1  HIS  10           HE1      HIS  10   1.532   3.295  -7.336
  218    HE2  HIS  10           HE2      HIS  10  -0.239   2.195  -8.805
  219    H    LEU  11           H        LEU  11  -1.751   1.927  -1.829
  220    HA   LEU  11           HA       LEU  11   0.752   0.557  -2.435
  221    HB2  LEU  11           2HB      LEU  11   0.637   2.388  -0.843
  222    HB3  LEU  11           3HB      LEU  11  -0.435   1.479   0.215
  223    HG   LEU  11           HG       LEU  11   2.232   0.246  -0.541
  224   HD11  LEU  11          1HD1      LEU  11   3.313   1.421   1.344
  225   HD12  LEU  11          2HD1      LEU  11   2.827   2.532   0.060
  226   HD13  LEU  11          3HD1      LEU  11   1.856   2.425   1.539
  227   HD21  LEU  11          3HD2      LEU  11   0.689  -1.060   0.920
  228   HD22  LEU  11          1HD2      LEU  11   2.127  -0.578   1.804
  229   HD23  LEU  11          2HD2      LEU  11   0.602   0.300   2.046
  230    H    VAL  12           H        VAL  12  -2.303  -0.425  -0.706
  231    HA   VAL  12           HA       VAL  12  -1.220  -3.052  -0.188
  232    HB   VAL  12           HB       VAL  12  -3.460  -3.690   0.445
  233   HG11  VAL  12          1HG1      VAL  12  -2.645  -0.989   1.576
  234   HG12  VAL  12          2HG1      VAL  12  -3.643  -2.217   2.384
  235   HG13  VAL  12          3HG1      VAL  12  -1.939  -2.555   2.032
  236   HG21  VAL  12          3HG2      VAL  12  -5.309  -2.112   0.567
  237   HG22  VAL  12          1HG2      VAL  12  -4.333  -0.874  -0.238
  238   HG23  VAL  12          2HG2      VAL  12  -4.835  -2.337  -1.121
  239    H    GLU  13           H        GLU  13  -3.150  -1.716  -2.868
  240    HA   GLU  13           HA       GLU  13  -3.384  -4.195  -4.332
  241    HB2  GLU  13           2HB      GLU  13  -3.354  -1.282  -5.194
  242    HB3  GLU  13           3HB      GLU  13  -3.489  -2.613  -6.345
  243    HG2  GLU  13           2HG      GLU  13  -5.500  -3.461  -5.218
  244    HG3  GLU  13           3HG      GLU  13  -5.421  -2.167  -4.031
  245    H    ALA  14           H        ALA  14  -0.649  -1.885  -4.057
  246    HA   ALA  14           HA       ALA  14   0.995  -3.296  -5.973
  247    HB1  ALA  14           3HB      ALA  14   2.840  -2.006  -4.943
  248    HB2  ALA  14           1HB      ALA  14   1.454  -0.988  -5.379
  249    HB3  ALA  14           2HB      ALA  14   1.748  -1.432  -3.684
  250    H    LEU  15           H        LEU  15   0.547  -3.663  -2.406
  251    HA   LEU  15           HA       LEU  15   2.515  -5.741  -2.151
  252    HB2  LEU  15           2HB      LEU  15   0.077  -5.068  -0.448
  253    HB3  LEU  15           3HB      LEU  15   1.221  -6.327  -0.038
  254    HG   LEU  15           HG       LEU  15   2.118  -3.454  -0.502
  255   HD11  LEU  15          1HD1      LEU  15   2.090  -3.199   1.946
  256   HD12  LEU  15          2HD1      LEU  15   0.463  -3.489   1.328
  257   HD13  LEU  15          3HD1      LEU  15   1.349  -4.803   2.115
  258   HD21  LEU  15          3HD2      LEU  15   3.373  -5.794   1.007
  259   HD22  LEU  15          1HD2      LEU  15   3.882  -5.220  -0.598
  260   HD23  LEU  15          2HD2      LEU  15   4.053  -4.172   0.795
  261    H    TYR  16           H        TYR  16  -0.896  -5.933  -3.123
  262    HA   TYR  16           HA       TYR  16  -1.091  -8.780  -3.292
  263    HB2  TYR  16           2HB      TYR  16  -2.510  -6.447  -4.494
  264    HB3  TYR  16           3HB      TYR  16  -2.657  -7.972  -5.342
  265    HD1  TYR  16           HD1      TYR  16  -3.486 -10.024  -4.180
  266    HD2  TYR  16           HD2      TYR  16  -3.708  -6.109  -2.388
  267    HE1  TYR  16           HE1      TYR  16  -5.128 -10.863  -2.524
  268    HE2  TYR  16           HE2      TYR  16  -5.316  -6.962  -0.705
  269    HH   TYR  16           HH       TYR  16  -6.512  -8.760   0.038
  270    H    LEU  17           H        LEU  17   0.945  -6.683  -5.171
  271    HA   LEU  17           HA       LEU  17   1.472  -8.859  -7.166
  272    HB2  LEU  17           2HB      LEU  17   2.283  -5.931  -7.225
  273    HB3  LEU  17           3HB      LEU  17   2.597  -7.125  -8.476
  274    HG   LEU  17           HG       LEU  17  -0.156  -6.097  -7.647
  275   HD11  LEU  17          1HD1      LEU  17   1.215  -4.453  -8.872
  276   HD12  LEU  17          2HD1      LEU  17   1.489  -5.636 -10.169
  277   HD13  LEU  17          3HD1      LEU  17  -0.148  -5.018  -9.848
  278   HD21  LEU  17          3HD2      LEU  17  -0.965  -7.292  -9.670
  279   HD22  LEU  17          1HD2      LEU  17   0.645  -8.018  -9.877
  280   HD23  LEU  17          2HD2      LEU  17  -0.347  -8.408  -8.452
  281    H    VAL  18           H        VAL  18   3.140  -6.607  -4.945
  282    HA   VAL  18           HA       VAL  18   5.775  -7.674  -5.411
  283    HB   VAL  18           HB       VAL  18   4.640  -5.834  -3.271
  284   HG11  VAL  18          1HG1      VAL  18   6.680  -6.739  -2.315
  285   HG12  VAL  18          2HG1      VAL  18   7.559  -6.491  -3.845
  286   HG13  VAL  18          3HG1      VAL  18   7.004  -5.102  -2.890
  287   HG21  VAL  18          3HG2      VAL  18   5.722  -4.080  -4.590
  288   HG22  VAL  18          1HG2      VAL  18   6.349  -5.285  -5.737
  289   HG23  VAL  18          2HG2      VAL  18   4.604  -4.978  -5.615
  290    H    CYS  19           H        CYS  19   3.456  -8.140  -2.747
  291    HA   CYS  19           HA       CYS  19   5.190 -10.259  -1.557
  292    HB2  CYS  19           2HB      CYS  19   4.700  -8.518  -0.041
  293    HB3  CYS  19           3HB      CYS  19   2.995  -8.475  -0.482
  294    H    GLY  20           H        GLY  20   2.144  -9.764  -3.187
  295    HA2  GLY  20           HA2      GLY  20   0.515 -11.736  -2.333
  296    HA3  GLY  20           HA3      GLY  20   0.537 -11.172  -3.996
  297    H    GLU  21           H        GLU  21   3.350 -12.458  -4.264
  298    HA   GLU  21           HA       GLU  21   2.607 -15.020  -5.307
  299    HB2  GLU  21           2HB      GLU  21   5.332 -13.945  -4.466
  300    HB3  GLU  21           3HB      GLU  21   5.054 -15.414  -5.409
  301    HG2  GLU  21           2HG      GLU  21   3.867 -14.003  -7.141
  302    HG3  GLU  21           3HG      GLU  21   4.397 -12.566  -6.261
  303    H    ARG  22           H        ARG  22   3.210 -14.081  -2.022
  304    HA   ARG  22           HA       ARG  22   3.718 -16.803  -1.015
  305    HB2  ARG  22           2HB      ARG  22   3.030 -14.223   0.452
  306    HB3  ARG  22           3HB      ARG  22   3.528 -15.747   1.203
  307    HG2  ARG  22           2HG      ARG  22   5.702 -15.637  -0.004
  308    HG3  ARG  22           3HG      ARG  22   5.240 -14.052  -0.654
  309    HD2  ARG  22           2HD      ARG  22   4.976 -13.206   1.696
  310    HD3  ARG  22           3HD      ARG  22   5.508 -14.778   2.296
  311    HE   ARG  22           HE       ARG  22   7.711 -14.316   1.667
  312   HH11  ARG  22          1HH2      ARG  22   5.686 -11.745   0.397
  313   HH12  ARG  22          2HH2      ARG  22   7.085 -10.720   0.063
  314   HH21  ARG  22          1HH1      ARG  22   9.410 -12.978   1.076
  315   HH22  ARG  22          2HH1      ARG  22   9.071 -11.393   0.407
  316    H    GLY  23           H        GLY  23   1.065 -15.851  -2.481
  317    HA2  GLY  23           HA2      GLY  23  -1.078 -16.794  -2.476
  318    HA3  GLY  23           HA3      GLY  23  -0.790 -17.518  -0.890
  319    H    DHI  24           H        DHI  24  -0.231 -14.115  -1.635
  320    HA   DHI  24           HA       DHI  24  -2.391 -13.283   0.253
  321    HB2  DHI  24           2HB      DHI  24  -2.902 -11.394  -1.211
  322    HB3  DHI  24           3HB      DHI  24  -1.723 -11.950  -2.394
  323    HD2  DHI  24           HD2      DHI  24  -2.430 -13.872  -4.035
  324    HE1  DHI  24           HE1      DHI  24  -6.335 -14.653  -2.507
  325    HE2  DHI  24           HE2      DHI  24  -4.712 -15.154  -4.401
  326    H    PHE  25           H        PHE  25  -2.079 -10.890   0.908
  327    HA   PHE  25           HA       PHE  25   0.641 -10.032   1.466
  328    HB2  PHE  25           2HB      PHE  25  -1.263  -8.509   1.673
  329    HB3  PHE  25           3HB      PHE  25  -1.996  -9.541   2.896
  330    HD1  PHE  25           HD1      PHE  25   0.854  -7.199   2.209
  331    HD2  PHE  25           HD2      PHE  25  -1.255  -9.487   5.212
  332    HE1  PHE  25           HE1      PHE  25   2.040  -5.983   3.959
  333    HE2  PHE  25           HE2      PHE  25  -0.018  -8.267   6.983
  334    HZ   PHE  25           HZ       PHE  25   1.643  -6.520   6.368
  335    H    TYR  26           H        TYR  26   1.778 -10.348   3.509
  336    HA   TYR  26           HA       TYR  26   1.137 -12.942   4.820
  337    HB2  TYR  26           2HB      TYR  26   2.982 -12.769   2.945
  338    HB3  TYR  26           3HB      TYR  26   3.971 -12.176   4.269
  339    HD1  TYR  26           HD2      TYR  26   1.873 -14.978   3.025
  340    HD2  TYR  26           HD1      TYR  26   4.752 -13.736   5.993
  341    HE1  TYR  26           HE2      TYR  26   2.185 -17.348   3.707
  342    HE2  TYR  26           HE1      TYR  26   5.050 -16.107   6.690
  343    HH   TYR  26           HH       TYR  26   4.447 -18.292   6.335
  344    H    THR  27           H        THR  27   2.083 -11.410   7.976
  345    HA   THR  27           HA       THR  27   1.815 -14.055   7.325
  346    HB   THR  27           HB       THR  27   1.839 -13.069   9.556
  347    HG1  THR  27           HG1      THR  27   0.417 -14.499  10.489
  348   HG21  THR  27          1HG2      THR  27   0.179 -11.214   9.230
  349   HG22  THR  27          2HG2      THR  27  -1.119 -12.426   9.199
  350   HG23  THR  27          3HG2      THR  27  -0.134 -12.208  10.659
  351    HA   PRO  28           HA       PRO  28  -1.342 -14.352   4.477
  352    HB2  PRO  28           2HB      PRO  28  -2.021 -16.990   4.440
  353    HB3  PRO  28           3HB      PRO  28  -0.414 -16.364   3.961
  354    HG2  PRO  28           2HG      PRO  28  -1.243 -17.508   6.645
  355    HG3  PRO  28           3HG      PRO  28   0.204 -17.918   5.665
  356    HD2  PRO  28           2HD      PRO  28   0.306 -16.163   7.720
  357    HD3  PRO  28           3HD      PRO  28   1.277 -15.906   6.252
  358    H    LYS  29           H        LYS  29  -3.532 -14.591   3.906
  359    HA   LYS  29           HA       LYS  29  -5.499 -14.118   5.993
  360    HB2  LYS  29           2HB      LYS  29  -7.140 -14.097   4.158
  361    HB3  LYS  29           3HB      LYS  29  -5.794 -12.995   3.894
  362    HG2  LYS  29           2HG      LYS  29  -4.838 -14.385   2.191
  363    HG3  LYS  29           3HG      LYS  29  -5.822 -15.772   2.652
  364    HD2  LYS  29           2HD      LYS  29  -6.630 -14.794   0.563
  365    HD3  LYS  29           3HD      LYS  29  -7.840 -14.746   1.836
  366    HE2  LYS  29           2HE      LYS  29  -7.966 -12.701   0.606
  367    HE3  LYS  29           3HE      LYS  29  -7.364 -12.330   2.221
  368    HZ1  LYS  29           HZ1      LYS  29  -5.147 -12.127   1.303
  369    HZ2  LYS  29           HZ2      LYS  29  -5.627 -12.654  -0.175
  370    HZ3  LYS  29           HZ3      LYS  29  -6.140 -11.208   0.378
  371    H    THR  30           H        THR  30  -7.414 -15.310   6.375
  372    HA   THR  30           HA       THR  30  -6.983 -18.155   6.826
  373    HB   THR  30           HB       THR  30  -9.337 -18.034   7.757
  374    HG1  THR  30           HG1      THR  30  -9.917 -16.155   6.542
  375   HG21  THR  30          1HG2      THR  30  -7.333 -17.830   9.190
  376   HG22  THR  30          2HG2      THR  30  -7.287 -16.079   8.895
  377   HG23  THR  30          3HG2      THR  30  -8.655 -16.802   9.768
  Start of MODEL   12
    1    H1   GLY   1           1H       GLY   1   3.448   3.155  13.075
    2    H2   GLY   1           2H       GLY   1   4.145   4.369  12.217
    3    H3   GLY   1           3H       GLY   1   2.525   4.117  12.121
    4    HA2  GLY   1           HA2      GLY   1   3.566   3.297  10.133
    5    HA3  GLY   1           HA3      GLY   1   4.615   2.276  11.141
    6    H    ILE   2           H        ILE   2   1.712   0.148  10.055
    7    HA   ILE   2           HA       ILE   2   4.008   1.621   8.785
    8    HB   ILE   2           HB       ILE   2   4.554  -0.639   9.572
    9   HG12  ILE   2          2HG1      ILE   2   4.613  -0.362   6.545
   10   HG13  ILE   2          3HG1      ILE   2   5.711   0.437   7.662
   11   HG21  ILE   2          1HG2      ILE   2   3.661  -2.633   8.494
   12   HG22  ILE   2          2HG2      ILE   2   2.350  -1.741   9.252
   13   HG23  ILE   2          3HG2      ILE   2   2.571  -1.665   7.492
   14   HD11  ILE   2          3HD1      ILE   2   6.493  -1.827   8.436
   15   HD12  ILE   2          1HD1      ILE   2   5.488  -2.556   7.155
   16   HD13  ILE   2          2HD1      ILE   2   6.818  -1.478   6.725
   17    H    VAL   3           H        VAL   3   0.731   0.353   8.203
   18    HA   VAL   3           HA       VAL   3   0.802   0.944   5.362
   19    HB   VAL   3           HB       VAL   3  -1.765   0.748   6.936
   20   HG11  VAL   3          1HG1      VAL   3  -2.551  -0.387   4.869
   21   HG12  VAL   3          2HG1      VAL   3  -1.988   1.240   4.520
   22   HG13  VAL   3          3HG1      VAL   3  -0.954  -0.152   4.130
   23   HG21  VAL   3          3HG2      VAL   3  -0.458  -1.193   7.699
   24   HG22  VAL   3          1HG2      VAL   3  -1.691  -1.720   6.567
   25   HG23  VAL   3          2HG2      VAL   3  -0.008  -1.577   6.022
   26    H    GLU   4           H        GLU   4   0.790   3.011   7.978
   27    HA   GLU   4           HA       GLU   4  -0.578   5.323   6.863
   28    HB2  GLU   4           2HB      GLU   4   1.639   5.088   8.937
   29    HB3  GLU   4           3HB      GLU   4   0.678   6.535   8.626
   30    HG2  GLU   4           2HG      GLU   4  -1.370   5.374   9.351
   31    HG3  GLU   4           3HG      GLU   4  -0.446   3.900   9.661
   32    H    GLN   5           H        GLN   5   2.396   3.798   6.009
   33    HA   GLN   5           HA       GLN   5   3.888   6.222   5.340
   34    HB2  GLN   5           2HB      GLN   5   4.458   3.278   4.856
   35    HB3  GLN   5           3HB      GLN   5   5.586   4.593   4.526
   36    HG2  GLN   5           2HG      GLN   5   5.552   5.257   6.910
   37    HG3  GLN   5           3HG      GLN   5   4.476   3.911   7.280
   38   HE21  GLN   5          2HE2      GLN   5   6.676   3.880   8.764
   39   HE22  GLN   5          1HE2      GLN   5   7.834   2.705   8.159
   40    H    CYS   6           H        CYS   6   5.119   5.910   3.070
   41    HA   CYS   6           HA       CYS   6   5.079   6.366   0.894
   42    HB2  CYS   6           2HB      CYS   6   2.700   4.550   0.588
   43    HB3  CYS   6           3HB      CYS   6   3.968   4.919  -0.581
   44    H    CYS   7           H        CYS   7   3.466   8.037   2.664
   45    HA   CYS   7           HA       CYS   7   1.875   9.567   0.656
   46    HB2  CYS   7           2HB      CYS   7   2.017   9.884   3.670
   47    HB3  CYS   7           3HB      CYS   7   0.949  10.760   2.586
   48    H    THR   8           H        THR   8   2.502  11.712   0.254
   49    HA   THR   8           HA       THR   8   3.884  13.414  -0.220
   50    HB   THR   8           HB       THR   8   5.220  12.951   2.458
   51    HG1  THR   8           HG1      THR   8   3.659  14.380   3.205
   52   HG21  THR   8          1HG2      THR   8   4.931  15.440   0.717
   53   HG22  THR   8          2HG2      THR   8   5.552  15.418   2.384
   54   HG23  THR   8          3HG2      THR   8   6.444  14.590   1.105
   55    H    SER   9           H        SER   9   5.746  10.586   0.846
   56    HA   SER   9           HA       SER   9   7.634  11.021  -1.440
   57    HB2  SER   9           2HB      SER   9   8.163   9.558   1.167
   58    HB3  SER   9           3HB      SER   9   9.280   9.690  -0.202
   59    HG   SER   9           HG       SER   9   9.708  11.256   1.433
   60    H    ILE  10           H        ILE  10   8.266   9.146  -2.602
   61    HA   ILE  10           HA       ILE  10   6.101   7.119  -2.767
   62    HB   ILE  10           HB       ILE  10   8.279   7.691  -4.802
   63   HG12  ILE  10          2HG1      ILE  10   5.447   8.798  -4.590
   64   HG13  ILE  10          3HG1      ILE  10   6.948   9.725  -4.515
   65   HG21  ILE  10          1HG2      ILE  10   7.112   5.434  -4.920
   66   HG22  ILE  10          2HG2      ILE  10   5.575   6.314  -5.129
   67   HG23  ILE  10          3HG2      ILE  10   6.867   6.443  -6.335
   68   HD11  ILE  10          3HD1      ILE  10   5.997  10.099  -6.653
   69   HD12  ILE  10          1HD1      ILE  10   7.418   9.064  -6.896
   70   HD13  ILE  10          2HD1      ILE  10   5.771   8.373  -6.959
   71    H    CYS  11           H        CYS  11   6.399   5.052  -2.204
   72    HA   CYS  11           HA       CYS  11   8.875   4.223  -0.917
   73    HB2  CYS  11           2HB      CYS  11   6.192   2.899  -1.390
   74    HB3  CYS  11           3HB      CYS  11   7.521   2.080  -0.596
   75    H    SER  12           H        SER  12  10.188   2.457  -1.409
   76    HA   SER  12           HA       SER  12  10.447   1.743  -4.259
   77    HB2  SER  12           2HB      SER  12  12.600   0.893  -3.669
   78    HB3  SER  12           3HB      SER  12  12.405   2.486  -2.920
   79    HG   SER  12           HG       SER  12  13.237   1.046  -1.411
   80    H    LEU  13           H        LEU  13  10.997  -0.552  -4.784
   81    HA   LEU  13           HA       LEU  13   9.098  -2.497  -4.019
   82    HB2  LEU  13           2HB      LEU  13  10.504  -2.530  -6.061
   83    HB3  LEU  13           3HB      LEU  13  11.946  -2.772  -5.072
   84    HG   LEU  13           HG       LEU  13  11.097  -4.998  -4.361
   85   HD11  LEU  13          1HD1      LEU  13   9.172  -5.996  -5.574
   86   HD12  LEU  13          2HD1      LEU  13   8.678  -4.646  -4.550
   87   HD13  LEU  13          3HD1      LEU  13   8.821  -4.417  -6.309
   88   HD21  LEU  13          3HD2      LEU  13  11.399  -6.121  -6.524
   89   HD22  LEU  13          1HD2      LEU  13  11.118  -4.588  -7.381
   90   HD23  LEU  13          2HD2      LEU  13  12.549  -4.787  -6.344
   91    H    TYR  14           H        TYR  14  12.354  -1.852  -2.684
   92    HA   TYR  14           HA       TYR  14  12.483  -4.030  -0.835
   93    HB2  TYR  14           2HB      TYR  14  14.478  -2.876  -1.429
   94    HB3  TYR  14           3HB      TYR  14  13.803  -1.309  -1.014
   95    HD1  TYR  14           HD1      TYR  14  15.014  -4.527   0.454
   96    HD2  TYR  14           HD2      TYR  14  13.929  -0.415   1.187
   97    HE1  TYR  14           HE1      TYR  14  15.925  -4.699   2.767
   98    HE2  TYR  14           HE2      TYR  14  14.829  -0.594   3.510
   99    HH   TYR  14           HH       TYR  14  16.292  -3.622   4.756
  100    H    GLN  15           H        GLN  15  11.027  -0.769  -0.521
  101    HA   GLN  15           HA       GLN  15  10.399  -1.073   2.308
  102    HB2  GLN  15           2HB      GLN  15   9.134   0.680   0.168
  103    HB3  GLN  15           3HB      GLN  15   8.760   0.783   1.884
  104    HG2  GLN  15           2HG      GLN  15  11.564   1.160   0.782
  105    HG3  GLN  15           3HG      GLN  15  10.411   2.477   0.958
  106   HE21  GLN  15          2HE2      GLN  15  12.326   0.056   2.832
  107   HE22  GLN  15          1HE2      GLN  15  12.211   0.962   4.332
  108    H    LEU  16           H        LEU  16   8.590  -1.730  -0.711
  109    HA   LEU  16           HA       LEU  16   6.206  -2.622   0.638
  110    HB2  LEU  16           2HB      LEU  16   7.145  -3.414  -2.123
  111    HB3  LEU  16           3HB      LEU  16   5.542  -3.671  -1.443
  112    HG   LEU  16           HG       LEU  16   6.840  -1.214  -2.483
  113   HD11  LEU  16          1HD1      LEU  16   5.230  -2.425  -3.854
  114   HD12  LEU  16          2HD1      LEU  16   3.988  -2.236  -2.600
  115   HD13  LEU  16          3HD1      LEU  16   4.624  -0.820  -3.462
  116   HD21  LEU  16          3HD2      LEU  16   5.117   0.278  -1.446
  117   HD22  LEU  16          1HD2      LEU  16   4.597  -1.071  -0.414
  118   HD23  LEU  16          2HD2      LEU  16   6.220  -0.368  -0.243
  119    H    GLU  17           H        GLU  17   9.131  -4.444  -0.268
  120    HA   GLU  17           HA       GLU  17   8.181  -7.026   0.531
  121    HB2  GLU  17           2HB      GLU  17  10.963  -5.824   0.408
  122    HB3  GLU  17           3HB      GLU  17  10.661  -7.491   0.899
  123    HG2  GLU  17           2HG      GLU  17   9.512  -7.942  -1.245
  124    HG3  GLU  17           3HG      GLU  17   9.863  -6.305  -1.789
  125    H    ASN  18           H        ASN  18   8.961  -4.281   2.562
  126    HA   ASN  18           HA       ASN  18   9.616  -5.835   4.923
  127    HB2  ASN  18           2HB      ASN  18  10.352  -3.445   4.351
  128    HB3  ASN  18           3HB      ASN  18   8.715  -2.937   4.779
  129   HD21  ASN  18          2HD2      ASN  18   9.446  -1.646   6.533
  130   HD22  ASN  18          1HD2      ASN  18  10.105  -2.382   7.987
  131    H    TYR  19           H        TYR  19   6.596  -5.051   3.433
  132    HA   TYR  19           HA       TYR  19   4.943  -5.099   5.845
  133    HB2  TYR  19           2HB      TYR  19   4.308  -5.244   2.886
  134    HB3  TYR  19           3HB      TYR  19   3.095  -5.242   4.149
  135    HD1  TYR  19           HD2      TYR  19   5.832  -3.171   2.666
  136    HD2  TYR  19           HD1      TYR  19   2.321  -3.249   5.162
  137    HE1  TYR  19           HE2      TYR  19   5.797  -0.691   2.681
  138    HE2  TYR  19           HE1      TYR  19   2.284  -0.772   5.171
  139    HH   TYR  19           HH       TYR  19   3.432   1.153   4.614
  140    H    CYS  20           H        CYS  20   6.402  -7.573   3.951
  141    HA   CYS  20           HA       CYS  20   4.126  -9.197   3.567
  142    HB2  CYS  20           2HB      CYS  20   7.051  -9.811   3.135
  143    HB3  CYS  20           3HB      CYS  20   5.671 -10.654   2.421
  144    H    ASN  21           H        ASN  21   5.444  -8.994   6.421
  145    HA   ASN  21           HA       ASN  21   5.676 -11.641   7.483
  146    HB2  ASN  21           2HB      ASN  21   6.320  -9.571   8.683
  147    HB3  ASN  21           3HB      ASN  21   4.629  -9.069   8.754
  148   HD21  ASN  21          2HD2      ASN  21   3.257 -10.028  10.315
  149   HD22  ASN  21          1HD2      ASN  21   3.886 -11.153  11.526
  150    H1   PHE   1           H        PHE   1   8.571   1.993  -5.466
  151    HA   PHE   1           HA       PHE   1   7.822  -0.046  -7.498
  152    HB2  PHE   1           2HB      PHE   1   7.044  -0.314  -5.017
  153    HB3  PHE   1           3HB      PHE   1   5.925   0.991  -5.382
  154    HD1  PHE   1           HD1      PHE   1   7.051  -2.427  -6.364
  155    HD2  PHE   1           HD2      PHE   1   3.874   0.480  -6.641
  156    HE1  PHE   1           HE1      PHE   1   5.597  -4.117  -7.431
  157    HE2  PHE   1           HE2      PHE   1   2.419  -1.219  -7.715
  158    HZ   PHE   1           HZ       PHE   1   3.297  -3.506  -8.154
  159    H    VAL   2           H        VAL   2   5.673   0.542  -8.629
  160    HA   VAL   2           HA       VAL   2   6.270   2.901 -10.099
  161    HB   VAL   2           HB       VAL   2   5.309   0.820 -11.028
  162   HG11  VAL   2          1HG1      VAL   2   2.923   0.451 -11.106
  163   HG12  VAL   2          2HG1      VAL   2   3.440   0.474  -9.414
  164   HG13  VAL   2          3HG1      VAL   2   2.609   1.881 -10.107
  165   HG21  VAL   2          3HG2      VAL   2   3.787   3.342 -11.781
  166   HG22  VAL   2          1HG2      VAL   2   5.429   2.920 -12.322
  167   HG23  VAL   2          2HG2      VAL   2   4.054   1.908 -12.787
  168    H    ASN   3           H        ASN   3   5.445   4.843 -10.284
  169    HA   ASN   3           HA       ASN   3   4.079   6.108  -8.095
  170    HB2  ASN   3           2HB      ASN   3   4.514   8.133  -9.412
  171    HB3  ASN   3           3HB      ASN   3   5.923   7.104  -9.437
  172   HD21  ASN   3          2HD2      ASN   3   3.527   8.692 -11.407
  173   HD22  ASN   3          1HD2      ASN   3   4.100   8.036 -12.931
  174    H    GLN   4           H        GLN   4   0.763   6.761  -9.568
  175    HA   GLN   4           HA       GLN   4   2.684   8.578  -8.443
  176    HB2  GLN   4           2HB      GLN   4  -0.309   8.267  -7.973
  177    HB3  GLN   4           3HB      GLN   4   0.682   9.639  -7.510
  178    HG2  GLN   4           2HG      GLN   4  -0.309  10.410  -9.429
  179    HG3  GLN   4           3HG      GLN   4   1.287   9.929  -9.982
  180   HE21  GLN   4          2HE2      GLN   4  -0.087  10.130 -12.103
  181   HE22  GLN   4          1HE2      GLN   4  -0.880   8.646 -12.617
  182    H    HIS   5           H        HIS   5   2.188   9.338  -6.061
  183    HA   HIS   5           HA       HIS   5   3.288   7.695  -4.130
  184    HB2  HIS   5           2HB      HIS   5   1.164   9.860  -3.828
  185    HB3  HIS   5           3HB      HIS   5   2.089   9.172  -2.494
  186    HD2  HIS   5           HD2      HIS   5   4.219  10.410  -1.867
  187    HE1  HIS   5           HE1      HIS   5   5.080  12.401  -5.532
  188    HE2  HIS   5           HE2      HIS   5   5.760  12.172  -3.081
  189    H    LEU   6           H        LEU   6   2.666   6.071  -2.828
  190    HA   LEU   6           HA       LEU   6   0.340   4.652  -3.761
  191    HB2  LEU   6           2HB      LEU   6   2.323   3.763  -1.644
  192    HB3  LEU   6           3HB      LEU   6   1.150   2.803  -2.506
  193    HG   LEU   6           HG       LEU   6   2.425   3.499  -4.679
  194   HD11  LEU   6          1HD1      LEU   6   4.018   5.131  -3.756
  195   HD12  LEU   6          2HD1      LEU   6   4.577   3.930  -2.564
  196   HD13  LEU   6          3HD1      LEU   6   4.883   3.703  -4.298
  197   HD21  LEU   6          3HD2      LEU   6   2.299   1.220  -3.743
  198   HD22  LEU   6          1HD2      LEU   6   3.917   1.555  -4.360
  199   HD23  LEU   6          2HD2      LEU   6   3.608   1.602  -2.609
  200    H    CYS   7           H        CYS   7   0.808   6.696  -1.154
  201    HA   CYS   7           HA       CYS   7  -0.157   6.264   1.123
  202    HB2  CYS   7           2HB      CYS   7   0.191   8.449  -0.078
  203    HB3  CYS   7           3HB      CYS   7  -1.474   8.373  -0.622
  204    H    GLY   8           H        GLY   8  -2.679   6.304  -1.458
  205    HA2  GLY   8           HA2      GLY   8  -4.873   5.638   0.403
  206    HA3  GLY   8           HA3      GLY   8  -4.975   5.880  -1.333
  207    H    SER   9           H        SER   9  -6.137   4.040  -1.825
  208    HA   SER   9           HA       SER   9  -5.583   1.393  -0.921
  209    HB2  SER   9           2HB      SER   9  -6.942   2.255  -3.502
  210    HB3  SER   9           3HB      SER   9  -7.080   0.676  -2.704
  211    HG   SER   9           HG       SER   9  -8.846   2.066  -2.199
  212    H    HIS  10           H        HIS  10  -3.988   3.273  -3.355
  213    HA   HIS  10           HA       HIS  10  -2.923   1.338  -5.127
  214    HB2  HIS  10           2HB      HIS  10  -2.926   3.836  -5.297
  215    HB3  HIS  10           3HB      HIS  10  -1.663   3.903  -4.092
  216    HD2  HIS  10           HD2      HIS  10   0.541   1.984  -5.141
  217    HE1  HIS  10           HE1      HIS  10   0.314   4.135  -8.808
  218    HE2  HIS  10           HE2      HIS  10   1.803   2.683  -7.356
  219    H    LEU  11           H        LEU  11  -1.731   2.280  -1.858
  220    HA   LEU  11           HA       LEU  11   0.638   0.723  -1.920
  221    HB2  LEU  11           2HB      LEU  11   0.247   2.457  -0.256
  222    HB3  LEU  11           3HB      LEU  11  -1.134   1.582   0.401
  223    HG   LEU  11           HG       LEU  11   0.347  -0.197   1.231
  224   HD11  LEU  11          1HD1      LEU  11   2.139  -0.217  -0.428
  225   HD12  LEU  11          2HD1      LEU  11   2.595   1.449  -0.008
  226   HD13  LEU  11          3HD1      LEU  11   2.830   0.128   1.158
  227   HD21  LEU  11          3HD2      LEU  11   1.500   1.092   2.943
  228   HD22  LEU  11          1HD2      LEU  11   1.397   2.567   1.959
  229   HD23  LEU  11          2HD2      LEU  11  -0.077   1.823   2.611
  230    H    VAL  12           H        VAL  12  -2.569  -0.264  -0.488
  231    HA   VAL  12           HA       VAL  12  -1.588  -2.878   0.127
  232    HB   VAL  12           HB       VAL  12  -3.908  -3.460   0.569
  233   HG11  VAL  12          1HG1      VAL  12  -4.232  -1.922   2.433
  234   HG12  VAL  12          2HG1      VAL  12  -2.511  -2.303   2.252
  235   HG13  VAL  12          3HG1      VAL  12  -3.138  -0.739   1.688
  236   HG21  VAL  12          3HG2      VAL  12  -4.658  -0.643  -0.292
  237   HG22  VAL  12          1HG2      VAL  12  -5.092  -2.129  -1.169
  238   HG23  VAL  12          2HG2      VAL  12  -5.721  -1.843   0.457
  239    H    GLU  13           H        GLU  13  -3.194  -1.611  -2.761
  240    HA   GLU  13           HA       GLU  13  -3.426  -4.143  -4.151
  241    HB2  GLU  13           2HB      GLU  13  -3.072  -1.278  -5.122
  242    HB3  GLU  13           3HB      GLU  13  -3.277  -2.637  -6.216
  243    HG2  GLU  13           2HG      GLU  13  -5.306  -1.898  -4.060
  244    HG3  GLU  13           3HG      GLU  13  -5.376  -1.331  -5.722
  245    H    ALA  14           H        ALA  14  -0.727  -1.752  -3.968
  246    HA   ALA  14           HA       ALA  14   1.016  -3.196  -5.712
  247    HB1  ALA  14           3HB      ALA  14   1.267  -0.810  -5.243
  248    HB2  ALA  14           1HB      ALA  14   1.626  -1.160  -3.534
  249    HB3  ALA  14           2HB      ALA  14   2.733  -1.702  -4.801
  250    H    LEU  15           H        LEU  15   0.541  -3.444  -2.145
  251    HA   LEU  15           HA       LEU  15   2.768  -5.136  -1.625
  252    HB2  LEU  15           2HB      LEU  15   0.021  -5.238  -0.310
  253    HB3  LEU  15           3HB      LEU  15   1.489  -5.996   0.287
  254    HG   LEU  15           HG       LEU  15   0.905  -3.032   0.163
  255   HD11  LEU  15          1HD1      LEU  15  -0.109  -4.265   2.006
  256   HD12  LEU  15          2HD1      LEU  15   1.478  -4.916   2.456
  257   HD13  LEU  15          3HD1      LEU  15   1.159  -3.169   2.577
  258   HD21  LEU  15          3HD2      LEU  15   3.239  -3.247  -0.445
  259   HD22  LEU  15          1HD2      LEU  15   3.112  -2.690   1.220
  260   HD23  LEU  15          2HD2      LEU  15   3.519  -4.392   0.884
  261    H    TYR  16           H        TYR  16  -0.501  -6.076  -2.783
  262    HA   TYR  16           HA       TYR  16   0.030  -8.892  -2.931
  263    HB2  TYR  16           2HB      TYR  16  -2.024  -7.045  -4.149
  264    HB3  TYR  16           3HB      TYR  16  -1.914  -8.716  -4.674
  265    HD1  TYR  16           HD2      TYR  16  -1.852 -10.570  -2.878
  266    HD2  TYR  16           HD1      TYR  16  -3.332  -6.580  -2.182
  267    HE1  TYR  16           HE2      TYR  16  -3.106 -11.384  -0.914
  268    HE2  TYR  16           HE1      TYR  16  -4.588  -7.396  -0.191
  269    HH   TYR  16           HH       TYR  16  -4.563 -10.846   0.786
  270    H    LEU  17           H        LEU  17   1.121  -6.330  -5.034
  271    HA   LEU  17           HA       LEU  17   1.752  -8.167  -7.273
  272    HB2  LEU  17           2HB      LEU  17   2.310  -5.210  -6.835
  273    HB3  LEU  17           3HB      LEU  17   2.721  -6.102  -8.289
  274    HG   LEU  17           HG       LEU  17  -0.122  -5.699  -7.261
  275   HD11  LEU  17          1HD1      LEU  17  -0.369  -4.148  -9.148
  276   HD12  LEU  17          2HD1      LEU  17   0.878  -3.588  -8.030
  277   HD13  LEU  17          3HD1      LEU  17   1.347  -4.358  -9.565
  278   HD21  LEU  17          3HD2      LEU  17  -0.781  -6.479  -9.524
  279   HD22  LEU  17          1HD2      LEU  17   0.919  -6.859  -9.879
  280   HD23  LEU  17          2HD2      LEU  17   0.042  -7.740  -8.605
  281    H    VAL  18           H        VAL  18   3.221  -7.179  -4.353
  282    HA   VAL  18           HA       VAL  18   5.989  -7.816  -5.290
  283    HB   VAL  18           HB       VAL  18   4.924  -6.257  -2.905
  284   HG11  VAL  18          1HG1      VAL  18   6.970  -7.306  -2.122
  285   HG12  VAL  18          2HG1      VAL  18   7.816  -6.881  -3.627
  286   HG13  VAL  18          3HG1      VAL  18   7.301  -5.612  -2.494
  287   HG21  VAL  18          3HG2      VAL  18   4.804  -5.059  -5.017
  288   HG22  VAL  18          1HG2      VAL  18   6.159  -4.410  -4.091
  289   HG23  VAL  18          2HG2      VAL  18   6.459  -5.528  -5.434
  290    H    CYS  19           H        CYS  19   3.540  -8.814  -2.940
  291    HA   CYS  19           HA       CYS  19   5.089 -11.276  -2.346
  292    HB2  CYS  19           2HB      CYS  19   3.894  -9.313  -0.375
  293    HB3  CYS  19           3HB      CYS  19   4.342 -10.960   0.065
  294    H    GLY  20           H        GLY  20   3.967 -13.000  -1.897
  295    HA2  GLY  20           HA2      GLY  20   1.305 -13.314  -1.026
  296    HA3  GLY  20           HA3      GLY  20   1.309 -13.521  -2.785
  297    H    GLU  21           H        GLU  21   2.012 -16.931  -1.407
  298    HA   GLU  21           HA       GLU  21  -0.182 -14.952  -1.033
  299    HB2  GLU  21           2HB      GLU  21  -1.649 -16.242  -2.493
  300    HB3  GLU  21           3HB      GLU  21  -0.262 -15.607  -3.363
  301    HG2  GLU  21           2HG      GLU  21   0.836 -17.831  -3.291
  302    HG3  GLU  21           3HG      GLU  21  -0.522 -18.487  -2.381
  303    H    ARG  22           H        ARG  22   1.375 -16.485   0.864
  304    HA   ARG  22           HA       ARG  22  -0.142 -18.832   1.705
  305    HB2  ARG  22           2HB      ARG  22   2.286 -17.462   2.924
  306    HB3  ARG  22           3HB      ARG  22   1.599 -19.001   3.461
  307    HG2  ARG  22           2HG      ARG  22   1.976 -19.958   1.188
  308    HG3  ARG  22           3HG      ARG  22   2.787 -18.465   0.699
  309    HD2  ARG  22           2HD      ARG  22   3.653 -20.267   2.997
  310    HD3  ARG  22           3HD      ARG  22   4.346 -20.292   1.367
  311    HE   ARG  22           HE       ARG  22   4.564 -17.635   2.240
  312   HH11  ARG  22          1HH2      ARG  22   5.898 -20.711   3.255
  313   HH12  ARG  22          2HH2      ARG  22   7.331 -19.974   3.919
  314   HH21  ARG  22          1HH1      ARG  22   6.411 -16.759   3.114
  315   HH22  ARG  22          2HH1      ARG  22   7.608 -17.795   3.833
  316    H    GLY  23           H        GLY  23  -2.084 -17.367   1.853
  317    HA2  GLY  23           HA2      GLY  23  -3.875 -17.154   3.336
  318    HA3  GLY  23           HA3      GLY  23  -2.771 -17.218   4.708
  319    H    DHI  24           H        DHI  24  -1.228 -14.886   3.251
  320    HA   DHI  24           HA       DHI  24  -3.184 -12.665   3.719
  321    HB2  DHI  24           2HB      DHI  24  -2.218 -11.552   1.798
  322    HB3  DHI  24           3HB      DHI  24  -0.993 -12.806   1.624
  323    HD2  DHI  24           HD2      DHI  24  -4.904 -13.113   1.923
  324    HE1  DHI  24           HE1      DHI  24  -3.674 -15.204  -1.584
  325    HE2  DHI  24           HE2      DHI  24  -5.666 -14.583  -0.126
  326    H    PHE  25           H        PHE  25  -2.417 -10.618   4.280
  327    HA   PHE  25           HA       PHE  25   0.362 -10.368   5.323
  328    HB2  PHE  25           2HB      PHE  25  -1.718  -8.302   4.511
  329    HB3  PHE  25           3HB      PHE  25  -0.162  -7.921   5.227
  330    HD1  PHE  25           HD1      PHE  25  -1.851  -9.144   2.158
  331    HD2  PHE  25           HD2      PHE  25   1.906  -8.115   3.995
  332    HE1  PHE  25           HE1      PHE  25  -0.745  -9.198  -0.067
  333    HE2  PHE  25           HE2      PHE  25   3.002  -8.124   1.775
  334    HZ   PHE  25           HZ       PHE  25   1.679  -8.722  -0.261
  335    H    TYR  26           H        TYR  26   0.818  -9.843   7.393
  336    HA   TYR  26           HA       TYR  26  -1.213  -8.541   9.064
  337    HB2  TYR  26           2HB      TYR  26  -1.556 -10.872   9.690
  338    HB3  TYR  26           3HB      TYR  26   0.172 -11.102   9.934
  339    HD1  TYR  26           HD1      TYR  26  -2.623  -8.833  11.095
  340    HD2  TYR  26           HD2      TYR  26   0.999 -10.939  12.129
  341    HE1  TYR  26           HE1      TYR  26  -2.870  -8.101  13.467
  342    HE2  TYR  26           HE2      TYR  26   0.728 -10.242  14.501
  343    HH   TYR  26           HH       TYR  26  -0.552  -9.121  16.007
  344    H    THR  27           H        THR  27  -0.278  -6.761   9.751
  345    HA   THR  27           HA       THR  27   2.680  -6.655  10.192
  346    HB   THR  27           HB       THR  27   2.454  -4.267   9.467
  347    HG1  THR  27           HG1      THR  27   0.206  -4.088   9.604
  348   HG21  THR  27          1HG2      THR  27   3.373  -6.015   7.972
  349   HG22  THR  27          2HG2      THR  27   1.741  -6.364   7.368
  350   HG23  THR  27          3HG2      THR  27   2.480  -4.780   7.073
  351    HA   PRO  28           HA       PRO  28   0.577  -5.725  14.152
  352    HB2  PRO  28           2HB      PRO  28   2.471  -6.698  15.885
  353    HB3  PRO  28           3HB      PRO  28   1.257  -7.694  15.043
  354    HG2  PRO  28           2HG      PRO  28   4.137  -7.209  14.244
  355    HG3  PRO  28           3HG      PRO  28   3.249  -8.765  14.312
  356    HD2  PRO  28           2HD      PRO  28   3.585  -7.400  11.990
  357    HD3  PRO  28           3HD      PRO  28   2.066  -8.282  12.330
  358    H    LYS  29           H        LYS  29   2.206  -2.645  15.088
  359    HA   LYS  29           HA       LYS  29  -0.217  -3.842  13.844
  360    HB2  LYS  29           2HB      LYS  29  -0.090  -2.667  16.655
  361    HB3  LYS  29           3HB      LYS  29  -1.577  -2.886  15.733
  362    HG2  LYS  29           2HG      LYS  29  -1.190  -5.332  15.645
  363    HG3  LYS  29           3HG      LYS  29   0.285  -5.129  16.617
  364    HD2  LYS  29           2HD      LYS  29  -1.047  -4.129  18.445
  365    HD3  LYS  29           3HD      LYS  29  -2.529  -4.332  17.509
  366    HE2  LYS  29           2HE      LYS  29  -0.701  -6.614  18.400
  367    HE3  LYS  29           3HE      LYS  29  -2.124  -6.066  19.287
  368    HZ1  LYS  29           HZ1      LYS  29  -2.137  -7.266  16.569
  369    HZ2  LYS  29           HZ2      LYS  29  -2.735  -7.921  17.929
  370    HZ3  LYS  29           HZ3      LYS  29  -3.464  -6.613  17.288
  371    H    THR  30           H        THR  30  -1.336  -2.418  12.688
  372    HA   THR  30           HA       THR  30  -0.518   0.463  12.685
  373    HB   THR  30           HB       THR  30  -1.995  -1.022  10.492
  374    HG1  THR  30           HG1      THR  30   0.155  -1.715  10.777
  375   HG21  THR  30          1HG2      THR  30  -0.662   1.722  10.641
  376   HG22  THR  30          2HG2      THR  30  -1.300   0.975   9.162
  377   HG23  THR  30          3HG2      THR  30  -2.403   1.408  10.470
  Start of MODEL   13
    1    H1   GLY   1           1H       GLY   1  -4.739  -4.718   7.878
    2    H2   GLY   1           2H       GLY   1  -4.722  -3.633   9.104
    3    H3   GLY   1           3H       GLY   1  -5.913  -3.577   7.981
    4    HA2  GLY   1           HA2      GLY   1  -4.368  -2.977   6.248
    5    HA3  GLY   1           HA3      GLY   1  -4.320  -1.813   7.585
    6    H    ILE   2           H        ILE   2  -2.204  -1.145   7.355
    7    HA   ILE   2           HA       ILE   2  -0.134  -3.014   8.267
    8    HB   ILE   2           HB       ILE   2  -0.064  -3.166   5.815
    9   HG12  ILE   2          2HG1      ILE   2   2.272  -2.716   5.390
   10   HG13  ILE   2          3HG1      ILE   2   2.407  -1.706   6.820
   11   HG21  ILE   2          1HG2      ILE   2   0.658  -1.289   4.414
   12   HG22  ILE   2          2HG2      ILE   2  -0.905  -0.959   5.171
   13   HG23  ILE   2          3HG2      ILE   2   0.570  -0.198   5.804
   14   HD11  ILE   2          3HD1      ILE   2   1.981  -3.706   8.259
   15   HD12  ILE   2          1HD1      ILE   2   1.762  -4.696   6.798
   16   HD13  ILE   2          2HD1      ILE   2   3.341  -3.980   7.165
   17    H    VAL   3           H        VAL   3   1.784  -1.947   9.076
   18    HA   VAL   3           HA       VAL   3   0.925   0.010  10.932
   19    HB   VAL   3           HB       VAL   3   3.225  -0.113  11.834
   20   HG11  VAL   3          1HG1      VAL   3   1.500  -1.768  12.462
   21   HG12  VAL   3          2HG1      VAL   3   2.044  -2.838  11.151
   22   HG13  VAL   3          3HG1      VAL   3   3.133  -2.449  12.495
   23   HG21  VAL   3          3HG2      VAL   3   4.510  -0.404   9.720
   24   HG22  VAL   3          1HG2      VAL   3   4.867  -1.660  10.908
   25   HG23  VAL   3          2HG2      VAL   3   3.820  -2.029   9.529
   26    H    GLU   4           H        GLU   4   2.548   0.577   7.911
   27    HA   GLU   4           HA       GLU   4   2.625   3.485   8.489
   28    HB2  GLU   4           2HB      GLU   4   4.985   1.905   7.389
   29    HB3  GLU   4           3HB      GLU   4   4.824   3.660   7.297
   30    HG2  GLU   4           2HG      GLU   4   4.690   3.761   9.793
   31    HG3  GLU   4           3HG      GLU   4   4.995   2.021   9.857
   32    H    GLN   5           H        GLN   5   2.669   4.804   6.555
   33    HA   GLN   5           HA       GLN   5   1.564   3.449   4.138
   34    HB2  GLN   5           2HB      GLN   5   0.363   5.546   5.888
   35    HB3  GLN   5           3HB      GLN   5   0.243   5.858   4.166
   36    HG2  GLN   5           2HG      GLN   5  -0.618   3.221   5.439
   37    HG3  GLN   5           3HG      GLN   5  -1.699   4.588   5.172
   38   HE21  GLN   5          2HE2      GLN   5  -2.669   2.493   3.911
   39   HE22  GLN   5          1HE2      GLN   5  -2.277   2.530   2.193
   40    H    CYS   6           H        CYS   6   1.843   4.413   2.168
   41    HA   CYS   6           HA       CYS   6   4.482   5.666   1.942
   42    HB2  CYS   6           2HB      CYS   6   2.621   4.330  -0.030
   43    HB3  CYS   6           3HB      CYS   6   4.195   5.001  -0.473
   44    H    CYS   7           H        CYS   7   2.808   7.535   2.942
   45    HA   CYS   7           HA       CYS   7   2.085   9.467   0.794
   46    HB2  CYS   7           2HB      CYS   7   1.451   9.169   3.722
   47    HB3  CYS   7           3HB      CYS   7   1.528  10.785   3.055
   48    H    THR   8           H        THR   8   3.007  11.439   0.618
   49    HA   THR   8           HA       THR   8   4.561  12.989   0.395
   50    HB   THR   8           HB       THR   8   5.653  14.003   2.230
   51    HG1  THR   8           HG1      THR   8   4.986  11.641   3.618
   52   HG21  THR   8          1HG2      THR   8   2.908  13.047   3.141
   53   HG22  THR   8          2HG2      THR   8   3.771  14.506   3.669
   54   HG23  THR   8          3HG2      THR   8   3.214  14.370   1.993
   55    H    SER   9           H        SER   9   6.198  10.251   2.040
   56    HA   SER   9           HA       SER   9   8.507  10.606   0.195
   57    HB2  SER   9           2HB      SER   9   9.646   8.928   1.586
   58    HB3  SER   9           3HB      SER   9   9.184  10.379   2.482
   59    HG   SER   9           HG       SER   9   8.685   8.465   3.644
   60    H    ILE  10           H        ILE  10   9.288   8.849  -0.998
   61    HA   ILE  10           HA       ILE  10   7.037   7.334  -2.193
   62    HB   ILE  10           HB       ILE  10   9.767   8.077  -3.293
   63   HG12  ILE  10          2HG1      ILE  10   6.950   9.035  -3.986
   64   HG13  ILE  10          3HG1      ILE  10   8.099   9.943  -3.003
   65   HG21  ILE  10          1HG2      ILE  10   8.838   7.218  -5.459
   66   HG22  ILE  10          2HG2      ILE  10   9.064   5.941  -4.277
   67   HG23  ILE  10          3HG2      ILE  10   7.435   6.587  -4.577
   68   HD11  ILE  10          3HD1      ILE  10   8.355   9.330  -5.952
   69   HD12  ILE  10          1HD1      ILE  10   8.126  10.893  -5.164
   70   HD13  ILE  10          2HD1      ILE  10   9.662  10.024  -4.958
   71    H    CYS  11           H        CYS  11   6.884   5.194  -2.265
   72    HA   CYS  11           HA       CYS  11   8.855   3.575  -0.760
   73    HB2  CYS  11           2HB      CYS  11   6.010   3.106  -1.657
   74    HB3  CYS  11           3HB      CYS  11   7.016   1.838  -0.962
   75    H    SER  12           H        SER  12  10.432   2.643  -1.817
   76    HA   SER  12           HA       SER  12  10.200   1.583  -4.558
   77    HB2  SER  12           2HB      SER  12  12.366   1.284  -2.439
   78    HB3  SER  12           3HB      SER  12  12.471   0.691  -4.109
   79    HG   SER  12           HG       SER  12  13.448   2.776  -3.803
   80    H    LEU  13           H        LEU  13  10.644  -0.784  -4.933
   81    HA   LEU  13           HA       LEU  13   8.716  -2.407  -3.673
   82    HB2  LEU  13           2HB      LEU  13   9.680  -2.648  -5.922
   83    HB3  LEU  13           3HB      LEU  13  11.198  -3.218  -5.234
   84    HG   LEU  13           HG       LEU  13   8.669  -4.691  -4.477
   85   HD11  LEU  13          1HD1      LEU  13   8.383  -4.376  -6.896
   86   HD12  LEU  13          2HD1      LEU  13  10.027  -4.982  -7.189
   87   HD13  LEU  13          3HD1      LEU  13   8.777  -6.061  -6.529
   88   HD21  LEU  13          3HD2      LEU  13  11.446  -5.677  -5.287
   89   HD22  LEU  13          1HD2      LEU  13  10.922  -5.417  -3.618
   90   HD23  LEU  13          2HD2      LEU  13  10.132  -6.654  -4.600
   91    H    TYR  14           H        TYR  14  12.133  -1.990  -2.804
   92    HA   TYR  14           HA       TYR  14  12.452  -3.997  -0.840
   93    HB2  TYR  14           2HB      TYR  14  14.301  -2.666  -1.570
   94    HB3  TYR  14           3HB      TYR  14  13.494  -1.162  -1.148
   95    HD1  TYR  14           HD1      TYR  14  15.062  -4.226   0.330
   96    HD2  TYR  14           HD2      TYR  14  13.684  -0.191   1.010
   97    HE1  TYR  14           HE1      TYR  14  16.110  -4.244   2.592
   98    HE2  TYR  14           HE2      TYR  14  14.712  -0.218   3.272
   99    HH   TYR  14           HH       TYR  14  16.493  -3.074   4.525
  100    H    GLN  15           H        GLN  15  10.634  -0.935  -0.605
  101    HA   GLN  15           HA       GLN  15  10.315  -1.107   2.322
  102    HB2  GLN  15           2HB      GLN  15   8.801   0.582   0.294
  103    HB3  GLN  15           3HB      GLN  15   8.752   0.772   2.037
  104    HG2  GLN  15           2HG      GLN  15  11.246   1.139   0.315
  105    HG3  GLN  15           3HG      GLN  15  10.209   2.438   0.885
  106   HE21  GLN  15          2HE2      GLN  15  12.797   2.752   1.538
  107   HE22  GLN  15          1HE2      GLN  15  13.046   2.374   3.235
  108    H    LEU  16           H        LEU  16   8.517  -2.032  -0.557
  109    HA   LEU  16           HA       LEU  16   6.139  -2.896   0.856
  110    HB2  LEU  16           2HB      LEU  16   7.173  -3.741  -1.871
  111    HB3  LEU  16           3HB      LEU  16   5.527  -3.957  -1.273
  112    HG   LEU  16           HG       LEU  16   6.962  -1.371  -1.930
  113   HD11  LEU  16          1HD1      LEU  16   4.624  -2.775  -3.245
  114   HD12  LEU  16          2HD1      LEU  16   5.226  -1.153  -3.675
  115   HD13  LEU  16          3HD1      LEU  16   6.272  -2.551  -3.887
  116   HD21  LEU  16          3HD2      LEU  16   4.125  -1.779  -0.886
  117   HD22  LEU  16          1HD2      LEU  16   5.435  -0.913  -0.049
  118   HD23  LEU  16          2HD2      LEU  16   4.752  -0.244  -1.531
  119    H    GLU  17           H        GLU  17   9.131  -4.564  -0.227
  120    HA   GLU  17           HA       GLU  17   8.492  -7.141   0.875
  121    HB2  GLU  17           2HB      GLU  17  11.151  -5.769   0.355
  122    HB3  GLU  17           3HB      GLU  17  11.002  -7.421   0.960
  123    HG2  GLU  17           2HG      GLU  17   9.626  -8.018  -1.033
  124    HG3  GLU  17           3HG      GLU  17   9.923  -6.414  -1.698
  125    H    ASN  18           H        ASN  18   9.775  -4.191   2.455
  126    HA   ASN  18           HA       ASN  18  10.325  -5.463   4.968
  127    HB2  ASN  18           2HB      ASN  18  11.254  -3.284   4.307
  128    HB3  ASN  18           3HB      ASN  18   9.649  -2.560   4.348
  129   HD21  ASN  18          2HD2      ASN  18   8.881  -1.773   6.304
  130   HD22  ASN  18          1HD2      ASN  18   9.721  -2.029   7.825
  131    H    TYR  19           H        TYR  19   7.237  -4.265   3.595
  132    HA   TYR  19           HA       TYR  19   5.751  -4.840   6.065
  133    HB2  TYR  19           2HB      TYR  19   4.734  -4.515   3.231
  134    HB3  TYR  19           3HB      TYR  19   3.773  -4.470   4.694
  135    HD1  TYR  19           HD1      TYR  19   5.309  -2.653   6.489
  136    HD2  TYR  19           HD2      TYR  19   4.539  -2.408   2.250
  137    HE1  TYR  19           HE1      TYR  19   5.589  -0.187   6.573
  138    HE2  TYR  19           HE2      TYR  19   4.902   0.039   2.324
  139    HH   TYR  19           HH       TYR  19   5.363   1.863   3.641
  140    H    CYS  20           H        CYS  20   6.670  -6.616   3.152
  141    HA   CYS  20           HA       CYS  20   4.987  -8.901   3.570
  142    HB2  CYS  20           2HB      CYS  20   6.183  -8.122   1.455
  143    HB3  CYS  20           3HB      CYS  20   7.660  -8.803   2.141
  144    H    ASN  21           H        ASN  21   8.260  -8.118   4.721
  145    HA   ASN  21           HA       ASN  21   8.979 -10.646   5.773
  146    HB2  ASN  21           2HB      ASN  21  10.518  -8.746   5.342
  147    HB3  ASN  21           3HB      ASN  21   9.783  -7.841   6.666
  148   HD21  ASN  21          2HD2      ASN  21  12.257  -7.888   7.165
  149   HD22  ASN  21          1HD2      ASN  21  12.763  -9.209   8.210
  150    H1   PHE   1           H        PHE   1   5.390   3.976  -6.747
  151    HA   PHE   1           HA       PHE   1   6.829   1.982  -6.107
  152    HB2  PHE   1           2HB      PHE   1   6.293   1.406  -9.044
  153    HB3  PHE   1           3HB      PHE   1   7.681   0.745  -8.213
  154    HD1  PHE   1           HD1      PHE   1   3.935   0.741  -8.204
  155    HD2  PHE   1           HD2      PHE   1   7.554  -1.217  -6.909
  156    HE1  PHE   1           HE1      PHE   1   2.618  -1.248  -7.523
  157    HE2  PHE   1           HE2      PHE   1   6.236  -3.214  -6.262
  158    HZ   PHE   1           HZ       PHE   1   3.771  -3.233  -6.553
  159    H    VAL   2           H        VAL   2   8.684   2.912  -5.675
  160    HA   VAL   2           HA       VAL   2  10.759   3.748  -5.783
  161    HB   VAL   2           HB       VAL   2  10.701   3.131  -8.748
  162   HG11  VAL   2          1HG1      VAL   2  13.020   3.386  -6.785
  163   HG12  VAL   2          2HG1      VAL   2  13.147   2.828  -8.467
  164   HG13  VAL   2          3HG1      VAL   2  12.662   4.489  -8.131
  165   HG21  VAL   2          3HG2      VAL   2  10.106   1.114  -7.410
  166   HG22  VAL   2          1HG2      VAL   2  11.696   0.971  -8.151
  167   HG23  VAL   2          2HG2      VAL   2  11.571   1.357  -6.426
  168    H    ASN   3           H        ASN   3   9.005   5.166  -8.551
  169    HA   ASN   3           HA       ASN   3  10.176   7.849  -7.906
  170    HB2  ASN   3           2HB      ASN   3   9.392   6.668 -10.606
  171    HB3  ASN   3           3HB      ASN   3   9.946   8.317 -10.341
  172   HD21  ASN   3          2HD2      ASN   3  10.991   5.128 -11.016
  173   HD22  ASN   3          1HD2      ASN   3  12.703   5.435 -10.774
  174    H    GLN   4           H        GLN   4   7.335   6.156  -7.627
  175    HA   GLN   4           HA       GLN   4   5.709   8.639  -7.599
  176    HB2  GLN   4           2HB      GLN   4   4.908   6.011  -8.922
  177    HB3  GLN   4           3HB      GLN   4   3.781   7.311  -8.554
  178    HG2  GLN   4           2HG      GLN   4   6.158   7.539 -10.456
  179    HG3  GLN   4           3HG      GLN   4   4.491   7.271 -10.929
  180   HE21  GLN   4          2HE2      GLN   4   5.778   9.430 -12.040
  181   HE22  GLN   4          1HE2      GLN   4   5.122  10.906 -11.343
  182    H    HIS   5           H        HIS   5   4.302   8.783  -5.941
  183    HA   HIS   5           HA       HIS   5   4.637   7.167  -3.626
  184    HB2  HIS   5           2HB      HIS   5   2.408   9.126  -4.304
  185    HB3  HIS   5           3HB      HIS   5   2.806   8.533  -2.696
  186    HD2  HIS   5           HD2      HIS   5   4.843   9.668  -1.411
  187    HE1  HIS   5           HE1      HIS   5   5.913  12.521  -4.390
  188    HE2  HIS   5           HE2      HIS   5   6.256  11.820  -1.961
  189    H    LEU   6           H        LEU   6   3.109   5.941  -2.449
  190    HA   LEU   6           HA       LEU   6   1.062   4.466  -4.055
  191    HB2  LEU   6           2HB      LEU   6   3.273   3.319  -2.304
  192    HB3  LEU   6           3HB      LEU   6   1.906   2.375  -2.878
  193    HG   LEU   6           HG       LEU   6   3.951   3.693  -4.704
  194   HD11  LEU   6          1HD1      LEU   6   4.670   1.328  -5.069
  195   HD12  LEU   6          2HD1      LEU   6   4.944   1.881  -3.412
  196   HD13  LEU   6          3HD1      LEU   6   3.570   0.819  -3.775
  197   HD21  LEU   6          3HD2      LEU   6   1.816   3.448  -5.866
  198   HD22  LEU   6          1HD2      LEU   6   2.897   2.170  -6.412
  199   HD23  LEU   6          2HD2      LEU   6   1.615   1.797  -5.241
  200    H    CYS   7           H        CYS   7   0.729   6.631  -1.996
  201    HA   CYS   7           HA       CYS   7   0.043   5.369   0.466
  202    HB2  CYS   7           2HB      CYS   7   0.708   7.780   0.023
  203    HB3  CYS   7           3HB      CYS   7  -0.964   8.061  -0.443
  204    H    GLY   8           H        GLY   8  -1.907   4.966   1.485
  205    HA2  GLY   8           HA2      GLY   8  -4.211   4.642   1.782
  206    HA3  GLY   8           HA3      GLY   8  -4.520   5.376   0.210
  207    H    SER   9           H        SER   9  -5.852   3.829  -0.688
  208    HA   SER   9           HA       SER   9  -5.620   1.022  -0.521
  209    HB2  SER   9           2HB      SER   9  -6.767   2.652  -2.819
  210    HB3  SER   9           3HB      SER   9  -7.136   0.960  -2.428
  211    HG   SER   9           HG       SER   9  -8.724   2.416  -1.607
  212    H    HIS  10           H        HIS  10  -3.890   3.263  -2.641
  213    HA   HIS  10           HA       HIS  10  -2.894   1.442  -4.571
  214    HB2  HIS  10           2HB      HIS  10  -1.675   3.952  -3.382
  215    HB3  HIS  10           3HB      HIS  10  -1.024   3.097  -4.777
  216    HD2  HIS  10           HD2      HIS  10  -2.102   3.542  -7.117
  217    HE1  HIS  10           HE1      HIS  10  -5.336   6.045  -5.900
  218    HE2  HIS  10           HE2      HIS  10  -4.070   5.111  -7.903
  219    H    LEU  11           H        LEU  11  -2.025   1.698  -1.153
  220    HA   LEU  11           HA       LEU  11   0.530   0.414  -1.482
  221    HB2  LEU  11           2HB      LEU  11  -0.022   1.915   0.409
  222    HB3  LEU  11           3HB      LEU  11  -1.176   0.732   1.019
  223    HG   LEU  11           HG       LEU  11   0.569  -0.838   1.543
  224   HD11  LEU  11          1HD1      LEU  11   2.985  -0.295   1.158
  225   HD12  LEU  11          2HD1      LEU  11   2.105  -0.626  -0.322
  226   HD13  LEU  11          3HD1      LEU  11   2.477   1.053   0.113
  227   HD21  LEU  11          3HD2      LEU  11   1.501   1.954   2.310
  228   HD22  LEU  11          1HD2      LEU  11   0.245   1.013   3.147
  229   HD23  LEU  11          2HD2      LEU  11   1.920   0.446   3.145
  230    H    VAL  12           H        VAL  12  -2.736  -0.874  -0.522
  231    HA   VAL  12           HA       VAL  12  -1.746  -3.594  -0.380
  232    HB   VAL  12           HB       VAL  12  -4.083  -4.260  -0.415
  233   HG11  VAL  12          1HG1      VAL  12  -2.897  -3.717   1.677
  234   HG12  VAL  12          2HG1      VAL  12  -3.466  -2.037   1.561
  235   HG13  VAL  12          3HG1      VAL  12  -4.628  -3.360   1.790
  236   HG21  VAL  12          3HG2      VAL  12  -4.821  -1.315  -0.419
  237   HG22  VAL  12          1HG2      VAL  12  -5.125  -2.451  -1.759
  238   HG23  VAL  12          2HG2      VAL  12  -5.914  -2.690  -0.200
  239    H    GLU  13           H        GLU  13  -3.224  -1.610  -2.952
  240    HA   GLU  13           HA       GLU  13  -3.273  -3.664  -4.941
  241    HB2  GLU  13           2HB      GLU  13  -3.065  -0.652  -5.154
  242    HB3  GLU  13           3HB      GLU  13  -3.167  -1.713  -6.562
  243    HG2  GLU  13           2HG      GLU  13  -5.296  -2.642  -5.769
  244    HG3  GLU  13           3HG      GLU  13  -5.246  -1.622  -4.334
  245    H    ALA  14           H        ALA  14  -0.542  -1.654  -3.858
  246    HA   ALA  14           HA       ALA  14   1.276  -2.707  -5.878
  247    HB1  ALA  14           3HB      ALA  14   2.975  -1.566  -4.517
  248    HB2  ALA  14           1HB      ALA  14   1.598  -0.509  -4.846
  249    HB3  ALA  14           2HB      ALA  14   1.780  -1.258  -3.242
  250    H    LEU  15           H        LEU  15   0.567  -3.502  -2.439
  251    HA   LEU  15           HA       LEU  15   2.573  -5.538  -2.222
  252    HB2  LEU  15           2HB      LEU  15   0.080  -4.860  -0.644
  253    HB3  LEU  15           3HB      LEU  15   1.049  -6.266  -0.230
  254    HG   LEU  15           HG       LEU  15   2.304  -3.500  -0.444
  255   HD11  LEU  15          1HD1      LEU  15   2.104  -3.308   1.986
  256   HD12  LEU  15          2HD1      LEU  15   0.498  -3.424   1.251
  257   HD13  LEU  15          3HD1      LEU  15   1.206  -4.839   2.063
  258   HD21  LEU  15          3HD2      LEU  15   4.025  -4.487   0.984
  259   HD22  LEU  15          1HD2      LEU  15   3.129  -6.016   1.079
  260   HD23  LEU  15          2HD2      LEU  15   3.840  -5.486  -0.457
  261    H    TYR  16           H        TYR  16  -0.707  -5.721  -3.566
  262    HA   TYR  16           HA       TYR  16  -1.052  -8.489  -3.818
  263    HB2  TYR  16           2HB      TYR  16  -1.509  -6.326  -5.889
  264    HB3  TYR  16           3HB      TYR  16  -2.113  -7.971  -6.021
  265    HD1  TYR  16           HD1      TYR  16  -2.669  -7.769  -2.709
  266    HD2  TYR  16           HD2      TYR  16  -3.929  -5.762  -6.325
  267    HE1  TYR  16           HE1      TYR  16  -4.678  -7.003  -1.577
  268    HE2  TYR  16           HE2      TYR  16  -5.984  -4.978  -5.151
  269    HH   TYR  16           HH       TYR  16  -7.100  -4.864  -3.158
  270    H    LEU  17           H        LEU  17   1.245  -6.395  -5.555
  271    HA   LEU  17           HA       LEU  17   2.004  -8.467  -7.506
  272    HB2  LEU  17           2HB      LEU  17   3.168  -5.690  -7.085
  273    HB3  LEU  17           3HB      LEU  17   3.330  -6.711  -8.504
  274    HG   LEU  17           HG       LEU  17   0.772  -5.350  -7.544
  275   HD11  LEU  17          1HD1      LEU  17   1.002  -4.024  -9.589
  276   HD12  LEU  17          2HD1      LEU  17   2.429  -3.836  -8.561
  277   HD13  LEU  17          3HD1      LEU  17   2.510  -4.877  -9.998
  278   HD21  LEU  17          3HD2      LEU  17   0.195  -7.482  -8.632
  279   HD22  LEU  17          1HD2      LEU  17  -0.214  -6.124  -9.684
  280   HD23  LEU  17          2HD2      LEU  17   1.249  -7.083 -10.009
  281    H    VAL  18           H        VAL  18   3.149  -7.327  -4.449
  282    HA   VAL  18           HA       VAL  18   5.914  -8.368  -4.877
  283    HB   VAL  18           HB       VAL  18   4.803  -6.363  -2.878
  284   HG11  VAL  18          1HG1      VAL  18   6.792  -7.380  -1.906
  285   HG12  VAL  18          2HG1      VAL  18   7.680  -7.193  -3.439
  286   HG13  VAL  18          3HG1      VAL  18   7.200  -5.770  -2.496
  287   HG21  VAL  18          3HG2      VAL  18   6.433  -6.038  -5.434
  288   HG22  VAL  18          1HG2      VAL  18   4.782  -5.452  -5.137
  289   HG23  VAL  18          2HG2      VAL  18   6.132  -4.745  -4.256
  290    H    CYS  19           H        CYS  19   3.115  -8.767  -2.770
  291    HA   CYS  19           HA       CYS  19   4.496 -11.029  -1.366
  292    HB2  CYS  19           2HB      CYS  19   4.547  -8.713  -0.194
  293    HB3  CYS  19           3HB      CYS  19   2.818  -8.944   0.051
  294    H    GLY  20           H        GLY  20   1.382  -9.548  -2.284
  295    HA2  GLY  20           HA2      GLY  20  -0.762 -10.382  -2.401
  296    HA3  GLY  20           HA3      GLY  20  -0.052 -11.991  -2.536
  297    H    GLU  21           H        GLU  21  -1.195 -13.194  -1.170
  298    HA   GLU  21           HA       GLU  21  -1.274 -12.467   1.726
  299    HB2  GLU  21           2HB      GLU  21  -3.285 -13.873   1.934
  300    HB3  GLU  21           3HB      GLU  21  -3.518 -12.454   0.926
  301    HG2  GLU  21           2HG      GLU  21  -3.477 -13.739  -1.104
  302    HG3  GLU  21           3HG      GLU  21  -2.908 -15.178  -0.275
  303    H    ARG  22           H        ARG  22   0.829 -13.885   0.085
  304    HA   ARG  22           HA       ARG  22   1.063 -16.368   1.762
  305    HB2  ARG  22           2HB      ARG  22   1.481 -16.134  -1.245
  306    HB3  ARG  22           3HB      ARG  22   1.979 -17.527  -0.291
  307    HG2  ARG  22           2HG      ARG  22  -0.895 -16.566  -0.584
  308    HG3  ARG  22           3HG      ARG  22  -0.154 -17.893  -1.470
  309    HD2  ARG  22           2HD      ARG  22   0.222 -19.149   0.604
  310    HD3  ARG  22           3HD      ARG  22  -0.452 -17.838   1.570
  311    HE   ARG  22           HE       ARG  22  -1.921 -19.763  -0.103
  312   HH11  ARG  22          1HH1      ARG  22  -2.212 -16.752   1.714
  313   HH12  ARG  22          2HH1      ARG  22  -3.947 -16.738   1.502
  314   HH21  ARG  22          1HH2      ARG  22  -4.168 -19.718  -0.115
  315   HH22  ARG  22          2HH2      ARG  22  -4.995 -18.410   0.692
  316    H    GLY  23           H        GLY  23   2.802 -13.627   0.484
  317    HA2  GLY  23           HA2      GLY  23   5.434 -14.774   0.911
  318    HA3  GLY  23           HA3      GLY  23   5.042 -13.082   0.653
  319    H    DHI  24           H        DHI  24   3.140 -13.412   3.139
  320    HA   DHI  24           HA       DHI  24   5.220 -12.904   5.229
  321    HB2  DHI  24           2HB      DHI  24   4.285 -15.149   5.527
  322    HB3  DHI  24           3HB      DHI  24   3.856 -14.086   6.861
  323    HD2  DHI  24           HD2      DHI  24   2.367 -15.901   3.856
  324    HE1  DHI  24           HE1      DHI  24  -0.971 -14.265   5.941
  325    HE2  DHI  24           HE2      DHI  24  -0.274 -15.687   3.950
  326    H    PHE  25           H        PHE  25   3.064 -11.333   3.477
  327    HA   PHE  25           HA       PHE  25   1.703  -9.780   5.629
  328    HB2  PHE  25           2HB      PHE  25   2.858  -8.467   3.872
  329    HB3  PHE  25           3HB      PHE  25   1.928  -9.307   2.635
  330    HD1  PHE  25           HD1      PHE  25   1.358  -7.266   5.754
  331    HD2  PHE  25           HD2      PHE  25   0.095  -8.197   1.733
  332    HE1  PHE  25           HE1      PHE  25  -0.360  -5.478   5.872
  333    HE2  PHE  25           HE2      PHE  25  -1.585  -6.374   1.841
  334    HZ   PHE  25           HZ       PHE  25  -1.823  -5.017   3.914
  335    H    TYR  26           H        TYR  26  -0.608  -9.698   5.589
  336    HA   TYR  26           HA       TYR  26  -1.985 -11.703   3.850
  337    HB2  TYR  26           2HB      TYR  26  -2.146 -12.331   6.244
  338    HB3  TYR  26           3HB      TYR  26  -2.895 -10.778   6.592
  339    HD1  TYR  26           HD2      TYR  26  -3.281 -13.951   4.652
  340    HD2  TYR  26           HD1      TYR  26  -5.284 -10.401   6.111
  341    HE1  TYR  26           HE2      TYR  26  -5.481 -14.883   3.948
  342    HE2  TYR  26           HE1      TYR  26  -7.462 -11.359   5.439
  343    HH   TYR  26           HH       TYR  26  -8.563 -13.136   4.501
  344    H    THR  27           H        THR  27  -3.697 -11.051   2.702
  345    HA   THR  27           HA       THR  27  -4.980  -8.494   3.320
  346    HB   THR  27           HB       THR  27  -3.491  -7.809   1.568
  347    HG1  THR  27           HG1      THR  27  -5.322  -6.761   1.321
  348   HG21  THR  27          1HG2      THR  27  -4.799  -9.802  -0.322
  349   HG22  THR  27          2HG2      THR  27  -3.458  -8.684  -0.643
  350   HG23  THR  27          3HG2      THR  27  -3.204 -10.060   0.422
  351    HA   PRO  28           HA       PRO  28  -8.459 -11.223   2.345
  352    HB2  PRO  28           2HB      PRO  28 -10.520  -9.609   2.999
  353    HB3  PRO  28           3HB      PRO  28  -9.394 -10.249   4.241
  354    HG2  PRO  28           2HG      PRO  28  -9.320  -7.520   2.914
  355    HG3  PRO  28           3HG      PRO  28  -9.240  -7.910   4.667
  356    HD2  PRO  28           2HD      PRO  28  -7.011  -7.489   3.109
  357    HD3  PRO  28           3HD      PRO  28  -7.019  -8.592   4.517
  358    H    LYS  29           H        LYS  29  -7.350  -8.531   0.683
  359    HA   LYS  29           HA       LYS  29  -7.491  -7.635  -1.311
  360    HB2  LYS  29           2HB      LYS  29  -7.298 -10.011  -1.947
  361    HB3  LYS  29           3HB      LYS  29  -9.034 -10.088  -2.218
  362    HG2  LYS  29           2HG      LYS  29  -7.362  -7.993  -3.634
  363    HG3  LYS  29           3HG      LYS  29  -7.312  -9.664  -4.187
  364    HD2  LYS  29           2HD      LYS  29  -9.670  -9.703  -4.674
  365    HD3  LYS  29           3HD      LYS  29  -9.923  -8.142  -3.892
  366    HE2  LYS  29           2HE      LYS  29  -8.264  -7.159  -5.581
  367    HE3  LYS  29           3HE      LYS  29  -8.380  -8.694  -6.457
  368    HZ1  LYS  29           HZ1      LYS  29 -10.797  -8.288  -6.633
  369    HZ2  LYS  29           HZ2      LYS  29 -10.644  -6.884  -5.793
  370    HZ3  LYS  29           HZ3      LYS  29  -9.975  -7.030  -7.284
  371    H    THR  30           H        THR  30  -8.488  -6.095  -2.374
  372    HA   THR  30           HA       THR  30 -10.951  -5.035  -1.312
  373    HB   THR  30           HB       THR  30 -10.539  -3.202  -3.003
  374    HG1  THR  30           HG1      THR  30  -9.349  -4.515  -4.435
  375   HG21  THR  30          1HG2      THR  30  -9.736  -3.003  -0.698
  376   HG22  THR  30          2HG2      THR  30  -8.263  -3.908  -1.099
  377   HG23  THR  30          3HG2      THR  30  -8.557  -2.316  -1.829
  Start of MODEL   14
    1    H1   GLY   1           1H       GLY   1  -4.634  -6.874   5.989
    2    H2   GLY   1           2H       GLY   1  -3.205  -7.263   6.682
    3    H3   GLY   1           3H       GLY   1  -4.148  -6.104   7.360
    4    HA2  GLY   1           HA2      GLY   1  -2.931  -5.905   4.678
    5    HA3  GLY   1           HA3      GLY   1  -3.819  -4.621   5.521
    6    H    ILE   2           H        ILE   2  -2.285  -3.081   5.943
    7    HA   ILE   2           HA       ILE   2  -0.082  -3.820   7.752
    8    HB   ILE   2           HB       ILE   2   0.897  -3.847   5.495
    9   HG12  ILE   2          2HG1      ILE   2   2.754  -2.252   5.845
   10   HG13  ILE   2          3HG1      ILE   2   1.899  -1.519   7.178
   11   HG21  ILE   2          1HG2      ILE   2   0.143  -0.902   5.298
   12   HG22  ILE   2          2HG2      ILE   2   1.179  -1.790   4.175
   13   HG23  ILE   2          3HG2      ILE   2  -0.530  -2.226   4.322
   14   HD11  ILE   2          3HD1      ILE   2   3.627  -3.141   7.914
   15   HD12  ILE   2          1HD1      ILE   2   2.019  -3.643   8.453
   16   HD13  ILE   2          2HD1      ILE   2   2.778  -4.440   7.054
   17    H    VAL   3           H        VAL   3   0.499  -2.259   9.224
   18    HA   VAL   3           HA       VAL   3  -1.509  -0.124   9.647
   19    HB   VAL   3           HB       VAL   3  -0.703  -0.083  11.960
   20   HG11  VAL   3          1HG1      VAL   3  -2.548  -1.578  11.283
   21   HG12  VAL   3          2HG1      VAL   3  -1.385  -2.892  11.007
   22   HG13  VAL   3          3HG1      VAL   3  -1.610  -2.229  12.637
   23   HG21  VAL   3          3HG2      VAL   3   1.093  -2.433  11.198
   24   HG22  VAL   3          1HG2      VAL   3   1.658  -0.797  11.602
   25   HG23  VAL   3          2HG2      VAL   3   0.827  -1.771  12.820
   26    H    GLU   4           H        GLU   4   1.346  -0.116   8.119
   27    HA   GLU   4           HA       GLU   4   1.862   2.754   8.683
   28    HB2  GLU   4           2HB      GLU   4   3.988   0.581   8.448
   29    HB3  GLU   4           3HB      GLU   4   4.305   2.317   8.351
   30    HG2  GLU   4           2HG      GLU   4   3.341   2.606  10.641
   31    HG3  GLU   4           3HG      GLU   4   3.157   0.855  10.763
   32    H    GLN   5           H        GLN   5   2.872   3.867   6.885
   33    HA   GLN   5           HA       GLN   5   2.590   2.570   4.222
   34    HB2  GLN   5           2HB      GLN   5   1.410   5.283   4.940
   35    HB3  GLN   5           3HB      GLN   5   1.383   4.493   3.359
   36    HG2  GLN   5           2HG      GLN   5   0.014   2.625   4.416
   37    HG3  GLN   5           3HG      GLN   5  -0.097   3.613   5.874
   38   HE21  GLN   5          2HE2      GLN   5  -1.007   3.464   2.410
   39   HE22  GLN   5          1HE2      GLN   5  -2.166   4.784   2.501
   40    H    CYS   6           H        CYS   6   3.539   3.950   2.469
   41    HA   CYS   6           HA       CYS   6   6.212   3.996   2.872
   42    HB2  CYS   6           2HB      CYS   6   5.284   3.789   0.694
   43    HB3  CYS   6           3HB      CYS   6   4.606   5.409   0.735
   44    H    CYS   7           H        CYS   7   5.859   7.969   3.755
   45    HA   CYS   7           HA       CYS   7   3.663   6.777   2.094
   46    HB2  CYS   7           2HB      CYS   7   2.929   7.042   4.385
   47    HB3  CYS   7           3HB      CYS   7   3.633   8.646   4.474
   48    H    THR   8           H        THR   8   5.598   9.707   2.861
   49    HA   THR   8           HA       THR   8   4.258  11.379   0.899
   50    HB   THR   8           HB       THR   8   6.038  13.033   1.590
   51    HG1  THR   8           HG1      THR   8   7.299  12.441   3.363
   52   HG21  THR   8          1HG2      THR   8   4.507  11.727   3.889
   53   HG22  THR   8          2HG2      THR   8   5.150  13.384   3.840
   54   HG23  THR   8          3HG2      THR   8   3.840  12.913   2.746
   55    H    SER   9           H        SER   9   6.832   9.151   0.635
   56    HA   SER   9           HA       SER   9   7.644  10.266  -2.015
   57    HB2  SER   9           2HB      SER   9   9.672   8.986  -1.833
   58    HB3  SER   9           3HB      SER   9   9.487  10.000  -0.397
   59    HG   SER   9           HG       SER   9  10.093   7.897   0.193
   60    H    ILE  10           H        ILE  10   8.409   8.217  -3.432
   61    HA   ILE  10           HA       ILE  10   5.908   6.700  -3.861
   62    HB   ILE  10           HB       ILE  10   8.336   7.096  -5.643
   63   HG12  ILE  10          2HG1      ILE  10   5.582   8.417  -5.578
   64   HG13  ILE  10          3HG1      ILE  10   7.109   9.196  -5.171
   65   HG21  ILE  10          1HG2      ILE  10   7.162   5.038  -6.281
   66   HG22  ILE  10          2HG2      ILE  10   5.600   5.888  -6.234
   67   HG23  ILE  10          3HG2      ILE  10   6.813   6.290  -7.461
   68   HD11  ILE  10          3HD1      ILE  10   7.856   8.865  -7.549
   69   HD12  ILE  10          1HD1      ILE  10   6.180   8.369  -7.923
   70   HD13  ILE  10          2HD1      ILE  10   6.501   9.984  -7.287
   71    H    CYS  11           H        CYS  11   8.939   6.128  -2.462
   72    HA   CYS  11           HA       CYS  11  10.089   4.429  -1.662
   73    HB2  CYS  11           2HB      CYS  11   7.371   3.137  -1.601
   74    HB3  CYS  11           3HB      CYS  11   8.812   2.264  -1.116
   75    H    SER  12           H        SER  12  11.397   2.760  -2.032
   76    HA   SER  12           HA       SER  12  11.458   1.463  -4.687
   77    HB2  SER  12           2HB      SER  12  13.255   1.133  -2.251
   78    HB3  SER  12           3HB      SER  12  13.518   0.409  -3.850
   79    HG   SER  12           HG       SER  12  14.705   2.363  -3.568
   80    H    LEU  13           H        LEU  13  11.422  -0.874  -4.902
   81    HA   LEU  13           HA       LEU  13   9.162  -2.039  -3.698
   82    HB2  LEU  13           2HB      LEU  13  11.511  -3.363  -5.122
   83    HB3  LEU  13           3HB      LEU  13  10.016  -4.171  -4.704
   84    HG   LEU  13           HG       LEU  13   9.906  -3.705  -6.990
   85   HD11  LEU  13          1HD1      LEU  13   7.897  -2.404  -7.234
   86   HD12  LEU  13          2HD1      LEU  13   7.813  -3.297  -5.708
   87   HD13  LEU  13          3HD1      LEU  13   8.181  -1.558  -5.700
   88   HD21  LEU  13          3HD2      LEU  13  11.585  -1.849  -7.094
   89   HD22  LEU  13          1HD2      LEU  13  10.140  -1.608  -8.085
   90   HD23  LEU  13          2HD2      LEU  13  10.301  -0.723  -6.567
   91    H    TYR  14           H        TYR  14  12.539  -2.319  -2.659
   92    HA   TYR  14           HA       TYR  14  12.350  -4.398  -0.772
   93    HB2  TYR  14           2HB      TYR  14  14.470  -3.471  -1.356
   94    HB3  TYR  14           3HB      TYR  14  13.981  -1.844  -0.894
   95    HD1  TYR  14           HD1      TYR  14  14.847  -5.218   0.467
   96    HD2  TYR  14           HD2      TYR  14  14.114  -1.057   1.356
   97    HE1  TYR  14           HE1      TYR  14  15.587  -5.586   2.817
   98    HE2  TYR  14           HE2      TYR  14  14.809  -1.426   3.700
   99    HH   TYR  14           HH       TYR  14  15.908  -4.648   4.883
  100    H    GLN  15           H        GLN  15  11.257  -1.011  -0.426
  101    HA   GLN  15           HA       GLN  15  10.829  -1.100   2.448
  102    HB2  GLN  15           2HB      GLN  15   9.567   0.646   0.302
  103    HB3  GLN  15           3HB      GLN  15   9.437   0.925   2.030
  104    HG2  GLN  15           2HG      GLN  15  12.107   0.854   0.550
  105    HG3  GLN  15           3HG      GLN  15  11.168   2.324   0.807
  106   HE21  GLN  15          2HE2      GLN  15  10.606   2.818   3.217
  107   HE22  GLN  15          1HE2      GLN  15  11.880   2.436   4.365
  108    H    LEU  16           H        LEU  16   8.918  -1.909  -0.374
  109    HA   LEU  16           HA       LEU  16   6.418  -2.387   1.057
  110    HB2  LEU  16           2HB      LEU  16   7.204  -3.420  -1.687
  111    HB3  LEU  16           3HB      LEU  16   5.586  -3.172  -1.059
  112    HG   LEU  16           HG       LEU  16   7.625  -1.059  -1.833
  113   HD11  LEU  16          1HD1      LEU  16   6.543  -2.124  -3.713
  114   HD12  LEU  16          2HD1      LEU  16   4.932  -1.786  -3.027
  115   HD13  LEU  16          3HD1      LEU  16   5.991  -0.455  -3.554
  116   HD21  LEU  16          3HD2      LEU  16   5.851   0.625  -1.390
  117   HD22  LEU  16          1HD2      LEU  16   4.804  -0.658  -0.744
  118   HD23  LEU  16          2HD2      LEU  16   6.305  -0.209   0.097
  119    H    GLU  17           H        GLU  17   9.130  -4.408  -0.129
  120    HA   GLU  17           HA       GLU  17   8.108  -6.928   0.749
  121    HB2  GLU  17           2HB      GLU  17  10.964  -5.963   0.386
  122    HB3  GLU  17           3HB      GLU  17  10.531  -7.618   0.814
  123    HG2  GLU  17           2HG      GLU  17   9.168  -7.822  -1.238
  124    HG3  GLU  17           3HG      GLU  17   9.605  -6.182  -1.709
  125    H    ASN  18           H        ASN  18   9.668  -4.344   2.682
  126    HA   ASN  18           HA       ASN  18   9.965  -5.932   5.067
  127    HB2  ASN  18           2HB      ASN  18   9.384  -2.946   4.832
  128    HB3  ASN  18           3HB      ASN  18   9.908  -3.779   6.286
  129   HD21  ASN  18          2HD2      ASN  18  12.076  -5.266   5.689
  130   HD22  ASN  18          1HD2      ASN  18  13.304  -4.217   4.989
  131    H    TYR  19           H        TYR  19   7.077  -4.443   3.625
  132    HA   TYR  19           HA       TYR  19   5.396  -4.965   5.981
  133    HB2  TYR  19           2HB      TYR  19   4.570  -4.304   3.151
  134    HB3  TYR  19           3HB      TYR  19   3.579  -4.186   4.581
  135    HD1  TYR  19           HD2      TYR  19   5.696  -2.736   6.395
  136    HD2  TYR  19           HD1      TYR  19   4.316  -2.091   2.360
  137    HE1  TYR  19           HE2      TYR  19   6.189  -0.313   6.604
  138    HE2  TYR  19           HE1      TYR  19   4.810   0.321   2.569
  139    HH   TYR  19           HH       TYR  19   6.174   1.736   5.570
  140    H    CYS  20           H        CYS  20   6.177  -6.592   2.932
  141    HA   CYS  20           HA       CYS  20   4.237  -8.725   3.123
  142    HB2  CYS  20           2HB      CYS  20   5.402  -8.051   1.053
  143    HB3  CYS  20           3HB      CYS  20   6.943  -8.528   1.760
  144    H    ASN  21           H        ASN  21   7.567  -8.344   4.370
  145    HA   ASN  21           HA       ASN  21   7.981 -11.016   5.244
  146    HB2  ASN  21           2HB      ASN  21   9.750  -9.297   4.899
  147    HB3  ASN  21           3HB      ASN  21   9.155  -8.402   6.298
  148   HD21  ASN  21          2HD2      ASN  21  10.680 -11.472   5.270
  149   HD22  ASN  21          1HD2      ASN  21  11.329 -11.839   6.861
  150    H1   PHE   1           H        PHE   1   3.036   2.663 -10.100
  151    HA   PHE   1           HA       PHE   1   4.942   2.313  -7.906
  152    HB2  PHE   1           2HB      PHE   1   5.165   0.643 -10.441
  153    HB3  PHE   1           3HB      PHE   1   6.395   0.772  -9.199
  154    HD1  PHE   1           HD2      PHE   1   6.046  -0.233  -6.932
  155    HD2  PHE   1           HD1      PHE   1   3.236  -0.813 -10.154
  156    HE1  PHE   1           HE2      PHE   1   5.125  -2.226  -5.778
  157    HE2  PHE   1           HE1      PHE   1   2.306  -2.797  -8.982
  158    HZ   PHE   1           HZ       PHE   1   3.279  -3.527  -6.812
  159    H    VAL   2           H        VAL   2   6.907   3.275  -8.275
  160    HA   VAL   2           HA       VAL   2   8.380   4.798  -8.838
  161    HB   VAL   2           HB       VAL   2   8.758   2.793 -10.327
  162   HG11  VAL   2          1HG1      VAL   2   7.202   3.248 -12.171
  163   HG12  VAL   2          2HG1      VAL   2   8.064   4.759 -12.552
  164   HG13  VAL   2          3HG1      VAL   2   8.865   3.189 -12.745
  165   HG21  VAL   2          3HG2      VAL   2  10.499   4.427  -9.695
  166   HG22  VAL   2          1HG2      VAL   2  10.744   3.727 -11.300
  167   HG23  VAL   2          2HG2      VAL   2  10.119   5.378 -11.149
  168    H    ASN   3           H        ASN   3   5.459   5.436 -10.499
  169    HA   ASN   3           HA       ASN   3   6.335   8.239 -11.063
  170    HB2  ASN   3           2HB      ASN   3   5.374   8.175 -13.154
  171    HB3  ASN   3           3HB      ASN   3   6.085   6.572 -13.040
  172   HD21  ASN   3          2HD2      ASN   3   4.417   4.774 -12.241
  173   HD22  ASN   3          1HD2      ASN   3   2.802   4.983 -12.898
  174    H    GLN   4           H        GLN   4   4.109   6.394  -9.297
  175    HA   GLN   4           HA       GLN   4   2.630   8.836  -8.553
  176    HB2  GLN   4           2HB      GLN   4   1.240   7.493 -10.251
  177    HB3  GLN   4           3HB      GLN   4   1.212   6.191  -9.062
  178    HG2  GLN   4           2HG      GLN   4   0.357   8.364  -7.534
  179    HG3  GLN   4           3HG      GLN   4  -0.255   8.789  -9.120
  180   HE21  GLN   4          2HE2      GLN   4  -0.495   6.504  -6.402
  181   HE22  GLN   4          1HE2      GLN   4  -1.980   5.761  -6.973
  182    H    HIS   5           H        HIS   5   2.416   8.973  -6.383
  183    HA   HIS   5           HA       HIS   5   3.727   7.231  -4.589
  184    HB2  HIS   5           2HB      HIS   5   1.577   9.318  -4.038
  185    HB3  HIS   5           3HB      HIS   5   2.705   8.653  -2.856
  186    HD2  HIS   5           HD2      HIS   5   4.818  10.068  -2.470
  187    HE1  HIS   5           HE1      HIS   5   5.116  12.080  -6.208
  188    HE2  HIS   5           HE2      HIS   5   6.134  11.861  -3.879
  189    H    LEU   6           H        LEU   6   3.059   5.673  -3.163
  190    HA   LEU   6           HA       LEU   6   0.695   4.176  -3.966
  191    HB2  LEU   6           2HB      LEU   6   3.131   3.681  -2.272
  192    HB3  LEU   6           3HB      LEU   6   1.723   2.663  -2.024
  193    HG   LEU   6           HG       LEU   6   1.709   1.913  -4.318
  194   HD11  LEU   6          1HD1      LEU   6   3.580   2.420  -5.866
  195   HD12  LEU   6          2HD1      LEU   6   2.584   3.837  -5.547
  196   HD13  LEU   6          3HD1      LEU   6   4.164   3.669  -4.744
  197   HD21  LEU   6          3HD2      LEU   6   4.495   1.772  -3.097
  198   HD22  LEU   6          1HD2      LEU   6   3.119   0.733  -2.665
  199   HD23  LEU   6          2HD2      LEU   6   3.817   0.646  -4.289
  200    H    CYS   7           H        CYS   7   1.276   6.448  -1.482
  201    HA   CYS   7           HA       CYS   7  -0.050   5.134   0.656
  202    HB2  CYS   7           2HB      CYS   7   1.768   6.875   0.738
  203    HB3  CYS   7           3HB      CYS   7   0.542   8.099   0.414
  204    H    GLY   8           H        GLY   8  -1.468   7.033  -1.894
  205    HA2  GLY   8           HA2      GLY   8  -3.716   8.169  -0.581
  206    HA3  GLY   8           HA3      GLY   8  -3.598   7.806  -2.304
  207    H    SER   9           H        SER   9  -3.873   5.381  -2.838
  208    HA   SER   9           HA       SER   9  -5.596   3.838  -0.990
  209    HB2  SER   9           2HB      SER   9  -7.028   5.436  -2.400
  210    HB3  SER   9           3HB      SER   9  -6.557   4.473  -3.807
  211    HG   SER   9           HG       SER   9  -7.459   2.642  -2.721
  212    H    HIS  10           H        HIS  10  -2.904   3.682  -2.557
  213    HA   HIS  10           HA       HIS  10  -3.469   1.497  -4.498
  214    HB2  HIS  10           2HB      HIS  10  -1.249   3.555  -4.322
  215    HB3  HIS  10           3HB      HIS  10  -1.507   2.427  -5.654
  216    HD2  HIS  10           HD2      HIS  10  -3.395   3.066  -7.438
  217    HE1  HIS  10           HE1      HIS  10  -4.629   6.773  -5.719
  218    HE2  HIS  10           HE2      HIS  10  -4.830   5.254  -7.755
  219    H    LEU  11           H        LEU  11  -1.501   2.148  -1.681
  220    HA   LEU  11           HA       LEU  11   0.584   0.362  -1.946
  221    HB2  LEU  11           2HB      LEU  11   0.301   2.034  -0.148
  222    HB3  LEU  11           3HB      LEU  11  -1.022   1.093   0.540
  223    HG   LEU  11           HG       LEU  11   0.545  -0.741   1.095
  224   HD11  LEU  11          1HD1      LEU  11   2.694   1.132  -0.001
  225   HD12  LEU  11          2HD1      LEU  11   2.992  -0.343   0.947
  226   HD13  LEU  11          3HD1      LEU  11   2.254  -0.469  -0.648
  227   HD21  LEU  11          3HD2      LEU  11   1.785   0.449   2.859
  228   HD22  LEU  11          1HD2      LEU  11   1.442   2.001   2.059
  229   HD23  LEU  11          2HD2      LEU  11   0.116   1.013   2.730
  230    H    VAL  12           H        VAL  12  -2.761  -0.485  -0.938
  231    HA   VAL  12           HA       VAL  12  -2.125  -3.155  -0.140
  232    HB   VAL  12           HB       VAL  12  -4.500  -3.545  -0.136
  233   HG11  VAL  12          1HG1      VAL  12  -5.172  -1.881   1.488
  234   HG12  VAL  12          2HG1      VAL  12  -3.453  -2.235   1.720
  235   HG13  VAL  12          3HG1      VAL  12  -3.951  -0.738   0.910
  236   HG21  VAL  12          3HG2      VAL  12  -4.846  -0.831  -1.485
  237   HG22  VAL  12          1HG2      VAL  12  -5.294  -2.420  -2.152
  238   HG23  VAL  12          2HG2      VAL  12  -6.141  -1.788  -0.745
  239    H    GLU  13           H        GLU  13  -3.077  -1.822  -3.308
  240    HA   GLU  13           HA       GLU  13  -3.222  -4.450  -4.597
  241    HB2  GLU  13           2HB      GLU  13  -2.963  -1.652  -5.783
  242    HB3  GLU  13           3HB      GLU  13  -3.244  -3.139  -6.693
  243    HG2  GLU  13           2HG      GLU  13  -5.362  -3.489  -5.363
  244    HG3  GLU  13           3HG      GLU  13  -5.120  -1.897  -4.638
  245    H    ALA  14           H        ALA  14  -0.766  -1.856  -4.293
  246    HA   ALA  14           HA       ALA  14   1.245  -3.074  -5.886
  247    HB1  ALA  14           3HB      ALA  14   1.504  -1.259  -3.448
  248    HB2  ALA  14           1HB      ALA  14   2.778  -1.594  -4.632
  249    HB3  ALA  14           2HB      ALA  14   1.314  -0.729  -5.135
  250    H    LEU  15           H        LEU  15   0.513  -3.487  -2.372
  251    HA   LEU  15           HA       LEU  15   2.658  -5.349  -1.952
  252    HB2  LEU  15           2HB      LEU  15   0.156  -4.637  -0.394
  253    HB3  LEU  15           3HB      LEU  15   1.254  -5.902   0.155
  254    HG   LEU  15           HG       LEU  15   2.211  -3.071  -0.426
  255   HD11  LEU  15          1HD1      LEU  15   2.131  -2.643   1.949
  256   HD12  LEU  15          2HD1      LEU  15   0.515  -3.139   1.430
  257   HD13  LEU  15          3HD1      LEU  15   1.567  -4.290   2.286
  258   HD21  LEU  15          3HD2      LEU  15   4.135  -3.749   0.929
  259   HD22  LEU  15          1HD2      LEU  15   3.435  -5.362   1.179
  260   HD23  LEU  15          2HD2      LEU  15   3.978  -4.845  -0.427
  261    H    TYR  16           H        TYR  16  -0.743  -5.954  -2.960
  262    HA   TYR  16           HA       TYR  16  -0.474  -8.820  -2.886
  263    HB2  TYR  16           2HB      TYR  16  -2.259  -6.870  -4.304
  264    HB3  TYR  16           3HB      TYR  16  -2.136  -8.488  -4.973
  265    HD1  TYR  16           HD2      TYR  16  -2.281 -10.490  -3.271
  266    HD2  TYR  16           HD1      TYR  16  -3.906  -6.550  -2.592
  267    HE1  TYR  16           HE2      TYR  16  -3.852 -11.429  -1.598
  268    HE2  TYR  16           HE1      TYR  16  -5.486  -7.496  -0.922
  269    HH   TYR  16           HH       TYR  16  -5.620 -11.008  -0.216
  270    H    LEU  17           H        LEU  17   0.497  -6.445  -5.387
  271    HA   LEU  17           HA       LEU  17   1.385  -8.478  -7.260
  272    HB2  LEU  17           2HB      LEU  17   1.809  -5.476  -7.066
  273    HB3  LEU  17           3HB      LEU  17   2.396  -6.442  -8.413
  274    HG   LEU  17           HG       LEU  17  -0.553  -6.299  -7.630
  275   HD11  LEU  17          1HD1      LEU  17   0.264  -4.081  -8.303
  276   HD12  LEU  17          2HD1      LEU  17   0.956  -4.773  -9.791
  277   HD13  LEU  17          3HD1      LEU  17  -0.804  -4.766  -9.534
  278   HD21  LEU  17          3HD2      LEU  17  -0.914  -7.144  -9.929
  279   HD22  LEU  17          1HD2      LEU  17   0.844  -7.291 -10.152
  280   HD23  LEU  17          2HD2      LEU  17  -0.002  -8.298  -8.954
  281    H    VAL  18           H        VAL  18   3.067  -6.652  -4.733
  282    HA   VAL  18           HA       VAL  18   5.723  -7.623  -5.548
  283    HB   VAL  18           HB       VAL  18   4.733  -5.920  -3.237
  284   HG11  VAL  18          1HG1      VAL  18   6.771  -6.965  -2.398
  285   HG12  VAL  18          2HG1      VAL  18   7.616  -6.634  -3.930
  286   HG13  VAL  18          3HG1      VAL  18   7.128  -5.300  -2.867
  287   HG21  VAL  18          3HG2      VAL  18   5.826  -4.132  -4.473
  288   HG22  VAL  18          1HG2      VAL  18   6.431  -5.284  -5.693
  289   HG23  VAL  18          2HG2      VAL  18   4.700  -4.953  -5.552
  290    H    CYS  19           H        CYS  19   3.424  -8.357  -2.940
  291    HA   CYS  19           HA       CYS  19   5.256 -10.273  -1.697
  292    HB2  CYS  19           2HB      CYS  19   3.620  -8.664  -0.554
  293    HB3  CYS  19           3HB      CYS  19   2.344  -9.782  -1.023
  294    H    GLY  20           H        GLY  20   2.539 -10.488  -3.963
  295    HA2  GLY  20           HA2      GLY  20   2.249 -13.376  -3.808
  296    HA3  GLY  20           HA3      GLY  20   1.655 -12.322  -5.092
  297    H    GLU  21           H        GLU  21   4.599 -14.477  -6.352
  298    HA   GLU  21           HA       GLU  21   1.978 -15.111  -5.156
  299    HB2  GLU  21           2HB      GLU  21   4.000 -16.790  -6.678
  300    HB3  GLU  21           3HB      GLU  21   2.408 -17.340  -6.139
  301    HG2  GLU  21           2HG      GLU  21   1.332 -15.549  -7.500
  302    HG3  GLU  21           3HG      GLU  21   2.918 -15.081  -8.118
  303    H    ARG  22           H        ARG  22   4.956 -14.756  -3.761
  304    HA   ARG  22           HA       ARG  22   5.298 -17.206  -2.267
  305    HB2  ARG  22           2HB      ARG  22   6.311 -14.396  -1.642
  306    HB3  ARG  22           3HB      ARG  22   6.904 -15.889  -0.930
  307    HG2  ARG  22           2HG      ARG  22   7.188 -14.995  -3.827
  308    HG3  ARG  22           3HG      ARG  22   8.459 -15.127  -2.622
  309    HD2  ARG  22           2HD      ARG  22   6.895 -17.437  -3.845
  310    HD3  ARG  22           3HD      ARG  22   8.552 -16.966  -4.237
  311    HE   ARG  22           HE       ARG  22   8.578 -17.407  -1.483
  312   HH11  ARG  22          2HH1      ARG  22   7.928 -19.409  -4.284
  313   HH12  ARG  22          1HH1      ARG  22   8.426 -20.867  -3.471
  314   HH21  ARG  22          2HH2      ARG  22   9.191 -19.305  -0.503
  315   HH22  ARG  22          1HH2      ARG  22   9.128 -20.801  -1.388
  316    H    GLY  23           H        GLY  23   3.512 -14.269  -1.537
  317    HA2  GLY  23           HA2      GLY  23   1.618 -14.108  -0.170
  318    HA3  GLY  23           HA3      GLY  23   1.956 -15.679   0.544
  319    H    DHI  24           H        DHI  24   1.118 -13.644   2.081
  320    HA   DHI  24           HA       DHI  24   3.474 -12.482   3.521
  321    HB2  DHI  24           2HB      DHI  24   2.646 -14.422   4.742
  322    HB3  DHI  24           3HB      DHI  24   2.341 -12.936   5.635
  323    HD2  DHI  24           HD2      DHI  24   0.557 -15.727   3.723
  324    HE1  DHI  24           HE1      DHI  24  -2.539 -13.415   5.540
  325    HE2  DHI  24           HE2      DHI  24  -2.035 -15.546   4.237
  326    H    PHE  25           H        PHE  25   0.532 -11.797   1.954
  327    HA   PHE  25           HA       PHE  25  -0.135  -9.455   3.625
  328    HB2  PHE  25           2HB      PHE  25   1.394  -8.666   1.815
  329    HB3  PHE  25           3HB      PHE  25   0.267  -9.292   0.612
  330    HD1  PHE  25           HD1      PHE  25   0.672  -6.849   3.403
  331    HD2  PHE  25           HD2      PHE  25  -1.713  -8.021   0.002
  332    HE1  PHE  25           HE1      PHE  25  -0.623  -4.744   3.585
  333    HE2  PHE  25           HE2      PHE  25  -3.033  -5.932   0.213
  334    HZ   PHE  25           HZ       PHE  25  -2.505  -4.300   2.016
  335    H    TYR  26           H        TYR  26  -2.292  -8.824   3.529
  336    HA   TYR  26           HA       TYR  26  -4.225 -10.172   1.785
  337    HB2  TYR  26           2HB      TYR  26  -3.892 -11.823   3.593
  338    HB3  TYR  26           3HB      TYR  26  -4.245 -10.594   4.797
  339    HD1  TYR  26           HD2      TYR  26  -5.695 -12.420   1.870
  340    HD2  TYR  26           HD1      TYR  26  -6.531 -10.170   5.464
  341    HE1  TYR  26           HE2      TYR  26  -8.106 -13.005   1.685
  342    HE2  TYR  26           HE1      TYR  26  -8.916 -10.814   5.308
  343    HH   TYR  26           HH       TYR  26 -10.500 -12.027   4.173
  344    H    THR  27           H        THR  27  -6.021  -8.908   1.462
  345    HA   THR  27           HA       THR  27  -6.959  -7.319   3.744
  346    HB   THR  27           HB       THR  27  -7.913  -5.536   2.344
  347    HG1  THR  27           HG1      THR  27  -7.126  -5.194   0.303
  348   HG21  THR  27          1HG2      THR  27  -4.878  -5.670   2.171
  349   HG22  THR  27          2HG2      THR  27  -5.887  -4.209   2.103
  350   HG23  THR  27          3HG2      THR  27  -5.810  -5.158   3.595
  351    HA   PRO  28           HA       PRO  28 -10.464  -9.778   2.744
  352    HB2  PRO  28           2HB      PRO  28 -12.392  -8.734   4.402
  353    HB3  PRO  28           3HB      PRO  28 -10.991  -9.680   4.987
  354    HG2  PRO  28           2HG      PRO  28 -11.289  -6.667   4.879
  355    HG3  PRO  28           3HG      PRO  28 -10.687  -7.684   6.234
  356    HD2  PRO  28           2HD      PRO  28  -9.009  -6.409   4.496
  357    HD3  PRO  28           3HD      PRO  28  -8.613  -8.001   5.211
  358    H    LYS  29           H        LYS  29 -13.015  -8.204   0.710
  359    HA   LYS  29           HA       LYS  29 -12.431 -10.531   2.479
  360    HB2  LYS  29           2HB      LYS  29 -14.650 -11.096   2.424
  361    HB3  LYS  29           3HB      LYS  29 -14.703  -9.347   2.478
  362    HG2  LYS  29           2HG      LYS  29 -15.263 -11.175   0.115
  363    HG3  LYS  29           3HG      LYS  29 -16.395 -10.146   0.973
  364    HD2  LYS  29           2HD      LYS  29 -15.277  -8.126   0.092
  365    HD3  LYS  29           3HD      LYS  29 -14.112  -9.129  -0.787
  366    HE2  LYS  29           2HE      LYS  29 -17.123  -9.125  -1.243
  367    HE3  LYS  29           3HE      LYS  29 -15.925  -8.277  -2.225
  368    HZ1  LYS  29           HZ1      LYS  29 -16.385 -10.343  -3.292
  369    HZ2  LYS  29           HZ2      LYS  29 -14.883 -10.508  -2.649
  370    HZ3  LYS  29           HZ3      LYS  29 -16.166 -11.215  -1.931
  371    H    THR  30           H        THR  30 -11.200  -9.766  -0.178
  372    HA   THR  30           HA       THR  30 -10.754 -10.504  -2.296
  373    HB   THR  30           HB       THR  30  -9.718 -12.726  -2.471
  374    HG1  THR  30           HG1      THR  30 -11.050 -13.743  -0.894
  375   HG21  THR  30          1HG2      THR  30  -8.435 -10.757  -1.703
  376   HG22  THR  30          2HG2      THR  30  -8.851 -11.144  -0.020
  377   HG23  THR  30          3HG2      THR  30  -7.858 -12.265  -0.975
  Start of MODEL   15
    1    H1   GLY   1           1H       GLY   1   4.575  -1.094  10.661
    2    H2   GLY   1           2H       GLY   1   4.756  -0.008   9.442
    3    H3   GLY   1           3H       GLY   1   3.575   0.204  10.564
    4    HA2  GLY   1           HA2      GLY   1   2.574  -0.574   8.560
    5    HA3  GLY   1           HA3      GLY   1   3.696  -1.944   8.554
    6    H    ILE   2           H        ILE   2   0.612  -3.323  10.037
    7    HA   ILE   2           HA       ILE   2   1.929  -2.703   7.427
    8    HB   ILE   2           HB       ILE   2   0.001  -4.975   7.999
    9   HG12  ILE   2          2HG1      ILE   2   3.042  -4.944   8.123
   10   HG13  ILE   2          3HG1      ILE   2   1.947  -5.280   9.458
   11   HG21  ILE   2          1HG2      ILE   2   1.984  -4.384   5.740
   12   HG22  ILE   2          2HG2      ILE   2   1.068  -5.895   5.896
   13   HG23  ILE   2          3HG2      ILE   2   0.207  -4.414   5.620
   14   HD11  ILE   2          3HD1      ILE   2   2.482  -7.091   7.090
   15   HD12  ILE   2          1HD1      ILE   2   2.886  -7.342   8.788
   16   HD13  ILE   2          2HD1      ILE   2   1.184  -7.353   8.290
   17    H    VAL   3           H        VAL   3   0.545  -2.320   5.592
   18    HA   VAL   3           HA       VAL   3  -0.719  -0.888   4.494
   19    HB   VAL   3           HB       VAL   3  -3.087  -1.044   4.502
   20   HG11  VAL   3          1HG1      VAL   3  -1.895  -3.793   4.958
   21   HG12  VAL   3          2HG1      VAL   3  -3.306  -3.367   3.978
   22   HG13  VAL   3          3HG1      VAL   3  -1.694  -2.821   3.478
   23   HG21  VAL   3          3HG2      VAL   3  -4.408  -2.363   5.994
   24   HG22  VAL   3          1HG2      VAL   3  -2.994  -2.864   6.932
   25   HG23  VAL   3          2HG2      VAL   3  -3.539  -1.171   6.973
   26    H    GLU   4           H        GLU   4   0.408   0.174   7.073
   27    HA   GLU   4           HA       GLU   4  -1.098   2.680   7.415
   28    HB2  GLU   4           2HB      GLU   4   1.760   1.924   8.140
   29    HB3  GLU   4           3HB      GLU   4   0.984   3.469   8.511
   30    HG2  GLU   4           2HG      GLU   4  -0.752   2.262   9.841
   31    HG3  GLU   4           3HG      GLU   4   0.097   0.739   9.542
   32    H    GLN   5           H        GLN   5  -0.986   4.406   6.094
   33    HA   GLN   5           HA       GLN   5  -0.074   3.908   3.475
   34    HB2  GLN   5           2HB      GLN   5  -1.174   6.465   4.686
   35    HB3  GLN   5           3HB      GLN   5  -0.923   6.151   2.971
   36    HG2  GLN   5           2HG      GLN   5  -3.190   5.746   3.255
   37    HG3  GLN   5           3HG      GLN   5  -2.473   4.144   3.174
   38   HE21  GLN   5          1HE2      GLN   5  -4.813   3.816   4.140
   39   HE22  GLN   5          2HE2      GLN   5  -4.882   3.829   5.895
   40    H    CYS   6           H        CYS   6   1.491   4.748   2.145
   41    HA   CYS   6           HA       CYS   6   3.917   5.812   3.414
   42    HB2  CYS   6           2HB      CYS   6   3.306   5.001   0.558
   43    HB3  CYS   6           3HB      CYS   6   4.876   5.509   1.146
   44    H    CYS   7           H        CYS   7   2.184   7.704   3.916
   45    HA   CYS   7           HA       CYS   7   1.977   9.714   1.767
   46    HB2  CYS   7           2HB      CYS   7   1.076   9.713   4.665
   47    HB3  CYS   7           3HB      CYS   7   0.709  10.970   3.491
   48    H    THR   8           H        THR   8   3.850   9.341   4.780
   49    HA   THR   8           HA       THR   8   5.050  12.019   4.531
   50    HB   THR   8           HB       THR   8   5.824   9.758   6.406
   51    HG1  THR   8           HG1      THR   8   3.967  11.868   6.802
   52   HG21  THR   8          1HG2      THR   8   6.185  12.784   6.591
   53   HG22  THR   8          2HG2      THR   8   6.533  11.622   7.895
   54   HG23  THR   8          3HG2      THR   8   7.470  11.570   6.397
   55    H    SER   9           H        SER   9   6.071   8.648   4.012
   56    HA   SER   9           HA       SER   9   8.671   9.587   2.862
   57    HB2  SER   9           2HB      SER   9   8.111   7.016   4.370
   58    HB3  SER   9           3HB      SER   9   9.670   7.537   3.705
   59    HG   SER   9           HG       SER   9   9.476   8.020   5.949
   60    H    ILE  10           H        ILE  10   9.571   8.448   1.174
   61    HA   ILE  10           HA       ILE  10   7.777   7.442  -0.852
   62    HB   ILE  10           HB       ILE  10  10.817   7.317  -0.646
   63   HG12  ILE  10          2HG1      ILE  10   9.990   9.663  -0.563
   64   HG13  ILE  10          3HG1      ILE  10  10.968   9.300  -1.968
   65   HG21  ILE  10          1HG2      ILE  10  10.133   5.745  -2.328
   66   HG22  ILE  10          2HG2      ILE  10   8.952   6.893  -3.001
   67   HG23  ILE  10          3HG2      ILE  10  10.696   7.192  -3.171
   68   HD11  ILE  10          3HD1      ILE  10   8.986  10.734  -2.461
   69   HD12  ILE  10          1HD1      ILE  10   9.026   9.255  -3.420
   70   HD13  ILE  10          2HD1      ILE  10   7.925   9.370  -2.033
   71    H    CYS  11           H        CYS  11   7.261   5.368  -1.422
   72    HA   CYS  11           HA       CYS  11   8.715   3.128  -0.073
   73    HB2  CYS  11           2HB      CYS  11   5.790   3.216  -0.780
   74    HB3  CYS  11           3HB      CYS  11   6.697   1.765  -0.295
   75    H    SER  12           H        SER  12  10.257   2.912  -1.531
   76    HA   SER  12           HA       SER  12   9.907   3.036  -4.374
   77    HB2  SER  12           2HB      SER  12  12.412   2.568  -4.279
   78    HB3  SER  12           3HB      SER  12  11.840   3.991  -3.401
   79    HG   SER  12           HG       SER  12  13.330   2.640  -2.213
   80    H    LEU  13           H        LEU  13   8.319   0.929  -3.506
   81    HA   LEU  13           HA       LEU  13   7.723  -1.217  -3.728
   82    HB2  LEU  13           2HB      LEU  13   8.386  -0.707  -6.051
   83    HB3  LEU  13           3HB      LEU  13   9.947  -1.464  -5.780
   84    HG   LEU  13           HG       LEU  13   7.313  -2.948  -5.426
   85   HD11  LEU  13          1HD1      LEU  13   7.650  -3.817  -7.702
   86   HD12  LEU  13          2HD1      LEU  13   7.458  -2.063  -7.722
   87   HD13  LEU  13          3HD1      LEU  13   9.078  -2.773  -7.903
   88   HD21  LEU  13          3HD2      LEU  13  10.200  -3.865  -5.841
   89   HD22  LEU  13          1HD2      LEU  13   9.160  -4.196  -4.435
   90   HD23  LEU  13          2HD2      LEU  13   8.799  -4.940  -5.984
   91    H    TYR  14           H        TYR  14  11.294  -1.189  -3.571
   92    HA   TYR  14           HA       TYR  14  11.822  -3.553  -2.162
   93    HB2  TYR  14           2HB      TYR  14  13.610  -2.289  -3.038
   94    HB3  TYR  14           3HB      TYR  14  13.052  -0.795  -2.304
   95    HD1  TYR  14           HD2      TYR  14  14.540  -4.133  -1.439
   96    HD2  TYR  14           HD1      TYR  14  13.870  -0.040  -0.244
   97    HE1  TYR  14           HE2      TYR  14  16.045  -4.457   0.520
   98    HE2  TYR  14           HE1      TYR  14  15.350  -0.372   1.729
   99    HH   TYR  14           HH       TYR  14  16.981  -3.505   2.382
  100    H    GLN  15           H        GLN  15  10.639  -0.462  -0.841
  101    HA   GLN  15           HA       GLN  15  10.992  -1.073   1.933
  102    HB2  GLN  15           2HB      GLN  15   8.950   0.759   0.644
  103    HB3  GLN  15           3HB      GLN  15   9.452   0.799   2.333
  104    HG2  GLN  15           2HG      GLN  15  11.259   1.316  -0.062
  105    HG3  GLN  15           3HG      GLN  15  10.534   2.563   0.942
  106   HE21  GLN  15          1HE2      GLN  15  13.224   2.684   0.618
  107   HE22  GLN  15          2HE2      GLN  15  14.008   2.219   2.123
  108    H    LEU  16           H        LEU  16   8.540  -2.020  -0.312
  109    HA   LEU  16           HA       LEU  16   6.511  -2.730   1.671
  110    HB2  LEU  16           2HB      LEU  16   6.720  -3.517  -1.258
  111    HB3  LEU  16           3HB      LEU  16   5.304  -3.627  -0.249
  112    HG   LEU  16           HG       LEU  16   6.705  -1.141  -1.266
  113   HD11  LEU  16          1HD1      LEU  16   3.900  -2.195  -1.730
  114   HD12  LEU  16          2HD1      LEU  16   4.609  -0.721  -2.426
  115   HD13  LEU  16          3HD1      LEU  16   5.268  -2.303  -2.860
  116   HD21  LEU  16          3HD2      LEU  16   4.836   0.169  -0.193
  117   HD22  LEU  16          1HD2      LEU  16   4.321  -1.313   0.641
  118   HD23  LEU  16          2HD2      LEU  16   5.901  -0.581   1.000
  119    H    GLU  17           H        GLU  17   9.135  -4.450   0.100
  120    HA   GLU  17           HA       GLU  17   8.361  -7.137   0.515
  121    HB2  GLU  17           2HB      GLU  17  11.155  -5.923   0.609
  122    HB3  GLU  17           3HB      GLU  17  10.800  -7.647   0.536
  123    HG2  GLU  17           2HG      GLU  17   9.593  -7.305  -1.615
  124    HG3  GLU  17           3HG      GLU  17  10.076  -5.604  -1.600
  125    H    ASN  18           H        ASN  18   9.417  -4.826   2.913
  126    HA   ASN  18           HA       ASN  18  10.170  -6.537   5.059
  127    HB2  ASN  18           2HB      ASN  18  10.480  -4.070   4.948
  128    HB3  ASN  18           3HB      ASN  18   8.734  -3.838   5.040
  129   HD21  ASN  18          2HD2      ASN  18   7.759  -3.832   7.092
  130   HD22  ASN  18          1HD2      ASN  18   8.676  -4.128   8.562
  131    H    TYR  19           H        TYR  19   6.998  -5.891   3.679
  132    HA   TYR  19           HA       TYR  19   5.575  -7.026   6.012
  133    HB2  TYR  19           2HB      TYR  19   4.544  -5.595   3.558
  134    HB3  TYR  19           3HB      TYR  19   3.608  -6.030   4.978
  135    HD1  TYR  19           HD2      TYR  19   5.161  -5.236   7.278
  136    HD2  TYR  19           HD1      TYR  19   4.867  -3.266   3.454
  137    HE1  TYR  19           HE2      TYR  19   5.689  -3.064   8.352
  138    HE2  TYR  19           HE1      TYR  19   5.396  -1.098   4.517
  139    HH   TYR  19           HH       TYR  19   5.847   0.001   6.507
  140    H    CYS  20           H        CYS  20   7.042  -8.535   3.641
  141    HA   CYS  20           HA       CYS  20   4.915 -10.329   2.734
  142    HB2  CYS  20           2HB      CYS  20   7.935 -10.478   2.506
  143    HB3  CYS  20           3HB      CYS  20   6.817 -11.602   1.768
  144    H    ASN  21           H        ASN  21   6.219 -10.077   5.724
  145    HA   ASN  21           HA       ASN  21   5.737 -12.947   6.384
  146    HB2  ASN  21           2HB      ASN  21   8.067 -11.212   7.335
  147    HB3  ASN  21           3HB      ASN  21   7.643 -12.780   8.016
  148   HD21  ASN  21          2HD2      ASN  21   7.815 -14.712   6.594
  149   HD22  ASN  21          1HD2      ASN  21   8.954 -14.645   5.260
  150    H1   PHE   1           H        PHE   1   6.559   2.221  -4.862
  151    HA   PHE   1           HA       PHE   1   6.951   0.734  -7.329
  152    HB2  PHE   1           2HB      PHE   1   4.180   1.647  -6.573
  153    HB3  PHE   1           3HB      PHE   1   4.687   1.760  -8.243
  154    HD1  PHE   1           HD1      PHE   1   5.278  -0.914  -5.620
  155    HD2  PHE   1           HD2      PHE   1   3.636   0.098  -9.482
  156    HE1  PHE   1           HE1      PHE   1   4.704  -3.272  -5.996
  157    HE2  PHE   1           HE2      PHE   1   3.022  -2.281  -9.832
  158    HZ   PHE   1           HZ       PHE   1   3.596  -3.981  -8.108
  159    H    VAL   2           H        VAL   2   7.884   1.943  -8.794
  160    HA   VAL   2           HA       VAL   2   8.960   3.674  -9.770
  161    HB   VAL   2           HB       VAL   2   6.288   5.079  -9.821
  162   HG11  VAL   2          1HG1      VAL   2   8.183   6.106 -11.123
  163   HG12  VAL   2          2HG1      VAL   2   8.421   4.564 -11.960
  164   HG13  VAL   2          3HG1      VAL   2   6.922   5.489 -12.182
  165   HG21  VAL   2          3HG2      VAL   2   7.037   2.545 -11.343
  166   HG22  VAL   2          1HG2      VAL   2   5.697   2.740 -10.189
  167   HG23  VAL   2          2HG2      VAL   2   5.653   3.594 -11.722
  168    H    ASN   3           H        ASN   3   9.332   3.885  -7.004
  169    HA   ASN   3           HA       ASN   3   9.846   5.238  -5.257
  170    HB2  ASN   3           2HB      ASN   3  10.936   6.944  -7.522
  171    HB3  ASN   3           3HB      ASN   3  11.365   7.126  -5.824
  172   HD21  ASN   3          2HD2      ASN   3  13.406   6.736  -7.550
  173   HD22  ASN   3          1HD2      ASN   3  14.040   5.109  -7.344
  174    H    GLN   4           H        GLN   4   7.192   5.433  -5.629
  175    HA   GLN   4           HA       GLN   4   6.471   8.310  -5.369
  176    HB2  GLN   4           2HB      GLN   4   4.769   5.828  -5.793
  177    HB3  GLN   4           3HB      GLN   4   4.146   7.474  -5.629
  178    HG2  GLN   4           2HG      GLN   4   5.455   8.171  -7.632
  179    HG3  GLN   4           3HG      GLN   4   6.001   6.506  -7.835
  180   HE21  GLN   4          2HE2      GLN   4   4.842   7.398 -10.024
  181   HE22  GLN   4          1HE2      GLN   4   3.186   6.824 -10.161
  182    H    HIS   5           H        HIS   5   4.969   9.013  -3.816
  183    HA   HIS   5           HA       HIS   5   4.888   7.717  -1.153
  184    HB2  HIS   5           2HB      HIS   5   3.644  10.228  -2.348
  185    HB3  HIS   5           3HB      HIS   5   3.249   9.633  -0.745
  186    HD2  HIS   5           HD2      HIS   5   5.239   9.626   1.125
  187    HE1  HIS   5           HE1      HIS   5   7.742  12.410  -0.911
  188    HE2  HIS   5           HE2      HIS   5   7.270  11.299   1.336
  189    H    LEU   6           H        LEU   6   3.867   5.730  -1.497
  190    HA   LEU   6           HA       LEU   6   1.341   5.497  -2.949
  191    HB2  LEU   6           2HB      LEU   6   2.672   3.506  -1.088
  192    HB3  LEU   6           3HB      LEU   6   1.331   3.199  -2.190
  193    HG   LEU   6           HG       LEU   6   4.202   3.841  -2.947
  194   HD11  LEU   6          1HD1      LEU   6   4.170   1.570  -3.864
  195   HD12  LEU   6          2HD1      LEU   6   3.760   1.548  -2.142
  196   HD13  LEU   6          3HD1      LEU   6   2.480   1.363  -3.364
  197   HD21  LEU   6          3HD2      LEU   6   1.810   3.367  -4.773
  198   HD22  LEU   6          1HD2      LEU   6   2.730   4.879  -4.620
  199   HD23  LEU   6          2HD2      LEU   6   3.511   3.449  -5.287
  200    H    CYS   7           H        CYS   7   0.058   7.029  -2.049
  201    HA   CYS   7           HA       CYS   7  -0.851   6.711   0.781
  202    HB2  CYS   7           2HB      CYS   7   0.824   8.446   0.474
  203    HB3  CYS   7           3HB      CYS   7  -0.096   9.153  -0.846
  204    H    GLY   8           H        GLY   8  -2.994   6.757   1.128
  205    HA2  GLY   8           HA2      GLY   8  -5.265   6.959   0.843
  206    HA3  GLY   8           HA3      GLY   8  -4.975   8.036  -0.522
  207    H    SER   9           H        SER   9  -3.414   5.964  -1.992
  208    HA   SER   9           HA       SER   9  -5.214   3.701  -2.532
  209    HB2  SER   9           2HB      SER   9  -6.036   5.710  -3.879
  210    HB3  SER   9           3HB      SER   9  -4.494   5.658  -4.752
  211    HG   SER   9           HG       SER   9  -6.222   4.465  -5.772
  212    H    HIS  10           H        HIS  10  -4.188   2.605  -4.619
  213    HA   HIS  10           HA       HIS  10  -2.588   1.279  -5.502
  214    HB2  HIS  10           2HB      HIS  10  -1.904   3.631  -6.171
  215    HB3  HIS  10           3HB      HIS  10  -0.599   3.477  -5.000
  216    HD2  HIS  10           HD2      HIS  10   0.977   1.115  -5.462
  217    HE1  HIS  10           HE1      HIS  10   0.383   1.229  -9.679
  218    HE2  HIS  10           HE2      HIS  10   1.799   0.229  -7.808
  219    H    LEU  11           H        LEU  11  -1.531   2.392  -2.286
  220    HA   LEU  11           HA       LEU  11   0.681   0.755  -1.970
  221    HB2  LEU  11           2HB      LEU  11   0.000   2.518  -0.409
  222    HB3  LEU  11           3HB      LEU  11  -1.392   1.572   0.102
  223    HG   LEU  11           HG       LEU  11   0.056  -0.119   1.116
  224   HD11  LEU  11          1HD1      LEU  11   2.500   0.270   1.348
  225   HD12  LEU  11          2HD1      LEU  11   2.048  -0.053  -0.327
  226   HD13  LEU  11          3HD1      LEU  11   2.389   1.613   0.195
  227   HD21  LEU  11          3HD2      LEU  11  -0.604   1.861   2.424
  228   HD22  LEU  11          1HD2      LEU  11   0.973   1.224   2.927
  229   HD23  LEU  11          2HD2      LEU  11   0.899   2.677   1.907
  230    H    VAL  12           H        VAL  12  -2.715  -0.278  -1.272
  231    HA   VAL  12           HA       VAL  12  -1.939  -2.901  -0.384
  232    HB   VAL  12           HB       VAL  12  -4.303  -3.461  -0.610
  233   HG11  VAL  12          1HG1      VAL  12  -3.422  -2.339   1.410
  234   HG12  VAL  12          2HG1      VAL  12  -3.861  -0.763   0.718
  235   HG13  VAL  12          3HG1      VAL  12  -5.123  -1.948   1.109
  236   HG21  VAL  12          3HG2      VAL  12  -4.997  -2.159  -2.576
  237   HG22  VAL  12          1HG2      VAL  12  -5.987  -1.761  -1.175
  238   HG23  VAL  12          2HG2      VAL  12  -4.718  -0.639  -1.691
  239    H    GLU  13           H        GLU  13  -2.741  -1.602  -3.581
  240    HA   GLU  13           HA       GLU  13  -2.801  -4.163  -4.955
  241    HB2  GLU  13           2HB      GLU  13  -2.240  -1.369  -6.037
  242    HB3  GLU  13           3HB      GLU  13  -2.517  -2.818  -7.002
  243    HG2  GLU  13           2HG      GLU  13  -4.786  -3.053  -5.972
  244    HG3  GLU  13           3HG      GLU  13  -4.523  -1.552  -5.081
  245    H    ALA  14           H        ALA  14  -0.218  -1.710  -4.392
  246    HA   ALA  14           HA       ALA  14   1.877  -3.158  -5.675
  247    HB1  ALA  14           3HB      ALA  14   1.907  -1.183  -3.349
  248    HB2  ALA  14           1HB      ALA  14   3.319  -1.710  -4.283
  249    HB3  ALA  14           2HB      ALA  14   2.038  -0.800  -5.083
  250    H    LEU  15           H        LEU  15   0.696  -3.293  -2.251
  251    HA   LEU  15           HA       LEU  15   2.642  -5.257  -1.478
  252    HB2  LEU  15           2HB      LEU  15   0.081  -4.182  -0.289
  253    HB3  LEU  15           3HB      LEU  15   0.845  -5.596   0.427
  254    HG   LEU  15           HG       LEU  15   2.479  -3.103  -0.116
  255   HD11  LEU  15          1HD1      LEU  15   0.543  -2.450   1.320
  256   HD12  LEU  15          2HD1      LEU  15   1.058  -3.672   2.502
  257   HD13  LEU  15          3HD1      LEU  15   2.119  -2.309   2.120
  258   HD21  LEU  15          3HD2      LEU  15   3.649  -5.263   0.438
  259   HD22  LEU  15          1HD2      LEU  15   3.888  -4.015   1.657
  260   HD23  LEU  15          2HD2      LEU  15   2.735  -5.334   1.951
  261    H    TYR  16           H        TYR  16  -0.656  -5.722  -2.837
  262    HA   TYR  16           HA       TYR  16  -0.618  -8.584  -2.629
  263    HB2  TYR  16           2HB      TYR  16  -1.974  -6.671  -4.555
  264    HB3  TYR  16           3HB      TYR  16  -2.125  -8.412  -4.714
  265    HD1  TYR  16           HD2      TYR  16  -2.568  -9.608  -2.240
  266    HD2  TYR  16           HD1      TYR  16  -3.921  -5.735  -3.576
  267    HE1  TYR  16           HE2      TYR  16  -4.381  -9.663  -0.565
  268    HE2  TYR  16           HE1      TYR  16  -5.764  -5.804  -1.912
  269    HH   TYR  16           HH       TYR  16  -6.772  -6.993  -0.234
  270    H    LEU  17           H        LEU  17   0.916  -6.404  -4.998
  271    HA   LEU  17           HA       LEU  17   1.769  -8.590  -6.750
  272    HB2  LEU  17           2HB      LEU  17   2.349  -5.610  -6.644
  273    HB3  LEU  17           3HB      LEU  17   3.044  -6.673  -7.861
  274    HG   LEU  17           HG       LEU  17   0.034  -6.369  -7.464
  275   HD11  LEU  17          1HD1      LEU  17   1.028  -4.208  -8.118
  276   HD12  LEU  17          2HD1      LEU  17   1.842  -4.995  -9.494
  277   HD13  LEU  17          3HD1      LEU  17   0.068  -4.905  -9.428
  278   HD21  LEU  17          3HD2      LEU  17   1.691  -7.510  -9.754
  279   HD22  LEU  17          1HD2      LEU  17   0.667  -8.437  -8.635
  280   HD23  LEU  17          2HD2      LEU  17  -0.072  -7.293  -9.757
  281    H    VAL  18           H        VAL  18   3.338  -6.654  -4.216
  282    HA   VAL  18           HA       VAL  18   5.979  -7.836  -4.679
  283    HB   VAL  18           HB       VAL  18   4.902  -5.971  -2.529
  284   HG11  VAL  18          1HG1      VAL  18   7.308  -5.433  -2.076
  285   HG12  VAL  18          2HG1      VAL  18   6.864  -7.066  -1.566
  286   HG13  VAL  18          3HG1      VAL  18   7.777  -6.822  -3.074
  287   HG21  VAL  18          3HG2      VAL  18   5.029  -5.091  -4.868
  288   HG22  VAL  18          1HG2      VAL  18   6.161  -4.277  -3.780
  289   HG23  VAL  18          2HG2      VAL  18   6.738  -5.517  -4.924
  290    H    CYS  19           H        CYS  19   3.368  -8.323  -2.345
  291    HA   CYS  19           HA       CYS  19   4.798 -10.692  -1.205
  292    HB2  CYS  19           2HB      CYS  19   2.980  -8.709   0.179
  293    HB3  CYS  19           3HB      CYS  19   3.717 -10.123   0.922
  294    H    GLY  20           H        GLY  20   1.663 -12.002  -2.824
  295    HA2  GLY  20           HA2      GLY  20   3.336 -10.677  -4.451
  296    HA3  GLY  20           HA3      GLY  20   4.496 -11.553  -3.440
  297    H    GLU  21           H        GLU  21   5.149 -12.600  -5.420
  298    HA   GLU  21           HA       GLU  21   3.530 -14.294  -7.010
  299    HB2  GLU  21           2HB      GLU  21   5.810 -13.379  -7.503
  300    HB3  GLU  21           3HB      GLU  21   6.500 -14.556  -6.383
  301    HG2  GLU  21           2HG      GLU  21   5.737 -16.404  -7.807
  302    HG3  GLU  21           3HG      GLU  21   4.845 -15.283  -8.841
  303    H    ARG  22           H        ARG  22   4.680 -14.860  -3.793
  304    HA   ARG  22           HA       ARG  22   3.209 -17.416  -3.792
  305    HB2  ARG  22           2HB      ARG  22   5.875 -17.613  -3.933
  306    HB3  ARG  22           3HB      ARG  22   5.793 -17.296  -2.215
  307    HG2  ARG  22           2HG      ARG  22   5.917 -19.705  -2.812
  308    HG3  ARG  22           3HG      ARG  22   4.490 -19.332  -1.853
  309    HD2  ARG  22           2HD      ARG  22   4.152 -20.952  -3.793
  310    HD3  ARG  22           3HD      ARG  22   3.024 -19.614  -3.685
  311    HE   ARG  22           HE       ARG  22   4.008 -18.540  -5.560
  312   HH11  ARG  22          1HH2      ARG  22   5.639 -21.607  -5.042
  313   HH12  ARG  22          2HH2      ARG  22   6.350 -21.575  -6.634
  314   HH21  ARG  22          2HH1      ARG  22   4.895 -18.570  -7.504
  315   HH22  ARG  22          1HH1      ARG  22   5.932 -19.880  -8.009
  316    H    GLY  23           H        GLY  23   2.467 -14.787  -2.978
  317    HA2  GLY  23           HA2      GLY  23   1.166 -13.837  -1.317
  318    HA3  GLY  23           HA3      GLY  23   1.200 -15.379  -0.473
  319    H    DHI  24           H        DHI  24   1.206 -14.041   1.431
  320    HA   DHI  24           HA       DHI  24   3.905 -13.070   2.255
  321    HB2  DHI  24           2HB      DHI  24   3.544 -15.283   3.102
  322    HB3  DHI  24           3HB      DHI  24   3.525 -14.135   4.429
  323    HD2  DHI  24           HD2      DHI  24   1.242 -16.488   2.434
  324    HE1  DHI  24           HE1      DHI  24  -1.016 -15.253   5.840
  325    HE2  DHI  24           HE2      DHI  24  -0.979 -16.820   3.831
  326    H    PHE  25           H        PHE  25   1.266 -11.637   1.453
  327    HA   PHE  25           HA       PHE  25   1.577  -9.408   3.212
  328    HB2  PHE  25           2HB      PHE  25   1.031  -9.218   0.842
  329    HB3  PHE  25           3HB      PHE  25  -0.465 -10.098   1.080
  330    HD1  PHE  25           HD2      PHE  25   0.938  -7.193   3.090
  331    HD2  PHE  25           HD1      PHE  25  -2.043  -8.589   0.307
  332    HE1  PHE  25           HE2      PHE  25  -0.340  -5.100   3.395
  333    HE2  PHE  25           HE1      PHE  25  -3.226  -6.416   0.486
  334    HZ   PHE  25           HZ       PHE  25  -2.397  -4.680   2.052
  335    H    TYR  26           H        TYR  26   0.013  -8.337   4.459
  336    HA   TYR  26           HA       TYR  26  -1.460  -9.707   6.445
  337    HB2  TYR  26           2HB      TYR  26  -0.581  -7.471   6.700
  338    HB3  TYR  26           3HB      TYR  26  -1.533  -6.875   5.345
  339    HD1  TYR  26           HD1      TYR  26  -1.979  -8.568   8.679
  340    HD2  TYR  26           HD2      TYR  26  -3.556  -5.779   5.785
  341    HE1  TYR  26           HE1      TYR  26  -3.860  -8.033  10.213
  342    HE2  TYR  26           HE2      TYR  26  -5.426  -5.241   7.322
  343    HH   TYR  26           HH       TYR  26  -6.407  -5.649   9.361
  344    H    THR  27           H        THR  27  -2.575  -8.345   3.326
  345    HA   THR  27           HA       THR  27  -4.510  -8.509   2.143
  346    HB   THR  27           HB       THR  27  -4.833 -11.128   3.611
  347    HG1  THR  27           HG1      THR  27  -3.747 -11.912   1.843
  348   HG21  THR  27          1HG2      THR  27  -6.049 -10.159   0.983
  349   HG22  THR  27          2HG2      THR  27  -6.072 -11.834   1.571
  350   HG23  THR  27          3HG2      THR  27  -6.943 -10.580   2.454
  351    HA   PRO  28           HA       PRO  28  -6.991  -6.645   5.582
  352    HB2  PRO  28           2HB      PRO  28  -7.665  -4.297   4.332
  353    HB3  PRO  28           3HB      PRO  28  -6.089  -4.559   5.138
  354    HG2  PRO  28           2HG      PRO  28  -6.737  -4.871   2.189
  355    HG3  PRO  28           3HG      PRO  28  -5.385  -3.959   2.930
  356    HD2  PRO  28           2HD      PRO  28  -5.053  -6.474   1.999
  357    HD3  PRO  28           3HD      PRO  28  -4.238  -5.956   3.505
  358    H    LYS  29           H        LYS  29  -9.207  -6.473   5.835
  359    HA   LYS  29           HA       LYS  29 -10.969  -7.229   3.541
  360    HB2  LYS  29           2HB      LYS  29 -10.171  -9.084   5.209
  361    HB3  LYS  29           3HB      LYS  29 -11.354  -8.379   6.313
  362    HG2  LYS  29           2HG      LYS  29 -13.135  -8.791   4.588
  363    HG3  LYS  29           3HG      LYS  29 -11.905  -9.455   3.501
  364    HD2  LYS  29           2HD      LYS  29 -11.389 -11.221   5.169
  365    HD3  LYS  29           3HD      LYS  29 -12.638 -10.586   6.246
  366    HE2  LYS  29           2HE      LYS  29 -13.121 -11.632   3.414
  367    HE3  LYS  29           3HE      LYS  29 -13.316 -12.594   4.881
  368    HZ1  LYS  29           HZ1      LYS  29 -14.884 -10.154   4.239
  369    HZ2  LYS  29           HZ2      LYS  29 -15.435 -11.686   4.175
  370    HZ3  LYS  29           HZ3      LYS  29 -15.036 -11.029   5.613
  371    H    THR  30           H        THR  30 -10.464  -4.647   4.857
  372    HA   THR  30           HA       THR  30 -11.437  -2.794   5.726
  373    HB   THR  30           HB       THR  30 -13.972  -3.704   4.343
  374    HG1  THR  30           HG1      THR  30 -12.181  -3.853   2.975
  375   HG21  THR  30          1HG2      THR  30 -14.242  -1.267   3.950
  376   HG22  THR  30          2HG2      THR  30 -14.217  -1.615   5.682
  377   HG23  THR  30          3HG2      THR  30 -12.773  -0.941   4.898
  Start of MODEL   16
    1    H1   GLY   1           1H       GLY   1   2.736  -1.021  15.299
    2    H2   GLY   1           2H       GLY   1   1.485  -1.752  16.067
    3    H3   GLY   1           3H       GLY   1   2.770  -2.636  15.564
    4    HA2  GLY   1           HA2      GLY   1   0.905  -2.991  14.088
    5    HA3  GLY   1           HA3      GLY   1   0.849  -1.240  13.812
    6    H    ILE   2           H        ILE   2   1.142  -3.185  11.758
    7    HA   ILE   2           HA       ILE   2   3.910  -3.495  11.008
    8    HB   ILE   2           HB       ILE   2   2.114  -5.088  10.479
    9   HG12  ILE   2          2HG1      ILE   2   3.431  -4.108   7.918
   10   HG13  ILE   2          3HG1      ILE   2   4.315  -4.916   9.205
   11   HG21  ILE   2          1HG2      ILE   2   0.303  -3.482   9.851
   12   HG22  ILE   2          2HG2      ILE   2   1.186  -3.093   8.357
   13   HG23  ILE   2          3HG2      ILE   2   0.555  -4.722   8.629
   14   HD11  ILE   2          3HD1      ILE   2   3.752  -6.566   7.556
   15   HD12  ILE   2          1HD1      ILE   2   2.758  -6.884   8.983
   16   HD13  ILE   2          2HD1      ILE   2   2.048  -6.086   7.553
   17    H    VAL   3           H        VAL   3   1.627  -0.936  10.377
   18    HA   VAL   3           HA       VAL   3   2.657  -0.090   7.858
   19    HB   VAL   3           HB       VAL   3   1.016   1.509   9.847
   20   HG11  VAL   3          1HG1      VAL   3   2.033   2.962   8.118
   21   HG12  VAL   3          2HG1      VAL   3   1.451   1.864   6.847
   22   HG13  VAL   3          3HG1      VAL   3   0.300   2.784   7.839
   23   HG21  VAL   3          3HG2      VAL   3   0.179  -0.244   7.489
   24   HG22  VAL   3          1HG2      VAL   3  -0.146  -0.574   9.205
   25   HG23  VAL   3          2HG2      VAL   3  -0.903   0.812   8.422
   26    H    GLU   4           H        GLU   4   4.513   0.769   7.402
   27    HA   GLU   4           HA       GLU   4   5.611   3.062   8.844
   28    HB2  GLU   4           2HB      GLU   4   6.539   0.822   9.899
   29    HB3  GLU   4           3HB      GLU   4   7.478   0.709   8.409
   30    HG2  GLU   4           2HG      GLU   4   8.312   3.095   8.943
   31    HG3  GLU   4           3HG      GLU   4   7.524   2.926  10.504
   32    H    GLN   5           H        GLN   5   7.154   4.210   7.551
   33    HA   GLN   5           HA       GLN   5   8.053   5.129   5.729
   34    HB2  GLN   5           2HB      GLN   5   8.324   2.348   4.560
   35    HB3  GLN   5           3HB      GLN   5   9.278   3.766   4.169
   36    HG2  GLN   5           2HG      GLN   5   9.296   2.252   6.815
   37    HG3  GLN   5           3HG      GLN   5  10.528   2.195   5.575
   38   HE21  GLN   5          2HE2      GLN   5  10.815   2.989   8.432
   39   HE22  GLN   5          1HE2      GLN   5  11.495   4.620   8.346
   40    H    CYS   6           H        CYS   6   5.191   3.317   5.118
   41    HA   CYS   6           HA       CYS   6   4.508   5.108   2.880
   42    HB2  CYS   6           2HB      CYS   6   5.499   2.583   2.398
   43    HB3  CYS   6           3HB      CYS   6   3.776   2.260   2.422
   44    H    CYS   7           H        CYS   7   1.104   4.804   4.089
   45    HA   CYS   7           HA       CYS   7   2.646   5.571   1.739
   46    HB2  CYS   7           2HB      CYS   7   0.687   6.736   1.111
   47    HB3  CYS   7           3HB      CYS   7   0.219   5.159   1.745
   48    H    THR   8           H        THR   8   3.286   6.488   4.774
   49    HA   THR   8           HA       THR   8   3.194   9.300   4.917
   50    HB   THR   8           HB       THR   8   5.141   8.985   6.528
   51    HG1  THR   8           HG1      THR   8   5.671   6.857   7.007
   52   HG21  THR   8          1HG2      THR   8   2.772   8.865   7.273
   53   HG22  THR   8          2HG2      THR   8   2.755   7.121   6.931
   54   HG23  THR   8          3HG2      THR   8   3.818   7.775   8.195
   55    H    SER   9           H        SER   9   5.548   7.260   3.255
   56    HA   SER   9           HA       SER   9   6.559   9.690   1.858
   57    HB2  SER   9           2HB      SER   9   8.245   7.274   2.632
   58    HB3  SER   9           3HB      SER   9   8.772   8.628   1.628
   59    HG   SER   9           HG       SER   9   8.443  10.018   3.424
   60    H    ILE  10           H        ILE  10   7.471   9.114  -0.316
   61    HA   ILE  10           HA       ILE  10   5.637   7.311  -1.745
   62    HB   ILE  10           HB       ILE  10   7.883   8.996  -2.912
   63   HG12  ILE  10          2HG1      ILE  10   4.978   9.725  -2.358
   64   HG13  ILE  10          3HG1      ILE  10   6.417  10.498  -1.693
   65   HG21  ILE  10          1HG2      ILE  10   6.628   8.744  -4.995
   66   HG22  ILE  10          2HG2      ILE  10   6.924   7.138  -4.337
   67   HG23  ILE  10          3HG2      ILE  10   5.322   7.886  -4.151
   68   HD11  ILE  10          3HD1      ILE  10   5.540  11.946  -3.358
   69   HD12  ILE  10          1HD1      ILE  10   7.037  11.250  -4.006
   70   HD13  ILE  10          2HD1      ILE  10   5.446  10.658  -4.560
   71    H    CYS  11           H        CYS  11   6.307   5.388  -0.683
   72    HA   CYS  11           HA       CYS  11   8.988   4.548  -0.495
   73    HB2  CYS  11           2HB      CYS  11   8.089   2.471   0.340
   74    HB3  CYS  11           3HB      CYS  11   7.244   3.841   1.035
   75    H    SER  12           H        SER  12  10.123   2.768  -1.333
   76    HA   SER  12           HA       SER  12   9.639   2.140  -4.184
   77    HB2  SER  12           2HB      SER  12  11.934   1.351  -4.177
   78    HB3  SER  12           3HB      SER  12  11.857   2.973  -3.467
   79    HG   SER  12           HG       SER  12  13.139   1.633  -2.187
   80    H    LEU  13           H        LEU  13  10.117  -0.110  -4.898
   81    HA   LEU  13           HA       LEU  13   8.455  -2.068  -3.676
   82    HB2  LEU  13           2HB      LEU  13  10.845  -2.516  -5.502
   83    HB3  LEU  13           3HB      LEU  13   9.512  -3.634  -5.227
   84    HG   LEU  13           HG       LEU  13   9.357  -0.947  -6.664
   85   HD11  LEU  13          1HD1      LEU  13   9.010  -3.801  -7.664
   86   HD12  LEU  13          2HD1      LEU  13   8.859  -2.319  -8.634
   87   HD13  LEU  13          3HD1      LEU  13  10.428  -2.764  -7.942
   88   HD21  LEU  13          3HD2      LEU  13   7.154  -2.982  -6.146
   89   HD22  LEU  13          1HD2      LEU  13   7.231  -1.328  -5.492
   90   HD23  LEU  13          2HD2      LEU  13   7.029  -1.580  -7.227
   91    H    TYR  14           H        TYR  14  11.898  -1.392  -3.209
   92    HA   TYR  14           HA       TYR  14  12.619  -3.690  -1.658
   93    HB2  TYR  14           2HB      TYR  14  14.319  -2.330  -2.621
   94    HB3  TYR  14           3HB      TYR  14  13.660  -0.858  -1.929
   95    HD1  TYR  14           HD1      TYR  14  15.423  -4.038  -1.053
   96    HD2  TYR  14           HD2      TYR  14  14.295  -0.067   0.213
   97    HE1  TYR  14           HE1      TYR  14  16.930  -4.235   0.930
   98    HE2  TYR  14           HE2      TYR  14  15.790  -0.271   2.193
   99    HH   TYR  14           HH       TYR  14  17.274  -1.596   3.333
  100    H    GLN  15           H        GLN  15  11.083  -0.592  -0.727
  101    HA   GLN  15           HA       GLN  15  11.264  -1.120   2.145
  102    HB2  GLN  15           2HB      GLN  15   9.490   0.786   0.578
  103    HB3  GLN  15           3HB      GLN  15   9.626   0.762   2.333
  104    HG2  GLN  15           2HG      GLN  15  11.926   1.309   0.419
  105    HG3  GLN  15           3HG      GLN  15  10.969   2.550   1.211
  106   HE21  GLN  15          2HE2      GLN  15  13.626   2.758   1.630
  107   HE22  GLN  15          1HE2      GLN  15  14.030   2.211   3.251
  108    H    LEU  16           H        LEU  16   8.801  -1.580  -0.361
  109    HA   LEU  16           HA       LEU  16   6.679  -2.512   1.297
  110    HB2  LEU  16           2HB      LEU  16   7.392  -3.154  -1.579
  111    HB3  LEU  16           3HB      LEU  16   5.880  -3.642  -0.820
  112    HG   LEU  16           HG       LEU  16   6.825  -0.812  -1.335
  113   HD11  LEU  16          1HD1      LEU  16   4.564  -2.442  -2.534
  114   HD12  LEU  16          2HD1      LEU  16   4.902  -0.727  -2.876
  115   HD13  LEU  16          3HD1      LEU  16   6.078  -1.960  -3.339
  116   HD21  LEU  16          3HD2      LEU  16   4.232  -1.786  -0.060
  117   HD22  LEU  16          1HD2      LEU  16   5.474  -0.771   0.713
  118   HD23  LEU  16          2HD2      LEU  16   4.519  -0.130  -0.624
  119    H    GLU  17           H        GLU  17   9.531  -4.326   0.182
  120    HA   GLU  17           HA       GLU  17   8.549  -6.930   0.682
  121    HB2  GLU  17           2HB      GLU  17  11.400  -5.952   1.075
  122    HB3  GLU  17           3HB      GLU  17  10.863  -7.632   0.997
  123    HG2  GLU  17           2HG      GLU  17   9.813  -6.889  -1.327
  124    HG3  GLU  17           3HG      GLU  17  11.017  -5.600  -1.215
  125    H    ASN  18           H        ASN  18   9.375  -4.507   3.077
  126    HA   ASN  18           HA       ASN  18   9.805  -6.272   5.313
  127    HB2  ASN  18           2HB      ASN  18   8.834  -3.381   5.180
  128    HB3  ASN  18           3HB      ASN  18   9.274  -4.221   6.662
  129   HD21  ASN  18          2HD2      ASN  18  10.509  -2.557   3.889
  130   HD22  ASN  18          1HD2      ASN  18  12.212  -2.709   4.331
  131    H    TYR  19           H        TYR  19   6.861  -5.362   3.659
  132    HA   TYR  19           HA       TYR  19   5.063  -6.098   5.863
  133    HB2  TYR  19           2HB      TYR  19   4.644  -5.443   2.944
  134    HB3  TYR  19           3HB      TYR  19   3.338  -5.854   4.036
  135    HD1  TYR  19           HD1      TYR  19   5.974  -3.294   3.355
  136    HD2  TYR  19           HD2      TYR  19   2.417  -4.298   5.579
  137    HE1  TYR  19           HE1      TYR  19   5.763  -0.926   4.078
  138    HE2  TYR  19           HE2      TYR  19   2.225  -1.937   6.326
  139    HH   TYR  19           HH       TYR  19   4.573   0.576   5.298
  140    H    CYS  20           H        CYS  20   6.772  -7.817   3.361
  141    HA   CYS  20           HA       CYS  20   4.694  -9.748   2.836
  142    HB2  CYS  20           2HB      CYS  20   7.608  -9.829   2.025
  143    HB3  CYS  20           3HB      CYS  20   6.271 -10.727   1.315
  144    H    ASN  21           H        ASN  21   7.181  -9.701   5.257
  145    HA   ASN  21           HA       ASN  21   7.471 -12.572   5.530
  146    HB2  ASN  21           2HB      ASN  21   9.211 -10.932   6.186
  147    HB3  ASN  21           3HB      ASN  21   8.145 -10.293   7.441
  148   HD21  ASN  21          2HD2      ASN  21  10.268 -10.907   8.638
  149   HD22  ASN  21          1HD2      ASN  21  10.288 -12.529   9.316
  150    H1   PHE   1           H        PHE   1   5.349   1.428  -7.870
  151    HA   PHE   1           HA       PHE   1   3.967   1.292  -9.804
  152    HB2  PHE   1           2HB      PHE   1   2.261   1.459  -7.291
  153    HB3  PHE   1           3HB      PHE   1   1.566   1.075  -8.856
  154    HD1  PHE   1           HD1      PHE   1   3.995  -0.124  -6.294
  155    HD2  PHE   1           HD2      PHE   1   1.818  -1.051  -9.892
  156    HE1  PHE   1           HE1      PHE   1   4.633  -2.515  -6.063
  157    HE2  PHE   1           HE2      PHE   1   2.462  -3.446  -9.666
  158    HZ   PHE   1           HZ       PHE   1   3.868  -4.181  -7.745
  159    H    VAL   2           H        VAL   2   3.528   4.219  -7.977
  160    HA   VAL   2           HA       VAL   2   2.490   5.665 -10.304
  161    HB   VAL   2           HB       VAL   2   0.471   4.666  -9.286
  162   HG11  VAL   2          1HG1      VAL   2   1.057   4.558  -6.951
  163   HG12  VAL   2          2HG1      VAL   2   1.128   6.329  -6.824
  164   HG13  VAL   2          3HG1      VAL   2  -0.414   5.515  -7.151
  165   HG21  VAL   2          3HG2      VAL   2  -0.901   6.653  -9.252
  166   HG22  VAL   2          1HG2      VAL   2   0.507   7.695  -8.991
  167   HG23  VAL   2          2HG2      VAL   2   0.325   6.801 -10.519
  168    H    ASN   3           H        ASN   3   2.671   7.950 -10.104
  169    HA   ASN   3           HA       ASN   3   4.966   8.686  -8.465
  170    HB2  ASN   3           2HB      ASN   3   3.460  10.154 -10.662
  171    HB3  ASN   3           3HB      ASN   3   4.929  10.743  -9.893
  172   HD21  ASN   3          2HD2      ASN   3   4.973  10.494 -12.583
  173   HD22  ASN   3          1HD2      ASN   3   5.994   9.130 -13.021
  174    H    GLN   4           H        GLN   4   2.920   8.283  -6.701
  175    HA   GLN   4           HA       GLN   4   2.774  10.889  -5.379
  176    HB2  GLN   4           2HB      GLN   4   0.403  10.896  -4.978
  177    HB3  GLN   4           3HB      GLN   4   0.690  10.891  -6.714
  178    HG2  GLN   4           2HG      GLN   4   0.124   8.492  -6.829
  179    HG3  GLN   4           3HG      GLN   4  -0.058   8.418  -5.078
  180   HE21  GLN   4          2HE2      GLN   4  -2.278   7.538  -5.702
  181   HE22  GLN   4          1HE2      GLN   4  -3.519   8.745  -5.989
  182    H    HIS   5           H        HIS   5   2.030  10.724  -3.123
  183    HA   HIS   5           HA       HIS   5   3.048   8.561  -1.597
  184    HB2  HIS   5           2HB      HIS   5   0.905  10.627  -0.951
  185    HB3  HIS   5           3HB      HIS   5   1.657   9.559   0.230
  186    HD2  HIS   5           HD2      HIS   5   4.027  10.231   1.163
  187    HE1  HIS   5           HE1      HIS   5   4.896  13.486  -1.440
  188    HE2  HIS   5           HE2      HIS   5   5.660  12.235   0.642
  189    H    LEU   6           H        LEU   6   2.271   6.646  -1.017
  190    HA   LEU   6           HA       LEU   6   0.506   5.674  -2.964
  191    HB2  LEU   6           2HB      LEU   6   2.780   4.805  -1.848
  192    HB3  LEU   6           3HB      LEU   6   1.668   3.876  -0.855
  193    HG   LEU   6           HG       LEU   6   0.716   2.908  -3.003
  194   HD11  LEU   6          1HD1      LEU   6   2.080   3.102  -5.060
  195   HD12  LEU   6          2HD1      LEU   6   1.379   4.659  -4.609
  196   HD13  LEU   6          3HD1      LEU   6   3.089   4.335  -4.273
  197   HD21  LEU   6          3HD2      LEU   6   2.489   1.752  -1.678
  198   HD22  LEU   6          1HD2      LEU   6   2.594   1.404  -3.409
  199   HD23  LEU   6          2HD2      LEU   6   3.721   2.558  -2.663
  200    H    CYS   7           H        CYS   7  -0.895   7.015  -0.588
  201    HA   CYS   7           HA       CYS   7  -2.790   4.909   0.261
  202    HB2  CYS   7           2HB      CYS   7  -2.403   7.813   0.967
  203    HB3  CYS   7           3HB      CYS   7  -3.962   7.040   1.219
  204    H    GLY   8           H        GLY   8  -5.188   5.452  -0.007
  205    HA2  GLY   8           HA2      GLY   8  -6.980   5.687  -1.525
  206    HA3  GLY   8           HA3      GLY   8  -5.892   6.318  -2.764
  207    H    SER   9           H        SER   9  -5.662   3.349  -0.829
  208    HA   SER   9           HA       SER   9  -5.406   1.182  -1.237
  209    HB2  SER   9           2HB      SER   9  -7.172   1.613  -3.652
  210    HB3  SER   9           3HB      SER   9  -6.815   0.067  -2.865
  211    HG   SER   9           HG       SER   9  -8.797   0.994  -2.137
  212    H    HIS  10           H        HIS  10  -3.794   3.222  -3.368
  213    HA   HIS  10           HA       HIS  10  -2.664   1.330  -5.183
  214    HB2  HIS  10           2HB      HIS  10  -1.523   3.895  -4.010
  215    HB3  HIS  10           3HB      HIS  10  -0.729   2.949  -5.266
  216    HD2  HIS  10           HD2      HIS  10  -2.497   2.441  -7.519
  217    HE1  HIS  10           HE1      HIS  10  -4.160   6.357  -7.243
  218    HE2  HIS  10           HE2      HIS  10  -3.882   4.320  -8.742
  219    H    LEU  11           H        LEU  11  -1.659   2.123  -1.833
  220    HA   LEU  11           HA       LEU  11   0.592   0.411  -1.729
  221    HB2  LEU  11           2HB      LEU  11   0.095   2.146  -0.082
  222    HB3  LEU  11           3HB      LEU  11  -1.376   1.312   0.412
  223    HG   LEU  11           HG       LEU  11  -0.032  -0.533   1.361
  224   HD11  LEU  11          1HD1      LEU  11   2.389   1.163   0.602
  225   HD12  LEU  11          2HD1      LEU  11   2.412  -0.291   1.617
  226   HD13  LEU  11          3HD1      LEU  11   1.974  -0.424  -0.087
  227   HD21  LEU  11          3HD2      LEU  11   0.932   0.737   3.239
  228   HD22  LEU  11          1HD2      LEU  11   0.861   2.233   2.282
  229   HD23  LEU  11          2HD2      LEU  11  -0.637   1.404   2.762
  230    H    VAL  12           H        VAL  12  -2.855  -0.370  -1.292
  231    HA   VAL  12           HA       VAL  12  -2.401  -3.095  -0.379
  232    HB   VAL  12           HB       VAL  12  -4.903  -1.915  -1.654
  233   HG11  VAL  12          1HG1      VAL  12  -4.485  -4.374   0.099
  234   HG12  VAL  12          2HG1      VAL  12  -6.058  -3.731  -0.423
  235   HG13  VAL  12          3HG1      VAL  12  -4.929  -4.365  -1.621
  236   HG21  VAL  12          3HG2      VAL  12  -4.108  -2.124   1.286
  237   HG22  VAL  12          1HG2      VAL  12  -4.311  -0.619   0.364
  238   HG23  VAL  12          2HG2      VAL  12  -5.710  -1.644   0.682
  239    H    GLU  13           H        GLU  13  -3.279  -1.652  -3.558
  240    HA   GLU  13           HA       GLU  13  -3.165  -4.083  -5.069
  241    HB2  GLU  13           2HB      GLU  13  -2.692  -1.176  -5.844
  242    HB3  GLU  13           3HB      GLU  13  -2.768  -2.490  -7.013
  243    HG2  GLU  13           2HG      GLU  13  -5.044  -1.779  -5.108
  244    HG3  GLU  13           3HG      GLU  13  -4.895  -1.179  -6.752
  245    H    ALA  14           H        ALA  14  -0.572  -1.748  -4.235
  246    HA   ALA  14           HA       ALA  14   1.506  -3.012  -5.725
  247    HB1  ALA  14           3HB      ALA  14   1.652  -0.718  -4.851
  248    HB2  ALA  14           1HB      ALA  14   1.624  -1.328  -3.181
  249    HB3  ALA  14           2HB      ALA  14   2.989  -1.707  -4.245
  250    H    LEU  15           H        LEU  15   0.624  -3.386  -2.219
  251    HA   LEU  15           HA       LEU  15   2.586  -5.397  -1.711
  252    HB2  LEU  15           2HB      LEU  15  -0.024  -4.635  -0.342
  253    HB3  LEU  15           3HB      LEU  15   1.031  -5.895   0.284
  254    HG   LEU  15           HG       LEU  15   1.936  -3.010  -0.142
  255   HD11  LEU  15          1HD1      LEU  15   0.202  -3.169   1.610
  256   HD12  LEU  15          2HD1      LEU  15   1.129  -4.451   2.421
  257   HD13  LEU  15          3HD1      LEU  15   1.790  -2.807   2.302
  258   HD21  LEU  15          3HD2      LEU  15   3.214  -5.397   1.225
  259   HD22  LEU  15          1HD2      LEU  15   3.824  -4.533  -0.195
  260   HD23  LEU  15          2HD2      LEU  15   3.800  -3.724   1.370
  261    H    TYR  16           H        TYR  16  -0.781  -5.765  -2.866
  262    HA   TYR  16           HA       TYR  16  -0.868  -8.617  -2.763
  263    HB2  TYR  16           2HB      TYR  16  -2.230  -6.574  -4.543
  264    HB3  TYR  16           3HB      TYR  16  -2.559  -8.295  -4.639
  265    HD1  TYR  16           HD2      TYR  16  -2.067  -7.964  -1.193
  266    HD2  TYR  16           HD1      TYR  16  -4.830  -6.779  -4.305
  267    HE1  TYR  16           HE2      TYR  16  -3.866  -7.906   0.441
  268    HE2  TYR  16           HE1      TYR  16  -6.663  -6.713  -2.621
  269    HH   TYR  16           HH       TYR  16  -6.111  -7.514   0.832
  270    H    LEU  17           H        LEU  17   0.951  -6.571  -4.942
  271    HA   LEU  17           HA       LEU  17   1.518  -8.870  -6.772
  272    HB2  LEU  17           2HB      LEU  17   1.983  -5.877  -7.023
  273    HB3  LEU  17           3HB      LEU  17   2.512  -7.064  -8.210
  274    HG   LEU  17           HG       LEU  17  -0.409  -6.621  -7.427
  275   HD11  LEU  17          1HD1      LEU  17   0.531  -4.653  -8.551
  276   HD12  LEU  17          2HD1      LEU  17   1.142  -5.678  -9.873
  277   HD13  LEU  17          3HD1      LEU  17  -0.609  -5.498  -9.606
  278   HD21  LEU  17          3HD2      LEU  17   0.855  -8.215  -9.698
  279   HD22  LEU  17          1HD2      LEU  17  -0.046  -8.878  -8.314
  280   HD23  LEU  17          2HD2      LEU  17  -0.882  -7.886  -9.509
  281    H    VAL  18           H        VAL  18   3.137  -6.590  -4.576
  282    HA   VAL  18           HA       VAL  18   5.819  -7.570  -5.147
  283    HB   VAL  18           HB       VAL  18   4.702  -5.766  -2.967
  284   HG11  VAL  18          1HG1      VAL  18   7.617  -6.392  -3.616
  285   HG12  VAL  18          2HG1      VAL  18   7.068  -5.022  -2.635
  286   HG13  VAL  18          3HG1      VAL  18   6.782  -6.668  -2.067
  287   HG21  VAL  18          3HG2      VAL  18   4.612  -4.897  -5.301
  288   HG22  VAL  18          1HG2      VAL  18   5.760  -4.001  -4.309
  289   HG23  VAL  18          2HG2      VAL  18   6.348  -5.207  -5.477
  290    H    CYS  19           H        CYS  19   3.472  -8.179  -2.516
  291    HA   CYS  19           HA       CYS  19   5.298 -10.186  -1.324
  292    HB2  CYS  19           2HB      CYS  19   2.514  -9.357  -0.464
  293    HB3  CYS  19           3HB      CYS  19   3.633 -10.400   0.407
  294    H    GLY  20           H        GLY  20   2.098 -10.153  -2.963
  295    HA2  GLY  20           HA2      GLY  20   0.943 -11.841  -4.051
  296    HA3  GLY  20           HA3      GLY  20   2.539 -12.444  -4.496
  297    H    GLU  21           H        GLU  21   2.954 -14.464  -3.886
  298    HA   GLU  21           HA       GLU  21   1.343 -15.804  -1.773
  299    HB2  GLU  21           2HB      GLU  21   1.407 -16.582  -4.169
  300    HB3  GLU  21           3HB      GLU  21   3.098 -17.027  -3.926
  301    HG2  GLU  21           2HG      GLU  21   2.442 -18.682  -2.232
  302    HG3  GLU  21           3HG      GLU  21   0.772 -18.105  -2.268
  303    H    ARG  22           H        ARG  22   4.449 -14.391  -1.984
  304    HA   ARG  22           HA       ARG  22   5.769 -16.522  -0.399
  305    HB2  ARG  22           2HB      ARG  22   7.880 -15.377  -0.808
  306    HB3  ARG  22           3HB      ARG  22   7.035 -15.907  -2.244
  307    HG2  ARG  22           2HG      ARG  22   8.101 -13.842  -2.701
  308    HG3  ARG  22           3HG      ARG  22   6.367 -13.589  -2.758
  309    HD2  ARG  22           2HD      ARG  22   6.432 -12.469  -0.572
  310    HD3  ARG  22           3HD      ARG  22   8.139 -12.879  -0.373
  311    HE   ARG  22           HE       ARG  22   6.999 -10.986  -2.422
  312   HH11  ARG  22          1HH1      ARG  22   9.885 -11.858  -0.526
  313   HH12  ARG  22          2HH1      ARG  22  10.676 -10.386  -1.104
  314   HH21  ARG  22          1HH2      ARG  22   8.151  -9.241  -2.970
  315   HH22  ARG  22          2HH2      ARG  22   9.822  -9.076  -2.368
  316    H    GLY  23           H        GLY  23   6.914 -16.244   1.470
  317    HA2  GLY  23           HA2      GLY  23   7.467 -15.442   3.543
  318    HA3  GLY  23           HA3      GLY  23   6.942 -13.846   3.015
  319    H    DHI  24           H        DHI  24   4.192 -15.467   2.585
  320    HA   DHI  24           HA       DHI  24   3.260 -15.841   5.325
  321    HB2  DHI  24           2HB      DHI  24   2.639 -17.257   3.302
  322    HB3  DHI  24           3HB      DHI  24   1.339 -16.753   4.367
  323    HD2  DHI  24           HD2      DHI  24   2.699 -14.384   1.575
  324    HE1  DHI  24           HE1      DHI  24  -1.280 -15.482   0.520
  325    HE2  DHI  24           HE2      DHI  24   0.703 -14.011  -0.096
  326    H    PHE  25           H        PHE  25   3.756 -12.992   3.818
  327    HA   PHE  25           HA       PHE  25   3.012 -10.879   4.089
  328    HB2  PHE  25           2HB      PHE  25   1.766 -11.796   2.173
  329    HB3  PHE  25           3HB      PHE  25   0.425 -12.203   3.230
  330    HD1  PHE  25           HD2      PHE  25   2.549  -9.083   2.814
  331    HD2  PHE  25           HD1      PHE  25  -1.403 -10.816   2.754
  332    HE1  PHE  25           HE2      PHE  25   1.575  -6.845   2.458
  333    HE2  PHE  25           HE1      PHE  25  -2.373  -8.566   2.387
  334    HZ   PHE  25           HZ       PHE  25  -0.891  -6.572   2.235
  335    H    TYR  26           H        TYR  26   0.043 -10.325   4.850
  336    HA   TYR  26           HA       TYR  26   0.216 -10.535   7.809
  337    HB2  TYR  26           2HB      TYR  26   1.418  -8.497   7.174
  338    HB3  TYR  26           3HB      TYR  26   0.066  -7.967   6.183
  339    HD1  TYR  26           HD1      TYR  26   1.001  -8.854   9.707
  340    HD2  TYR  26           HD2      TYR  26  -1.691  -6.655   7.142
  341    HE1  TYR  26           HE1      TYR  26   0.007  -7.738  11.696
  342    HE2  TYR  26           HE2      TYR  26  -2.657  -5.521   9.128
  343    HH   TYR  26           HH       TYR  26  -2.574  -5.260  11.409
  344    H    THR  27           H        THR  27  -1.738 -10.295   8.865
  345    HA   THR  27           HA       THR  27  -4.160  -9.553   7.348
  346    HB   THR  27           HB       THR  27  -5.483 -11.302   8.593
  347    HG1  THR  27           HG1      THR  27  -3.786 -11.908  10.039
  348   HG21  THR  27          1HG2      THR  27  -4.966 -11.500   6.173
  349   HG22  THR  27          2HG2      THR  27  -3.475 -12.382   6.572
  350   HG23  THR  27          3HG2      THR  27  -5.058 -13.074   6.983
  351    HA   PRO  28           HA       PRO  28  -4.376  -7.203  11.196
  352    HB2  PRO  28           2HB      PRO  28  -6.577  -5.667  10.688
  353    HB3  PRO  28           3HB      PRO  28  -4.994  -5.394   9.900
  354    HG2  PRO  28           2HG      PRO  28  -7.385  -6.907   8.807
  355    HG3  PRO  28           3HG      PRO  28  -6.388  -5.660   7.986
  356    HD2  PRO  28           2HD      PRO  28  -5.989  -8.338   7.625
  357    HD3  PRO  28           3HD      PRO  28  -4.632  -7.170   7.615
  358    H    LYS  29           H        LYS  29  -5.714  -7.029  13.051
  359    HA   LYS  29           HA       LYS  29  -8.030  -8.898  13.314
  360    HB2  LYS  29           2HB      LYS  29  -5.607  -8.769  15.163
  361    HB3  LYS  29           3HB      LYS  29  -7.115  -9.618  15.519
  362    HG2  LYS  29           2HG      LYS  29  -6.772 -11.074  13.522
  363    HG3  LYS  29           3HG      LYS  29  -5.251 -10.240  13.186
  364    HD2  LYS  29           2HD      LYS  29  -4.745 -12.309  14.274
  365    HD3  LYS  29           3HD      LYS  29  -4.353 -10.986  15.382
  366    HE2  LYS  29           2HE      LYS  29  -6.489 -11.369  16.596
  367    HE3  LYS  29           3HE      LYS  29  -6.914 -12.652  15.455
  368    HZ1  LYS  29           HZ1      LYS  29  -4.565 -12.703  17.277
  369    HZ2  LYS  29           HZ2      LYS  29  -5.940 -13.554  17.488
  370    HZ3  LYS  29           HZ3      LYS  29  -4.962 -13.892  16.227
  371    H    THR  30           H        THR  30  -9.410  -8.484  15.085
  372    HA   THR  30           HA       THR  30  -9.838  -5.653  15.676
  373    HB   THR  30           HB       THR  30 -11.837  -6.560  16.942
  374    HG1  THR  30           HG1      THR  30 -12.361  -8.708  16.518
  375   HG21  THR  30          1HG2      THR  30 -13.094  -7.074  14.900
  376   HG22  THR  30          2HG2      THR  30 -11.986  -5.723  14.616
  377   HG23  THR  30          3HG2      THR  30 -11.583  -7.341  14.001
  Start of MODEL   17
    1    H1   GLY   1           1H       GLY   1   5.367   0.371  14.027
    2    H2   GLY   1           2H       GLY   1   6.531  -0.587  14.671
    3    H3   GLY   1           3H       GLY   1   6.944   0.672  13.707
    4    HA2  GLY   1           HA2      GLY   1   7.166  -1.408  12.508
    5    HA3  GLY   1           HA3      GLY   1   5.452  -1.718  12.841
    6    H    ILE   2           H        ILE   2   5.224  -1.878  10.506
    7    HA   ILE   2           HA       ILE   2   5.550   0.520   8.858
    8    HB   ILE   2           HB       ILE   2   4.538  -0.857   7.069
    9   HG12  ILE   2          2HG1      ILE   2   4.436  -3.293   7.277
   10   HG13  ILE   2          3HG1      ILE   2   4.703  -3.203   8.999
   11   HG21  ILE   2          1HG2      ILE   2   6.515  -2.226   6.745
   12   HG22  ILE   2          2HG2      ILE   2   6.956  -0.653   7.417
   13   HG23  ILE   2          3HG2      ILE   2   6.936  -2.090   8.464
   14   HD11  ILE   2          3HD1      ILE   2   2.325  -3.624   8.283
   15   HD12  ILE   2          1HD1      ILE   2   2.521  -2.258   9.383
   16   HD13  ILE   2          2HD1      ILE   2   2.274  -1.970   7.642
   17    H    VAL   3           H        VAL   3   3.719   1.161   7.373
   18    HA   VAL   3           HA       VAL   3   1.073   1.294   8.719
   19    HB   VAL   3           HB       VAL   3   0.843   3.670   8.013
   20   HG11  VAL   3          1HG1      VAL   3   1.330   3.058  10.357
   21   HG12  VAL   3          2HG1      VAL   3   3.071   3.205  10.032
   22   HG13  VAL   3          3HG1      VAL   3   2.017   4.629   9.911
   23   HG21  VAL   3          3HG2      VAL   3   2.788   5.056   7.580
   24   HG22  VAL   3          1HG2      VAL   3   3.879   3.664   7.709
   25   HG23  VAL   3          2HG2      VAL   3   2.728   3.774   6.361
   26    H    GLU   4           H        GLU   4  -0.702   1.600   7.321
   27    HA   GLU   4           HA       GLU   4  -0.335   0.362   4.712
   28    HB2  GLU   4           2HB      GLU   4  -2.120  -0.132   6.470
   29    HB3  GLU   4           3HB      GLU   4  -2.915   1.357   5.964
   30    HG2  GLU   4           2HG      GLU   4  -3.062   0.379   3.622
   31    HG3  GLU   4           3HG      GLU   4  -2.314  -1.092   4.238
   32    H    GLN   5           H        GLN   5   1.022   2.696   4.518
   33    HA   GLN   5           HA       GLN   5  -0.756   4.611   3.060
   34    HB2  GLN   5           2HB      GLN   5   1.313   5.320   5.158
   35    HB3  GLN   5           3HB      GLN   5   0.441   6.470   4.140
   36    HG2  GLN   5           2HG      GLN   5  -1.720   5.655   5.095
   37    HG3  GLN   5           3HG      GLN   5  -0.826   4.567   6.162
   38   HE21  GLN   5          2HE2      GLN   5  -1.515   8.022   5.479
   39   HE22  GLN   5          1HE2      GLN   5  -0.931   8.575   7.040
   40    H    CYS   6           H        CYS   6   2.809   4.686   3.628
   41    HA   CYS   6           HA       CYS   6   4.339   5.745   2.350
   42    HB2  CYS   6           2HB      CYS   6   3.157   4.150   0.074
   43    HB3  CYS   6           3HB      CYS   6   4.654   5.060   0.025
   44    H    CYS   7           H        CYS   7   2.529   7.463   3.013
   45    HA   CYS   7           HA       CYS   7   2.342   9.253   0.631
   46    HB2  CYS   7           2HB      CYS   7   0.295   8.682   2.730
   47    HB3  CYS   7           3HB      CYS   7   0.418  10.328   2.112
   48    H    THR   8           H        THR   8   3.700   8.910   3.797
   49    HA   THR   8           HA       THR   8   4.385  11.703   4.172
   50    HB   THR   8           HB       THR   8   5.971   9.279   5.094
   51    HG1  THR   8           HG1      THR   8   4.653   9.344   6.927
   52   HG21  THR   8          1HG2      THR   8   5.579  12.062   6.292
   53   HG22  THR   8          2HG2      THR   8   6.490  10.731   7.045
   54   HG23  THR   8          3HG2      THR   8   7.068  11.448   5.537
   55    H    SER   9           H        SER   9   5.766   9.008   2.353
   56    HA   SER   9           HA       SER   9   7.284  10.798   0.616
   57    HB2  SER   9           2HB      SER   9   9.396   9.543   0.856
   58    HB3  SER   9           3HB      SER   9   8.946  10.364   2.355
   59    HG   SER   9           HG       SER   9   9.624   8.212   2.741
   60    H    ILE  10           H        ILE  10   8.181   9.568  -1.264
   61    HA   ILE  10           HA       ILE  10   6.324   7.452  -2.170
   62    HB   ILE  10           HB       ILE  10   8.621   8.831  -3.619
   63   HG12  ILE  10          2HG1      ILE  10   5.602   9.266  -3.650
   64   HG13  ILE  10          3HG1      ILE  10   6.841  10.393  -3.085
   65   HG21  ILE  10          1HG2      ILE  10   8.125   6.547  -4.513
   66   HG22  ILE  10          2HG2      ILE  10   6.420   7.011  -4.687
   67   HG23  ILE  10          3HG2      ILE  10   7.680   7.810  -5.650
   68   HD11  ILE  10          3HD1      ILE  10   6.061  11.170  -5.186
   69   HD12  ILE  10          1HD1      ILE  10   7.715  10.566  -5.420
   70   HD13  ILE  10          2HD1      ILE  10   6.313   9.603  -5.959
   71    H    CYS  11           H        CYS  11   6.722   5.525  -1.244
   72    HA   CYS  11           HA       CYS  11   9.387   4.811  -0.366
   73    HB2  CYS  11           2HB      CYS  11   8.365   3.009   0.779
   74    HB3  CYS  11           3HB      CYS  11   7.383   4.448   0.980
   75    H    SER  12           H        SER  12  10.600   3.001  -0.850
   76    HA   SER  12           HA       SER  12  10.640   2.179  -3.659
   77    HB2  SER  12           2HB      SER  12  12.716   2.642  -2.494
   78    HB3  SER  12           3HB      SER  12  12.359   1.404  -1.277
   79    HG   SER  12           HG       SER  12  13.798   0.768  -3.057
   80    H    LEU  13           H        LEU  13  10.587   0.002  -4.418
   81    HA   LEU  13           HA       LEU  13   8.527  -1.698  -3.320
   82    HB2  LEU  13           2HB      LEU  13  10.732  -2.352  -5.305
   83    HB3  LEU  13           3HB      LEU  13   9.284  -3.310  -5.008
   84    HG   LEU  13           HG       LEU  13   9.380  -0.523  -6.249
   85   HD11  LEU  13          1HD1      LEU  13   8.609  -3.232  -7.410
   86   HD12  LEU  13          2HD1      LEU  13   8.587  -1.672  -8.264
   87   HD13  LEU  13          3HD1      LEU  13  10.127  -2.359  -7.720
   88   HD21  LEU  13          3HD2      LEU  13   7.304  -0.711  -4.968
   89   HD22  LEU  13          1HD2      LEU  13   6.953  -0.843  -6.690
   90   HD23  LEU  13          2HD2      LEU  13   6.977  -2.308  -5.688
   91    H    TYR  14           H        TYR  14  12.021  -1.528  -2.747
   92    HA   TYR  14           HA       TYR  14  12.302  -4.038  -1.352
   93    HB2  TYR  14           2HB      TYR  14  14.241  -2.774  -2.084
   94    HB3  TYR  14           3HB      TYR  14  13.759  -1.376  -1.125
   95    HD1  TYR  14           HD2      TYR  14  14.965  -4.907  -0.904
   96    HD2  TYR  14           HD1      TYR  14  14.269  -1.213   1.222
   97    HE1  TYR  14           HE2      TYR  14  16.161  -5.821   1.080
   98    HE2  TYR  14           HE1      TYR  14  15.441  -2.140   3.213
   99    HH   TYR  14           HH       TYR  14  16.845  -5.443   3.234
  100    H    GLN  15           H        GLN  15  11.054  -0.859  -0.334
  101    HA   GLN  15           HA       GLN  15  10.934  -1.551   2.514
  102    HB2  GLN  15           2HB      GLN  15   9.443   0.624   0.985
  103    HB3  GLN  15           3HB      GLN  15   9.540   0.451   2.733
  104    HG2  GLN  15           2HG      GLN  15  11.994   0.763   2.664
  105    HG3  GLN  15           3HG      GLN  15  11.937   0.896   0.903
  106   HE21  GLN  15          2HE2      GLN  15  10.872   2.541   3.933
  107   HE22  GLN  15          1HE2      GLN  15  10.715   4.109   3.155
  108    H    LEU  16           H        LEU  16   8.752  -1.686  -0.287
  109    HA   LEU  16           HA       LEU  16   6.462  -2.655   1.146
  110    HB2  LEU  16           2HB      LEU  16   7.232  -3.015  -1.756
  111    HB3  LEU  16           3HB      LEU  16   5.682  -3.464  -1.056
  112    HG   LEU  16           HG       LEU  16   6.855  -0.716  -1.448
  113   HD11  LEU  16          1HD1      LEU  16   5.761  -1.762  -3.375
  114   HD12  LEU  16          2HD1      LEU  16   4.290  -2.025  -2.409
  115   HD13  LEU  16          3HD1      LEU  16   4.830  -0.373  -2.799
  116   HD21  LEU  16          3HD2      LEU  16   5.729  -0.574   0.723
  117   HD22  LEU  16          1HD2      LEU  16   4.693   0.176  -0.489
  118   HD23  LEU  16          2HD2      LEU  16   4.320  -1.460   0.090
  119    H    GLU  17           H        GLU  17   9.170  -4.477  -0.408
  120    HA   GLU  17           HA       GLU  17   8.218  -7.092   0.248
  121    HB2  GLU  17           2HB      GLU  17  11.044  -5.994  -0.048
  122    HB3  GLU  17           3HB      GLU  17  10.693  -7.696   0.244
  123    HG2  GLU  17           2HG      GLU  17   9.307  -7.774  -1.815
  124    HG3  GLU  17           3HG      GLU  17   9.750  -6.104  -2.163
  125    H    ASN  18           H        ASN  18   9.427  -4.652   2.436
  126    HA   ASN  18           HA       ASN  18  10.040  -6.592   4.564
  127    HB2  ASN  18           2HB      ASN  18  10.227  -3.585   4.316
  128    HB3  ASN  18           3HB      ASN  18  10.251  -4.352   5.892
  129   HD21  ASN  18          2HD2      ASN  18  12.020  -4.283   2.736
  130   HD22  ASN  18          1HD2      ASN  18  13.507  -4.848   3.475
  131    H    TYR  19           H        TYR  19   7.079  -5.392   3.392
  132    HA   TYR  19           HA       TYR  19   5.658  -5.365   5.961
  133    HB2  TYR  19           2HB      TYR  19   4.733  -5.543   3.081
  134    HB3  TYR  19           3HB      TYR  19   3.632  -5.662   4.436
  135    HD1  TYR  19           HD1      TYR  19   6.329  -3.359   3.176
  136    HD2  TYR  19           HD2      TYR  19   2.580  -3.757   5.240
  137    HE1  TYR  19           HE1      TYR  19   6.144  -0.887   3.288
  138    HE2  TYR  19           HE2      TYR  19   2.388  -1.290   5.361
  139    HH   TYR  19           HH       TYR  19   3.317   0.731   4.782
  140    H    CYS  20           H        CYS  20   6.308  -7.793   3.407
  141    HA   CYS  20           HA       CYS  20   4.917  -9.893   4.935
  142    HB2  CYS  20           2HB      CYS  20   5.574 -11.322   3.057
  143    HB3  CYS  20           3HB      CYS  20   4.388 -10.059   2.775
  144    H    ASN  21           H        ASN  21   6.133  -9.728   6.661
  145    HA   ASN  21           HA       ASN  21   8.981 -10.345   6.822
  146    HB2  ASN  21           2HB      ASN  21   7.814  -8.832   8.407
  147    HB3  ASN  21           3HB      ASN  21   6.853 -10.189   9.002
  148   HD21  ASN  21          2HD2      ASN  21   7.989  -9.112  11.017
  149   HD22  ASN  21          1HD2      ASN  21   9.494  -9.893  11.481
  150    H1   PHE   1           H        PHE   1   0.778   2.728  -8.558
  151    HA   PHE   1           HA       PHE   1   2.449   1.546  -6.677
  152    HB2  PHE   1           2HB      PHE   1   0.955   0.473  -8.379
  153    HB3  PHE   1           3HB      PHE   1   2.155   0.823  -9.613
  154    HD1  PHE   1           HD1      PHE   1   3.620  -0.335  -6.425
  155    HD2  PHE   1           HD2      PHE   1   1.766  -1.607 -10.110
  156    HE1  PHE   1           HE1      PHE   1   4.527  -2.593  -6.102
  157    HE2  PHE   1           HE2      PHE   1   2.655  -3.889  -9.756
  158    HZ   PHE   1           HZ       PHE   1   4.062  -4.390  -7.762
  159    H    VAL   2           H        VAL   2   3.420   3.579  -9.330
  160    HA   VAL   2           HA       VAL   2   6.226   3.481  -8.435
  161    HB   VAL   2           HB       VAL   2   6.142   1.814 -10.216
  162   HG11  VAL   2          1HG1      VAL   2   5.764   2.377 -12.548
  163   HG12  VAL   2          2HG1      VAL   2   4.302   2.710 -11.611
  164   HG13  VAL   2          3HG1      VAL   2   5.351   4.049 -12.126
  165   HG21  VAL   2          3HG2      VAL   2   7.662   4.284 -11.124
  166   HG22  VAL   2          1HG2      VAL   2   8.192   3.157  -9.852
  167   HG23  VAL   2          2HG2      VAL   2   8.013   2.593 -11.519
  168    H    ASN   3           H        ASN   3   7.287   5.387  -8.601
  169    HA   ASN   3           HA       ASN   3   7.479   7.624  -8.450
  170    HB2  ASN   3           2HB      ASN   3   6.288   7.468 -11.239
  171    HB3  ASN   3           3HB      ASN   3   7.121   8.871 -10.581
  172   HD21  ASN   3          2HD2      ASN   3   8.030   7.747 -12.917
  173   HD22  ASN   3          1HD2      ASN   3   9.583   6.988 -12.595
  174    H    GLN   4           H        GLN   4   4.984   6.609  -7.277
  175    HA   GLN   4           HA       GLN   4   3.729   9.234  -6.847
  176    HB2  GLN   4           2HB      GLN   4   1.462   8.412  -7.063
  177    HB3  GLN   4           3HB      GLN   4   2.301   8.272  -8.601
  178    HG2  GLN   4           2HG      GLN   4   2.446   5.893  -8.441
  179    HG3  GLN   4           3HG      GLN   4   2.085   5.885  -6.721
  180   HE21  GLN   4          2HE2      GLN   4  -0.147   6.568  -6.023
  181   HE22  GLN   4          1HE2      GLN   4  -1.455   6.141  -7.127
  182    H    HIS   5           H        HIS   5   2.548   9.419  -4.915
  183    HA   HIS   5           HA       HIS   5   3.189   7.667  -2.678
  184    HB2  HIS   5           2HB      HIS   5   1.074   9.839  -2.943
  185    HB3  HIS   5           3HB      HIS   5   1.702   9.140  -1.455
  186    HD2  HIS   5           HD2      HIS   5   4.134   9.956  -0.606
  187    HE1  HIS   5           HE1      HIS   5   4.819  12.911  -3.591
  188    HE2  HIS   5           HE2      HIS   5   5.600  12.018  -1.344
  189    H    LEU   6           H        LEU   6   1.631   6.386  -1.483
  190    HA   LEU   6           HA       LEU   6  -0.197   5.015  -3.418
  191    HB2  LEU   6           2HB      LEU   6   1.504   3.792  -1.240
  192    HB3  LEU   6           3HB      LEU   6   0.543   2.937  -2.428
  193    HG   LEU   6           HG       LEU   6   2.992   4.594  -3.088
  194   HD11  LEU   6          1HD1      LEU   6   3.522   2.526  -1.854
  195   HD12  LEU   6          2HD1      LEU   6   2.560   1.577  -3.007
  196   HD13  LEU   6          3HD1      LEU   6   4.035   2.412  -3.542
  197   HD21  LEU   6          3HD2      LEU   6   1.322   2.726  -4.833
  198   HD22  LEU   6          1HD2      LEU   6   1.345   4.499  -4.960
  199   HD23  LEU   6          2HD2      LEU   6   2.810   3.582  -5.310
  200    H    CYS   7           H        CYS   7  -0.591   6.661  -0.491
  201    HA   CYS   7           HA       CYS   7  -1.986   4.741   1.002
  202    HB2  CYS   7           2HB      CYS   7  -2.911   6.591   2.336
  203    HB3  CYS   7           3HB      CYS   7  -1.168   6.634   2.131
  204    H    GLY   8           H        GLY   8  -4.034   4.146   1.371
  205    HA2  GLY   8           HA2      GLY   8  -6.329   3.771   0.766
  206    HA3  GLY   8           HA3      GLY   8  -6.126   4.790  -0.656
  207    H    SER   9           H        SER   9  -6.770   3.262  -2.173
  208    HA   SER   9           HA       SER   9  -6.269   0.521  -2.068
  209    HB2  SER   9           2HB      SER   9  -6.823   2.182  -4.555
  210    HB3  SER   9           3HB      SER   9  -7.120   0.444  -4.350
  211    HG   SER   9           HG       SER   9  -9.021   1.695  -4.003
  212    H    HIS  10           H        HIS  10  -4.183   2.971  -3.624
  213    HA   HIS  10           HA       HIS  10  -2.802   1.208  -5.372
  214    HB2  HIS  10           2HB      HIS  10  -1.901   3.817  -4.103
  215    HB3  HIS  10           3HB      HIS  10  -1.065   3.001  -5.420
  216    HD2  HIS  10           HD2      HIS  10  -2.046   3.266  -7.865
  217    HE1  HIS  10           HE1      HIS  10  -5.328   5.824  -6.921
  218    HE2  HIS  10           HE2      HIS  10  -3.960   4.810  -8.816
  219    H    LEU  11           H        LEU  11  -2.051   2.008  -1.962
  220    HA   LEU  11           HA       LEU  11   0.419   0.558  -1.859
  221    HB2  LEU  11           2HB      LEU  11  -0.292   2.332  -0.299
  222    HB3  LEU  11           3HB      LEU  11  -1.573   1.326   0.327
  223    HG   LEU  11           HG       LEU  11   0.529   1.676   1.703
  224   HD11  LEU  11          1HD1      LEU  11  -1.106  -0.038   2.258
  225   HD12  LEU  11          2HD1      LEU  11  -0.274  -1.199   1.218
  226   HD13  LEU  11          3HD1      LEU  11   0.548  -0.555   2.648
  227   HD21  LEU  11          3HD2      LEU  11   2.472   0.310   1.342
  228   HD22  LEU  11          1HD2      LEU  11   1.776  -0.402  -0.123
  229   HD23  LEU  11          2HD2      LEU  11   2.199   1.326  -0.081
  230    H    VAL  12           H        VAL  12  -2.947  -0.419  -1.253
  231    HA   VAL  12           HA       VAL  12  -2.324  -3.107  -0.376
  232    HB   VAL  12           HB       VAL  12  -4.911  -2.006  -1.554
  233   HG11  VAL  12          1HG1      VAL  12  -4.883  -4.458  -1.598
  234   HG12  VAL  12          2HG1      VAL  12  -4.364  -4.510   0.100
  235   HG13  VAL  12          3HG1      VAL  12  -5.974  -3.893  -0.333
  236   HG21  VAL  12          3HG2      VAL  12  -3.999  -2.282   1.346
  237   HG22  VAL  12          1HG2      VAL  12  -4.281  -0.758   0.476
  238   HG23  VAL  12          2HG2      VAL  12  -5.635  -1.831   0.820
  239    H    GLU  13           H        GLU  13  -3.291  -1.754  -3.585
  240    HA   GLU  13           HA       GLU  13  -3.067  -4.212  -5.047
  241    HB2  GLU  13           2HB      GLU  13  -2.676  -1.302  -5.860
  242    HB3  GLU  13           3HB      GLU  13  -2.593  -2.627  -7.010
  243    HG2  GLU  13           2HG      GLU  13  -5.040  -2.081  -5.266
  244    HG3  GLU  13           3HG      GLU  13  -4.816  -1.422  -6.880
  245    H    ALA  14           H        ALA  14  -0.555  -1.710  -4.300
  246    HA   ALA  14           HA       ALA  14   1.547  -2.959  -5.726
  247    HB1  ALA  14           3HB      ALA  14   1.598  -0.641  -4.862
  248    HB2  ALA  14           1HB      ALA  14   1.654  -1.255  -3.193
  249    HB3  ALA  14           2HB      ALA  14   2.994  -1.574  -4.309
  250    H    LEU  15           H        LEU  15   0.605  -3.367  -2.245
  251    HA   LEU  15           HA       LEU  15   2.622  -5.369  -1.801
  252    HB2  LEU  15           2HB      LEU  15   0.162  -4.494  -0.247
  253    HB3  LEU  15           3HB      LEU  15   1.191  -5.808   0.319
  254    HG   LEU  15           HG       LEU  15   2.244  -3.006  -0.292
  255   HD11  LEU  15          1HD1      LEU  15   1.762  -4.263   2.425
  256   HD12  LEU  15          2HD1      LEU  15   2.225  -2.590   2.056
  257   HD13  LEU  15          3HD1      LEU  15   0.599  -3.175   1.640
  258   HD21  LEU  15          3HD2      LEU  15   4.011  -4.744  -0.365
  259   HD22  LEU  15          1HD2      LEU  15   4.160  -3.784   1.111
  260   HD23  LEU  15          2HD2      LEU  15   3.438  -5.403   1.171
  261    H    TYR  16           H        TYR  16  -0.753  -5.717  -2.907
  262    HA   TYR  16           HA       TYR  16  -0.753  -8.589  -2.794
  263    HB2  TYR  16           2HB      TYR  16  -2.279  -6.594  -4.481
  264    HB3  TYR  16           3HB      TYR  16  -2.529  -8.327  -4.591
  265    HD1  TYR  16           HD1      TYR  16  -1.935  -8.143  -1.179
  266    HD2  TYR  16           HD2      TYR  16  -4.819  -6.821  -4.123
  267    HE1  TYR  16           HE1      TYR  16  -3.668  -8.182   0.523
  268    HE2  TYR  16           HE2      TYR  16  -6.591  -6.865  -2.368
  269    HH   TYR  16           HH       TYR  16  -5.896  -7.823   1.017
  270    H    LEU  17           H        LEU  17   1.116  -6.550  -4.833
  271    HA   LEU  17           HA       LEU  17   1.674  -8.834  -6.696
  272    HB2  LEU  17           2HB      LEU  17   2.021  -5.833  -7.017
  273    HB3  LEU  17           3HB      LEU  17   2.580  -7.028  -8.186
  274    HG   LEU  17           HG       LEU  17  -0.345  -6.674  -7.362
  275   HD11  LEU  17          1HD1      LEU  17   1.103  -5.767  -9.880
  276   HD12  LEU  17          2HD1      LEU  17  -0.641  -5.632  -9.558
  277   HD13  LEU  17          3HD1      LEU  17   0.505  -4.714  -8.572
  278   HD21  LEU  17          3HD2      LEU  17   0.076  -8.944  -8.183
  279   HD22  LEU  17          1HD2      LEU  17  -0.805  -8.021  -9.399
  280   HD23  LEU  17          2HD2      LEU  17   0.939  -8.300  -9.600
  281    H    VAL  18           H        VAL  18   3.246  -6.505  -4.515
  282    HA   VAL  18           HA       VAL  18   5.931  -7.562  -5.003
  283    HB   VAL  18           HB       VAL  18   4.827  -5.637  -2.922
  284   HG11  VAL  18          1HG1      VAL  18   6.867  -6.551  -1.980
  285   HG12  VAL  18          2HG1      VAL  18   7.709  -6.394  -3.543
  286   HG13  VAL  18          3HG1      VAL  18   7.233  -4.954  -2.632
  287   HG21  VAL  18          3HG2      VAL  18   4.775  -4.837  -5.291
  288   HG22  VAL  18          1HG2      VAL  18   5.905  -3.927  -4.288
  289   HG23  VAL  18          2HG2      VAL  18   6.515  -5.156  -5.421
  290    H    CYS  19           H        CYS  19   3.492  -7.945  -2.444
  291    HA   CYS  19           HA       CYS  19   5.101 -10.115  -1.166
  292    HB2  CYS  19           2HB      CYS  19   3.091  -8.108  -0.120
  293    HB3  CYS  19           3HB      CYS  19   3.453  -9.582   0.750
  294    H    GLY  20           H        GLY  20   2.419  -9.709  -3.192
  295    HA2  GLY  20           HA2      GLY  20   1.196 -11.458  -4.165
  296    HA3  GLY  20           HA3      GLY  20   1.613 -12.534  -2.843
  297    H    GLU  21           H        GLU  21  -0.954 -12.164  -4.041
  298    HA   GLU  21           HA       GLU  21  -2.622 -10.452  -2.438
  299    HB2  GLU  21           2HB      GLU  21  -4.429 -11.249  -3.811
  300    HB3  GLU  21           3HB      GLU  21  -3.021 -10.900  -4.810
  301    HG2  GLU  21           2HG      GLU  21  -2.480 -13.333  -4.901
  302    HG3  GLU  21           3HG      GLU  21  -3.888 -13.684  -3.899
  303    H    ARG  22           H        ARG  22  -1.393 -13.414  -1.568
  304    HA   ARG  22           HA       ARG  22  -3.701 -14.501  -0.105
  305    HB2  ARG  22           2HB      ARG  22  -0.760 -15.298  -0.126
  306    HB3  ARG  22           3HB      ARG  22  -2.053 -16.168   0.712
  307    HG2  ARG  22           2HG      ARG  22  -3.216 -16.538  -1.458
  308    HG3  ARG  22           3HG      ARG  22  -1.884 -15.730  -2.303
  309    HD2  ARG  22           2HD      ARG  22  -0.295 -17.411  -1.422
  310    HD3  ARG  22           3HD      ARG  22  -1.608 -18.240  -0.589
  311    HE   ARG  22           HE       ARG  22  -0.997 -18.254  -3.472
  312   HH11  ARG  22          2HH1      ARG  22  -3.453 -19.103  -1.114
  313   HH12  ARG  22          1HH1      ARG  22  -4.243 -20.206  -2.208
  314   HH21  ARG  22          1HH2      ARG  22  -2.054 -19.669  -4.804
  315   HH22  ARG  22          2HH2      ARG  22  -3.467 -20.513  -4.239
  316    H    GLY  23           H        GLY  23  -3.818 -12.163   0.743
  317    HA2  GLY  23           HA2      GLY  23  -3.900 -10.799   2.629
  318    HA3  GLY  23           HA3      GLY  23  -2.989 -12.000   3.550
  319    H    DHI  24           H        DHI  24  -0.631 -12.257   2.660
  320    HA   DHI  24           HA       DHI  24   0.663 -10.324   1.147
  321    HB2  DHI  24           2HB      DHI  24   1.533 -12.542   1.542
  322    HB3  DHI  24           3HB      DHI  24   2.743 -11.327   1.909
  323    HD2  DHI  24           HD2      DHI  24   0.640 -14.042   3.496
  324    HE1  DHI  24           HE1      DHI  24   3.164 -12.578   6.615
  325    HE2  DHI  24           HE2      DHI  24   1.510 -14.408   5.975
  326    H    PHE  25           H        PHE  25   0.191 -10.240   4.630
  327    HA   PHE  25           HA       PHE  25   1.525  -7.613   4.869
  328    HB2  PHE  25           2HB      PHE  25  -0.853  -7.436   3.883
  329    HB3  PHE  25           3HB      PHE  25  -1.438  -7.840   5.473
  330    HD1  PHE  25           HD2      PHE  25  -0.861  -6.253   7.441
  331    HD2  PHE  25           HD1      PHE  25  -0.099  -5.300   3.307
  332    HE1  PHE  25           HE2      PHE  25  -0.650  -3.847   8.029
  333    HE2  PHE  25           HE1      PHE  25   0.132  -2.910   3.892
  334    HZ   PHE  25           HZ       PHE  25  -0.161  -2.166   6.260
  335    H    TYR  26           H        TYR  26   0.532  -9.665   8.274
  336    HA   TYR  26           HA       TYR  26  -0.912 -10.512   5.839
  337    HB2  TYR  26           2HB      TYR  26   0.045 -12.182   7.365
  338    HB3  TYR  26           3HB      TYR  26  -0.940 -11.550   8.679
  339    HD1  TYR  26           HD1      TYR  26  -1.112 -13.142   5.294
  340    HD2  TYR  26           HD2      TYR  26  -3.240 -12.277   8.955
  341    HE1  TYR  26           HE1      TYR  26  -2.976 -14.625   4.569
  342    HE2  TYR  26           HE2      TYR  26  -5.073 -13.782   8.240
  343    HH   TYR  26           HH       TYR  26  -5.845 -15.229   6.631
  344    H    THR  27           H        THR  27  -3.118 -10.518   5.634
  345    HA   THR  27           HA       THR  27  -4.820  -9.453   7.718
  346    HB   THR  27           HB       THR  27  -4.312  -7.392   6.580
  347    HG1  THR  27           HG1      THR  27  -6.438  -6.806   6.202
  348   HG21  THR  27          1HG2      THR  27  -3.834  -8.236   4.273
  349   HG22  THR  27          2HG2      THR  27  -5.574  -8.532   4.054
  350   HG23  THR  27          3HG2      THR  27  -4.972  -6.884   4.313
  351    HA   PRO  28           HA       PRO  28  -6.904 -12.936   5.886
  352    HB2  PRO  28           2HB      PRO  28  -9.116 -13.134   7.481
  353    HB3  PRO  28           3HB      PRO  28  -7.461 -13.510   8.045
  354    HG2  PRO  28           2HG      PRO  28  -9.024 -10.945   8.433
  355    HG3  PRO  28           3HG      PRO  28  -8.067 -11.868   9.643
  356    HD2  PRO  28           2HD      PRO  28  -7.083  -9.676   8.321
  357    HD3  PRO  28           3HD      PRO  28  -6.049 -11.047   8.826
  358    H    LYS  29           H        LYS  29  -8.679 -13.546   4.604
  359    HA   LYS  29           HA       LYS  29  -9.888 -11.446   3.007
  360    HB2  LYS  29           2HB      LYS  29  -9.123 -13.787   2.255
  361    HB3  LYS  29           3HB      LYS  29 -10.602 -14.398   3.005
  362    HG2  LYS  29           2HG      LYS  29 -11.896 -12.798   1.463
  363    HG3  LYS  29           3HG      LYS  29 -10.356 -12.386   0.721
  364    HD2  LYS  29           2HD      LYS  29 -11.429 -14.013  -0.679
  365    HD3  LYS  29           3HD      LYS  29 -10.052 -14.791   0.096
  366    HE2  LYS  29           2HE      LYS  29 -11.875 -16.343   0.119
  367    HE3  LYS  29           3HE      LYS  29 -11.614 -15.817   1.781
  368    HZ1  LYS  29           HZ1      LYS  29 -13.727 -14.742  -0.018
  369    HZ2  LYS  29           HZ2      LYS  29 -13.978 -15.840   1.160
  370    HZ3  LYS  29           HZ3      LYS  29 -13.540 -14.324   1.557
  371    H    THR  30           H        THR  30 -12.053 -10.898   2.782
  372    HA   THR  30           HA       THR  30 -13.867 -11.024   5.044
  373    HB   THR  30           HB       THR  30 -15.516 -10.100   3.348
  374    HG1  THR  30           HG1      THR  30 -14.429 -10.953   1.508
  375   HG21  THR  30          1HG2      THR  30 -12.868  -8.611   3.654
  376   HG22  THR  30          2HG2      THR  30 -14.443  -7.896   3.245
  377   HG23  THR  30          3HG2      THR  30 -14.195  -8.634   4.836
  Start of MODEL   18
    1    H1   GLY   1           1H       GLY   1  -3.787   1.653   5.847
    2    H2   GLY   1           2H       GLY   1  -3.587   1.021   7.342
    3    H3   GLY   1           3H       GLY   1  -3.026   2.528   7.006
    4    HA2  GLY   1           HA2      GLY   1  -2.014   0.004   5.846
    5    HA3  GLY   1           HA3      GLY   1  -1.432   1.623   5.418
    6    H    ILE   2           H        ILE   2  -1.844  -0.592   8.177
    7    HA   ILE   2           HA       ILE   2  -0.982  -0.623  10.273
    8    HB   ILE   2           HB       ILE   2   1.319  -1.225  10.409
    9   HG12  ILE   2          2HG1      ILE   2   1.725  -0.535   7.473
   10   HG13  ILE   2          3HG1      ILE   2   2.225   0.539   8.777
   11   HG21  ILE   2          1HG2      ILE   2   0.114  -2.324   7.852
   12   HG22  ILE   2          2HG2      ILE   2   1.236  -3.137   8.961
   13   HG23  ILE   2          3HG2      ILE   2  -0.403  -2.762   9.506
   14   HD11  ILE   2          3HD1      ILE   2   3.261  -2.281   8.310
   15   HD12  ILE   2          1HD1      ILE   2   4.137  -0.754   8.109
   16   HD13  ILE   2          2HD1      ILE   2   3.653  -1.279   9.729
   17    H    VAL   3           H        VAL   3   1.704   0.534  11.102
   18    HA   VAL   3           HA       VAL   3   0.570   2.972  12.186
   19    HB   VAL   3           HB       VAL   3   2.691   3.173  13.438
   20   HG11  VAL   3          1HG1      VAL   3   1.431   0.403  13.597
   21   HG12  VAL   3          2HG1      VAL   3   2.334   1.240  14.875
   22   HG13  VAL   3          3HG1      VAL   3   0.780   1.887  14.327
   23   HG21  VAL   3          3HG2      VAL   3   4.335   1.366  13.429
   24   HG22  VAL   3          1HG2      VAL   3   3.488   0.537  12.112
   25   HG23  VAL   3          2HG2      VAL   3   4.265   2.113  11.832
   26    H    GLU   4           H        GLU   4   2.731   2.291   9.541
   27    HA   GLU   4           HA       GLU   4   2.855   5.141   8.787
   28    HB2  GLU   4           2HB      GLU   4   5.335   3.383   9.080
   29    HB3  GLU   4           3HB      GLU   4   5.279   4.919   8.211
   30    HG2  GLU   4           2HG      GLU   4   4.600   6.069  10.327
   31    HG3  GLU   4           3HG      GLU   4   4.800   4.541  11.194
   32    H    GLN   5           H        GLN   5   3.071   5.434   6.535
   33    HA   GLN   5           HA       GLN   5   2.905   3.008   4.819
   34    HB2  GLN   5           2HB      GLN   5   0.859   3.616   3.882
   35    HB3  GLN   5           3HB      GLN   5   0.625   3.713   5.616
   36    HG2  GLN   5           2HG      GLN   5   1.000   6.061   3.705
   37    HG3  GLN   5           3HG      GLN   5  -0.512   5.521   4.401
   38   HE21  GLN   5          2HE2      GLN   5   2.598   7.146   5.180
   39   HE22  GLN   5          1HE2      GLN   5   1.955   7.907   6.629
   40    H    CYS   6           H        CYS   6   3.088   3.345   2.559
   41    HA   CYS   6           HA       CYS   6   5.054   5.276   1.729
   42    HB2  CYS   6           2HB      CYS   6   3.411   3.247   0.191
   43    HB3  CYS   6           3HB      CYS   6   4.772   4.161  -0.466
   44    H    CYS   7           H        CYS   7   3.626   7.054   2.516
   45    HA   CYS   7           HA       CYS   7   2.320   8.398   0.192
   46    HB2  CYS   7           2HB      CYS   7   0.614   7.446   1.757
   47    HB3  CYS   7           3HB      CYS   7   1.299   8.421   3.058
   48    H    THR   8           H        THR   8   3.908   8.766   3.405
   49    HA   THR   8           HA       THR   8   4.512  11.547   3.176
   50    HB   THR   8           HB       THR   8   6.195   9.517   4.676
   51    HG1  THR   8           HG1      THR   8   4.673   9.703   6.348
   52   HG21  THR   8          1HG2      THR   8   6.920  11.880   4.832
   53   HG22  THR   8          2HG2      THR   8   5.285  12.356   5.346
   54   HG23  THR   8          3HG2      THR   8   6.288  11.315   6.382
   55    H    SER   9           H        SER   9   6.068   8.682   1.878
   56    HA   SER   9           HA       SER   9   7.790  10.293   0.147
   57    HB2  SER   9           2HB      SER   9   9.128   9.837   2.260
   58    HB3  SER   9           3HB      SER   9   9.052   8.111   1.849
   59    HG   SER   9           HG       SER   9  10.954   9.198   1.048
   60    H    ILE  10           H        ILE  10   9.005   8.743  -1.358
   61    HA   ILE  10           HA       ILE  10   7.049   6.799  -2.478
   62    HB   ILE  10           HB       ILE  10   9.539   8.012  -3.737
   63   HG12  ILE  10          2HG1      ILE  10   6.580   8.707  -4.017
   64   HG13  ILE  10          3HG1      ILE  10   7.848   9.718  -3.320
   65   HG21  ILE  10          1HG2      ILE  10   8.660   7.082  -5.843
   66   HG22  ILE  10          2HG2      ILE  10   8.941   5.790  -4.691
   67   HG23  ILE  10          3HG2      ILE  10   7.285   6.370  -4.973
   68   HD11  ILE  10          3HD1      ILE  10   8.958   9.847  -5.546
   69   HD12  ILE  10          1HD1      ILE  10   7.548   9.007  -6.245
   70   HD13  ILE  10          2HD1      ILE  10   7.341  10.578  -5.469
   71    H    CYS  11           H        CYS  11   7.408   4.645  -2.473
   72    HA   CYS  11           HA       CYS  11   9.677   3.704  -0.830
   73    HB2  CYS  11           2HB      CYS  11   6.972   2.583  -1.544
   74    HB3  CYS  11           3HB      CYS  11   8.201   1.620  -0.731
   75    H    SER  12           H        SER  12  11.204   2.338  -1.409
   76    HA   SER  12           HA       SER  12  11.485   1.279  -4.138
   77    HB2  SER  12           2HB      SER  12  13.437   1.995  -2.805
   78    HB3  SER  12           3HB      SER  12  13.081   0.736  -1.605
   79    HG   SER  12           HG       SER  12  14.668   0.137  -3.227
   80    H    LEU  13           H        LEU  13  11.711  -1.062  -4.540
   81    HA   LEU  13           HA       LEU  13   9.377  -2.487  -3.706
   82    HB2  LEU  13           2HB      LEU  13  11.904  -3.582  -5.017
   83    HB3  LEU  13           3HB      LEU  13  10.360  -4.397  -4.889
   84    HG   LEU  13           HG       LEU  13  10.426  -3.708  -7.074
   85   HD11  LEU  13          1HD1      LEU  13   8.282  -3.098  -5.986
   86   HD12  LEU  13          2HD1      LEU  13   8.878  -1.432  -5.779
   87   HD13  LEU  13          3HD1      LEU  13   8.661  -2.103  -7.407
   88   HD21  LEU  13          3HD2      LEU  13  12.347  -2.123  -6.875
   89   HD22  LEU  13          1HD2      LEU  13  11.062  -1.607  -7.974
   90   HD23  LEU  13          2HD2      LEU  13  11.196  -0.856  -6.378
   91    H    TYR  14           H        TYR  14  12.726  -2.633  -2.507
   92    HA   TYR  14           HA       TYR  14  12.473  -4.871  -0.755
   93    HB2  TYR  14           2HB      TYR  14  14.619  -3.881  -1.295
   94    HB3  TYR  14           3HB      TYR  14  14.138  -2.327  -0.624
   95    HD1  TYR  14           HD2      TYR  14  15.009  -5.849   0.247
   96    HD2  TYR  14           HD1      TYR  14  14.268  -1.865   1.738
   97    HE1  TYR  14           HE2      TYR  14  15.860  -6.524   2.495
   98    HE2  TYR  14           HE1      TYR  14  15.093  -2.546   3.980
   99    HH   TYR  14           HH       TYR  14  15.965  -4.239   5.258
  100    H    GLN  15           H        GLN  15  11.491  -1.469  -0.325
  101    HA   GLN  15           HA       GLN  15  10.814  -1.755   2.504
  102    HB2  GLN  15           2HB      GLN  15   9.911   0.362   0.503
  103    HB3  GLN  15           3HB      GLN  15   9.751   0.434   2.255
  104    HG2  GLN  15           2HG      GLN  15  12.210   0.447   2.508
  105    HG3  GLN  15           3HG      GLN  15  12.406   0.317   0.754
  106   HE21  GLN  15          2HE2      GLN  15  11.309   2.525   3.366
  107   HE22  GLN  15          1HE2      GLN  15  11.385   3.954   2.345
  108    H    LEU  16           H        LEU  16   9.045  -1.878  -0.600
  109    HA   LEU  16           HA       LEU  16   6.440  -2.306   0.533
  110    HB2  LEU  16           2HB      LEU  16   7.516  -3.067  -2.181
  111    HB3  LEU  16           3HB      LEU  16   5.817  -3.103  -1.706
  112    HG   LEU  16           HG       LEU  16   7.597  -0.653  -1.915
  113   HD11  LEU  16          1HD1      LEU  16   6.958  -1.516  -4.080
  114   HD12  LEU  16          2HD1      LEU  16   5.237  -1.503  -3.604
  115   HD13  LEU  16          3HD1      LEU  16   6.147   0.017  -3.747
  116   HD21  LEU  16          3HD2      LEU  16   5.539   0.684  -1.559
  117   HD22  LEU  16          1HD2      LEU  16   4.618  -0.797  -1.267
  118   HD23  LEU  16          2HD2      LEU  16   5.897  -0.294  -0.134
  119    H    GLU  17           H        GLU  17   9.010  -4.662  -0.327
  120    HA   GLU  17           HA       GLU  17   7.478  -7.015   0.360
  121    HB2  GLU  17           2HB      GLU  17  10.473  -6.460   0.336
  122    HB3  GLU  17           3HB      GLU  17   9.777  -8.028   0.746
  123    HG2  GLU  17           2HG      GLU  17   8.644  -8.104  -1.471
  124    HG3  GLU  17           3HG      GLU  17   9.445  -6.597  -1.912
  125    H    ASN  18           H        ASN  18   9.312  -4.736   2.408
  126    HA   ASN  18           HA       ASN  18   9.488  -6.408   4.697
  127    HB2  ASN  18           2HB      ASN  18  10.845  -4.353   4.216
  128    HB3  ASN  18           3HB      ASN  18   9.425  -3.362   4.564
  129   HD21  ASN  18          2HD2      ASN  18  11.673  -5.752   6.025
  130   HD22  ASN  18          1HD2      ASN  18  11.430  -5.164   7.662
  131    H    TYR  19           H        TYR  19   6.774  -4.470   3.570
  132    HA   TYR  19           HA       TYR  19   5.131  -4.576   5.955
  133    HB2  TYR  19           2HB      TYR  19   4.525  -4.421   2.996
  134    HB3  TYR  19           3HB      TYR  19   3.284  -4.317   4.213
  135    HD1  TYR  19           HD2      TYR  19   3.086  -2.388   5.747
  136    HD2  TYR  19           HD1      TYR  19   5.939  -2.510   2.537
  137    HE1  TYR  19           HE2      TYR  19   3.364   0.078   5.904
  138    HE2  TYR  19           HE1      TYR  19   6.270  -0.049   2.714
  139    HH   TYR  19           HH       TYR  19   5.683   1.861   3.808
  140    H    CYS  20           H        CYS  20   5.816  -6.905   3.365
  141    HA   CYS  20           HA       CYS  20   3.516  -8.620   4.081
  142    HB2  CYS  20           2HB      CYS  20   4.139  -7.943   1.715
  143    HB3  CYS  20           3HB      CYS  20   5.583  -8.940   1.889
  144    H    ASN  21           H        ASN  21   7.072  -8.693   4.176
  145    HA   ASN  21           HA       ASN  21   7.392 -11.450   4.818
  146    HB2  ASN  21           2HB      ASN  21   9.141  -9.955   3.878
  147    HB3  ASN  21           3HB      ASN  21   9.201  -9.062   5.401
  148   HD21  ASN  21          1HD2      ASN  21  11.575  -9.851   4.838
  149   HD22  ASN  21          2HD2      ASN  21  12.024 -11.349   5.642
  150    H1   PHE   1           H        PHE   1   3.461   1.989  -8.579
  151    HA   PHE   1           HA       PHE   1   3.823   3.641  -6.302
  152    HB2  PHE   1           2HB      PHE   1   4.065   1.427  -5.105
  153    HB3  PHE   1           3HB      PHE   1   2.591   1.687  -6.028
  154    HD1  PHE   1           HD2      PHE   1   5.937   0.002  -6.143
  155    HD2  PHE   1           HD1      PHE   1   1.884   0.073  -7.612
  156    HE1  PHE   1           HE2      PHE   1   6.258  -2.238  -7.132
  157    HE2  PHE   1           HE1      PHE   1   2.206  -2.177  -8.610
  158    HZ   PHE   1           HZ       PHE   1   4.399  -3.340  -8.377
  159    H    VAL   2           H        VAL   2   6.244   2.250  -8.315
  160    HA   VAL   2           HA       VAL   2   8.417   2.592  -6.336
  161    HB   VAL   2           HB       VAL   2   8.408   0.706  -7.914
  162   HG11  VAL   2          1HG1      VAL   2   8.995   2.758 -10.093
  163   HG12  VAL   2          2HG1      VAL   2   9.024   0.994 -10.257
  164   HG13  VAL   2          3HG1      VAL   2   7.494   1.816  -9.937
  165   HG21  VAL   2          3HG2      VAL   2  10.749   0.761  -8.491
  166   HG22  VAL   2          1HG2      VAL   2  10.808   2.522  -8.343
  167   HG23  VAL   2          2HG2      VAL   2  10.518   1.519  -6.903
  168    H    ASN   3           H        ASN   3   6.863   4.466  -8.786
  169    HA   ASN   3           HA       ASN   3   8.872   6.656  -8.522
  170    HB2  ASN   3           2HB      ASN   3   8.527   7.188 -10.844
  171    HB3  ASN   3           3HB      ASN   3   8.989   5.498 -10.709
  172   HD21  ASN   3          2HD2      ASN   3   7.924   6.190 -13.060
  173   HD22  ASN   3          1HD2      ASN   3   6.265   5.620 -13.183
  174    H    GLN   4           H        GLN   4   6.015   5.982  -7.298
  175    HA   GLN   4           HA       GLN   4   5.170   8.788  -7.171
  176    HB2  GLN   4           2HB      GLN   4   2.835   8.319  -7.687
  177    HB3  GLN   4           3HB      GLN   4   3.851   7.995  -9.085
  178    HG2  GLN   4           2HG      GLN   4   3.617   5.629  -8.861
  179    HG3  GLN   4           3HG      GLN   4   3.003   5.744  -7.213
  180   HE21  GLN   4          2HE2      GLN   4   0.830   6.736  -6.861
  181   HE22  GLN   4          1HE2      GLN   4  -0.351   6.492  -8.144
  182    H    HIS   5           H        HIS   5   3.671   9.210  -5.441
  183    HA   HIS   5           HA       HIS   5   3.782   7.449  -3.114
  184    HB2  HIS   5           2HB      HIS   5   2.023   9.880  -3.596
  185    HB3  HIS   5           3HB      HIS   5   2.461   9.167  -2.045
  186    HD2  HIS   5           HD2      HIS   5   4.914   9.754  -1.066
  187    HE1  HIS   5           HE1      HIS   5   6.146  12.444  -4.126
  188    HE2  HIS   5           HE2      HIS   5   6.672  11.579  -1.796
  189    H    LEU   6           H        LEU   6   1.911   6.468  -2.103
  190    HA   LEU   6           HA       LEU   6  -0.084   5.466  -4.104
  191    HB2  LEU   6           2HB      LEU   6   0.984   4.215  -1.538
  192    HB3  LEU   6           3HB      LEU   6  -0.289   3.558  -2.540
  193    HG   LEU   6           HG       LEU   6   1.421   3.507  -4.481
  194   HD11  LEU   6          1HD1      LEU   6   3.816   3.186  -3.634
  195   HD12  LEU   6          2HD1      LEU   6   3.264   4.844  -3.656
  196   HD13  LEU   6          3HD1      LEU   6   3.299   3.950  -2.126
  197   HD21  LEU   6          3HD2      LEU   6   2.416   1.378  -3.571
  198   HD22  LEU   6          1HD2      LEU   6   1.766   1.801  -1.985
  199   HD23  LEU   6          2HD2      LEU   6   0.676   1.507  -3.374
  200    H    CYS   7           H        CYS   7   0.044   5.928  -0.613
  201    HA   CYS   7           HA       CYS   7  -1.328   6.880   0.938
  202    HB2  CYS   7           2HB      CYS   7  -2.380   8.528  -1.360
  203    HB3  CYS   7           3HB      CYS   7  -2.558   8.894   0.356
  204    H    GLY   8           H        GLY   8  -4.198   7.841  -0.294
  205    HA2  GLY   8           HA2      GLY   8  -5.649   5.710   0.983
  206    HA3  GLY   8           HA3      GLY   8  -6.323   7.097   0.128
  207    H    SER   9           H        SER   9  -4.408   5.804  -2.141
  208    HA   SER   9           HA       SER   9  -6.136   3.540  -2.991
  209    HB2  SER   9           2HB      SER   9  -6.643   5.665  -4.306
  210    HB3  SER   9           3HB      SER   9  -4.987   5.567  -4.939
  211    HG   SER   9           HG       SER   9  -6.582   4.517  -6.278
  212    H    HIS  10           H        HIS  10  -4.785   2.492  -4.936
  213    HA   HIS  10           HA       HIS  10  -3.086   1.120  -5.536
  214    HB2  HIS  10           2HB      HIS  10  -1.360   3.432  -4.554
  215    HB3  HIS  10           3HB      HIS  10  -0.818   2.122  -5.592
  216    HD2  HIS  10           HD2      HIS  10  -2.025   1.965  -8.102
  217    HE1  HIS  10           HE1      HIS  10  -3.196   6.067  -8.199
  218    HE2  HIS  10           HE2      HIS  10  -2.886   3.960  -9.597
  219    H    LEU  11           H        LEU  11  -2.615   2.144  -2.187
  220    HA   LEU  11           HA       LEU  11  -0.312   0.813  -1.598
  221    HB2  LEU  11           2HB      LEU  11  -1.475   2.565  -0.274
  222    HB3  LEU  11           3HB      LEU  11  -2.639   1.363   0.273
  223    HG   LEU  11           HG       LEU  11  -0.777   0.108   1.388
  224   HD11  LEU  11          1HD1      LEU  11   1.380   1.322   1.768
  225   HD12  LEU  11          2HD1      LEU  11   1.170   0.816   0.095
  226   HD13  LEU  11          3HD1      LEU  11   0.896   2.519   0.546
  227   HD21  LEU  11          3HD2      LEU  11  -1.012   3.037   2.178
  228   HD22  LEU  11          1HD2      LEU  11  -2.150   1.743   2.615
  229   HD23  LEU  11          2HD2      LEU  11  -0.488   1.694   3.227
  230    H    VAL  12           H        VAL  12  -3.538  -0.591  -0.842
  231    HA   VAL  12           HA       VAL  12  -2.458  -3.043   0.171
  232    HB   VAL  12           HB       VAL  12  -5.223  -2.499  -0.983
  233   HG11  VAL  12          1HG1      VAL  12  -5.945  -4.392   0.467
  234   HG12  VAL  12          2HG1      VAL  12  -4.846  -4.915  -0.809
  235   HG13  VAL  12          3HG1      VAL  12  -4.244  -4.730   0.854
  236   HG21  VAL  12          3HG2      VAL  12  -4.196  -2.373   1.892
  237   HG22  VAL  12          1HG2      VAL  12  -4.718  -0.988   0.909
  238   HG23  VAL  12          2HG2      VAL  12  -5.892  -2.210   1.392
  239    H    GLU  13           H        GLU  13  -3.480  -2.131  -3.118
  240    HA   GLU  13           HA       GLU  13  -3.217  -4.773  -4.254
  241    HB2  GLU  13           2HB      GLU  13  -3.033  -2.048  -5.624
  242    HB3  GLU  13           3HB      GLU  13  -3.257  -3.606  -6.421
  243    HG2  GLU  13           2HG      GLU  13  -5.420  -3.886  -5.184
  244    HG3  GLU  13           3HG      GLU  13  -5.216  -2.275  -4.495
  245    H    ALA  14           H        ALA  14  -1.013  -1.921  -4.256
  246    HA   ALA  14           HA       ALA  14   1.095  -3.062  -5.753
  247    HB1  ALA  14           3HB      ALA  14   2.438  -1.246  -4.725
  248    HB2  ALA  14           1HB      ALA  14   0.853  -0.655  -5.272
  249    HB3  ALA  14           2HB      ALA  14   1.144  -0.959  -3.543
  250    H    LEU  15           H        LEU  15   0.534  -3.104  -2.197
  251    HA   LEU  15           HA       LEU  15   3.050  -4.324  -1.583
  252    HB2  LEU  15           2HB      LEU  15   0.397  -4.153  -0.085
  253    HB3  LEU  15           3HB      LEU  15   1.858  -4.822   0.638
  254    HG   LEU  15           HG       LEU  15   1.741  -1.974  -0.483
  255   HD11  LEU  15          1HD1      LEU  15   1.542  -1.235   1.851
  256   HD12  LEU  15          2HD1      LEU  15   0.150  -2.236   1.404
  257   HD13  LEU  15          3HD1      LEU  15   1.461  -2.921   2.393
  258   HD21  LEU  15          3HD2      LEU  15   3.705  -1.645   0.960
  259   HD22  LEU  15          1HD2      LEU  15   3.656  -3.367   1.383
  260   HD23  LEU  15          2HD2      LEU  15   4.004  -2.876  -0.280
  261    H    TYR  16           H        TYR  16  -0.148  -5.805  -2.279
  262    HA   TYR  16           HA       TYR  16   0.838  -8.518  -1.911
  263    HB2  TYR  16           2HB      TYR  16  -1.592  -7.387  -3.325
  264    HB3  TYR  16           3HB      TYR  16  -1.262  -9.111  -3.176
  265    HD1  TYR  16           HD2      TYR  16  -0.246  -9.315  -0.341
  266    HD2  TYR  16           HD1      TYR  16  -3.569  -7.133  -2.043
  267    HE1  TYR  16           HE2      TYR  16  -1.385  -9.377   1.817
  268    HE2  TYR  16           HE1      TYR  16  -4.746  -7.257   0.147
  269    HH   TYR  16           HH       TYR  16  -3.245  -8.816   3.020
  270    H    LEU  17           H        LEU  17   0.596  -6.360  -4.776
  271    HA   LEU  17           HA       LEU  17   1.376  -8.337  -6.702
  272    HB2  LEU  17           2HB      LEU  17   1.545  -5.305  -6.621
  273    HB3  LEU  17           3HB      LEU  17   2.108  -6.220  -8.010
  274    HG   LEU  17           HG       LEU  17  -0.744  -6.465  -6.964
  275   HD11  LEU  17          1HD1      LEU  17   0.343  -4.698  -9.199
  276   HD12  LEU  17          2HD1      LEU  17  -1.373  -4.938  -8.791
  277   HD13  LEU  17          3HD1      LEU  17  -0.298  -4.133  -7.640
  278   HD21  LEU  17          3HD2      LEU  17  -0.025  -8.335  -8.398
  279   HD22  LEU  17          1HD2      LEU  17  -1.193  -7.314  -9.238
  280   HD23  LEU  17          2HD2      LEU  17   0.534  -7.187  -9.635
  281    H    VAL  18           H        VAL  18   3.384  -6.040  -4.804
  282    HA   VAL  18           HA       VAL  18   5.894  -6.959  -5.923
  283    HB   VAL  18           HB       VAL  18   5.287  -5.439  -3.357
  284   HG11  VAL  18          1HG1      VAL  18   7.700  -4.694  -3.566
  285   HG12  VAL  18          2HG1      VAL  18   7.502  -6.386  -3.112
  286   HG13  VAL  18          3HG1      VAL  18   7.936  -5.957  -4.784
  287   HG21  VAL  18          3HG2      VAL  18   6.279  -4.528  -6.097
  288   HG22  VAL  18          1HG2      VAL  18   4.641  -4.282  -5.473
  289   HG23  VAL  18          2HG2      VAL  18   5.989  -3.499  -4.671
  290    H    CYS  19           H        CYS  19   3.994  -7.961  -3.100
  291    HA   CYS  19           HA       CYS  19   5.928  -9.981  -2.283
  292    HB2  CYS  19           2HB      CYS  19   4.215  -8.733  -0.854
  293    HB3  CYS  19           3HB      CYS  19   3.016  -9.868  -1.479
  294    H    GLY  20           H        GLY  20   4.101  -9.892  -5.029
  295    HA2  GLY  20           HA2      GLY  20   3.845 -11.448  -6.695
  296    HA3  GLY  20           HA3      GLY  20   4.458 -12.709  -5.624
  297    H    GLU  21           H        GLU  21   2.631 -12.657  -3.554
  298    HA   GLU  21           HA       GLU  21  -0.029 -13.283  -4.789
  299    HB2  GLU  21           2HB      GLU  21   1.424 -14.890  -2.644
  300    HB3  GLU  21           3HB      GLU  21  -0.228 -15.141  -3.186
  301    HG2  GLU  21           2HG      GLU  21   0.873 -16.772  -4.352
  302    HG3  GLU  21           3HG      GLU  21   0.720 -15.497  -5.550
  303    H    ARG  22           H        ARG  22  -1.828 -13.304  -3.291
  304    HA   ARG  22           HA       ARG  22  -1.840 -11.068  -1.412
  305    HB2  ARG  22           2HB      ARG  22  -3.959 -13.139  -2.103
  306    HB3  ARG  22           3HB      ARG  22  -4.204 -11.780  -1.001
  307    HG2  ARG  22           2HG      ARG  22  -3.620 -10.187  -2.827
  308    HG3  ARG  22           3HG      ARG  22  -3.503 -11.536  -3.963
  309    HD2  ARG  22           2HD      ARG  22  -5.987 -10.778  -2.367
  310    HD3  ARG  22           3HD      ARG  22  -5.679 -10.320  -4.051
  311    HE   ARG  22           HE       ARG  22  -5.436 -13.107  -3.992
  312   HH11  ARG  22          2HH2      ARG  22  -8.033 -10.834  -3.392
  313   HH12  ARG  22          1HH2      ARG  22  -9.265 -11.980  -3.851
  314   HH21  ARG  22          1HH1      ARG  22  -7.056 -14.522  -4.552
  315   HH22  ARG  22          2HH1      ARG  22  -8.717 -14.009  -4.495
  316    H    GLY  23           H        GLY  23  -2.563 -11.219   0.782
  317    HA2  GLY  23           HA2      GLY  23  -2.449 -12.090   2.975
  318    HA3  GLY  23           HA3      GLY  23  -1.839 -13.624   2.358
  319    H    DHI  24           H        DHI  24  -0.491 -13.028   4.409
  320    HA   DHI  24           HA       DHI  24   2.153 -11.995   3.616
  321    HB2  DHI  24           2HB      DHI  24   2.804 -12.672   5.905
  322    HB3  DHI  24           3HB      DHI  24   1.140 -13.158   6.229
  323    HD2  DHI  24           HD2      DHI  24   0.377 -15.526   5.327
  324    HE1  DHI  24           HE1      DHI  24   3.935 -16.612   3.239
  325    HE2  DHI  24           HE2      DHI  24   1.666 -17.439   4.047
  326    H    PHE  25           H        PHE  25   0.936  -9.928   3.098
  327    HA   PHE  25           HA       PHE  25   1.044  -7.940   5.277
  328    HB2  PHE  25           2HB      PHE  25   1.805  -7.254   3.084
  329    HB3  PHE  25           3HB      PHE  25   0.304  -7.770   2.337
  330    HD1  PHE  25           HD2      PHE  25   1.527  -5.472   5.063
  331    HD2  PHE  25           HD1      PHE  25  -1.351  -6.129   1.919
  332    HE1  PHE  25           HE2      PHE  25   0.654  -3.172   5.378
  333    HE2  PHE  25           HE1      PHE  25  -2.271  -3.863   2.297
  334    HZ   PHE  25           HZ       PHE  25  -1.270  -2.373   4.013
  335    H    TYR  26           H        TYR  26  -0.801  -6.708   5.922
  336    HA   TYR  26           HA       TYR  26  -3.479  -7.998   5.622
  337    HB2  TYR  26           2HB      TYR  26  -2.532  -9.097   7.526
  338    HB3  TYR  26           3HB      TYR  26  -1.947  -7.587   8.206
  339    HD1  TYR  26           HD2      TYR  26  -5.191  -9.120   7.045
  340    HD2  TYR  26           HD1      TYR  26  -3.201  -6.624   9.961
  341    HE1  TYR  26           HE2      TYR  26  -7.331  -8.843   8.279
  342    HE2  TYR  26           HE1      TYR  26  -5.335  -6.382  11.206
  343    HH   TYR  26           HH       TYR  26  -7.563  -6.922  11.303
  344    H    THR  27           H        THR  27  -1.898  -5.415   7.459
  345    HA   THR  27           HA       THR  27  -2.511  -3.556   8.337
  346    HB   THR  27           HB       THR  27  -2.103  -2.587   6.250
  347    HG1  THR  27           HG1      THR  27  -4.327  -1.362   7.490
  348   HG21  THR  27          1HG2      THR  27  -5.087  -2.710   5.676
  349   HG22  THR  27          2HG2      THR  27  -3.918  -1.670   4.837
  350   HG23  THR  27          3HG2      THR  27  -3.772  -3.422   4.711
  351    HA   PRO  28           HA       PRO  28  -6.520  -4.227  10.222
  352    HB2  PRO  28           2HB      PRO  28  -6.341  -2.502  12.321
  353    HB3  PRO  28           3HB      PRO  28  -5.405  -4.026  12.242
  354    HG2  PRO  28           2HG      PRO  28  -4.474  -1.232  11.517
  355    HG3  PRO  28           3HG      PRO  28  -3.643  -2.453  12.537
  356    HD2  PRO  28           2HD      PRO  28  -3.066  -2.086   9.887
  357    HD3  PRO  28           3HD      PRO  28  -2.963  -3.691  10.672
  358    H    LYS  29           H        LYS  29  -8.488  -3.039  10.606
  359    HA   LYS  29           HA       LYS  29  -9.057  -0.995   8.626
  360    HB2  LYS  29           2HB      LYS  29 -10.607  -2.866   9.459
  361    HB3  LYS  29           3HB      LYS  29 -10.831  -1.902  10.922
  362    HG2  LYS  29           2HG      LYS  29 -11.657  -0.003   9.391
  363    HG3  LYS  29           3HG      LYS  29 -11.519  -1.132   8.048
  364    HD2  LYS  29           2HD      LYS  29 -13.818  -1.090   8.734
  365    HD3  LYS  29           3HD      LYS  29 -13.146  -2.646   9.206
  366    HE2  LYS  29           2HE      LYS  29 -14.530  -1.874  11.001
  367    HE3  LYS  29           3HE      LYS  29 -12.859  -1.781  11.552
  368    HZ1  LYS  29           HZ1      LYS  29 -12.913   0.632  11.142
  369    HZ2  LYS  29           HZ2      LYS  29 -14.433   0.532  10.535
  370    HZ3  LYS  29           HZ3      LYS  29 -14.153   0.218  12.110
  371    H    THR  30           H        THR  30  -9.606   1.141   8.898
  372    HA   THR  30           HA       THR  30  -8.582   2.794  10.991
  373    HB   THR  30           HB       THR  30 -10.897   3.398   9.114
  374    HG1  THR  30           HG1      THR  30  -9.280   4.136   7.722
  375   HG21  THR  30          1HG2      THR  30 -10.566   5.131  10.840
  376   HG22  THR  30          2HG2      THR  30  -8.829   5.198  10.467
  377   HG23  THR  30          3HG2      THR  30 -10.031   5.729   9.268
  Start of MODEL   19
    1    H1   GLY   1           1H       GLY   1   7.705   2.344  11.855
    2    H2   GLY   1           2H       GLY   1   7.392   2.934  10.358
    3    H3   GLY   1           3H       GLY   1   6.262   3.052  11.536
    4    HA2  GLY   1           HA2      GLY   1   7.236   0.527  10.360
    5    HA3  GLY   1           HA3      GLY   1   6.001   0.662  11.624
    6    H    ILE   2           H        ILE   2   4.787  -0.630   9.967
    7    HA   ILE   2           HA       ILE   2   3.938   0.608   7.503
    8    HB   ILE   2           HB       ILE   2   4.148  -1.835   7.942
    9   HG12  ILE   2          2HG1      ILE   2   1.461  -0.904   6.856
   10   HG13  ILE   2          3HG1      ILE   2   2.988  -0.977   5.977
   11   HG21  ILE   2          1HG2      ILE   2   3.053  -1.879  10.189
   12   HG22  ILE   2          2HG2      ILE   2   1.480  -1.667   9.379
   13   HG23  ILE   2          3HG2      ILE   2   2.474  -3.106   9.073
   14   HD11  ILE   2          3HD1      ILE   2   1.335  -3.309   7.009
   15   HD12  ILE   2          1HD1      ILE   2   1.715  -2.887   5.331
   16   HD13  ILE   2          2HD1      ILE   2   2.996  -3.489   6.404
   17    H    VAL   3           H        VAL   3   2.600   0.675  10.747
   18    HA   VAL   3           HA       VAL   3  -0.105   1.232   9.996
   19    HB   VAL   3           HB       VAL   3   1.259   1.595  12.688
   20   HG11  VAL   3          1HG1      VAL   3  -1.706   1.258  12.047
   21   HG12  VAL   3          2HG1      VAL   3  -0.981   1.346  13.662
   22   HG13  VAL   3          3HG1      VAL   3  -0.937   2.762  12.615
   23   HG21  VAL   3          3HG2      VAL   3  -0.272  -0.775  11.523
   24   HG22  VAL   3          1HG2      VAL   3   1.458  -0.734  11.934
   25   HG23  VAL   3          2HG2      VAL   3   0.254  -0.626  13.214
   26    H    GLU   4           H        GLU   4  -0.356   4.835  10.057
   27    HA   GLU   4           HA       GLU   4  -1.933   2.369  10.064
   28    HB2  GLU   4           2HB      GLU   4  -2.843   4.599  10.605
   29    HB3  GLU   4           3HB      GLU   4  -2.535   5.125   8.945
   30    HG2  GLU   4           2HG      GLU   4  -4.104   3.424   8.092
   31    HG3  GLU   4           3HG      GLU   4  -4.322   2.777   9.720
   32    H    GLN   5           H        GLN   5  -0.417   4.432   7.598
   33    HA   GLN   5           HA       GLN   5  -0.039   2.156   5.803
   34    HB2  GLN   5           2HB      GLN   5  -1.541   4.672   4.919
   35    HB3  GLN   5           3HB      GLN   5  -0.780   3.538   3.810
   36    HG2  GLN   5           2HG      GLN   5  -2.234   1.707   4.887
   37    HG3  GLN   5           3HG      GLN   5  -3.157   3.023   5.623
   38   HE21  GLN   5          2HE2      GLN   5  -2.879   1.059   2.842
   39   HE22  GLN   5          1HE2      GLN   5  -3.820   2.059   1.743
   40    H    CYS   6           H        CYS   6   1.630   2.631   4.189
   41    HA   CYS   6           HA       CYS   6   3.614   4.653   4.896
   42    HB2  CYS   6           2HB      CYS   6   4.141   2.448   3.873
   43    HB3  CYS   6           3HB      CYS   6   3.385   2.981   2.368
   44    H    CYS   7           H        CYS   7   2.666   6.641   4.853
   45    HA   CYS   7           HA       CYS   7   1.320   7.568   2.350
   46    HB2  CYS   7           2HB      CYS   7   0.002   6.757   4.516
   47    HB3  CYS   7           3HB      CYS   7   0.404   8.364   5.101
   48    H    THR   8           H        THR   8   3.431   8.619   5.020
   49    HA   THR   8           HA       THR   8   3.349  11.432   4.324
   50    HB   THR   8           HB       THR   8   5.586   9.943   5.745
   51    HG1  THR   8           HG1      THR   8   4.435  10.424   7.623
   52   HG21  THR   8          1HG2      THR   8   5.874  12.107   6.934
   53   HG22  THR   8          2HG2      THR   8   6.133  12.288   5.195
   54   HG23  THR   8          3HG2      THR   8   4.603  12.830   5.921
   55    H    SER   9           H        SER   9   5.408   8.710   3.399
   56    HA   SER   9           HA       SER   9   6.572  10.259   1.126
   57    HB2  SER   9           2HB      SER   9   8.050   8.308   2.933
   58    HB3  SER   9           3HB      SER   9   8.696   9.057   1.461
   59    HG   SER   9           HG       SER   9   9.326  10.186   3.365
   60    H    ILE  10           H        ILE  10   7.191   8.928  -0.687
   61    HA   ILE  10           HA       ILE  10   5.297   6.775  -1.168
   62    HB   ILE  10           HB       ILE  10   7.588   7.462  -3.041
   63   HG12  ILE  10          2HG1      ILE  10   5.666   8.922  -4.165
   64   HG13  ILE  10          3HG1      ILE  10   5.108   9.099  -2.508
   65   HG21  ILE  10          1HG2      ILE  10   5.957   6.737  -4.718
   66   HG22  ILE  10          2HG2      ILE  10   6.145   5.477  -3.490
   67   HG23  ILE  10          3HG2      ILE  10   4.718   6.544  -3.466
   68   HD11  ILE  10          3HD1      ILE  10   7.237  10.191  -1.901
   69   HD12  ILE  10          1HD1      ILE  10   7.925   9.785  -3.494
   70   HD13  ILE  10          2HD1      ILE  10   6.597  10.948  -3.363
   71    H    CYS  11           H        CYS  11   5.636   4.696  -0.523
   72    HA   CYS  11           HA       CYS  11   8.196   3.783   0.392
   73    HB2  CYS  11           2HB      CYS  11   5.501   2.529   0.057
   74    HB3  CYS  11           3HB      CYS  11   6.906   1.466   0.077
   75    H    SER  12           H        SER  12   9.871   2.951  -0.603
   76    HA   SER  12           HA       SER  12   9.970   2.232  -3.430
   77    HB2  SER  12           2HB      SER  12  11.950   3.037  -2.236
   78    HB3  SER  12           3HB      SER  12  11.863   1.666  -1.113
   79    HG   SER  12           HG       SER  12  13.362   1.424  -2.922
   80    H    LEU  13           H        LEU  13  10.379   0.038  -4.228
   81    HA   LEU  13           HA       LEU  13   8.559  -1.941  -3.257
   82    HB2  LEU  13           2HB      LEU  13   9.387  -1.657  -5.568
   83    HB3  LEU  13           3HB      LEU  13  10.970  -2.263  -5.088
   84    HG   LEU  13           HG       LEU  13   8.532  -3.978  -4.529
   85   HD11  LEU  13          1HD1      LEU  13   8.628  -4.935  -6.796
   86   HD12  LEU  13          2HD1      LEU  13   8.183  -3.225  -6.847
   87   HD13  LEU  13          3HD1      LEU  13   9.836  -3.719  -7.271
   88   HD21  LEU  13          3HD2      LEU  13  10.808  -4.793  -3.852
   89   HD22  LEU  13          1HD2      LEU  13  10.071  -5.821  -5.079
   90   HD23  LEU  13          2HD2      LEU  13  11.338  -4.661  -5.538
   91    H    TYR  14           H        TYR  14  11.973  -1.350  -2.487
   92    HA   TYR  14           HA       TYR  14  12.524  -3.721  -0.975
   93    HB2  TYR  14           2HB      TYR  14  14.262  -2.165  -1.636
   94    HB3  TYR  14           3HB      TYR  14  13.491  -0.844  -0.768
   95    HD1  TYR  14           HD2      TYR  14  15.370  -4.035  -0.359
   96    HD2  TYR  14           HD1      TYR  14  13.769  -0.544   1.614
   97    HE1  TYR  14           HE2      TYR  14  16.646  -4.611   1.702
   98    HE2  TYR  14           HE1      TYR  14  15.023  -1.137   3.680
   99    HH   TYR  14           HH       TYR  14  17.135  -4.034   3.864
  100    H    GLN  15           H        GLN  15  10.698  -0.789  -0.135
  101    HA   GLN  15           HA       GLN  15  10.533  -1.453   2.735
  102    HB2  GLN  15           2HB      GLN  15   8.995   0.618   1.120
  103    HB3  GLN  15           3HB      GLN  15   9.028   0.466   2.875
  104    HG2  GLN  15           2HG      GLN  15  11.463   0.930   2.894
  105    HG3  GLN  15           3HG      GLN  15  11.460   1.047   1.128
  106   HE21  GLN  15          2HE2      GLN  15  10.101   2.636   4.079
  107   HE22  GLN  15          1HE2      GLN  15   9.928   4.191   3.282
  108    H    LEU  16           H        LEU  16   8.538  -1.749  -0.189
  109    HA   LEU  16           HA       LEU  16   6.239  -2.858   1.143
  110    HB2  LEU  16           2HB      LEU  16   7.192  -3.303  -1.713
  111    HB3  LEU  16           3HB      LEU  16   5.589  -3.693  -1.092
  112    HG   LEU  16           HG       LEU  16   6.845  -0.993  -1.542
  113   HD11  LEU  16          1HD1      LEU  16   4.894  -0.651  -3.022
  114   HD12  LEU  16          2HD1      LEU  16   5.906  -2.011  -3.515
  115   HD13  LEU  16          3HD1      LEU  16   4.365  -2.313  -2.672
  116   HD21  LEU  16          3HD2      LEU  16   5.570  -0.773   0.555
  117   HD22  LEU  16          1HD2      LEU  16   4.717   0.036  -0.757
  118   HD23  LEU  16          2HD2      LEU  16   4.163  -1.559  -0.203
  119    H    GLU  17           H        GLU  17   9.113  -4.416  -0.363
  120    HA   GLU  17           HA       GLU  17   8.544  -7.114   0.336
  121    HB2  GLU  17           2HB      GLU  17  11.106  -5.538  -0.049
  122    HB3  GLU  17           3HB      GLU  17  11.161  -7.230   0.410
  123    HG2  GLU  17           2HG      GLU  17   9.563  -6.380  -2.021
  124    HG3  GLU  17           3HG      GLU  17  11.314  -6.537  -2.095
  125    H    ASN  18           H        ASN  18   9.938  -4.498   2.362
  126    HA   ASN  18           HA       ASN  18  10.465  -6.188   4.628
  127    HB2  ASN  18           2HB      ASN  18  11.526  -4.003   4.294
  128    HB3  ASN  18           3HB      ASN  18   9.973  -3.190   4.447
  129   HD21  ASN  18          2HD2      ASN  18   9.161  -2.738   6.510
  130   HD22  ASN  18          1HD2      ASN  18  10.031  -3.189   7.968
  131    H    TYR  19           H        TYR  19   7.389  -4.800   3.451
  132    HA   TYR  19           HA       TYR  19   5.978  -5.587   5.912
  133    HB2  TYR  19           2HB      TYR  19   4.859  -4.821   3.211
  134    HB3  TYR  19           3HB      TYR  19   3.986  -4.924   4.724
  135    HD1  TYR  19           HD2      TYR  19   5.963  -3.485   6.571
  136    HD2  TYR  19           HD1      TYR  19   4.535  -2.559   2.611
  137    HE1  TYR  19           HE2      TYR  19   6.379  -1.078   6.984
  138    HE2  TYR  19           HE1      TYR  19   5.011  -0.156   2.999
  139    HH   TYR  19           HH       TYR  19   6.343   1.041   6.113
  140    H    CYS  20           H        CYS  20   6.609  -6.976   2.685
  141    HA   CYS  20           HA       CYS  20   4.957  -9.314   3.066
  142    HB2  CYS  20           2HB      CYS  20   7.309  -8.949   1.205
  143    HB3  CYS  20           3HB      CYS  20   6.006 -10.121   1.060
  144    H    ASN  21           H        ASN  21   8.215  -8.571   4.090
  145    HA   ASN  21           HA       ASN  21   8.463 -11.206   5.455
  146    HB2  ASN  21           2HB      ASN  21   9.646 -11.366   3.284
  147    HB3  ASN  21           3HB      ASN  21  10.553  -9.902   3.646
  148   HD21  ASN  21          2HD2      ASN  21  12.157 -11.841   3.014
  149   HD22  ASN  21          1HD2      ASN  21  12.867 -12.614   4.425
  150    H1   PHE   1           H        PHE   1   5.650   2.565  -9.520
  151    HA   PHE   1           HA       PHE   1   2.962   1.726  -9.313
  152    HB2  PHE   1           2HB      PHE   1   4.336   1.932  -6.611
  153    HB3  PHE   1           3HB      PHE   1   2.617   1.681  -6.911
  154    HD1  PHE   1           HD2      PHE   1   2.001  -0.411  -8.427
  155    HD2  PHE   1           HD1      PHE   1   5.642   0.005  -6.155
  156    HE1  PHE   1           HE2      PHE   1   2.312  -2.873  -8.471
  157    HE2  PHE   1           HE1      PHE   1   5.937  -2.462  -6.181
  158    HZ   PHE   1           HZ       PHE   1   4.277  -3.905  -7.346
  159    H    VAL   2           H        VAL   2   1.655   3.448  -7.822
  160    HA   VAL   2           HA       VAL   2   2.106   5.754  -9.412
  161    HB   VAL   2           HB       VAL   2  -0.102   4.772  -8.678
  162   HG11  VAL   2          1HG1      VAL   2  -1.220   5.643  -6.746
  163   HG12  VAL   2          2HG1      VAL   2   0.296   4.910  -6.189
  164   HG13  VAL   2          3HG1      VAL   2   0.150   6.677  -6.318
  165   HG21  VAL   2          3HG2      VAL   2  -1.248   6.923  -8.896
  166   HG22  VAL   2          1HG2      VAL   2   0.268   7.787  -8.576
  167   HG23  VAL   2          2HG2      VAL   2   0.098   6.789 -10.036
  168    H    ASN   3           H        ASN   3   3.033   7.635  -9.135
  169    HA   ASN   3           HA       ASN   3   3.826   8.616  -6.445
  170    HB2  ASN   3           2HB      ASN   3   5.689   7.278  -7.318
  171    HB3  ASN   3           3HB      ASN   3   5.691   8.210  -8.813
  172   HD21  ASN   3          2HD2      ASN   3   8.060   8.220  -7.788
  173   HD22  ASN   3          1HD2      ASN   3   8.395   9.675  -6.860
  174    H    GLN   4           H        GLN   4   2.768  11.761  -7.858
  175    HA   GLN   4           HA       GLN   4   3.395  10.473  -5.389
  176    HB2  GLN   4           2HB      GLN   4   2.019  12.191  -4.418
  177    HB3  GLN   4           3HB      GLN   4   3.012  12.866  -5.687
  178    HG2  GLN   4           2HG      GLN   4   1.017  12.800  -7.233
  179    HG3  GLN   4           3HG      GLN   4   0.037  12.214  -5.885
  180   HE21  GLN   4          2HE2      GLN   4  -0.199  13.694  -3.955
  181   HE22  GLN   4          1HE2      GLN   4  -0.052  15.422  -4.240
  182    H    HIS   5           H        HIS   5   0.451   8.417  -4.672
  183    HA   HIS   5           HA       HIS   5   3.168   9.174  -3.797
  184    HB2  HIS   5           2HB      HIS   5   1.117  10.816  -3.015
  185    HB3  HIS   5           3HB      HIS   5   0.978   9.599  -1.779
  186    HD2  HIS   5           HD2      HIS   5   2.582   9.952   0.265
  187    HE1  HIS   5           HE1      HIS   5   5.587  12.339  -1.564
  188    HE2  HIS   5           HE2      HIS   5   4.733  11.418   0.666
  189    H    LEU   6           H        LEU   6   1.753   6.591  -4.530
  190    HA   LEU   6           HA       LEU   6   0.664   4.773  -3.719
  191    HB2  LEU   6           2HB      LEU   6   2.982   4.885  -1.771
  192    HB3  LEU   6           3HB      LEU   6   1.784   3.600  -1.704
  193    HG   LEU   6           HG       LEU   6   3.480   4.165  -4.153
  194   HD11  LEU   6          1HD1      LEU   6   4.657   2.113  -3.496
  195   HD12  LEU   6          2HD1      LEU   6   4.777   3.326  -2.222
  196   HD13  LEU   6          3HD1      LEU   6   3.644   1.966  -2.044
  197   HD21  LEU   6          3HD2      LEU   6   1.425   2.027  -3.453
  198   HD22  LEU   6          1HD2      LEU   6   1.468   3.074  -4.886
  199   HD23  LEU   6          2HD2      LEU   6   2.658   1.781  -4.683
  200    H    CYS   7           H        CYS   7   0.795   4.544  -0.472
  201    HA   CYS   7           HA       CYS   7  -0.876   4.520   1.030
  202    HB2  CYS   7           2HB      CYS   7  -0.084   6.924   0.983
  203    HB3  CYS   7           3HB      CYS   7  -1.564   7.322   0.127
  204    H    GLY   8           H        GLY   8  -3.424   5.158   1.343
  205    HA2  GLY   8           HA2      GLY   8  -5.585   4.604   0.803
  206    HA3  GLY   8           HA3      GLY   8  -5.210   5.197  -0.816
  207    H    SER   9           H        SER   9  -6.312   3.685  -2.010
  208    HA   SER   9           HA       SER   9  -6.158   0.837  -1.652
  209    HB2  SER   9           2HB      SER   9  -6.767   2.394  -4.191
  210    HB3  SER   9           3HB      SER   9  -7.193   0.709  -3.848
  211    HG   SER   9           HG       SER   9  -8.574   1.438  -2.192
  212    H    HIS  10           H        HIS  10  -4.019   3.127  -3.387
  213    HA   HIS  10           HA       HIS  10  -2.960   1.101  -5.125
  214    HB2  HIS  10           2HB      HIS  10  -2.922   3.772  -5.268
  215    HB3  HIS  10           3HB      HIS  10  -1.307   3.529  -4.603
  216    HD2  HIS  10           HD2      HIS  10  -3.493   2.866  -7.687
  217    HE1  HIS  10           HE1      HIS  10   0.394   1.510  -8.784
  218    HE2  HIS  10           HE2      HIS  10  -1.959   1.971  -9.631
  219    H    LEU  11           H        LEU  11  -1.953   2.135  -1.894
  220    HA   LEU  11           HA       LEU  11   0.568   0.763  -1.879
  221    HB2  LEU  11           2HB      LEU  11  -0.097   2.440  -0.198
  222    HB3  LEU  11           3HB      LEU  11  -1.347   1.354   0.409
  223    HG   LEU  11           HG       LEU  11   0.426  -0.278   1.093
  224   HD11  LEU  11          1HD1      LEU  11   2.226   0.297  -0.487
  225   HD12  LEU  11          2HD1      LEU  11   2.354   1.927   0.220
  226   HD13  LEU  11          3HD1      LEU  11   2.788   0.489   1.172
  227   HD21  LEU  11          3HD2      LEU  11   0.822   2.550   2.134
  228   HD22  LEU  11          1HD2      LEU  11  -0.408   1.384   2.685
  229   HD23  LEU  11          2HD2      LEU  11   1.304   1.038   2.961
  230    H    VAL  12           H        VAL  12  -2.738  -0.443  -0.974
  231    HA   VAL  12           HA       VAL  12  -1.696  -3.088  -0.403
  232    HB   VAL  12           HB       VAL  12  -3.998  -3.790  -0.263
  233   HG11  VAL  12          1HG1      VAL  12  -4.562  -2.510   1.735
  234   HG12  VAL  12          2HG1      VAL  12  -2.815  -2.801   1.669
  235   HG13  VAL  12          3HG1      VAL  12  -3.467  -1.203   1.237
  236   HG21  VAL  12          3HG2      VAL  12  -5.104  -2.302  -1.918
  237   HG22  VAL  12          1HG2      VAL  12  -5.881  -2.271  -0.333
  238   HG23  VAL  12          2HG2      VAL  12  -4.834  -0.927  -0.813
  239    H    GLU  13           H        GLU  13  -3.192  -1.568  -3.277
  240    HA   GLU  13           HA       GLU  13  -3.173  -3.946  -4.884
  241    HB2  GLU  13           2HB      GLU  13  -3.041  -1.012  -5.622
  242    HB3  GLU  13           3HB      GLU  13  -3.075  -2.304  -6.821
  243    HG2  GLU  13           2HG      GLU  13  -5.203  -3.148  -5.939
  244    HG3  GLU  13           3HG      GLU  13  -5.231  -1.897  -4.705
  245    H    ALA  14           H        ALA  14  -0.485  -1.646  -4.204
  246    HA   ALA  14           HA       ALA  14   1.374  -2.994  -5.941
  247    HB1  ALA  14           3HB      ALA  14   3.053  -1.767  -4.655
  248    HB2  ALA  14           1HB      ALA  14   1.702  -0.705  -5.080
  249    HB3  ALA  14           2HB      ALA  14   1.849  -1.335  -3.425
  250    H    LEU  15           H        LEU  15   0.653  -3.378  -2.419
  251    HA   LEU  15           HA       LEU  15   2.549  -5.481  -2.010
  252    HB2  LEU  15           2HB      LEU  15   0.090  -4.587  -0.484
  253    HB3  LEU  15           3HB      LEU  15   1.080  -5.930   0.067
  254    HG   LEU  15           HG       LEU  15   2.285  -3.186  -0.476
  255   HD11  LEU  15          1HD1      LEU  15   2.142  -2.775   1.946
  256   HD12  LEU  15          2HD1      LEU  15   0.531  -2.949   1.237
  257   HD13  LEU  15          3HD1      LEU  15   1.238  -4.291   2.165
  258   HD21  LEU  15          3HD2      LEU  15   3.849  -5.162  -0.319
  259   HD22  LEU  15          1HD2      LEU  15   4.084  -3.971   0.954
  260   HD23  LEU  15          2HD2      LEU  15   3.220  -5.476   1.306
  261    H    TYR  16           H        TYR  16  -0.821  -5.666  -3.149
  262    HA   TYR  16           HA       TYR  16  -1.239  -8.438  -3.054
  263    HB2  TYR  16           2HB      TYR  16  -2.004  -6.437  -5.197
  264    HB3  TYR  16           3HB      TYR  16  -2.617  -8.081  -5.123
  265    HD1  TYR  16           HD1      TYR  16  -2.642  -7.599  -1.781
  266    HD2  TYR  16           HD2      TYR  16  -4.478  -5.890  -5.295
  267    HE1  TYR  16           HE1      TYR  16  -4.509  -6.856  -0.418
  268    HE2  TYR  16           HE2      TYR  16  -6.363  -5.069  -3.887
  269    HH   TYR  16           HH       TYR  16  -7.273  -4.976  -1.778
  270    H    LEU  17           H        LEU  17   0.952  -6.661  -5.174
  271    HA   LEU  17           HA       LEU  17   1.553  -9.099  -6.791
  272    HB2  LEU  17           2HB      LEU  17   2.409  -6.205  -7.162
  273    HB3  LEU  17           3HB      LEU  17   2.785  -7.545  -8.241
  274    HG   LEU  17           HG       LEU  17  -0.005  -6.438  -7.678
  275   HD11  LEU  17          1HD1      LEU  17   1.417  -4.964  -9.045
  276   HD12  LEU  17          2HD1      LEU  17   1.752  -6.304 -10.162
  277   HD13  LEU  17          3HD1      LEU  17   0.102  -5.659 -10.000
  278   HD21  LEU  17          3HD2      LEU  17  -0.180  -8.831  -8.184
  279   HD22  LEU  17          1HD2      LEU  17  -0.722  -7.886  -9.571
  280   HD23  LEU  17          2HD2      LEU  17   0.889  -8.637  -9.593
  281    H    VAL  18           H        VAL  18   3.221  -6.639  -4.764
  282    HA   VAL  18           HA       VAL  18   5.814  -7.820  -4.981
  283    HB   VAL  18           HB       VAL  18   4.677  -6.025  -2.804
  284   HG11  VAL  18          1HG1      VAL  18   7.581  -6.616  -3.543
  285   HG12  VAL  18          2HG1      VAL  18   7.049  -5.324  -2.451
  286   HG13  VAL  18          3HG1      VAL  18   6.789  -7.011  -2.003
  287   HG21  VAL  18          3HG2      VAL  18   5.788  -4.221  -4.092
  288   HG22  VAL  18          1HG2      VAL  18   6.319  -5.396  -5.313
  289   HG23  VAL  18          2HG2      VAL  18   4.601  -5.034  -5.106
  290    H    CYS  19           H        CYS  19   3.229  -8.375  -2.560
  291    HA   CYS  19           HA       CYS  19   4.885 -10.288  -1.094
  292    HB2  CYS  19           2HB      CYS  19   1.945  -9.654  -0.791
  293    HB3  CYS  19           3HB      CYS  19   2.914 -10.654   0.280
  294    H    GLY  20           H        GLY  20   3.655 -10.711  -4.083
  295    HA2  GLY  20           HA2      GLY  20   2.519 -13.347  -3.997
  296    HA3  GLY  20           HA3      GLY  20   3.376 -12.601  -5.353
  297    H    GLU  21           H        GLU  21   5.787 -12.248  -3.423
  298    HA   GLU  21           HA       GLU  21   7.090 -14.839  -3.794
  299    HB2  GLU  21           2HB      GLU  21   7.944 -12.311  -2.329
  300    HB3  GLU  21           3HB      GLU  21   8.983 -13.704  -2.619
  301    HG2  GLU  21           2HG      GLU  21   7.748 -11.938  -4.779
  302    HG3  GLU  21           3HG      GLU  21   9.409 -11.876  -4.214
  303    H    ARG  22           H        ARG  22   5.052 -13.594  -1.348
  304    HA   ARG  22           HA       ARG  22   4.510 -14.194   0.791
  305    HB2  ARG  22           2HB      ARG  22   4.911 -16.945  -0.441
  306    HB3  ARG  22           3HB      ARG  22   3.905 -16.554   0.965
  307    HG2  ARG  22           2HG      ARG  22   2.547 -15.022  -0.474
  308    HG3  ARG  22           3HG      ARG  22   3.486 -15.538  -1.878
  309    HD2  ARG  22           2HD      ARG  22   2.756 -17.903  -1.458
  310    HD3  ARG  22           3HD      ARG  22   1.757 -17.319  -0.125
  311    HE   ARG  22           HE       ARG  22   0.239 -16.369  -1.615
  312   HH11  ARG  22          1HH1      ARG  22   2.990 -17.442  -3.503
  313   HH12  ARG  22          2HH1      ARG  22   2.138 -17.277  -5.009
  314   HH21  ARG  22          1HH2      ARG  22  -0.778 -16.132  -3.597
  315   HH22  ARG  22          2HH2      ARG  22   0.066 -16.578  -5.050
  316    H    GLY  23           H        GLY  23   6.846 -13.255   1.185
  317    HA2  GLY  23           HA2      GLY  23   8.835 -15.077   2.226
  318    HA3  GLY  23           HA3      GLY  23   8.889 -13.320   2.248
  319    H    DHI  24           H        DHI  24   6.076 -14.572   3.797
  320    HA   DHI  24           HA       DHI  24   7.172 -13.813   6.458
  321    HB2  DHI  24           2HB      DHI  24   7.331 -16.225   6.368
  322    HB3  DHI  24           3HB      DHI  24   6.105 -15.737   7.524
  323    HD2  DHI  24           HD2      DHI  24   6.575 -17.487   4.174
  324    HE1  DHI  24           HE1      DHI  24   2.459 -18.022   5.171
  325    HE2  DHI  24           HE2      DHI  24   4.308 -18.700   3.549
  326    H    PHE  25           H        PHE  25   5.240 -12.680   4.347
  327    HA   PHE  25           HA       PHE  25   2.615 -12.750   5.716
  328    HB2  PHE  25           2HB      PHE  25   3.630 -10.716   6.546
  329    HB3  PHE  25           3HB      PHE  25   4.164 -10.267   4.937
  330    HD1  PHE  25           HD1      PHE  25   1.011 -10.962   6.881
  331    HD2  PHE  25           HD2      PHE  25   2.853  -8.773   3.652
  332    HE1  PHE  25           HE1      PHE  25  -1.098  -9.698   6.522
  333    HE2  PHE  25           HE2      PHE  25   0.757  -7.501   3.310
  334    HZ   PHE  25           HZ       PHE  25  -1.229  -7.969   4.740
  335    H    TYR  26           H        TYR  26   0.865 -12.421   4.334
  336    HA   TYR  26           HA       TYR  26   1.252 -12.094   1.450
  337    HB2  TYR  26           2HB      TYR  26   1.602 -14.497   1.708
  338    HB3  TYR  26           3HB      TYR  26   0.153 -14.641   2.692
  339    HD1  TYR  26           HD2      TYR  26   0.965 -13.099  -0.680
  340    HD2  TYR  26           HD1      TYR  26  -1.583 -15.741   1.595
  341    HE1  TYR  26           HE2      TYR  26  -0.408 -13.531  -2.709
  342    HE2  TYR  26           HE1      TYR  26  -2.915 -16.213  -0.450
  343    HH   TYR  26           HH       TYR  26  -3.190 -15.791  -2.689
  344    H    THR  27           H        THR  27  -0.703 -11.733   0.330
  345    HA   THR  27           HA       THR  27  -2.961 -10.675   1.971
  346    HB   THR  27           HB       THR  27  -3.254  -9.106   0.025
  347    HG1  THR  27           HG1      THR  27  -1.994 -10.293  -1.450
  348   HG21  THR  27          1HG2      THR  27  -1.460  -7.583   0.669
  349   HG22  THR  27          2HG2      THR  27  -2.122  -8.376   2.111
  350   HG23  THR  27          3HG2      THR  27  -0.562  -8.906   1.440
  351    HA   PRO  28           HA       PRO  28  -4.694 -14.084  -0.687
  352    HB2  PRO  28           2HB      PRO  28  -6.514 -15.071   1.118
  353    HB3  PRO  28           3HB      PRO  28  -4.794 -15.564   1.078
  354    HG2  PRO  28           2HG      PRO  28  -6.084 -13.461   2.845
  355    HG3  PRO  28           3HG      PRO  28  -4.980 -14.789   3.329
  356    HD2  PRO  28           2HD      PRO  28  -4.072 -12.271   2.915
  357    HD3  PRO  28           3HD      PRO  28  -3.103 -13.686   2.406
  358    H    LYS  29           H        LYS  29  -6.479 -13.915  -1.940
  359    HA   LYS  29           HA       LYS  29  -8.201 -11.508  -1.554
  360    HB2  LYS  29           2HB      LYS  29  -7.461 -12.943  -4.130
  361    HB3  LYS  29           3HB      LYS  29  -8.342 -11.427  -3.997
  362    HG2  LYS  29           2HG      LYS  29  -5.420 -11.913  -3.293
  363    HG3  LYS  29           3HG      LYS  29  -6.041 -11.019  -4.663
  364    HD2  LYS  29           2HD      LYS  29  -6.226 -10.213  -1.731
  365    HD3  LYS  29           3HD      LYS  29  -5.187  -9.497  -2.947
  366    HE2  LYS  29           2HE      LYS  29  -8.240  -9.413  -2.976
  367    HE3  LYS  29           3HE      LYS  29  -7.194  -8.123  -2.385
  368    HZ1  LYS  29           HZ1      LYS  29  -7.223  -9.115  -5.186
  369    HZ2  LYS  29           HZ2      LYS  29  -7.867  -7.710  -4.670
  370    HZ3  LYS  29           HZ3      LYS  29  -6.250  -7.929  -4.613
  371    H    THR  30           H        THR  30  -8.765 -14.229  -0.510
  372    HA   THR  30           HA       THR  30 -11.601 -14.390  -1.278
  373    HB   THR  30           HB       THR  30 -10.498 -15.898  -2.848
  374    HG1  THR  30           HG1      THR  30 -11.859 -17.614  -2.424
  375   HG21  THR  30          1HG2      THR  30  -8.564 -16.668  -1.471
  376   HG22  THR  30          2HG2      THR  30  -9.686 -17.609  -0.463
  377   HG23  THR  30          3HG2      THR  30  -9.489 -17.995  -2.183
  Start of MODEL   20
    1    H1   GLY   1           1H       GLY   1  -1.230  -4.823  12.946
    2    H2   GLY   1           2H       GLY   1  -2.499  -3.810  12.746
    3    H3   GLY   1           3H       GLY   1  -2.649  -5.397  12.359
    4    HA2  GLY   1           HA2      GLY   1  -1.049  -5.180  10.575
    5    HA3  GLY   1           HA3      GLY   1  -2.434  -4.095  10.353
    6    H    ILE   2           H        ILE   2  -0.064  -3.586   9.050
    7    HA   ILE   2           HA       ILE   2   1.539  -1.628  10.527
    8    HB   ILE   2           HB       ILE   2   1.599  -2.070   7.542
    9   HG12  ILE   2          2HG1      ILE   2   1.841  -4.306   8.489
   10   HG13  ILE   2          3HG1      ILE   2   3.319  -3.736   7.749
   11   HG21  ILE   2          1HG2      ILE   2   2.948  -0.181   8.195
   12   HG22  ILE   2          2HG2      ILE   2   3.640  -1.054   9.576
   13   HG23  ILE   2          3HG2      ILE   2   4.066  -1.503   7.916
   14   HD11  ILE   2          3HD1      ILE   2   3.751  -4.958   9.826
   15   HD12  ILE   2          1HD1      ILE   2   4.331  -3.288   9.910
   16   HD13  ILE   2          2HD1      ILE   2   2.824  -3.750  10.746
   17    H    VAL   3           H        VAL   3   1.726   0.569   9.978
   18    HA   VAL   3           HA       VAL   3  -0.778   1.926   9.172
   19    HB   VAL   3           HB       VAL   3   0.298   3.994   9.827
   20   HG11  VAL   3          1HG1      VAL   3   0.463   3.598  12.212
   21   HG12  VAL   3          2HG1      VAL   3  -0.842   2.612  11.534
   22   HG13  VAL   3          3HG1      VAL   3   0.712   1.860  11.957
   23   HG21  VAL   3          3HG2      VAL   3   2.630   3.578   9.217
   24   HG22  VAL   3          1HG2      VAL   3   2.508   4.040  10.915
   25   HG23  VAL   3          2HG2      VAL   3   2.776   2.338  10.487
   26    H    GLU   4           H        GLU   4  -0.607   3.855   7.666
   27    HA   GLU   4           HA       GLU   4   0.524   2.963   5.123
   28    HB2  GLU   4           2HB      GLU   4  -1.061   5.458   5.830
   29    HB3  GLU   4           3HB      GLU   4  -0.592   4.952   4.199
   30    HG2  GLU   4           2HG      GLU   4  -1.869   2.824   4.520
   31    HG3  GLU   4           3HG      GLU   4  -2.418   3.413   6.088
   32    H    GLN   5           H        GLN   5   2.773   3.058   6.242
   33    HA   GLN   5           HA       GLN   5   4.150   5.498   6.692
   34    HB2  GLN   5           2HB      GLN   5   5.350   2.970   5.503
   35    HB3  GLN   5           3HB      GLN   5   6.202   4.229   6.380
   36    HG2  GLN   5           2HG      GLN   5   5.052   3.641   8.463
   37    HG3  GLN   5           3HG      GLN   5   4.078   2.426   7.622
   38   HE21  GLN   5          2HE2      GLN   5   5.318   0.638   6.469
   39   HE22  GLN   5          1HE2      GLN   5   6.767   0.062   7.291
   40    H    CYS   6           H        CYS   6   3.452   3.827   3.666
   41    HA   CYS   6           HA       CYS   6   5.163   5.361   1.974
   42    HB2  CYS   6           2HB      CYS   6   2.678   3.820   1.208
   43    HB3  CYS   6           3HB      CYS   6   4.021   4.273   0.161
   44    H    CYS   7           H        CYS   7   2.450   6.470   3.614
   45    HA   CYS   7           HA       CYS   7   1.415   8.284   1.580
   46    HB2  CYS   7           2HB      CYS   7   0.173   7.217   3.556
   47    HB3  CYS   7           3HB      CYS   7   1.023   8.357   4.591
   48    H    THR   8           H        THR   8   3.938   8.415   4.035
   49    HA   THR   8           HA       THR   8   4.400  11.334   3.504
   50    HB   THR   8           HB       THR   8   5.426  11.387   5.773
   51    HG1  THR   8           HG1      THR   8   4.911   9.691   7.172
   52   HG21  THR   8          1HG2      THR   8   3.081  12.139   5.391
   53   HG22  THR   8          2HG2      THR   8   2.505  10.500   5.766
   54   HG23  THR   8          3HG2      THR   8   3.325  11.468   7.011
   55    H    SER   9           H        SER   9   6.033   8.203   4.092
   56    HA   SER   9           HA       SER   9   8.527   9.271   2.838
   57    HB2  SER   9           2HB      SER   9   7.938   6.560   4.074
   58    HB3  SER   9           3HB      SER   9   9.484   7.070   3.379
   59    HG   SER   9           HG       SER   9   9.424   7.337   5.669
   60    H    ILE  10           H        ILE  10   9.407   8.191   0.961
   61    HA   ILE  10           HA       ILE  10   7.302   7.045  -0.821
   62    HB   ILE  10           HB       ILE  10  10.024   8.191  -1.507
   63   HG12  ILE  10          2HG1      ILE  10   7.167   9.217  -1.894
   64   HG13  ILE  10          3HG1      ILE  10   8.347   9.860  -0.749
   65   HG21  ILE  10          1HG2      ILE  10   9.283   7.937  -3.852
   66   HG22  ILE  10          2HG2      ILE  10   9.336   6.366  -3.071
   67   HG23  ILE  10          3HG2      ILE  10   7.772   7.175  -3.311
   68   HD11  ILE  10          3HD1      ILE  10   8.235  11.348  -2.581
   69   HD12  ILE  10          1HD1      ILE  10   9.809  10.527  -2.648
   70   HD13  ILE  10          2HD1      ILE  10   8.494  10.061  -3.764
   71    H    CYS  11           H        CYS  11   7.095   4.948  -0.701
   72    HA   CYS  11           HA       CYS  11   9.124   3.238   0.436
   73    HB2  CYS  11           2HB      CYS  11   6.386   2.745  -0.757
   74    HB3  CYS  11           3HB      CYS  11   7.393   1.460  -0.094
   75    H    SER  12           H        SER  12  10.853   2.580  -0.626
   76    HA   SER  12           HA       SER  12  11.003   1.940  -3.454
   77    HB2  SER  12           2HB      SER  12  12.974   2.527  -2.084
   78    HB3  SER  12           3HB      SER  12  12.766   1.031  -1.151
   79    HG   SER  12           HG       SER  12  14.293   0.892  -2.928
   80    H    LEU  13           H        LEU  13  11.429  -0.295  -4.240
   81    HA   LEU  13           HA       LEU  13   9.249  -2.038  -3.734
   82    HB2  LEU  13           2HB      LEU  13  11.012  -1.728  -5.740
   83    HB3  LEU  13           3HB      LEU  13  11.864  -3.012  -4.917
   84    HG   LEU  13           HG       LEU  13  10.566  -3.896  -6.720
   85   HD11  LEU  13          1HD1      LEU  13   9.034  -4.623  -4.204
   86   HD12  LEU  13          2HD1      LEU  13   9.216  -5.591  -5.677
   87   HD13  LEU  13          3HD1      LEU  13  10.625  -5.285  -4.645
   88   HD21  LEU  13          3HD2      LEU  13   8.896  -2.076  -6.888
   89   HD22  LEU  13          1HD2      LEU  13   8.166  -3.687  -6.946
   90   HD23  LEU  13          2HD2      LEU  13   8.056  -2.720  -5.461
   91    H    TYR  14           H        TYR  14  12.604  -2.148  -2.540
   92    HA   TYR  14           HA       TYR  14  12.495  -4.517  -0.968
   93    HB2  TYR  14           2HB      TYR  14  14.581  -3.446  -1.462
   94    HB3  TYR  14           3HB      TYR  14  14.050  -1.917  -0.774
   95    HD1  TYR  14           HD2      TYR  14  14.931  -5.448   0.132
   96    HD2  TYR  14           HD1      TYR  14  14.375  -1.398   1.516
   97    HE1  TYR  14           HE2      TYR  14  15.867  -6.075   2.354
   98    HE2  TYR  14           HE1      TYR  14  15.308  -2.026   3.733
   99    HH   TYR  14           HH       TYR  14  16.402  -5.360   4.470
  100    H    GLN  15           H        GLN  15  11.317  -1.219  -0.202
  101    HA   GLN  15           HA       GLN  15  10.817  -1.894   2.602
  102    HB2  GLN  15           2HB      GLN  15   9.775   0.458   0.984
  103    HB3  GLN  15           3HB      GLN  15   9.691   0.283   2.729
  104    HG2  GLN  15           2HG      GLN  15  12.256   0.486   1.099
  105    HG3  GLN  15           3HG      GLN  15  11.508   1.802   1.991
  106   HE21  GLN  15          2HE2      GLN  15  13.970   1.623   2.774
  107   HE22  GLN  15          1HE2      GLN  15  14.149   0.702   4.260
  108    H    LEU  16           H        LEU  16   8.938  -1.824  -0.405
  109    HA   LEU  16           HA       LEU  16   6.431  -2.491   0.871
  110    HB2  LEU  16           2HB      LEU  16   7.365  -3.095  -1.948
  111    HB3  LEU  16           3HB      LEU  16   5.723  -3.346  -1.336
  112    HG   LEU  16           HG       LEU  16   7.208  -0.760  -1.707
  113   HD11  LEU  16          1HD1      LEU  16   4.723  -1.867  -3.049
  114   HD12  LEU  16          2HD1      LEU  16   5.385  -0.237  -3.303
  115   HD13  LEU  16          3HD1      LEU  16   6.339  -1.641  -3.769
  116   HD21  LEU  16          3HD2      LEU  16   5.077   0.405  -1.055
  117   HD22  LEU  16          1HD2      LEU  16   4.396  -1.160  -0.573
  118   HD23  LEU  16          2HD2      LEU  16   5.786  -0.470   0.300
  119    H    GLU  17           H        GLU  17   9.124  -4.568  -0.318
  120    HA   GLU  17           HA       GLU  17   7.904  -7.057   0.466
  121    HB2  GLU  17           2HB      GLU  17  10.837  -6.262   0.284
  122    HB3  GLU  17           3HB      GLU  17  10.264  -7.892   0.628
  123    HG2  GLU  17           2HG      GLU  17   9.030  -7.920  -1.528
  124    HG3  GLU  17           3HG      GLU  17   9.679  -6.326  -1.913
  125    H    ASN  18           H        ASN  18   9.555  -4.584   2.437
  126    HA   ASN  18           HA       ASN  18   9.822  -6.255   4.755
  127    HB2  ASN  18           2HB      ASN  18   9.960  -3.254   4.372
  128    HB3  ASN  18           3HB      ASN  18  10.162  -4.012   5.937
  129   HD21  ASN  18          2HD2      ASN  18  12.178  -2.460   4.472
  130   HD22  ASN  18          1HD2      ASN  18  13.502  -3.591   4.248
  131    H    TYR  19           H        TYR  19   6.922  -5.005   3.494
  132    HA   TYR  19           HA       TYR  19   5.436  -5.064   6.035
  133    HB2  TYR  19           2HB      TYR  19   4.625  -5.149   3.118
  134    HB3  TYR  19           3HB      TYR  19   3.467  -5.261   4.422
  135    HD1  TYR  19           HD2      TYR  19   6.016  -3.009   2.925
  136    HD2  TYR  19           HD1      TYR  19   2.634  -3.356   5.555
  137    HE1  TYR  19           HE2      TYR  19   5.958  -0.533   3.149
  138    HE2  TYR  19           HE1      TYR  19   2.571  -0.876   5.798
  139    HH   TYR  19           HH       TYR  19   4.870   1.250   4.069
  140    H    CYS  20           H        CYS  20   6.706  -7.421   3.841
  141    HA   CYS  20           HA       CYS  20   4.964  -9.614   4.891
  142    HB2  CYS  20           2HB      CYS  20   6.507  -9.412   2.291
  143    HB3  CYS  20           3HB      CYS  20   5.304 -10.631   2.711
  144    H    ASN  21           H        ASN  21   8.261  -8.538   4.523
  145    HA   ASN  21           HA       ASN  21   9.791 -10.854   4.709
  146    HB2  ASN  21           2HB      ASN  21  10.540  -8.528   4.190
  147    HB3  ASN  21           3HB      ASN  21  10.303  -8.086   5.888
  148   HD21  ASN  21          2HD2      ASN  21  12.664  -7.436   5.097
  149   HD22  ASN  21          1HD2      ASN  21  13.877  -8.622   5.580
  150    H1   PHE   1           H        PHE   1   2.845   3.986  -8.024
  151    HA   PHE   1           HA       PHE   1   3.064   1.955  -6.939
  152    HB2  PHE   1           2HB      PHE   1   3.352   1.370  -9.415
  153    HB3  PHE   1           3HB      PHE   1   5.080   1.325  -9.135
  154    HD1  PHE   1           HD2      PHE   1   5.976  -0.388  -7.371
  155    HD2  PHE   1           HD1      PHE   1   2.003  -0.530  -9.046
  156    HE1  PHE   1           HE2      PHE   1   5.777  -2.758  -6.702
  157    HE2  PHE   1           HE1      PHE   1   1.824  -2.914  -8.404
  158    HZ   PHE   1           HZ       PHE   1   3.704  -4.037  -7.223
  159    H    VAL   2           H        VAL   2   6.089   3.500  -7.785
  160    HA   VAL   2           HA       VAL   2   7.354   2.768  -5.193
  161    HB   VAL   2           HB       VAL   2   7.818   0.955  -6.837
  162   HG11  VAL   2          1HG1      VAL   2   7.989   2.295  -8.917
  163   HG12  VAL   2          2HG1      VAL   2   9.521   2.989  -8.329
  164   HG13  VAL   2          3HG1      VAL   2   9.391   1.253  -8.653
  165   HG21  VAL   2          3HG2      VAL   2  10.170   0.716  -6.377
  166   HG22  VAL   2          1HG2      VAL   2  10.311   2.435  -5.956
  167   HG23  VAL   2          2HG2      VAL   2   9.313   1.345  -4.961
  168    H    ASN   3           H        ASN   3   7.303   4.861  -8.030
  169    HA   ASN   3           HA       ASN   3   9.606   6.446  -7.229
  170    HB2  ASN   3           2HB      ASN   3   8.979   6.003  -9.581
  171    HB3  ASN   3           3HB      ASN   3   7.442   6.842  -9.347
  172   HD21  ASN   3          2HD2      ASN   3  11.009   7.367  -9.222
  173   HD22  ASN   3          1HD2      ASN   3  10.891   9.054  -9.701
  174    H    GLN   4           H        GLN   4   6.247   6.558  -6.384
  175    HA   GLN   4           HA       GLN   4   6.522   9.220  -5.079
  176    HB2  GLN   4           2HB      GLN   4   4.209   8.396  -6.890
  177    HB3  GLN   4           3HB      GLN   4   4.316   9.885  -5.939
  178    HG2  GLN   4           2HG      GLN   4   6.358  10.536  -7.252
  179    HG3  GLN   4           3HG      GLN   4   6.129   9.102  -8.257
  180   HE21  GLN   4          2HE2      GLN   4   6.181  10.973  -9.902
  181   HE22  GLN   4          1HE2      GLN   4   4.605  11.648 -10.312
  182    H    HIS   5           H        HIS   5   4.604   9.646  -3.615
  183    HA   HIS   5           HA       HIS   5   4.327   7.608  -1.661
  184    HB2  HIS   5           2HB      HIS   5   2.619  10.082  -2.142
  185    HB3  HIS   5           3HB      HIS   5   2.681   9.152  -0.651
  186    HD2  HIS   5           HD2      HIS   5   4.976   9.311   0.819
  187    HE1  HIS   5           HE1      HIS   5   6.534  12.766  -1.120
  188    HE2  HIS   5           HE2      HIS   5   6.689  11.300   0.966
  189    H    LEU   6           H        LEU   6   2.676   6.275  -1.047
  190    HA   LEU   6           HA       LEU   6   0.305   5.915  -2.848
  191    HB2  LEU   6           2HB      LEU   6   1.604   3.682  -1.262
  192    HB3  LEU   6           3HB      LEU   6   0.254   3.590  -2.370
  193    HG   LEU   6           HG       LEU   6   1.929   2.530  -3.478
  194   HD11  LEU   6          1HD1      LEU   6   2.473   3.780  -5.441
  195   HD12  LEU   6          2HD1      LEU   6   0.849   4.249  -4.913
  196   HD13  LEU   6          3HD1      LEU   6   2.236   5.323  -4.614
  197   HD21  LEU   6          3HD2      LEU   6   3.804   3.089  -2.041
  198   HD22  LEU   6          1HD2      LEU   6   4.236   3.266  -3.746
  199   HD23  LEU   6          2HD2      LEU   6   3.920   4.705  -2.770
  200    H    CYS   7           H        CYS   7  -1.551   6.420  -1.751
  201    HA   CYS   7           HA       CYS   7  -1.830   5.817   1.115
  202    HB2  CYS   7           2HB      CYS   7  -0.554   8.008   0.832
  203    HB3  CYS   7           3HB      CYS   7  -2.026   8.705   0.175
  204    H    GLY   8           H        GLY   8  -3.909   5.489   1.697
  205    HA2  GLY   8           HA2      GLY   8  -6.203   5.444   1.711
  206    HA3  GLY   8           HA3      GLY   8  -6.231   6.715   0.486
  207    H    SER   9           H        SER   9  -4.830   5.378  -1.555
  208    HA   SER   9           HA       SER   9  -6.307   2.883  -2.251
  209    HB2  SER   9           2HB      SER   9  -5.934   5.327  -4.042
  210    HB3  SER   9           3HB      SER   9  -6.523   3.748  -4.585
  211    HG   SER   9           HG       SER   9  -7.759   5.457  -2.665
  212    H    HIS  10           H        HIS  10  -5.274   1.814  -4.121
  213    HA   HIS  10           HA       HIS  10  -3.633   0.753  -5.170
  214    HB2  HIS  10           2HB      HIS  10  -3.436   3.030  -6.167
  215    HB3  HIS  10           3HB      HIS  10  -2.084   3.349  -5.078
  216    HD2  HIS  10           HD2      HIS  10  -2.996   0.452  -7.572
  217    HE1  HIS  10           HE1      HIS  10   1.084   1.502  -8.222
  218    HE2  HIS  10           HE2      HIS  10  -0.814  -0.027  -8.967
  219    H    LEU  11           H        LEU  11  -2.375   2.221  -2.194
  220    HA   LEU  11           HA       LEU  11   0.091   0.916  -2.035
  221    HB2  LEU  11           2HB      LEU  11  -0.641   2.634  -0.458
  222    HB3  LEU  11           3HB      LEU  11  -1.908   1.588   0.163
  223    HG   LEU  11           HG       LEU  11  -0.294   0.095   1.183
  224   HD11  LEU  11          1HD1      LEU  11   1.885   1.879   0.018
  225   HD12  LEU  11          2HD1      LEU  11   2.130   0.599   1.218
  226   HD13  LEU  11          3HD1      LEU  11   1.589   0.182  -0.404
  227   HD21  LEU  11          3HD2      LEU  11   0.400   3.003   1.757
  228   HD22  LEU  11          1HD2      LEU  11  -0.983   2.107   2.419
  229   HD23  LEU  11          2HD2      LEU  11   0.667   1.618   2.844
  230    H    VAL  12           H        VAL  12  -3.077  -0.439  -0.930
  231    HA   VAL  12           HA       VAL  12  -1.991  -2.933  -0.075
  232    HB   VAL  12           HB       VAL  12  -4.283  -3.734  -0.072
  233   HG11  VAL  12          1HG1      VAL  12  -3.453  -2.340   1.803
  234   HG12  VAL  12          2HG1      VAL  12  -4.123  -0.897   1.016
  235   HG13  VAL  12          3HG1      VAL  12  -5.198  -2.194   1.568
  236   HG21  VAL  12          3HG2      VAL  12  -5.259  -2.715  -2.067
  237   HG22  VAL  12          1HG2      VAL  12  -6.186  -2.264  -0.640
  238   HG23  VAL  12          2HG2      VAL  12  -5.076  -1.088  -1.365
  239    H    GLU  13           H        GLU  13  -3.150  -1.870  -3.250
  240    HA   GLU  13           HA       GLU  13  -3.130  -4.504  -4.471
  241    HB2  GLU  13           2HB      GLU  13  -2.959  -1.740  -5.752
  242    HB3  GLU  13           3HB      GLU  13  -3.264  -3.260  -6.596
  243    HG2  GLU  13           2HG      GLU  13  -5.356  -3.568  -5.283
  244    HG3  GLU  13           3HG      GLU  13  -5.071  -2.023  -4.472
  245    H    ALA  14           H        ALA  14  -0.785  -1.770  -4.431
  246    HA   ALA  14           HA       ALA  14   1.268  -3.058  -5.925
  247    HB1  ALA  14           3HB      ALA  14   2.720  -1.339  -4.913
  248    HB2  ALA  14           1HB      ALA  14   1.189  -0.633  -5.462
  249    HB3  ALA  14           2HB      ALA  14   1.453  -0.944  -3.731
  250    H    LEU  15           H        LEU  15   0.542  -3.116  -2.400
  251    HA   LEU  15           HA       LEU  15   2.815  -4.713  -1.700
  252    HB2  LEU  15           2HB      LEU  15   0.170  -4.053  -0.379
  253    HB3  LEU  15           3HB      LEU  15   1.269  -5.205   0.369
  254    HG   LEU  15           HG       LEU  15   2.185  -2.407  -0.437
  255   HD11  LEU  15          1HD1      LEU  15   1.935  -1.767   1.917
  256   HD12  LEU  15          2HD1      LEU  15   0.365  -2.208   1.227
  257   HD13  LEU  15          3HD1      LEU  15   1.224  -3.345   2.297
  258   HD21  LEU  15          3HD2      LEU  15   3.973  -4.098  -0.048
  259   HD22  LEU  15          1HD2      LEU  15   3.953  -2.875   1.222
  260   HD23  LEU  15          2HD2      LEU  15   3.247  -4.482   1.516
  261    H    TYR  16           H        TYR  16  -0.544  -5.759  -2.548
  262    HA   TYR  16           HA       TYR  16   0.073  -8.558  -2.256
  263    HB2  TYR  16           2HB      TYR  16  -2.068  -7.032  -3.750
  264    HB3  TYR  16           3HB      TYR  16  -1.918  -8.777  -3.904
  265    HD1  TYR  16           HD2      TYR  16  -1.492 -10.011  -1.481
  266    HD2  TYR  16           HD1      TYR  16  -3.737  -6.396  -2.195
  267    HE1  TYR  16           HE2      TYR  16  -2.748 -10.373   0.630
  268    HE2  TYR  16           HE1      TYR  16  -4.993  -6.759  -0.087
  269    HH   TYR  16           HH       TYR  16  -5.264  -8.067   1.750
  270    H    LEU  17           H        LEU  17   0.626  -6.325  -4.975
  271    HA   LEU  17           HA       LEU  17   1.410  -8.450  -6.817
  272    HB2  LEU  17           2HB      LEU  17   1.639  -5.424  -6.835
  273    HB3  LEU  17           3HB      LEU  17   2.283  -6.418  -8.138
  274    HG   LEU  17           HG       LEU  17  -0.646  -6.544  -7.288
  275   HD11  LEU  17          1HD1      LEU  17  -1.107  -5.117  -9.246
  276   HD12  LEU  17          2HD1      LEU  17  -0.128  -4.270  -8.044
  277   HD13  LEU  17          3HD1      LEU  17   0.639  -4.913  -9.519
  278   HD21  LEU  17          3HD2      LEU  17  -0.958  -7.499  -9.548
  279   HD22  LEU  17          1HD2      LEU  17   0.797  -7.437  -9.822
  280   HD23  LEU  17          2HD2      LEU  17   0.116  -8.505  -8.575
  281    H    VAL  18           H        VAL  18   3.223  -6.276  -4.644
  282    HA   VAL  18           HA       VAL  18   5.855  -7.212  -5.431
  283    HB   VAL  18           HB       VAL  18   4.773  -5.691  -3.036
  284   HG11  VAL  18          1HG1      VAL  18   6.680  -6.821  -2.077
  285   HG12  VAL  18          2HG1      VAL  18   7.664  -6.498  -3.526
  286   HG13  VAL  18          3HG1      VAL  18   7.162  -5.167  -2.463
  287   HG21  VAL  18          3HG2      VAL  18   6.646  -4.978  -5.337
  288   HG22  VAL  18          1HG2      VAL  18   4.930  -4.552  -5.236
  289   HG23  VAL  18          2HG2      VAL  18   6.067  -3.872  -4.072
  290    H    CYS  19           H        CYS  19   3.696  -8.072  -2.718
  291    HA   CYS  19           HA       CYS  19   5.359 -10.437  -2.078
  292    HB2  CYS  19           2HB      CYS  19   2.863  -9.417  -0.703
  293    HB3  CYS  19           3HB      CYS  19   3.993 -10.635  -0.114
  294    H    GLY  20           H        GLY  20   4.576 -10.864  -4.538
  295    HA2  GLY  20           HA2      GLY  20   1.981 -11.670  -5.168
  296    HA3  GLY  20           HA3      GLY  20   3.437 -12.198  -6.012
  297    H    GLU  21           H        GLU  21   4.502 -13.685  -3.683
  298    HA   GLU  21           HA       GLU  21   2.792 -16.095  -3.666
  299    HB2  GLU  21           2HB      GLU  21   5.294 -16.200  -3.910
  300    HB3  GLU  21           3HB      GLU  21   5.447 -15.578  -2.272
  301    HG2  GLU  21           2HG      GLU  21   5.726 -17.965  -2.221
  302    HG3  GLU  21           3HG      GLU  21   4.201 -17.601  -1.431
  303    H    ARG  22           H        ARG  22   1.098 -14.602  -2.795
  304    HA   ARG  22           HA       ARG  22   1.440 -13.206  -0.398
  305    HB2  ARG  22           2HB      ARG  22  -0.828 -12.552  -0.525
  306    HB3  ARG  22           3HB      ARG  22  -0.035 -12.476  -2.095
  307    HG2  ARG  22           2HG      ARG  22  -1.158 -14.612  -2.760
  308    HG3  ARG  22           3HG      ARG  22  -1.994 -14.637  -1.186
  309    HD2  ARG  22           2HD      ARG  22  -2.932 -12.386  -1.677
  310    HD3  ARG  22           3HD      ARG  22  -2.096 -12.384  -3.226
  311    HE   ARG  22           HE       ARG  22  -3.642 -13.895  -4.123
  312   HH11  ARG  22          1HH2      ARG  22  -4.375 -13.546  -0.708
  313   HH12  ARG  22          2HH2      ARG  22  -5.910 -14.353  -0.868
  314   HH21  ARG  22          1HH1      ARG  22  -5.607 -14.909  -4.246
  315   HH22  ARG  22          2HH1      ARG  22  -6.583 -15.100  -2.820
  316    H    GLY  23           H        GLY  23   0.754 -13.287   1.619
  317    HA2  GLY  23           HA2      GLY  23  -0.975 -15.216   2.819
  318    HA3  GLY  23           HA3      GLY  23   0.711 -15.640   3.153
  319    H    DHI  24           H        DHI  24  -1.587 -14.489   4.849
  320    HA   DHI  24           HA       DHI  24  -0.153 -12.439   6.351
  321    HB2  DHI  24           2HB      DHI  24  -2.329 -12.204   7.558
  322    HB3  DHI  24           3HB      DHI  24  -3.045 -13.377   6.455
  323    HD2  DHI  24           HD2      DHI  24  -2.597 -15.934   6.968
  324    HE1  DHI  24           HE1      DHI  24   0.102 -15.489  10.243
  325    HE2  DHI  24           HE2      DHI  24  -1.273 -17.157   8.896
  326    H    PHE  25           H        PHE  25  -0.639 -10.269   6.511
  327    HA   PHE  25           HA       PHE  25  -1.131  -8.184   5.993
  328    HB2  PHE  25           2HB      PHE  25   0.126  -8.742   3.967
  329    HB3  PHE  25           3HB      PHE  25  -1.370  -9.153   3.142
  330    HD1  PHE  25           HD2      PHE  25  -0.434  -6.184   5.326
  331    HD2  PHE  25           HD1      PHE  25  -1.613  -7.593   1.424
  332    HE1  PHE  25           HE2      PHE  25  -0.691  -3.848   4.553
  333    HE2  PHE  25           HE1      PHE  25  -1.879  -5.261   0.657
  334    HZ   PHE  25           HZ       PHE  25  -1.436  -3.377   2.234
  335    H    TYR  26           H        TYR  26  -3.561 -10.248   4.463
  336    HA   TYR  26           HA       TYR  26  -5.737 -10.514   4.759
  337    HB2  TYR  26           2HB      TYR  26  -4.975 -10.780   7.009
  338    HB3  TYR  26           3HB      TYR  26  -5.102  -9.056   7.321
  339    HD1  TYR  26           HD2      TYR  26  -7.371 -11.775   5.974
  340    HD2  TYR  26           HD1      TYR  26  -6.865  -8.447   8.677
  341    HE1  TYR  26           HE2      TYR  26  -9.697 -12.087   6.802
  342    HE2  TYR  26           HE1      TYR  26  -9.174  -8.778   9.520
  343    HH   TYR  26           HH       TYR  26 -11.107 -10.013   9.369
  344    H    THR  27           H        THR  27  -5.240  -7.069   5.520
  345    HA   THR  27           HA       THR  27  -6.517  -5.207   5.127
  346    HB   THR  27           HB       THR  27  -6.795  -4.750   2.723
  347    HG1  THR  27           HG1      THR  27  -7.347  -6.866   2.079
  348   HG21  THR  27          1HG2      THR  27  -4.594  -4.455   3.810
  349   HG22  THR  27          2HG2      THR  27  -4.167  -6.132   3.397
  350   HG23  THR  27          3HG2      THR  27  -4.448  -4.943   2.113
  351    HA   PRO  28           HA       PRO  28 -10.718  -7.132   5.265
  352    HB2  PRO  28           2HB      PRO  28 -11.574  -6.255   7.704
  353    HB3  PRO  28           3HB      PRO  28 -10.455  -7.632   7.497
  354    HG2  PRO  28           2HG      PRO  28  -9.750  -4.738   8.101
  355    HG3  PRO  28           3HG      PRO  28  -9.190  -6.207   8.964
  356    HD2  PRO  28           2HD      PRO  28  -7.699  -5.013   7.026
  357    HD3  PRO  28           3HD      PRO  28  -7.733  -6.791   7.203
  358    H    LYS  29           H        LYS  29  -9.699  -3.853   5.344
  359    HA   LYS  29           HA       LYS  29 -10.592  -1.818   4.909
  360    HB2  LYS  29           2HB      LYS  29 -12.866  -3.313   3.552
  361    HB3  LYS  29           3HB      LYS  29 -12.497  -1.601   3.381
  362    HG2  LYS  29           2HG      LYS  29 -10.301  -2.133   2.394
  363    HG3  LYS  29           3HG      LYS  29 -10.645  -3.869   2.535
  364    HD2  LYS  29           2HD      LYS  29 -12.635  -3.610   1.093
  365    HD3  LYS  29           3HD      LYS  29 -12.301  -1.886   0.903
  366    HE2  LYS  29           2HE      LYS  29 -10.388  -4.124   0.087
  367    HE3  LYS  29           3HE      LYS  29 -11.561  -3.383  -1.005
  368    HZ1  LYS  29           HZ1      LYS  29  -9.405  -2.334  -1.245
  369    HZ2  LYS  29           HZ2      LYS  29 -10.459  -1.240  -0.654
  370    HZ3  LYS  29           HZ3      LYS  29  -9.348  -1.923   0.334
  371    H    THR  30           H        THR  30 -12.664  -0.415   5.098
  372    HA   THR  30           HA       THR  30 -14.080  -0.970   7.678
  373    HB   THR  30           HB       THR  30 -12.889   1.709   6.877
  374    HG1  THR  30           HG1      THR  30 -11.297   0.265   7.511
  375   HG21  THR  30          1HG2      THR  30 -14.899   1.959   8.283
  376   HG22  THR  30          2HG2      THR  30 -14.267   0.761   9.435
  377   HG23  THR  30          3HG2      THR  30 -13.448   2.326   9.222
  Start of MODEL   21
    1    H1   GLY   1           1H       GLY   1  -0.001  -3.777  13.244
    2    H2   GLY   1           2H       GLY   1   0.255  -2.242  12.732
    3    H3   GLY   1           3H       GLY   1  -0.491  -3.319  11.748
    4    HA2  GLY   1           HA2      GLY   1   2.314  -3.489  12.646
    5    HA3  GLY   1           HA3      GLY   1   1.503  -4.663  11.593
    6    H    ILE   2           H        ILE   2   3.655  -2.268  11.495
    7    HA   ILE   2           HA       ILE   2   4.480  -0.755  10.084
    8    HB   ILE   2           HB       ILE   2   2.865  -1.761   7.755
    9   HG12  ILE   2          2HG1      ILE   2   3.639  -3.852   8.787
   10   HG13  ILE   2          3HG1      ILE   2   4.414  -3.529   7.264
   11   HG21  ILE   2          1HG2      ILE   2   4.300   0.011   7.091
   12   HG22  ILE   2          2HG2      ILE   2   5.641  -0.559   8.118
   13   HG23  ILE   2          3HG2      ILE   2   5.187  -1.433   6.653
   14   HD11  ILE   2          3HD1      ILE   2   5.983  -4.444   8.918
   15   HD12  ILE   2          1HD1      ILE   2   6.484  -2.842   8.363
   16   HD13  ILE   2          2HD1      ILE   2   5.728  -3.032   9.965
   17    H    VAL   3           H        VAL   3   3.916   1.139   8.531
   18    HA   VAL   3           HA       VAL   3   1.176   2.181   8.837
   19    HB   VAL   3           HB       VAL   3   2.380   3.063  10.779
   20   HG11  VAL   3          1HG1      VAL   3   4.217   4.507   8.824
   21   HG12  VAL   3          2HG1      VAL   3   4.170   4.701  10.585
   22   HG13  VAL   3          3HG1      VAL   3   4.689   3.161   9.885
   23   HG21  VAL   3          3HG2      VAL   3   1.786   5.386  10.532
   24   HG22  VAL   3          1HG2      VAL   3   1.807   5.270   8.764
   25   HG23  VAL   3          2HG2      VAL   3   0.579   4.389   9.708
   26    H    GLU   4           H        GLU   4   0.533   3.544   7.179
   27    HA   GLU   4           HA       GLU   4   1.993   3.135   4.712
   28    HB2  GLU   4           2HB      GLU   4   0.033   3.963   3.593
   29    HB3  GLU   4           3HB      GLU   4  -0.338   2.701   4.763
   30    HG2  GLU   4           2HG      GLU   4  -1.134   4.458   6.361
   31    HG3  GLU   4           3HG      GLU   4  -0.879   5.680   5.115
   32    H    GLN   5           H        GLN   5   3.716   4.614   5.990
   33    HA   GLN   5           HA       GLN   5   3.615   7.436   5.670
   34    HB2  GLN   5           2HB      GLN   5   5.198   6.115   7.075
   35    HB3  GLN   5           3HB      GLN   5   6.045   5.595   5.612
   36    HG2  GLN   5           2HG      GLN   5   6.689   7.922   5.131
   37    HG3  GLN   5           3HG      GLN   5   5.692   8.507   6.469
   38   HE21  GLN   5          2HE2      GLN   5   8.594   6.475   5.729
   39   HE22  GLN   5          1HE2      GLN   5   9.336   6.757   7.297
   40    H    CYS   6           H        CYS   6   4.076   4.978   3.233
   41    HA   CYS   6           HA       CYS   6   5.246   6.626   1.202
   42    HB2  CYS   6           2HB      CYS   6   5.202   4.122   1.356
   43    HB3  CYS   6           3HB      CYS   6   3.527   4.168   0.801
   44    H    CYS   7           H        CYS   7   2.197   6.952   2.624
   45    HA   CYS   7           HA       CYS   7   0.743   7.991   0.349
   46    HB2  CYS   7           2HB      CYS   7  -0.143   7.117   2.594
   47    HB3  CYS   7           3HB      CYS   7   0.365   8.651   3.287
   48    H    THR   8           H        THR   8   3.211   9.331   2.479
   49    HA   THR   8           HA       THR   8   2.929  12.032   1.193
   50    HB   THR   8           HB       THR   8   3.795  12.990   3.308
   51    HG1  THR   8           HG1      THR   8   3.705  11.692   5.157
   52   HG21  THR   8          1HG2      THR   8   1.716  12.873   4.568
   53   HG22  THR   8          2HG2      THR   8   1.343  12.937   2.838
   54   HG23  THR   8          3HG2      THR   8   1.224  11.395   3.714
   55    H    SER   9           H        SER   9   5.200   9.637   2.514
   56    HA   SER   9           HA       SER   9   7.453  10.868   0.994
   57    HB2  SER   9           2HB      SER   9   7.772  10.003   3.347
   58    HB3  SER   9           3HB      SER   9   7.475   8.369   2.717
   59    HG   SER   9           HG       SER   9   9.731   8.987   2.791
   60    H    ILE  10           H        ILE  10   8.782   8.977  -0.165
   61    HA   ILE  10           HA       ILE  10   6.864   7.442  -1.899
   62    HB   ILE  10           HB       ILE  10   9.370   8.929  -2.728
   63   HG12  ILE  10          2HG1      ILE  10   6.469   9.333  -3.618
   64   HG13  ILE  10          3HG1      ILE  10   7.206  10.265  -2.322
   65   HG21  ILE  10          1HG2      ILE  10   8.794   8.194  -5.040
   66   HG22  ILE  10          2HG2      ILE  10   9.191   6.827  -4.015
   67   HG23  ILE  10          3HG2      ILE  10   7.488   7.185  -4.390
   68   HD11  ILE  10          3HD1      ILE  10   8.100  10.300  -5.212
   69   HD12  ILE  10          1HD1      ILE  10   7.297  11.581  -4.290
   70   HD13  ILE  10          2HD1      ILE  10   8.947  11.094  -3.856
   71    H    CYS  11           H        CYS  11   7.318   5.381  -2.391
   72    HA   CYS  11           HA       CYS  11   9.669   4.059  -1.122
   73    HB2  CYS  11           2HB      CYS  11   8.205   2.379  -0.208
   74    HB3  CYS  11           3HB      CYS  11   7.691   3.956   0.365
   75    H    SER  12           H        SER  12   9.875   1.743  -1.820
   76    HA   SER  12           HA       SER  12   8.940   1.170  -4.581
   77    HB2  SER  12           2HB      SER  12  11.213   2.332  -4.601
   78    HB3  SER  12           3HB      SER  12  11.857   0.899  -3.780
   79    HG   SER  12           HG       SER  12  12.035   0.777  -6.085
   80    H    LEU  13           H        LEU  13   9.934  -1.111  -5.159
   81    HA   LEU  13           HA       LEU  13   8.528  -3.075  -3.755
   82    HB2  LEU  13           2HB      LEU  13   9.305  -3.202  -6.046
   83    HB3  LEU  13           3HB      LEU  13  10.990  -3.262  -5.547
   84    HG   LEU  13           HG       LEU  13   9.104  -5.413  -4.565
   85   HD11  LEU  13          1HD1      LEU  13  10.374  -5.356  -7.332
   86   HD12  LEU  13          2HD1      LEU  13   9.515  -6.733  -6.603
   87   HD13  LEU  13          3HD1      LEU  13   8.636  -5.245  -6.980
   88   HD21  LEU  13          3HD2      LEU  13  12.029  -5.456  -5.436
   89   HD22  LEU  13          1HD2      LEU  13  11.446  -5.493  -3.760
   90   HD23  LEU  13          2HD2      LEU  13  11.108  -6.847  -4.829
   91    H    TYR  14           H        TYR  14  11.980  -2.230  -3.345
   92    HA   TYR  14           HA       TYR  14  12.714  -4.186  -1.444
   93    HB2  TYR  14           2HB      TYR  14  14.346  -2.824  -2.564
   94    HB3  TYR  14           3HB      TYR  14  13.622  -1.334  -1.972
   95    HD1  TYR  14           HD2      TYR  14  15.534  -4.372  -0.907
   96    HD2  TYR  14           HD1      TYR  14  14.203  -0.402   0.141
   97    HE1  TYR  14           HE2      TYR  14  16.992  -4.415   1.112
   98    HE2  TYR  14           HE1      TYR  14  15.636  -0.462   2.180
   99    HH   TYR  14           HH       TYR  14  17.697  -3.287   2.979
  100    H    GLN  15           H        GLN  15  10.928  -1.156  -0.926
  101    HA   GLN  15           HA       GLN  15  11.085  -1.347   2.023
  102    HB2  GLN  15           2HB      GLN  15   9.474   0.474   0.190
  103    HB3  GLN  15           3HB      GLN  15   9.517   0.603   1.941
  104    HG2  GLN  15           2HG      GLN  15  12.017   0.843   0.218
  105    HG3  GLN  15           3HG      GLN  15  10.986   2.208   0.622
  106   HE21  GLN  15          2HE2      GLN  15  13.084  -0.321   2.166
  107   HE22  GLN  15          1HE2      GLN  15  13.343   0.643   3.610
  108    H    LEU  16           H        LEU  16   8.696  -1.868  -0.580
  109    HA   LEU  16           HA       LEU  16   6.513  -2.591   1.149
  110    HB2  LEU  16           2HB      LEU  16   7.041  -3.282  -1.753
  111    HB3  LEU  16           3HB      LEU  16   5.529  -3.594  -0.913
  112    HG   LEU  16           HG       LEU  16   6.772  -0.999  -1.748
  113   HD11  LEU  16          1HD1      LEU  16   5.248  -2.205  -3.299
  114   HD12  LEU  16          2HD1      LEU  16   3.955  -2.099  -2.089
  115   HD13  LEU  16          3HD1      LEU  16   4.618  -0.624  -2.830
  116   HD21  LEU  16          3HD2      LEU  16   4.897   0.231  -0.617
  117   HD22  LEU  16          1HD2      LEU  16   4.480  -1.262   0.243
  118   HD23  LEU  16          2HD2      LEU  16   6.049  -0.465   0.521
  119    H    GLU  17           H        GLU  17   9.166  -4.600  -0.103
  120    HA   GLU  17           HA       GLU  17   8.155  -7.134   0.708
  121    HB2  GLU  17           2HB      GLU  17  10.965  -5.981   0.602
  122    HB3  GLU  17           3HB      GLU  17  10.654  -7.593   1.235
  123    HG2  GLU  17           2HG      GLU  17   9.439  -8.128  -0.938
  124    HG3  GLU  17           3HG      GLU  17  10.102  -6.628  -1.587
  125    H    ASN  18           H        ASN  18   9.294  -4.484   2.805
  126    HA   ASN  18           HA       ASN  18   9.835  -6.102   5.102
  127    HB2  ASN  18           2HB      ASN  18  10.631  -3.748   4.663
  128    HB3  ASN  18           3HB      ASN  18   8.989  -3.176   4.980
  129   HD21  ASN  18          2HD2      ASN  18  11.656  -5.070   6.510
  130   HD22  ASN  18          1HD2      ASN  18  11.280  -4.505   8.130
  131    H    TYR  19           H        TYR  19   6.802  -5.287   3.697
  132    HA   TYR  19           HA       TYR  19   5.154  -5.500   6.094
  133    HB2  TYR  19           2HB      TYR  19   4.561  -5.549   3.133
  134    HB3  TYR  19           3HB      TYR  19   3.337  -5.683   4.375
  135    HD1  TYR  19           HD2      TYR  19   6.100  -3.322   3.297
  136    HD2  TYR  19           HD1      TYR  19   2.260  -3.824   5.205
  137    HE1  TYR  19           HE2      TYR  19   5.823  -0.876   3.380
  138    HE2  TYR  19           HE1      TYR  19   1.979  -1.368   5.266
  139    HH   TYR  19           HH       TYR  19   4.435   0.877   3.923
  140    H    CYS  20           H        CYS  20   6.776  -7.852   4.108
  141    HA   CYS  20           HA       CYS  20   5.076 -10.063   5.159
  142    HB2  CYS  20           2HB      CYS  20   4.875 -10.967   2.840
  143    HB3  CYS  20           3HB      CYS  20   4.004  -9.471   3.143
  144    H    ASN  21           H        ASN  21   8.135  -9.270   3.426
  145    HA   ASN  21           HA       ASN  21   9.170 -11.991   3.805
  146    HB2  ASN  21           2HB      ASN  21   9.611 -10.651   1.748
  147    HB3  ASN  21           3HB      ASN  21  10.510  -9.480   2.717
  148   HD21  ASN  21          2HD2      ASN  21  11.961 -10.451   0.702
  149   HD22  ASN  21          1HD2      ASN  21  13.066 -11.694   1.284
  150    H1   PHE   1           H        PHE   1   4.929   4.557  -6.273
  151    HA   PHE   1           HA       PHE   1   6.617   2.694  -5.833
  152    HB2  PHE   1           2HB      PHE   1   5.809   2.136  -8.707
  153    HB3  PHE   1           3HB      PHE   1   7.348   1.613  -8.061
  154    HD1  PHE   1           HD1      PHE   1   7.494  -0.017  -6.187
  155    HD2  PHE   1           HD2      PHE   1   3.789   0.831  -8.228
  156    HE1  PHE   1           HE1      PHE   1   6.568  -2.180  -5.410
  157    HE2  PHE   1           HE2      PHE   1   2.863  -1.329  -7.442
  158    HZ   PHE   1           HZ       PHE   1   4.251  -2.844  -6.041
  159    H    VAL   2           H        VAL   2   8.551   3.462  -5.777
  160    HA   VAL   2           HA       VAL   2  10.452   4.494  -5.962
  161    HB   VAL   2           HB       VAL   2  10.595   2.754  -7.673
  162   HG11  VAL   2          1HG1      VAL   2  10.835   3.327 -10.037
  163   HG12  VAL   2          2HG1      VAL   2   9.195   3.652  -9.484
  164   HG13  VAL   2          3HG1      VAL   2  10.337   4.997  -9.720
  165   HG21  VAL   2          3HG2      VAL   2  12.570   3.997  -6.861
  166   HG22  VAL   2          1HG2      VAL   2  12.747   3.445  -8.533
  167   HG23  VAL   2          2HG2      VAL   2  12.388   5.151  -8.203
  168    H    ASN   3           H        ASN   3   8.416   6.084  -8.380
  169    HA   ASN   3           HA       ASN   3   9.670   8.706  -7.666
  170    HB2  ASN   3           2HB      ASN   3  10.258   7.839  -9.940
  171    HB3  ASN   3           3HB      ASN   3   8.542   7.783 -10.348
  172   HD21  ASN   3          2HD2      ASN   3  11.102  10.074  -9.225
  173   HD22  ASN   3          1HD2      ASN   3  10.436  11.436 -10.112
  174    H    GLN   4           H        GLN   4   6.816   6.881  -7.452
  175    HA   GLN   4           HA       GLN   4   5.229   9.331  -6.891
  176    HB2  GLN   4           2HB      GLN   4   3.278   8.442  -7.973
  177    HB3  GLN   4           3HB      GLN   4   4.608   8.560  -9.129
  178    HG2  GLN   4           2HG      GLN   4   5.013   6.105  -8.887
  179    HG3  GLN   4           3HG      GLN   4   3.662   6.001  -7.754
  180   HE21  GLN   4          1HE2      GLN   4   3.333   4.301  -9.690
  181   HE22  GLN   4          2HE2      GLN   4   2.239   4.898 -10.933
  182    H    HIS   5           H        HIS   5   3.655   9.207  -5.385
  183    HA   HIS   5           HA       HIS   5   4.095   7.597  -3.082
  184    HB2  HIS   5           2HB      HIS   5   1.730   9.352  -3.868
  185    HB3  HIS   5           3HB      HIS   5   2.104   8.805  -2.239
  186    HD2  HIS   5           HD2      HIS   5   3.881  10.148  -0.866
  187    HE1  HIS   5           HE1      HIS   5   5.126  12.909  -3.859
  188    HE2  HIS   5           HE2      HIS   5   5.262  12.322  -1.371
  189    H    LEU   6           H        LEU   6   2.615   6.251  -1.953
  190    HA   LEU   6           HA       LEU   6   0.471   4.868  -3.482
  191    HB2  LEU   6           2HB      LEU   6   2.739   3.498  -1.989
  192    HB3  LEU   6           3HB      LEU   6   1.274   2.689  -2.513
  193    HG   LEU   6           HG       LEU   6   3.227   4.014  -4.445
  194   HD11  LEU   6          1HD1      LEU   6   2.986   1.148  -3.480
  195   HD12  LEU   6          2HD1      LEU   6   3.905   1.638  -4.922
  196   HD13  LEU   6          3HD1      LEU   6   4.380   2.228  -3.326
  197   HD21  LEU   6          3HD2      LEU   6   0.958   3.740  -5.376
  198   HD22  LEU   6          1HD2      LEU   6   2.065   2.579  -6.110
  199   HD23  LEU   6          2HD2      LEU   6   0.930   2.040  -4.854
  200    H    CYS   7           H        CYS   7  -1.334   4.954  -2.320
  201    HA   CYS   7           HA       CYS   7  -1.266   4.881   0.654
  202    HB2  CYS   7           2HB      CYS   7  -1.158   7.243  -0.358
  203    HB3  CYS   7           3HB      CYS   7  -2.796   6.978  -0.927
  204    H    GLY   8           H        GLY   8  -3.230   4.155   1.627
  205    HA2  GLY   8           HA2      GLY   8  -5.158   2.895   1.769
  206    HA3  GLY   8           HA3      GLY   8  -5.737   3.911   0.451
  207    H    SER   9           H        SER   9  -6.790   2.529  -0.888
  208    HA   SER   9           HA       SER   9  -6.300  -0.188  -1.338
  209    HB2  SER   9           2HB      SER   9  -7.477   1.812  -3.306
  210    HB3  SER   9           3HB      SER   9  -7.710   0.053  -3.315
  211    HG   SER   9           HG       SER   9  -9.458   1.159  -2.300
  212    H    HIS  10           H        HIS  10  -4.778   2.590  -3.027
  213    HA   HIS  10           HA       HIS  10  -3.566   0.999  -5.121
  214    HB2  HIS  10           2HB      HIS  10  -2.751   3.716  -4.015
  215    HB3  HIS  10           3HB      HIS  10  -2.198   2.999  -5.523
  216    HD2  HIS  10           HD2      HIS  10  -3.959   2.867  -7.581
  217    HE1  HIS  10           HE1      HIS  10  -6.932   5.406  -5.869
  218    HE2  HIS  10           HE2      HIS  10  -6.167   4.247  -8.005
  219    H    LEU  11           H        LEU  11  -2.537   1.874  -1.830
  220    HA   LEU  11           HA       LEU  11   0.119   0.699  -2.120
  221    HB2  LEU  11           2HB      LEU  11  -0.325   2.451  -0.464
  222    HB3  LEU  11           3HB      LEU  11  -1.507   1.427   0.343
  223    HG   LEU  11           HG       LEU  11   0.263  -0.164   0.973
  224   HD11  LEU  11          1HD1      LEU  11   2.646   0.442   0.725
  225   HD12  LEU  11          2HD1      LEU  11   1.904   0.160  -0.851
  226   HD13  LEU  11          3HD1      LEU  11   2.200   1.826  -0.292
  227   HD21  LEU  11          3HD2      LEU  11  -0.319   1.707   2.454
  228   HD22  LEU  11          1HD2      LEU  11   1.387   1.259   2.613
  229   HD23  LEU  11          2HD2      LEU  11   0.935   2.712   1.687
  230    H    VAL  12           H        VAL  12  -3.072  -0.483  -0.959
  231    HA   VAL  12           HA       VAL  12  -2.174  -3.093  -0.168
  232    HB   VAL  12           HB       VAL  12  -4.881  -2.180  -1.205
  233   HG11  VAL  12          1HG1      VAL  12  -4.779  -4.586  -1.519
  234   HG12  VAL  12          2HG1      VAL  12  -4.125  -4.815   0.117
  235   HG13  VAL  12          3HG1      VAL  12  -5.785  -4.227  -0.118
  236   HG21  VAL  12          3HG2      VAL  12  -3.888  -2.754   1.625
  237   HG22  VAL  12          1HG2      VAL  12  -4.153  -1.139   0.949
  238   HG23  VAL  12          2HG2      VAL  12  -5.522  -2.230   1.169
  239    H    GLU  13           H        GLU  13  -3.373  -1.946  -3.380
  240    HA   GLU  13           HA       GLU  13  -2.927  -4.444  -4.728
  241    HB2  GLU  13           2HB      GLU  13  -3.026  -1.570  -5.721
  242    HB3  GLU  13           3HB      GLU  13  -2.804  -2.959  -6.791
  243    HG2  GLU  13           2HG      GLU  13  -4.923  -3.953  -5.981
  244    HG3  GLU  13           3HG      GLU  13  -5.194  -2.559  -4.940
  245    H    ALA  14           H        ALA  14  -0.710  -1.618  -4.301
  246    HA   ALA  14           HA       ALA  14   1.474  -2.721  -5.756
  247    HB1  ALA  14           3HB      ALA  14   1.422  -0.793  -3.399
  248    HB2  ALA  14           1HB      ALA  14   2.792  -1.059  -4.487
  249    HB3  ALA  14           2HB      ALA  14   1.292  -0.363  -5.122
  250    H    LEU  15           H        LEU  15   0.573  -3.098  -2.302
  251    HA   LEU  15           HA       LEU  15   2.833  -4.723  -1.589
  252    HB2  LEU  15           2HB      LEU  15   0.075  -4.242  -0.408
  253    HB3  LEU  15           3HB      LEU  15   1.174  -5.411   0.313
  254    HG   LEU  15           HG       LEU  15   2.072  -2.546  -0.211
  255   HD11  LEU  15          1HD1      LEU  15   0.902  -3.633   2.375
  256   HD12  LEU  15          2HD1      LEU  15   1.546  -2.005   2.094
  257   HD13  LEU  15          3HD1      LEU  15   0.057  -2.521   1.280
  258   HD21  LEU  15          3HD2      LEU  15   3.800  -4.319   0.269
  259   HD22  LEU  15          1HD2      LEU  15   3.697  -3.085   1.528
  260   HD23  LEU  15          2HD2      LEU  15   2.948  -4.678   1.771
  261    H    TYR  16           H        TYR  16  -0.420  -5.620  -2.848
  262    HA   TYR  16           HA       TYR  16   0.165  -8.446  -2.771
  263    HB2  TYR  16           2HB      TYR  16  -1.866  -6.823  -4.321
  264    HB3  TYR  16           3HB      TYR  16  -1.797  -8.576  -4.346
  265    HD1  TYR  16           HD2      TYR  16  -0.988  -8.562  -1.128
  266    HD2  TYR  16           HD1      TYR  16  -4.212  -7.009  -3.560
  267    HE1  TYR  16           HE2      TYR  16  -2.501  -8.767   0.765
  268    HE2  TYR  16           HE1      TYR  16  -5.744  -7.207  -1.614
  269    HH   TYR  16           HH       TYR  16  -5.963  -7.807   0.588
  270    H    LEU  17           H        LEU  17   0.950  -5.975  -5.185
  271    HA   LEU  17           HA       LEU  17   1.926  -7.801  -7.192
  272    HB2  LEU  17           2HB      LEU  17   1.975  -4.886  -6.610
  273    HB3  LEU  17           3HB      LEU  17   3.438  -5.439  -7.375
  274    HG   LEU  17           HG       LEU  17   1.789  -4.549  -8.941
  275   HD11  LEU  17          1HD1      LEU  17   2.292  -7.522  -9.388
  276   HD12  LEU  17          2HD1      LEU  17   1.950  -6.300 -10.628
  277   HD13  LEU  17          3HD1      LEU  17   3.455  -6.217  -9.698
  278   HD21  LEU  17          3HD2      LEU  17  -0.219  -5.784  -9.566
  279   HD22  LEU  17          1HD2      LEU  17   0.073  -6.978  -8.285
  280   HD23  LEU  17          2HD2      LEU  17  -0.298  -5.293  -7.869
  281    H    VAL  18           H        VAL  18   3.425  -6.443  -4.284
  282    HA   VAL  18           HA       VAL  18   6.098  -7.474  -5.002
  283    HB   VAL  18           HB       VAL  18   5.046  -5.763  -2.727
  284   HG11  VAL  18          1HG1      VAL  18   6.888  -6.932  -1.718
  285   HG12  VAL  18          2HG1      VAL  18   7.882  -6.771  -3.184
  286   HG13  VAL  18          3HG1      VAL  18   7.483  -5.344  -2.207
  287   HG21  VAL  18          3HG2      VAL  18   6.456  -4.062  -3.874
  288   HG22  VAL  18          1HG2      VAL  18   6.866  -5.255  -5.124
  289   HG23  VAL  18          2HG2      VAL  18   5.200  -4.696  -4.936
  290    H    CYS  19           H        CYS  19   3.732  -8.068  -2.397
  291    HA   CYS  19           HA       CYS  19   5.247 -10.343  -1.323
  292    HB2  CYS  19           2HB      CYS  19   2.458  -9.313  -0.718
  293    HB3  CYS  19           3HB      CYS  19   3.336 -10.518   0.215
  294    H    GLY  20           H        GLY  20   5.407 -11.878  -2.945
  295    HA2  GLY  20           HA2      GLY  20   3.356 -12.638  -4.765
  296    HA3  GLY  20           HA3      GLY  20   4.807 -13.571  -4.383
  297    H    GLU  21           H        GLU  21   4.069 -13.852  -1.520
  298    HA   GLU  21           HA       GLU  21   2.025 -15.987  -1.642
  299    HB2  GLU  21           2HB      GLU  21   4.012 -16.405  -0.333
  300    HB3  GLU  21           3HB      GLU  21   3.811 -14.905   0.567
  301    HG2  GLU  21           2HG      GLU  21   3.177 -16.896   1.880
  302    HG3  GLU  21           3HG      GLU  21   1.862 -15.744   1.712
  303    H    ARG  22           H        ARG  22  -0.090 -15.561  -1.361
  304    HA   ARG  22           HA       ARG  22  -0.958 -12.875  -0.659
  305    HB2  ARG  22           2HB      ARG  22  -1.924 -14.353  -2.502
  306    HB3  ARG  22           3HB      ARG  22  -2.696 -15.297  -1.236
  307    HG2  ARG  22           2HG      ARG  22  -4.235 -13.680  -2.266
  308    HG3  ARG  22           3HG      ARG  22  -4.037 -13.359  -0.551
  309    HD2  ARG  22           2HD      ARG  22  -4.100 -11.287  -1.862
  310    HD3  ARG  22           3HD      ARG  22  -2.573 -11.448  -1.023
  311    HE   ARG  22           HE       ARG  22  -3.049 -11.930  -3.955
  312   HH11  ARG  22          2HH1      ARG  22  -0.722 -11.056  -1.472
  313   HH12  ARG  22          1HH1      ARG  22   0.579 -10.952  -2.634
  314   HH21  ARG  22          1HH2      ARG  22  -1.374 -11.542  -5.367
  315   HH22  ARG  22          2HH2      ARG  22   0.106 -10.848  -4.756
  316    H    GLY  23           H        GLY  23  -0.505 -15.733   1.194
  317    HA2  GLY  23           HA2      GLY  23  -2.017 -14.886   3.538
  318    HA3  GLY  23           HA3      GLY  23  -0.619 -15.969   3.499
  319    H    DHI  24           H        DHI  24   1.045 -13.908   2.097
  320    HA   DHI  24           HA       DHI  24   2.412 -12.166   2.395
  321    HB2  DHI  24           2HB      DHI  24   3.332 -11.699   4.638
  322    HB3  DHI  24           3HB      DHI  24   2.135 -12.773   5.350
  323    HD2  DHI  24           HD2      DHI  24   2.723 -15.328   5.342
  324    HE1  DHI  24           HE1      DHI  24   6.160 -15.245   2.814
  325    HE2  DHI  24           HE2      DHI  24   4.743 -16.710   4.343
  326    H    PHE  25           H        PHE  25   2.217 -10.150   4.663
  327    HA   PHE  25           HA       PHE  25   1.127  -8.277   5.242
  328    HB2  PHE  25           2HB      PHE  25   1.882  -7.510   3.124
  329    HB3  PHE  25           3HB      PHE  25   0.541  -8.264   2.279
  330    HD1  PHE  25           HD2      PHE  25   0.858  -5.939   5.258
  331    HD2  PHE  25           HD1      PHE  25  -0.981  -6.711   1.428
  332    HE1  PHE  25           HE2      PHE  25  -0.527  -3.899   5.504
  333    HE2  PHE  25           HE1      PHE  25  -2.369  -4.681   1.691
  334    HZ   PHE  25           HZ       PHE  25  -2.159  -3.274   3.735
  335    H    TYR  26           H        TYR  26  -1.532  -8.457   3.080
  336    HA   TYR  26           HA       TYR  26  -3.725  -8.765   3.212
  337    HB2  TYR  26           2HB      TYR  26  -3.054 -11.052   3.253
  338    HB3  TYR  26           3HB      TYR  26  -2.866 -11.039   4.997
  339    HD1  TYR  26           HD2      TYR  26  -5.568 -10.136   2.507
  340    HD2  TYR  26           HD1      TYR  26  -4.519 -12.147   6.178
  341    HE1  TYR  26           HE2      TYR  26  -7.932 -10.865   2.786
  342    HE2  TYR  26           HE1      TYR  26  -6.876 -12.886   6.448
  343    HH   TYR  26           HH       TYR  26  -8.999 -12.858   5.573
  344    H    THR  27           H        THR  27  -2.624  -8.888   6.596
  345    HA   THR  27           HA       THR  27  -3.526  -8.073   8.539
  346    HB   THR  27           HB       THR  27  -3.602  -5.613   8.555
  347    HG1  THR  27           HG1      THR  27  -4.467  -5.320   6.459
  348   HG21  THR  27          1HG2      THR  27  -1.285  -5.266   7.903
  349   HG22  THR  27          2HG2      THR  27  -1.452  -6.839   8.702
  350   HG23  THR  27          3HG2      THR  27  -1.289  -6.753   6.934
  351    HA   PRO  28           HA       PRO  28  -8.050  -8.196   7.516
  352    HB2  PRO  28           2HB      PRO  28  -8.798 -10.339   9.025
  353    HB3  PRO  28           3HB      PRO  28  -8.035 -10.507   7.415
  354    HG2  PRO  28           2HG      PRO  28  -6.692 -10.650  10.136
  355    HG3  PRO  28           3HG      PRO  28  -6.544 -11.805   8.773
  356    HD2  PRO  28           2HD      PRO  28  -4.716  -9.827   9.217
  357    HD3  PRO  28           3HD      PRO  28  -5.156 -10.330   7.560
  358    H    LYS  29           H        LYS  29  -9.875  -7.709   8.839
  359    HA   LYS  29           HA       LYS  29  -9.272  -6.198  11.299
  360    HB2  LYS  29           2HB      LYS  29 -11.854  -6.587   9.730
  361    HB3  LYS  29           3HB      LYS  29 -11.684  -5.567  11.164
  362    HG2  LYS  29           2HG      LYS  29  -9.962  -4.200   9.997
  363    HG3  LYS  29           3HG      LYS  29 -10.185  -5.179   8.534
  364    HD2  LYS  29           2HD      LYS  29 -12.571  -4.502   8.439
  365    HD3  LYS  29           3HD      LYS  29 -12.348  -3.515   9.903
  366    HE2  LYS  29           2HE      LYS  29 -10.620  -2.169   8.725
  367    HE3  LYS  29           3HE      LYS  29 -10.847  -3.146   7.269
  368    HZ1  LYS  29           HZ1      LYS  29 -13.154  -2.357   7.181
  369    HZ2  LYS  29           HZ2      LYS  29 -12.944  -1.454   8.527
  370    HZ3  LYS  29           HZ3      LYS  29 -12.131  -1.087   7.161
  371    H    THR  30           H        THR  30 -10.403  -6.431  13.250
  372    HA   THR  30           HA       THR  30 -11.481  -9.131  13.942
  373    HB   THR  30           HB       THR  30  -9.432  -7.607  15.591
  374    HG1  THR  30           HG1      THR  30  -8.058  -9.273  14.980
  375   HG21  THR  30          1HG2      THR  30 -10.677 -10.379  15.933
  376   HG22  THR  30          2HG2      THR  30  -9.341  -9.721  16.907
  377   HG23  THR  30          3HG2      THR  30 -10.940  -8.975  16.992
  Start of MODEL   22
    1    H1   GLY   1           1H       GLY   1   4.927   0.232  12.958
    2    H2   GLY   1           2H       GLY   1   4.796  -1.134  13.872
    3    H3   GLY   1           3H       GLY   1   6.270  -0.459  13.591
    4    HA2  GLY   1           HA2      GLY   1   6.077  -0.893  11.236
    5    HA3  GLY   1           HA3      GLY   1   6.048  -2.381  12.200
    6    H    ILE   2           H        ILE   2   2.970  -2.020   9.814
    7    HA   ILE   2           HA       ILE   2   5.776  -1.065   9.383
    8    HB   ILE   2           HB       ILE   2   3.875  -1.791   7.209
    9   HG12  ILE   2          2HG1      ILE   2   3.664  -3.777   8.617
   10   HG13  ILE   2          3HG1      ILE   2   4.435  -4.081   7.082
   11   HG21  ILE   2          1HG2      ILE   2   6.899  -1.887   7.539
   12   HG22  ILE   2          2HG2      ILE   2   6.058  -2.584   6.142
   13   HG23  ILE   2          3HG2      ILE   2   5.943  -0.855   6.457
   14   HD11  ILE   2          3HD1      ILE   2   5.928  -3.822   9.707
   15   HD12  ILE   2          1HD1      ILE   2   5.505  -5.333   8.860
   16   HD13  ILE   2          2HD1      ILE   2   6.634  -4.194   8.112
   17    H    VAL   3           H        VAL   3   2.526   0.090   9.465
   18    HA   VAL   3           HA       VAL   3   2.418   1.705   7.191
   19    HB   VAL   3           HB       VAL   3   0.555   2.915   8.265
   20   HG11  VAL   3          1HG1      VAL   3  -0.928   0.997   8.472
   21   HG12  VAL   3          2HG1      VAL   3   0.202   0.755   7.133
   22   HG13  VAL   3          3HG1      VAL   3   0.451  -0.101   8.672
   23   HG21  VAL   3          3HG2      VAL   3   1.346   2.996  10.611
   24   HG22  VAL   3          1HG2      VAL   3  -0.259   2.270  10.480
   25   HG23  VAL   3          2HG2      VAL   3   1.155   1.233  10.743
   26    H    GLU   4           H        GLU   4   4.001   2.581  10.225
   27    HA   GLU   4           HA       GLU   4   4.186   5.396   9.571
   28    HB2  GLU   4           2HB      GLU   4   5.521   5.622  11.458
   29    HB3  GLU   4           3HB      GLU   4   4.316   4.424  11.877
   30    HG2  GLU   4           2HG      GLU   4   7.233   3.913  11.154
   31    HG3  GLU   4           3HG      GLU   4   6.547   3.896  12.768
   32    H    GLN   5           H        GLN   5   5.752   2.721   8.177
   33    HA   GLN   5           HA       GLN   5   8.138   4.232   7.288
   34    HB2  GLN   5           2HB      GLN   5   7.253   1.452   6.446
   35    HB3  GLN   5           3HB      GLN   5   8.833   2.185   6.234
   36    HG2  GLN   5           2HG      GLN   5   7.562   1.331   8.867
   37    HG3  GLN   5           3HG      GLN   5   8.860   0.515   8.022
   38   HE21  GLN   5          2HE2      GLN   5   8.626   1.864  10.780
   39   HE22  GLN   5          1HE2      GLN   5  10.090   2.860  10.825
   40    H    CYS   6           H        CYS   6   5.102   2.918   5.923
   41    HA   CYS   6           HA       CYS   6   5.698   4.249   3.313
   42    HB2  CYS   6           2HB      CYS   6   4.687   1.429   3.805
   43    HB3  CYS   6           3HB      CYS   6   4.816   2.192   2.230
   44    H    CYS   7           H        CYS   7   3.387   4.482   5.672
   45    HA   CYS   7           HA       CYS   7   1.304   5.078   3.629
   46    HB2  CYS   7           2HB      CYS   7   0.601   3.522   5.434
   47    HB3  CYS   7           3HB      CYS   7   0.910   4.810   6.600
   48    H    THR   8           H        THR   8   0.441   7.130   3.479
   49    HA   THR   8           HA       THR   8   0.674   9.337   3.142
   50    HB   THR   8           HB       THR   8   0.731  10.853   5.001
   51    HG1  THR   8           HG1      THR   8   1.832   8.664   6.315
   52   HG21  THR   8          1HG2      THR   8  -1.162  10.047   6.267
   53   HG22  THR   8          2HG2      THR   8  -1.356   9.583   4.568
   54   HG23  THR   8          3HG2      THR   8  -0.854   8.372   5.770
   55    H    SER   9           H        SER   9   3.146   7.671   2.902
   56    HA   SER   9           HA       SER   9   5.157   9.787   2.535
   57    HB2  SER   9           2HB      SER   9   6.842   8.422   3.824
   58    HB3  SER   9           3HB      SER   9   5.628   9.244   4.806
   59    HG   SER   9           HG       SER   9   4.554   7.323   5.112
   60    H    ILE  10           H        ILE  10   6.934   9.108   1.242
   61    HA   ILE  10           HA       ILE  10   6.055   7.295  -0.855
   62    HB   ILE  10           HB       ILE  10   8.597   8.935  -0.564
   63   HG12  ILE  10          2HG1      ILE  10   6.056   9.419  -2.195
   64   HG13  ILE  10          3HG1      ILE  10   6.476  10.248  -0.701
   65   HG21  ILE  10          1HG2      ILE  10   9.040   7.064  -2.077
   66   HG22  ILE  10          2HG2      ILE  10   7.515   7.359  -2.939
   67   HG23  ILE  10          3HG2      ILE  10   8.859   8.520  -3.033
   68   HD11  ILE  10          3HD1      ILE  10   6.999  11.728  -2.476
   69   HD12  ILE  10          1HD1      ILE  10   8.540  11.150  -1.817
   70   HD13  ILE  10          2HD1      ILE  10   7.915  10.503  -3.357
   71    H    CYS  11           H        CYS  11   6.657   5.265  -1.304
   72    HA   CYS  11           HA       CYS  11   9.131   4.171  -0.106
   73    HB2  CYS  11           2HB      CYS  11   6.376   3.031   0.243
   74    HB3  CYS  11           3HB      CYS  11   7.731   1.927   0.022
   75    H    SER  12           H        SER  12  10.320   2.951  -1.329
   76    HA   SER  12           HA       SER  12   9.625   2.219  -4.089
   77    HB2  SER  12           2HB      SER  12  11.910   2.825  -3.603
   78    HB3  SER  12           3HB      SER  12  12.008   1.626  -2.300
   79    HG   SER  12           HG       SER  12  12.926   1.008  -4.408
   80    H    LEU  13           H        LEU  13   9.635  -0.029  -4.805
   81    HA   LEU  13           HA       LEU  13   8.116  -1.847  -3.153
   82    HB2  LEU  13           2HB      LEU  13   8.338  -3.400  -4.971
   83    HB3  LEU  13           3HB      LEU  13   7.842  -1.798  -5.491
   84    HG   LEU  13           HG       LEU  13  10.373  -1.462  -6.138
   85   HD11  LEU  13          1HD1      LEU  13  11.294  -3.551  -5.158
   86   HD12  LEU  13          2HD1      LEU  13  10.168  -4.511  -6.137
   87   HD13  LEU  13          3HD1      LEU  13  11.454  -3.561  -6.909
   88   HD21  LEU  13          3HD2      LEU  13   8.514  -1.570  -7.740
   89   HD22  LEU  13          1HD2      LEU  13   9.923  -2.440  -8.356
   90   HD23  LEU  13          2HD2      LEU  13   8.547  -3.347  -7.684
   91    H    TYR  14           H        TYR  14  11.532  -1.253  -3.446
   92    HA   TYR  14           HA       TYR  14  12.543  -3.640  -2.184
   93    HB2  TYR  14           2HB      TYR  14  14.003  -2.051  -3.286
   94    HB3  TYR  14           3HB      TYR  14  13.445  -0.735  -2.262
   95    HD1  TYR  14           HD1      TYR  14  15.502  -3.838  -2.329
   96    HD2  TYR  14           HD2      TYR  14  14.306  -0.379  -0.038
   97    HE1  TYR  14           HE1      TYR  14  17.298  -4.310  -0.660
   98    HE2  TYR  14           HE2      TYR  14  16.060  -0.875   1.643
   99    HH   TYR  14           HH       TYR  14  17.793  -2.260   2.241
  100    H    GLN  15           H        GLN  15  10.780  -0.856  -0.937
  101    HA   GLN  15           HA       GLN  15  11.489  -1.443   1.892
  102    HB2  GLN  15           2HB      GLN  15   9.705   0.724   0.718
  103    HB3  GLN  15           3HB      GLN  15  10.188   0.572   2.404
  104    HG2  GLN  15           2HG      GLN  15  12.560   0.888   1.806
  105    HG3  GLN  15           3HG      GLN  15  12.144   0.938   0.087
  106   HE21  GLN  15          2HE2      GLN  15  11.612   2.746   3.179
  107   HE22  GLN  15          1HE2      GLN  15  11.347   4.271   2.349
  108    H    LEU  16           H        LEU  16   8.765  -1.621  -0.349
  109    HA   LEU  16           HA       LEU  16   6.719  -2.467   1.441
  110    HB2  LEU  16           2HB      LEU  16   7.235  -3.173  -1.470
  111    HB3  LEU  16           3HB      LEU  16   5.753  -3.543  -0.620
  112    HG   LEU  16           HG       LEU  16   6.816  -0.859  -1.474
  113   HD11  LEU  16          1HD1      LEU  16   4.629  -0.666  -2.568
  114   HD12  LEU  16          2HD1      LEU  16   5.493  -2.110  -3.095
  115   HD13  LEU  16          3HD1      LEU  16   4.158  -2.256  -1.927
  116   HD21  LEU  16          3HD2      LEU  16   6.005  -0.440   0.801
  117   HD22  LEU  16          1HD2      LEU  16   4.844   0.202  -0.356
  118   HD23  LEU  16          2HD2      LEU  16   4.507  -1.341   0.461
  119    H    GLU  17           H        GLU  17   9.459  -4.309   0.244
  120    HA   GLU  17           HA       GLU  17   8.632  -6.938   0.918
  121    HB2  GLU  17           2HB      GLU  17  11.343  -5.572   1.106
  122    HB3  GLU  17           3HB      GLU  17  11.089  -7.264   1.509
  123    HG2  GLU  17           2HG      GLU  17  10.117  -7.635  -0.785
  124    HG3  GLU  17           3HG      GLU  17  10.589  -5.984  -1.197
  125    H    ASN  18           H        ASN  18   9.226  -4.281   3.189
  126    HA   ASN  18           HA       ASN  18   9.692  -5.925   5.514
  127    HB2  ASN  18           2HB      ASN  18   8.622  -3.090   5.176
  128    HB3  ASN  18           3HB      ASN  18   8.857  -3.848   6.745
  129   HD21  ASN  18          2HD2      ASN  18  10.496  -2.407   4.031
  130   HD22  ASN  18          1HD2      ASN  18  12.107  -2.463   4.762
  131    H    TYR  19           H        TYR  19   6.743  -5.212   3.757
  132    HA   TYR  19           HA       TYR  19   4.887  -6.120   5.837
  133    HB2  TYR  19           2HB      TYR  19   4.640  -5.682   2.853
  134    HB3  TYR  19           3HB      TYR  19   3.314  -6.161   3.878
  135    HD1  TYR  19           HD1      TYR  19   5.649  -3.351   3.180
  136    HD2  TYR  19           HD2      TYR  19   2.107  -4.657   5.255
  137    HE1  TYR  19           HE1      TYR  19   5.069  -0.988   3.664
  138    HE2  TYR  19           HE2      TYR  19   1.536  -2.304   5.755
  139    HH   TYR  19           HH       TYR  19   2.089  -0.104   5.458
  140    H    CYS  20           H        CYS  20   7.095  -7.723   3.745
  141    HA   CYS  20           HA       CYS  20   5.388 -10.151   3.464
  142    HB2  CYS  20           2HB      CYS  20   6.131  -8.645   1.477
  143    HB3  CYS  20           3HB      CYS  20   7.712  -9.385   1.694
  144    H    ASN  21           H        ASN  21   8.813  -9.158   3.927
  145    HA   ASN  21           HA       ASN  21   9.752 -11.873   4.133
  146    HB2  ASN  21           2HB      ASN  21  11.112  -9.203   4.687
  147    HB3  ASN  21           3HB      ASN  21  11.935 -10.758   4.629
  148   HD21  ASN  21          2HD2      ASN  21  13.059  -9.096   3.006
  149   HD22  ASN  21          1HD2      ASN  21  12.498  -9.230   1.338
  150    H1   PHE   1           H        PHE   1   3.631   3.729  -9.057
  151    HA   PHE   1           HA       PHE   1   3.378   2.149  -6.869
  152    HB2  PHE   1           2HB      PHE   1   3.543   1.539  -9.346
  153    HB3  PHE   1           3HB      PHE   1   5.281   1.447  -9.133
  154    HD1  PHE   1           HD1      PHE   1   6.209  -0.295  -7.430
  155    HD2  PHE   1           HD2      PHE   1   2.110  -0.251  -8.776
  156    HE1  PHE   1           HE1      PHE   1   5.942  -2.656  -6.707
  157    HE2  PHE   1           HE2      PHE   1   1.870  -2.621  -8.112
  158    HZ   PHE   1           HZ       PHE   1   3.781  -3.833  -7.074
  159    H    VAL   2           H        VAL   2   6.342   3.709  -7.838
  160    HA   VAL   2           HA       VAL   2   7.904   2.474  -5.595
  161    HB   VAL   2           HB       VAL   2   8.281   1.584  -7.917
  162   HG11  VAL   2          1HG1      VAL   2   9.657   4.249  -8.451
  163   HG12  VAL   2          2HG1      VAL   2   9.611   2.832  -9.513
  164   HG13  VAL   2          3HG1      VAL   2   8.122   3.722  -9.181
  165   HG21  VAL   2          3HG2      VAL   2  10.752   2.799  -6.643
  166   HG22  VAL   2          1HG2      VAL   2   9.972   1.267  -6.189
  167   HG23  VAL   2          2HG2      VAL   2  10.688   1.451  -7.790
  168    H    ASN   3           H        ASN   3   6.893   5.425  -6.939
  169    HA   ASN   3           HA       ASN   3   8.881   7.007  -5.395
  170    HB2  ASN   3           2HB      ASN   3   9.232   8.453  -7.304
  171    HB3  ASN   3           3HB      ASN   3   9.614   6.799  -7.752
  172   HD21  ASN   3          1HD2      ASN   3   9.275   8.499  -9.798
  173   HD22  ASN   3          2HD2      ASN   3   7.721   8.223 -10.574
  174    H    GLN   4           H        GLN   4   5.952   6.325  -4.981
  175    HA   GLN   4           HA       GLN   4   4.985   9.072  -4.478
  176    HB2  GLN   4           2HB      GLN   4   2.858   8.718  -5.523
  177    HB3  GLN   4           3HB      GLN   4   4.139   8.470  -6.675
  178    HG2  GLN   4           2HG      GLN   4   3.119   6.596  -7.284
  179    HG3  GLN   4           3HG      GLN   4   3.719   5.853  -5.812
  180   HE21  GLN   4          2HE2      GLN   4   1.261   5.147  -7.257
  181   HE22  GLN   4          1HE2      GLN   4  -0.076   5.511  -6.167
  182    H    HIS   5           H        HIS   5   2.902   9.005  -3.161
  183    HA   HIS   5           HA       HIS   5   3.758   7.855  -0.697
  184    HB2  HIS   5           2HB      HIS   5   1.265   9.465  -1.344
  185    HB3  HIS   5           3HB      HIS   5   1.935   9.192   0.262
  186    HD2  HIS   5           HD2      HIS   5   3.591  10.993   1.127
  187    HE1  HIS   5           HE1      HIS   5   4.642  12.856  -2.561
  188    HE2  HIS   5           HE2      HIS   5   4.920  12.951  -0.031
  189    H    LEU   6           H        LEU   6   1.598   6.567  -2.936
  190    HA   LEU   6           HA       LEU   6   0.406   4.748  -3.141
  191    HB2  LEU   6           2HB      LEU   6   2.084   3.867  -0.782
  192    HB3  LEU   6           3HB      LEU   6   1.071   2.777  -1.705
  193    HG   LEU   6           HG       LEU   6   3.333   4.333  -2.970
  194   HD11  LEU   6          1HD1      LEU   6   3.237   1.450  -1.992
  195   HD12  LEU   6          2HD1      LEU   6   4.576   2.215  -2.878
  196   HD13  LEU   6          3HD1      LEU   6   4.169   2.770  -1.248
  197   HD21  LEU   6          3HD2      LEU   6   1.693   1.945  -3.921
  198   HD22  LEU   6          1HD2      LEU   6   1.631   3.595  -4.588
  199   HD23  LEU   6          2HD2      LEU   6   3.105   2.635  -4.740
  200    H    CYS   7           H        CYS   7   0.038   5.895   0.134
  201    HA   CYS   7           HA       CYS   7  -1.762   3.840   0.863
  202    HB2  CYS   7           2HB      CYS   7  -0.106   5.251   2.222
  203    HB3  CYS   7           3HB      CYS   7  -1.443   6.385   2.436
  204    H    GLY   8           H        GLY   8  -5.111   5.202   0.700
  205    HA2  GLY   8           HA2      GLY   8  -3.430   2.974   1.718
  206    HA3  GLY   8           HA3      GLY   8  -5.172   3.114   1.724
  207    H    SER   9           H        SER   9  -5.408   3.757  -1.153
  208    HA   SER   9           HA       SER   9  -5.996   1.091  -1.881
  209    HB2  SER   9           2HB      SER   9  -7.227   3.144  -2.608
  210    HB3  SER   9           3HB      SER   9  -5.895   3.512  -3.717
  211    HG   SER   9           HG       SER   9  -7.674   1.282  -3.742
  212    H    HIS  10           H        HIS  10  -3.452   3.237  -3.296
  213    HA   HIS  10           HA       HIS  10  -2.479   1.207  -5.113
  214    HB2  HIS  10           2HB      HIS  10  -1.093   3.697  -4.068
  215    HB3  HIS  10           3HB      HIS  10  -0.579   2.734  -5.442
  216    HD2  HIS  10           HD2      HIS  10  -3.666   2.515  -6.722
  217    HE1  HIS  10           HE1      HIS  10  -3.166   6.721  -7.209
  218    HE2  HIS  10           HE2      HIS  10  -4.507   4.685  -7.948
  219    H    LEU  11           H        LEU  11  -1.672   2.012  -1.768
  220    HA   LEU  11           HA       LEU  11   0.707   0.452  -1.545
  221    HB2  LEU  11           2HB      LEU  11  -0.089   2.181   0.097
  222    HB3  LEU  11           3HB      LEU  11  -1.399   1.115   0.563
  223    HG   LEU  11           HG       LEU  11   0.199  -0.520   1.465
  224   HD11  LEU  11          1HD1      LEU  11   2.593   0.118   1.738
  225   HD12  LEU  11          2HD1      LEU  11   2.169  -0.146   0.046
  226   HD13  LEU  11          3HD1      LEU  11   2.334   1.515   0.671
  227   HD21  LEU  11          3HD2      LEU  11   0.956   0.835   3.367
  228   HD22  LEU  11          1HD2      LEU  11   0.702   2.326   2.437
  229   HD23  LEU  11          2HD2      LEU  11  -0.682   1.302   2.888
  230    H    VAL  12           H        VAL  12  -2.719  -0.416  -0.897
  231    HA   VAL  12           HA       VAL  12  -2.191  -3.189  -0.300
  232    HB   VAL  12           HB       VAL  12  -4.708  -1.734  -1.188
  233   HG11  VAL  12          1HG1      VAL  12  -4.403  -4.606  -0.211
  234   HG12  VAL  12          2HG1      VAL  12  -5.945  -3.729  -0.339
  235   HG13  VAL  12          3HG1      VAL  12  -5.015  -4.075  -1.796
  236   HG21  VAL  12          3HG2      VAL  12  -5.343  -1.983   1.179
  237   HG22  VAL  12          1HG2      VAL  12  -3.819  -2.835   1.522
  238   HG23  VAL  12          2HG2      VAL  12  -3.806  -1.123   1.060
  239    H    GLU  13           H        GLU  13  -3.137  -1.564  -3.389
  240    HA   GLU  13           HA       GLU  13  -3.164  -3.972  -4.947
  241    HB2  GLU  13           2HB      GLU  13  -2.674  -1.074  -5.722
  242    HB3  GLU  13           3HB      GLU  13  -2.756  -2.398  -6.890
  243    HG2  GLU  13           2HG      GLU  13  -5.027  -2.993  -6.049
  244    HG3  GLU  13           3HG      GLU  13  -5.007  -1.570  -5.013
  245    H    ALA  14           H        ALA  14  -0.411  -1.726  -4.250
  246    HA   ALA  14           HA       ALA  14   1.472  -3.183  -5.848
  247    HB1  ALA  14           3HB      ALA  14   1.821  -0.851  -5.136
  248    HB2  ALA  14           1HB      ALA  14   1.895  -1.365  -3.435
  249    HB3  ALA  14           2HB      ALA  14   3.147  -1.885  -4.583
  250    H    LEU  15           H        LEU  15   0.572  -3.461  -2.370
  251    HA   LEU  15           HA       LEU  15   2.550  -5.479  -1.846
  252    HB2  LEU  15           2HB      LEU  15   0.075  -4.512  -0.381
  253    HB3  LEU  15           3HB      LEU  15   1.088  -5.804   0.255
  254    HG   LEU  15           HG       LEU  15   2.212  -3.055  -0.437
  255   HD11  LEU  15          1HD1      LEU  15   0.507  -2.922   1.386
  256   HD12  LEU  15          2HD1      LEU  15   1.424  -4.145   2.291
  257   HD13  LEU  15          3HD1      LEU  15   2.152  -2.566   1.940
  258   HD21  LEU  15          3HD2      LEU  15   3.910  -4.814  -0.381
  259   HD22  LEU  15          1HD2      LEU  15   4.039  -3.844   1.088
  260   HD23  LEU  15          2HD2      LEU  15   3.253  -5.440   1.136
  261    H    TYR  16           H        TYR  16  -0.719  -5.815  -3.149
  262    HA   TYR  16           HA       TYR  16  -0.662  -8.722  -2.954
  263    HB2  TYR  16           2HB      TYR  16  -2.331  -6.732  -4.499
  264    HB3  TYR  16           3HB      TYR  16  -2.463  -8.450  -4.814
  265    HD1  TYR  16           HD2      TYR  16  -2.401  -9.846  -2.327
  266    HD2  TYR  16           HD1      TYR  16  -4.243  -6.059  -3.277
  267    HE1  TYR  16           HE2      TYR  16  -4.023 -10.177  -0.491
  268    HE2  TYR  16           HE1      TYR  16  -5.922  -6.435  -1.478
  269    HH   TYR  16           HH       TYR  16  -6.665  -7.829   0.168
  270    H    LEU  17           H        LEU  17   1.298  -6.708  -4.784
  271    HA   LEU  17           HA       LEU  17   1.819  -8.865  -6.807
  272    HB2  LEU  17           2HB      LEU  17   2.229  -5.857  -6.980
  273    HB3  LEU  17           3HB      LEU  17   2.789  -7.009  -8.187
  274    HG   LEU  17           HG       LEU  17  -0.146  -6.614  -7.431
  275   HD11  LEU  17          1HD1      LEU  17   1.438  -5.595  -9.824
  276   HD12  LEU  17          2HD1      LEU  17  -0.324  -5.460  -9.602
  277   HD13  LEU  17          3HD1      LEU  17   0.767  -4.616  -8.497
  278   HD21  LEU  17          3HD2      LEU  17   1.164  -8.144  -9.723
  279   HD22  LEU  17          1HD2      LEU  17   0.259  -8.852  -8.364
  280   HD23  LEU  17          2HD2      LEU  17  -0.579  -7.843  -9.544
  281    H    VAL  18           H        VAL  18   3.412  -6.495  -4.655
  282    HA   VAL  18           HA       VAL  18   6.076  -7.637  -4.966
  283    HB   VAL  18           HB       VAL  18   4.908  -5.774  -2.854
  284   HG11  VAL  18          1HG1      VAL  18   7.817  -6.458  -3.472
  285   HG12  VAL  18          2HG1      VAL  18   7.287  -5.101  -2.462
  286   HG13  VAL  18          3HG1      VAL  18   6.952  -6.752  -1.943
  287   HG21  VAL  18          3HG2      VAL  18   6.553  -5.233  -5.368
  288   HG22  VAL  18          1HG2      VAL  18   4.851  -4.801  -5.113
  289   HG23  VAL  18          2HG2      VAL  18   6.098  -4.019  -4.152
  290    H    CYS  19           H        CYS  19   3.333  -8.243  -2.865
  291    HA   CYS  19           HA       CYS  19   4.631 -10.701  -1.855
  292    HB2  CYS  19           2HB      CYS  19   4.416  -8.677  -0.175
  293    HB3  CYS  19           3HB      CYS  19   2.712  -9.101  -0.162
  294    H    GLY  20           H        GLY  20   2.363 -11.734  -0.622
  295    HA2  GLY  20           HA2      GLY  20   0.282 -12.716  -0.939
  296    HA3  GLY  20           HA3      GLY  20  -0.011 -11.647  -2.314
  297    H    GLU  21           H        GLU  21   1.912 -12.244  -4.105
  298    HA   GLU  21           HA       GLU  21   1.618 -15.001  -5.019
  299    HB2  GLU  21           2HB      GLU  21   2.059 -12.929  -6.438
  300    HB3  GLU  21           3HB      GLU  21   3.688 -12.893  -5.771
  301    HG2  GLU  21           2HG      GLU  21   3.789 -13.902  -7.933
  302    HG3  GLU  21           3HG      GLU  21   4.104 -15.168  -6.763
  303    H    ARG  22           H        ARG  22   3.723 -13.332  -2.829
  304    HA   ARG  22           HA       ARG  22   5.224 -15.845  -2.213
  305    HB2  ARG  22           2HB      ARG  22   6.189 -13.041  -1.558
  306    HB3  ARG  22           3HB      ARG  22   7.059 -14.555  -1.358
  307    HG2  ARG  22           2HG      ARG  22   6.448 -13.057  -3.923
  308    HG3  ARG  22           3HG      ARG  22   8.015 -13.399  -3.206
  309    HD2  ARG  22           2HD      ARG  22   6.166 -15.331  -4.639
  310    HD3  ARG  22           3HD      ARG  22   7.738 -14.768  -5.151
  311    HE   ARG  22           HE       ARG  22   8.757 -16.018  -3.275
  312   HH11  ARG  22          1HH2      ARG  22   5.504 -17.093  -4.178
  313   HH12  ARG  22          2HH2      ARG  22   5.863 -18.733  -3.716
  314   HH21  ARG  22          2HH1      ARG  22   9.061 -18.111  -2.651
  315   HH22  ARG  22          1HH1      ARG  22   7.785 -19.277  -2.836
  316    H    GLY  23           H        GLY  23   5.532 -16.303   0.020
  317    HA2  GLY  23           HA2      GLY  23   3.199 -15.921   1.623
  318    HA3  GLY  23           HA3      GLY  23   4.723 -16.617   2.171
  319    H    DHI  24           H        DHI  24   2.630 -14.396   3.037
  320    HA   DHI  24           HA       DHI  24   4.393 -12.094   3.518
  321    HB2  DHI  24           2HB      DHI  24   4.710 -13.499   5.510
  322    HB3  DHI  24           3HB      DHI  24   3.937 -11.964   5.877
  323    HD2  DHI  24           HD2      DHI  24   3.097 -15.719   5.530
  324    HE1  DHI  24           HE1      DHI  24  -0.033 -13.962   7.838
  325    HE2  DHI  24           HE2      DHI  24   0.910 -16.155   6.953
  326    H    PHE  25           H        PHE  25   3.120 -10.211   4.424
  327    HA   PHE  25           HA       PHE  25   1.374  -8.798   4.498
  328    HB2  PHE  25           2HB      PHE  25   2.267  -8.573   2.258
  329    HB3  PHE  25           3HB      PHE  25   1.157  -9.802   1.654
  330    HD1  PHE  25           HD1      PHE  25   0.818  -6.683   3.789
  331    HD2  PHE  25           HD2      PHE  25  -0.539  -8.870   0.323
  332    HE1  PHE  25           HE1      PHE  25  -0.867  -4.930   3.341
  333    HE2  PHE  25           HE2      PHE  25  -2.215  -7.095  -0.132
  334    HZ   PHE  25           HZ       PHE  25  -2.394  -5.132   1.384
  335    H    TYR  26           H        TYR  26   0.303 -10.226   6.126
  336    HA   TYR  26           HA       TYR  26  -2.172 -11.552   5.499
  337    HB2  TYR  26           2HB      TYR  26  -1.057 -11.795   7.671
  338    HB3  TYR  26           3HB      TYR  26  -1.292 -10.084   8.013
  339    HD1  TYR  26           HD2      TYR  26  -3.097 -13.299   7.373
  340    HD2  TYR  26           HD1      TYR  26  -3.389  -9.275   8.927
  341    HE1  TYR  26           HE2      TYR  26  -5.358 -13.805   8.284
  342    HE2  TYR  26           HE1      TYR  26  -5.623  -9.801   9.864
  343    HH   TYR  26           HH       TYR  26  -7.249 -11.398  10.154
  344    H    THR  27           H        THR  27  -4.206 -10.808   5.182
  345    HA   THR  27           HA       THR  27  -4.857  -7.982   5.767
  346    HB   THR  27           HB       THR  27  -6.368  -7.927   3.776
  347    HG1  THR  27           HG1      THR  27  -5.745  -9.293   2.049
  348   HG21  THR  27          1HG2      THR  27  -4.171  -6.748   3.846
  349   HG22  THR  27          2HG2      THR  27  -3.399  -8.176   3.124
  350   HG23  THR  27          3HG2      THR  27  -4.622  -7.264   2.216
  351    HA   PRO  28           HA       PRO  28  -8.104 -10.246   7.861
  352    HB2  PRO  28           2HB      PRO  28  -9.425  -8.193   9.078
  353    HB3  PRO  28           3HB      PRO  28  -7.795  -8.736   9.579
  354    HG2  PRO  28           2HG      PRO  28  -8.512  -6.407   7.776
  355    HG3  PRO  28           3HG      PRO  28  -7.354  -6.442   9.150
  356    HD2  PRO  28           2HD      PRO  28  -6.574  -6.707   6.535
  357    HD3  PRO  28           3HD      PRO  28  -5.724  -7.524   7.883
  358    H    LYS  29           H        LYS  29 -10.405 -10.513   7.860
  359    HA   LYS  29           HA       LYS  29 -12.011  -9.160   5.762
  360    HB2  LYS  29           2HB      LYS  29 -10.907 -11.156   4.742
  361    HB3  LYS  29           3HB      LYS  29 -11.690 -12.190   5.943
  362    HG2  LYS  29           2HG      LYS  29 -13.915 -11.512   5.090
  363    HG3  LYS  29           3HG      LYS  29 -13.154 -10.430   3.915
  364    HD2  LYS  29           2HD      LYS  29 -12.801 -13.461   4.019
  365    HD3  LYS  29           3HD      LYS  29 -13.925 -12.599   2.959
  366    HE2  LYS  29           2HE      LYS  29 -12.009 -11.389   1.914
  367    HE3  LYS  29           3HE      LYS  29 -10.887 -12.303   2.933
  368    HZ1  LYS  29           HZ1      LYS  29 -12.730 -13.503   0.933
  369    HZ2  LYS  29           HZ2      LYS  29 -11.120 -13.323   0.745
  370    HZ3  LYS  29           HZ3      LYS  29 -11.696 -14.347   1.877
  371    H    THR  30           H        THR  30 -14.168  -9.071   6.184
  372    HA   THR  30           HA       THR  30 -15.299 -10.297   8.651
  373    HB   THR  30           HB       THR  30 -16.445  -8.119   9.122
  374    HG1  THR  30           HG1      THR  30 -15.515  -6.266   8.239
  375   HG21  THR  30          1HG2      THR  30 -14.454  -8.875  10.416
  376   HG22  THR  30          2HG2      THR  30 -13.401  -7.990   9.290
  377   HG23  THR  30          3HG2      THR  30 -14.572  -7.113  10.299
  Start of MODEL   23
    1    H1   GLY   1           1H       GLY   1  -3.222  -0.224   8.426
    2    H2   GLY   1           2H       GLY   1  -3.574  -1.623   7.647
    3    H3   GLY   1           3H       GLY   1  -2.565  -1.632   8.940
    4    HA2  GLY   1           HA2      GLY   1  -1.304  -1.865   6.897
    5    HA3  GLY   1           HA3      GLY   1  -2.009  -0.333   6.350
    6    H    ILE   2           H        ILE   2   0.369   0.167   6.145
    7    HA   ILE   2           HA       ILE   2   1.907   0.643   8.580
    8    HB   ILE   2           HB       ILE   2   2.395   1.507   5.709
    9   HG12  ILE   2          2HG1      ILE   2   2.453  -0.891   5.839
   10   HG13  ILE   2          3HG1      ILE   2   4.078  -0.272   5.689
   11   HG21  ILE   2          1HG2      ILE   2   3.683   2.993   7.100
   12   HG22  ILE   2          2HG2      ILE   2   4.247   1.650   8.125
   13   HG23  ILE   2          3HG2      ILE   2   4.781   1.786   6.439
   14   HD11  ILE   2          3HD1      ILE   2   2.829  -1.352   8.252
   15   HD12  ILE   2          1HD1      ILE   2   4.040  -2.148   7.245
   16   HD13  ILE   2          2HD1      ILE   2   4.472  -0.676   8.123
   17    H    VAL   3           H        VAL   3   2.267   2.446   9.661
   18    HA   VAL   3           HA       VAL   3   0.085   4.252   9.830
   19    HB   VAL   3           HB       VAL   3   1.427   3.460  11.721
   20   HG11  VAL   3          1HG1      VAL   3   3.719   3.745  10.785
   21   HG12  VAL   3          2HG1      VAL   3   3.528   5.509  10.915
   22   HG13  VAL   3          3HG1      VAL   3   3.517   4.500  12.370
   23   HG21  VAL   3          3HG2      VAL   3  -0.061   5.420  11.955
   24   HG22  VAL   3          1HG2      VAL   3   1.328   5.473  13.053
   25   HG23  VAL   3          2HG2      VAL   3   1.313   6.494  11.603
   26    H    GLU   4           H        GLU   4   3.227   4.739   8.290
   27    HA   GLU   4           HA       GLU   4   2.689   7.565   7.664
   28    HB2  GLU   4           2HB      GLU   4   4.837   5.666   6.648
   29    HB3  GLU   4           3HB      GLU   4   4.790   7.405   6.368
   30    HG2  GLU   4           2HG      GLU   4   5.115   6.039   9.074
   31    HG3  GLU   4           3HG      GLU   4   6.381   6.808   8.135
   32    H    GLN   5           H        GLN   5   1.567   4.664   6.353
   33    HA   GLN   5           HA       GLN   5   0.713   3.956   4.397
   34    HB2  GLN   5           2HB      GLN   5  -0.828   5.742   5.504
   35    HB3  GLN   5           3HB      GLN   5  -0.410   6.744   4.114
   36    HG2  GLN   5           2HG      GLN   5  -1.228   4.729   2.661
   37    HG3  GLN   5           3HG      GLN   5  -1.855   4.058   4.162
   38   HE21  GLN   5          2HE2      GLN   5  -3.572   5.363   5.314
   39   HE22  GLN   5          1HE2      GLN   5  -4.527   6.485   4.356
   40    H    CYS   6           H        CYS   6   3.431   4.998   3.921
   41    HA   CYS   6           HA       CYS   6   4.834   5.880   2.364
   42    HB2  CYS   6           2HB      CYS   6   2.955   4.259   0.641
   43    HB3  CYS   6           3HB      CYS   6   4.448   4.968   0.025
   44    H    CYS   7           H        CYS   7   2.876   7.748   3.176
   45    HA   CYS   7           HA       CYS   7   2.473   9.403   0.731
   46    HB2  CYS   7           2HB      CYS   7   0.480   8.249   1.977
   47    HB3  CYS   7           3HB      CYS   7   0.718   9.511   3.183
   48    H    THR   8           H        THR   8   2.963  11.526   0.837
   49    HA   THR   8           HA       THR   8   4.443  13.143   1.064
   50    HB   THR   8           HB       THR   8   4.686  14.458   2.966
   51    HG1  THR   8           HG1      THR   8   3.936  13.840   4.989
   52   HG21  THR   8          1HG2      THR   8   2.453  14.497   1.862
   53   HG22  THR   8          2HG2      THR   8   1.859  13.325   3.062
   54   HG23  THR   8          3HG2      THR   8   2.391  14.940   3.575
   55    H    SER   9           H        SER   9   5.281  10.502   3.255
   56    HA   SER   9           HA       SER   9   8.161  10.802   2.549
   57    HB2  SER   9           2HB      SER   9   6.744   8.778   4.316
   58    HB3  SER   9           3HB      SER   9   8.479   8.797   3.968
   59    HG   SER   9           HG       SER   9   6.988  10.875   5.237
   60    H    ILE  10           H        ILE  10   9.277   9.100   1.506
   61    HA   ILE  10           HA       ILE  10   7.677   7.999  -0.740
   62    HB   ILE  10           HB       ILE  10  10.527   8.960  -0.399
   63   HG12  ILE  10          2HG1      ILE  10   8.187   9.714  -2.217
   64   HG13  ILE  10          3HG1      ILE  10   8.721  10.590  -0.782
   65   HG21  ILE  10          1HG2      ILE  10  10.975   8.350  -2.764
   66   HG22  ILE  10          2HG2      ILE  10  10.777   6.936  -1.742
   67   HG23  ILE  10          3HG2      ILE  10   9.440   7.457  -2.789
   68   HD11  ILE  10          3HD1      ILE  10  10.199  10.357  -3.414
   69   HD12  ILE  10          1HD1      ILE  10   9.488  11.793  -2.668
   70   HD13  ILE  10          2HD1      ILE  10  10.913  11.037  -1.924
   71    H    CYS  11           H        CYS  11   7.919   5.956  -1.599
   72    HA   CYS  11           HA       CYS  11   9.412   3.925  -0.007
   73    HB2  CYS  11           2HB      CYS  11   6.523   3.745  -0.923
   74    HB3  CYS  11           3HB      CYS  11   7.454   2.387  -0.293
   75    H    SER  12           H        SER  12   9.573   1.860  -1.079
   76    HA   SER  12           HA       SER  12   9.320   1.715  -4.002
   77    HB2  SER  12           2HB      SER  12  11.910   1.173  -2.482
   78    HB3  SER  12           3HB      SER  12  11.622   0.690  -4.162
   79    HG   SER  12           HG       SER  12  12.755   2.731  -3.838
   80    H    LEU  13           H        LEU  13   9.690  -0.650  -4.720
   81    HA   LEU  13           HA       LEU  13   8.141  -2.429  -3.263
   82    HB2  LEU  13           2HB      LEU  13   8.824  -4.116  -4.706
   83    HB3  LEU  13           3HB      LEU  13   8.655  -2.625  -5.627
   84    HG   LEU  13           HG       LEU  13  11.286  -3.948  -4.796
   85   HD11  LEU  13          1HD1      LEU  13   9.894  -3.791  -7.501
   86   HD12  LEU  13          2HD1      LEU  13  11.469  -4.545  -7.170
   87   HD13  LEU  13          3HD1      LEU  13  10.000  -5.232  -6.467
   88   HD21  LEU  13          3HD2      LEU  13  11.715  -1.565  -5.100
   89   HD22  LEU  13          1HD2      LEU  13  12.308  -2.426  -6.511
   90   HD23  LEU  13          2HD2      LEU  13  10.768  -1.549  -6.614
   91    H    TYR  14           H        TYR  14  11.610  -1.940  -2.814
   92    HA   TYR  14           HA       TYR  14  12.121  -4.160  -1.078
   93    HB2  TYR  14           2HB      TYR  14  13.923  -3.006  -2.036
   94    HB3  TYR  14           3HB      TYR  14  13.350  -1.433  -1.482
   95    HD1  TYR  14           HD1      TYR  14  13.683  -0.664   0.811
   96    HD2  TYR  14           HD2      TYR  14  15.098  -4.539  -0.467
   97    HE1  TYR  14           HE1      TYR  14  14.987  -0.867   2.905
   98    HE2  TYR  14           HE2      TYR  14  16.450  -4.723   1.625
   99    HH   TYR  14           HH       TYR  14  16.447  -2.155   4.129
  100    H    GLN  15           H        GLN  15  10.397  -1.156  -0.525
  101    HA   GLN  15           HA       GLN  15  10.433  -1.420   2.438
  102    HB2  GLN  15           2HB      GLN  15   8.817   0.420   0.623
  103    HB3  GLN  15           3HB      GLN  15   8.698   0.360   2.358
  104    HG2  GLN  15           2HG      GLN  15  11.235   1.048   0.842
  105    HG3  GLN  15           3HG      GLN  15  10.117   2.216   1.556
  106   HE21  GLN  15          2HE2      GLN  15   9.600   1.596   4.082
  107   HE22  GLN  15          1HE2      GLN  15  11.082   1.313   4.984
  108    H    LEU  16           H        LEU  16   8.179  -1.812  -0.301
  109    HA   LEU  16           HA       LEU  16   5.972  -2.691   1.201
  110    HB2  LEU  16           2HB      LEU  16   6.620  -3.592  -1.631
  111    HB3  LEU  16           3HB      LEU  16   5.048  -3.586  -0.864
  112    HG   LEU  16           HG       LEU  16   6.644  -1.304  -1.972
  113   HD11  LEU  16          1HD1      LEU  16   4.961  -2.465  -3.360
  114   HD12  LEU  16          2HD1      LEU  16   3.705  -2.029  -2.184
  115   HD13  LEU  16          3HD1      LEU  16   4.564  -0.767  -3.090
  116   HD21  LEU  16          3HD2      LEU  16   6.010  -0.424   0.249
  117   HD22  LEU  16          1HD2      LEU  16   4.999   0.312  -0.989
  118   HD23  LEU  16          2HD2      LEU  16   4.341  -0.998   0.018
  119    H    GLU  17           H        GLU  17   8.550  -4.726  -0.296
  120    HA   GLU  17           HA       GLU  17   7.410  -7.193   0.548
  121    HB2  GLU  17           2HB      GLU  17   9.345  -8.236  -0.228
  122    HB3  GLU  17           3HB      GLU  17   9.173  -6.818  -1.261
  123    HG2  GLU  17           2HG      GLU  17  10.886  -5.633   0.003
  124    HG3  GLU  17           3HG      GLU  17  11.052  -7.000   1.100
  125    H    ASN  18           H        ASN  18   9.237  -4.898   2.391
  126    HA   ASN  18           HA       ASN  18   9.813  -6.741   4.611
  127    HB2  ASN  18           2HB      ASN  18  11.392  -4.965   4.024
  128    HB3  ASN  18           3HB      ASN  18  10.154  -3.734   4.240
  129   HD21  ASN  18          2HD2      ASN  18   9.799  -2.910   6.310
  130   HD22  ASN  18          1HD2      ASN  18  10.630  -3.531   7.728
  131    H    TYR  19           H        TYR  19   7.238  -4.448   3.714
  132    HA   TYR  19           HA       TYR  19   5.991  -4.425   6.356
  133    HB2  TYR  19           2HB      TYR  19   4.782  -3.859   3.642
  134    HB3  TYR  19           3HB      TYR  19   4.084  -3.421   5.188
  135    HD1  TYR  19           HD1      TYR  19   6.842  -2.373   6.419
  136    HD2  TYR  19           HD2      TYR  19   4.677  -1.643   2.756
  137    HE1  TYR  19           HE1      TYR  19   7.874  -0.120   6.244
  138    HE2  TYR  19           HE2      TYR  19   5.738   0.565   2.559
  139    HH   TYR  19           HH       TYR  19   7.104   2.133   3.577
  140    H    CYS  20           H        CYS  20   5.716  -6.485   3.477
  141    HA   CYS  20           HA       CYS  20   3.480  -8.038   4.355
  142    HB2  CYS  20           2HB      CYS  20   5.833  -8.679   2.549
  143    HB3  CYS  20           3HB      CYS  20   4.410  -9.714   2.714
  144    H    ASN  21           H        ASN  21   6.978  -8.408   5.010
  145    HA   ASN  21           HA       ASN  21   6.397  -9.964   7.415
  146    HB2  ASN  21           2HB      ASN  21   6.486 -11.749   5.678
  147    HB3  ASN  21           3HB      ASN  21   8.090 -11.190   5.187
  148   HD21  ASN  21          2HD2      ASN  21   8.252 -13.681   5.706
  149   HD22  ASN  21          1HD2      ASN  21   8.846 -14.009   7.326
  150    H1   PHE   1           H        PHE   1   4.357   3.127  -7.254
  151    HA   PHE   1           HA       PHE   1   5.254   1.120  -5.838
  152    HB2  PHE   1           2HB      PHE   1   4.405   1.242  -8.339
  153    HB3  PHE   1           3HB      PHE   1   6.094   1.031  -8.746
  154    HD1  PHE   1           HD1      PHE   1   7.294  -1.079  -7.599
  155    HD2  PHE   1           HD2      PHE   1   3.023  -0.593  -7.988
  156    HE1  PHE   1           HE1      PHE   1   6.986  -3.515  -7.303
  157    HE2  PHE   1           HE2      PHE   1   2.730  -3.044  -7.766
  158    HZ   PHE   1           HZ       PHE   1   4.707  -4.514  -7.432
  159    H    VAL   2           H        VAL   2   7.518   3.193  -7.572
  160    HA   VAL   2           HA       VAL   2   9.755   2.241  -5.907
  161    HB   VAL   2           HB       VAL   2   9.894   0.796  -7.833
  162   HG11  VAL   2          1HG1      VAL   2   8.878   2.234  -9.582
  163   HG12  VAL   2          2HG1      VAL   2  10.331   3.259  -9.566
  164   HG13  VAL   2          3HG1      VAL   2  10.441   1.562 -10.063
  165   HG21  VAL   2          3HG2      VAL   2  12.224   1.151  -8.373
  166   HG22  VAL   2          1HG2      VAL   2  12.144   2.841  -7.842
  167   HG23  VAL   2          2HG2      VAL   2  11.948   1.521  -6.664
  168    H    ASN   3           H        ASN   3  10.922   3.814  -5.150
  169    HA   ASN   3           HA       ASN   3  11.566   5.867  -4.576
  170    HB2  ASN   3           2HB      ASN   3  12.985   5.082  -6.604
  171    HB3  ASN   3           3HB      ASN   3  12.176   6.364  -7.498
  172   HD21  ASN   3          2HD2      ASN   3  12.287   8.597  -6.277
  173   HD22  ASN   3          1HD2      ASN   3  13.869   8.964  -5.576
  174    H    GLN   4           H        GLN   4   8.808   5.866  -4.717
  175    HA   GLN   4           HA       GLN   4   8.204   8.700  -5.258
  176    HB2  GLN   4           2HB      GLN   4   6.344   8.252  -6.748
  177    HB3  GLN   4           3HB      GLN   4   7.827   7.588  -7.419
  178    HG2  GLN   4           2HG      GLN   4   7.082   5.313  -6.416
  179    HG3  GLN   4           3HG      GLN   4   5.518   6.071  -6.139
  180   HE21  GLN   4          2HE2      GLN   4   7.931   5.302  -8.694
  181   HE22  GLN   4          1HE2      GLN   4   6.735   5.224  -9.993
  182    H    HIS   5           H        HIS   5   5.940   9.279  -4.624
  183    HA   HIS   5           HA       HIS   5   5.151   8.122  -2.060
  184    HB2  HIS   5           2HB      HIS   5   3.728  10.143  -3.835
  185    HB3  HIS   5           3HB      HIS   5   3.343   9.770  -2.154
  186    HD2  HIS   5           HD2      HIS   5   5.211  10.512  -0.271
  187    HE1  HIS   5           HE1      HIS   5   7.307  13.260  -2.761
  188    HE2  HIS   5           HE2      HIS   5   6.928  12.504  -0.351
  189    H    LEU   6           H        LEU   6   3.340   6.900  -1.626
  190    HA   LEU   6           HA       LEU   6   1.722   5.774  -3.834
  191    HB2  LEU   6           2HB      LEU   6   3.870   4.459  -3.592
  192    HB3  LEU   6           3HB      LEU   6   3.395   4.067  -1.943
  193    HG   LEU   6           HG       LEU   6   1.395   2.853  -2.821
  194   HD11  LEU   6          1HD1      LEU   6   1.318   2.290  -5.241
  195   HD12  LEU   6          2HD1      LEU   6   0.997   4.001  -4.947
  196   HD13  LEU   6          3HD1      LEU   6   2.591   3.492  -5.548
  197   HD21  LEU   6          3HD2      LEU   6   3.508   1.685  -2.381
  198   HD22  LEU   6          1HD2      LEU   6   2.682   0.982  -3.777
  199   HD23  LEU   6          2HD2      LEU   6   4.075   2.052  -4.024
  200    H    CYS   7           H        CYS   7   0.443   7.395  -2.441
  201    HA   CYS   7           HA       CYS   7  -0.536   6.538   0.146
  202    HB2  CYS   7           2HB      CYS   7  -1.858   8.472  -1.755
  203    HB3  CYS   7           3HB      CYS   7  -1.975   8.430  -0.002
  204    H    GLY   8           H        GLY   8  -2.850   6.107   0.619
  205    HA2  GLY   8           HA2      GLY   8  -4.939   5.215   0.334
  206    HA3  GLY   8           HA3      GLY   8  -4.823   5.713  -1.348
  207    H    SER   9           H        SER   9  -6.127   3.882  -1.868
  208    HA   SER   9           HA       SER   9  -5.631   1.206  -1.217
  209    HB2  SER   9           2HB      SER   9  -6.915   2.266  -3.763
  210    HB3  SER   9           3HB      SER   9  -7.142   0.657  -3.048
  211    HG   SER   9           HG       SER   9  -8.841   2.107  -2.487
  212    H    HIS  10           H        HIS  10  -4.010   3.111  -3.697
  213    HA   HIS  10           HA       HIS  10  -2.934   1.028  -5.314
  214    HB2  HIS  10           2HB      HIS  10  -1.724   3.715  -4.539
  215    HB3  HIS  10           3HB      HIS  10  -1.216   2.704  -5.889
  216    HD2  HIS  10           HD2      HIS  10  -2.672   2.745  -8.113
  217    HE1  HIS  10           HE1      HIS  10  -5.573   5.624  -6.886
  218    HE2  HIS  10           HE2      HIS  10  -4.673   4.291  -8.861
  219    H    LEU  11           H        LEU  11  -2.032   2.075  -2.056
  220    HA   LEU  11           HA       LEU  11   0.570   0.890  -1.979
  221    HB2  LEU  11           2HB      LEU  11  -0.323   2.605  -0.403
  222    HB3  LEU  11           3HB      LEU  11  -1.428   1.416   0.264
  223    HG   LEU  11           HG       LEU  11   0.407   0.092   1.141
  224   HD11  LEU  11          1HD1      LEU  11   2.243   2.154  -0.139
  225   HD12  LEU  11          2HD1      LEU  11   2.754   0.954   1.071
  226   HD13  LEU  11          3HD1      LEU  11   2.172   0.413  -0.502
  227   HD21  LEU  11          3HD2      LEU  11   1.274   1.692   2.796
  228   HD22  LEU  11          1HD2      LEU  11   0.744   3.037   1.760
  229   HD23  LEU  11          2HD2      LEU  11  -0.455   1.951   2.495
  230    H    VAL  12           H        VAL  12  -2.637  -0.414  -0.873
  231    HA   VAL  12           HA       VAL  12  -1.491  -2.937  -0.092
  232    HB   VAL  12           HB       VAL  12  -3.750  -3.676   0.258
  233   HG11  VAL  12          1HG1      VAL  12  -2.547  -2.337   1.970
  234   HG12  VAL  12          2HG1      VAL  12  -3.314  -0.866   1.335
  235   HG13  VAL  12          3HG1      VAL  12  -4.306  -2.145   2.064
  236   HG21  VAL  12          3HG2      VAL  12  -4.721  -0.963  -0.706
  237   HG22  VAL  12          1HG2      VAL  12  -4.966  -2.500  -1.571
  238   HG23  VAL  12          2HG2      VAL  12  -5.697  -2.250   0.016
  239    H    GLU  13           H        GLU  13  -3.040  -1.807  -3.068
  240    HA   GLU  13           HA       GLU  13  -3.075  -4.363  -4.416
  241    HB2  GLU  13           2HB      GLU  13  -2.838  -1.504  -5.439
  242    HB3  GLU  13           3HB      GLU  13  -2.969  -2.901  -6.503
  243    HG2  GLU  13           2HG      GLU  13  -5.058  -2.179  -4.400
  244    HG3  GLU  13           3HG      GLU  13  -5.124  -1.672  -6.082
  245    H    ALA  14           H        ALA  14  -0.535  -1.780  -4.291
  246    HA   ALA  14           HA       ALA  14   1.366  -3.240  -5.844
  247    HB1  ALA  14           3HB      ALA  14   1.772  -1.089  -3.741
  248    HB2  ALA  14           1HB      ALA  14   2.964  -1.601  -4.958
  249    HB3  ALA  14           2HB      ALA  14   1.464  -0.811  -5.473
  250    H    LEU  15           H        LEU  15   0.734  -3.236  -2.307
  251    HA   LEU  15           HA       LEU  15   2.938  -4.884  -1.550
  252    HB2  LEU  15           2HB      LEU  15   0.212  -4.277  -0.384
  253    HB3  LEU  15           3HB      LEU  15   1.215  -5.510   0.364
  254    HG   LEU  15           HG       LEU  15   2.451  -2.815  -0.244
  255   HD11  LEU  15          1HD1      LEU  15   0.383  -2.282   1.039
  256   HD12  LEU  15          2HD1      LEU  15   0.916  -3.393   2.311
  257   HD13  LEU  15          3HD1      LEU  15   1.873  -1.952   1.938
  258   HD21  LEU  15          3HD2      LEU  15   3.777  -4.821   0.556
  259   HD22  LEU  15          1HD2      LEU  15   3.863  -3.407   1.616
  260   HD23  LEU  15          2HD2      LEU  15   2.835  -4.787   2.049
  261    H    TYR  16           H        TYR  16  -0.389  -5.883  -2.572
  262    HA   TYR  16           HA       TYR  16   0.226  -8.692  -2.489
  263    HB2  TYR  16           2HB      TYR  16  -1.878  -7.053  -3.915
  264    HB3  TYR  16           3HB      TYR  16  -1.721  -8.782  -4.198
  265    HD1  TYR  16           HD2      TYR  16  -1.374 -10.215  -1.898
  266    HD2  TYR  16           HD1      TYR  16  -3.556  -6.514  -2.319
  267    HE1  TYR  16           HE2      TYR  16  -2.653 -10.742   0.154
  268    HE2  TYR  16           HE1      TYR  16  -4.870  -7.067  -0.277
  269    HH   TYR  16           HH       TYR  16  -4.301 -10.082   1.590
  270    H    LEU  17           H        LEU  17   0.696  -6.286  -5.116
  271    HA   LEU  17           HA       LEU  17   1.538  -8.240  -7.070
  272    HB2  LEU  17           2HB      LEU  17   1.913  -5.240  -6.816
  273    HB3  LEU  17           3HB      LEU  17   2.517  -6.145  -8.196
  274    HG   LEU  17           HG       LEU  17  -0.426  -6.169  -7.398
  275   HD11  LEU  17          1HD1      LEU  17   0.255  -3.872  -7.948
  276   HD12  LEU  17          2HD1      LEU  17   1.005  -4.439  -9.460
  277   HD13  LEU  17          3HD1      LEU  17  -0.756  -4.549  -9.229
  278   HD21  LEU  17          3HD2      LEU  17   1.010  -6.931  -9.977
  279   HD22  LEU  17          1HD2      LEU  17   0.242  -8.057  -8.834
  280   HD23  LEU  17          2HD2      LEU  17  -0.751  -6.908  -9.734
  281    H    VAL  18           H        VAL  18   3.405  -6.372  -4.666
  282    HA   VAL  18           HA       VAL  18   6.002  -7.315  -5.592
  283    HB   VAL  18           HB       VAL  18   5.064  -5.974  -3.027
  284   HG11  VAL  18          1HG1      VAL  18   7.933  -6.680  -3.793
  285   HG12  VAL  18          2HG1      VAL  18   7.455  -5.567  -2.498
  286   HG13  VAL  18          3HG1      VAL  18   7.044  -7.272  -2.370
  287   HG21  VAL  18          3HG2      VAL  18   6.741  -5.085  -5.416
  288   HG22  VAL  18          1HG2      VAL  18   5.090  -4.566  -5.032
  289   HG23  VAL  18          2HG2      VAL  18   6.422  -4.096  -3.978
  290    H    CYS  19           H        CYS  19   3.855  -8.297  -2.903
  291    HA   CYS  19           HA       CYS  19   5.773 -10.332  -2.081
  292    HB2  CYS  19           2HB      CYS  19   3.077  -9.549  -0.948
  293    HB3  CYS  19           3HB      CYS  19   4.290 -10.568  -0.158
  294    H    GLY  20           H        GLY  20   2.707 -10.436  -3.870
  295    HA2  GLY  20           HA2      GLY  20   1.705 -12.149  -5.023
  296    HA3  GLY  20           HA3      GLY  20   3.351 -12.737  -5.217
  297    H    GLU  21           H        GLU  21   3.486 -14.820  -4.785
  298    HA   GLU  21           HA       GLU  21   1.576 -16.223  -3.046
  299    HB2  GLU  21           2HB      GLU  21   3.892 -17.235  -4.739
  300    HB3  GLU  21           3HB      GLU  21   2.714 -18.253  -3.916
  301    HG2  GLU  21           2HG      GLU  21   2.105 -16.296  -6.173
  302    HG3  GLU  21           3HG      GLU  21   2.228 -18.042  -6.310
  303    H    ARG  22           H        ARG  22   4.360 -14.578  -2.260
  304    HA   ARG  22           HA       ARG  22   5.698 -16.479  -0.514
  305    HB2  ARG  22           2HB      ARG  22   6.590 -14.275  -1.594
  306    HB3  ARG  22           3HB      ARG  22   5.823 -13.479  -0.214
  307    HG2  ARG  22           2HG      ARG  22   7.214 -15.127   1.267
  308    HG3  ARG  22           3HG      ARG  22   8.046 -15.570  -0.227
  309    HD2  ARG  22           2HD      ARG  22   9.378 -13.921   0.828
  310    HD3  ARG  22           3HD      ARG  22   8.574 -13.111  -0.535
  311    HE   ARG  22           HE       ARG  22   7.026 -12.875   1.905
  312   HH11  ARG  22          1HH2      ARG  22   9.885 -11.451   0.438
  313   HH12  ARG  22          2HH2      ARG  22   9.720  -9.986   1.369
  314   HH21  ARG  22          1HH1      ARG  22   6.891 -10.990   3.011
  315   HH22  ARG  22          2HH1      ARG  22   8.052  -9.701   2.721
  316    H    GLY  23           H        GLY  23   5.679 -16.550   1.771
  317    HA2  GLY  23           HA2      GLY  23   3.194 -16.286   3.140
  318    HA3  GLY  23           HA3      GLY  23   4.766 -16.529   3.895
  319    H    DHI  24           H        DHI  24   2.421 -14.859   4.598
  320    HA   DHI  24           HA       DHI  24   3.825 -12.278   5.129
  321    HB2  DHI  24           2HB      DHI  24   2.354 -12.177   7.131
  322    HB3  DHI  24           3HB      DHI  24   1.683 -13.747   6.706
  323    HD2  DHI  24           HD2      DHI  24   3.149 -15.899   7.308
  324    HE1  DHI  24           HE1      DHI  24   6.427 -13.884   9.153
  325    HE2  DHI  24           HE2      DHI  24   5.356 -16.157   8.729
  326    H    PHE  25           H        PHE  25   2.362 -10.481   5.625
  327    HA   PHE  25           HA       PHE  25   0.854  -8.927   5.257
  328    HB2  PHE  25           2HB      PHE  25   1.996  -9.102   3.015
  329    HB3  PHE  25           3HB      PHE  25   0.587  -9.961   2.430
  330    HD1  PHE  25           HD2      PHE  25   1.292  -6.815   4.455
  331    HD2  PHE  25           HD1      PHE  25  -0.878  -8.619   1.183
  332    HE1  PHE  25           HE2      PHE  25   0.074  -4.699   4.090
  333    HE2  PHE  25           HE1      PHE  25  -2.033  -6.461   0.771
  334    HZ   PHE  25           HZ       PHE  25  -1.592  -4.514   2.249
  335    H    TYR  26           H        TYR  26  -1.283  -8.178   4.987
  336    HA   TYR  26           HA       TYR  26  -3.483  -9.946   4.399
  337    HB2  TYR  26           2HB      TYR  26  -2.973 -10.647   6.748
  338    HB3  TYR  26           3HB      TYR  26  -3.137  -8.979   7.273
  339    HD1  TYR  26           HD1      TYR  26  -5.083 -11.563   5.317
  340    HD2  TYR  26           HD2      TYR  26  -5.210  -8.405   8.266
  341    HE1  TYR  26           HE1      TYR  26  -7.519 -11.965   5.656
  342    HE2  TYR  26           HE2      TYR  26  -7.622  -8.855   8.638
  343    HH   TYR  26           HH       TYR  26  -9.442 -10.128   8.058
  344    H    THR  27           H        THR  27  -5.468  -8.814   4.199
  345    HA   THR  27           HA       THR  27  -5.501  -5.904   4.835
  346    HB   THR  27           HB       THR  27  -7.050  -5.540   2.925
  347    HG1  THR  27           HG1      THR  27  -5.835  -7.879   1.886
  348   HG21  THR  27          1HG2      THR  27  -5.276  -5.239   1.280
  349   HG22  THR  27          2HG2      THR  27  -4.712  -4.756   2.888
  350   HG23  THR  27          3HG2      THR  27  -4.195  -6.311   2.203
  351    HA   PRO  28           HA       PRO  28  -9.048  -7.609   7.052
  352    HB2  PRO  28           2HB      PRO  28  -9.320  -4.800   8.055
  353    HB3  PRO  28           3HB      PRO  28  -9.275  -6.339   8.973
  354    HG2  PRO  28           2HG      PRO  28  -7.126  -4.674   8.932
  355    HG3  PRO  28           3HG      PRO  28  -6.912  -6.451   8.840
  356    HD2  PRO  28           2HD      PRO  28  -6.912  -4.443   6.566
  357    HD3  PRO  28           3HD      PRO  28  -5.768  -5.780   6.910
  358    H    LYS  29           H        LYS  29 -11.335  -7.337   7.077
  359    HA   LYS  29           HA       LYS  29 -12.591  -5.287   5.331
  360    HB2  LYS  29           2HB      LYS  29 -13.163  -8.285   5.124
  361    HB3  LYS  29           3HB      LYS  29 -14.185  -7.013   4.471
  362    HG2  LYS  29           2HG      LYS  29 -13.038  -7.467   2.580
  363    HG3  LYS  29           3HG      LYS  29 -11.975  -6.227   3.240
  364    HD2  LYS  29           2HD      LYS  29 -10.617  -8.182   4.266
  365    HD3  LYS  29           3HD      LYS  29 -11.616  -9.261   3.285
  366    HE2  LYS  29           2HE      LYS  29 -10.874  -8.123   1.226
  367    HE3  LYS  29           3HE      LYS  29 -10.001  -6.919   2.186
  368    HZ1  LYS  29           HZ1      LYS  29  -8.615  -8.725   3.057
  369    HZ2  LYS  29           HZ2      LYS  29  -9.323  -9.804   2.028
  370    HZ3  LYS  29           HZ3      LYS  29  -8.430  -8.535   1.464
  371    H    THR  30           H        THR  30 -14.770  -4.867   5.797
  372    HA   THR  30           HA       THR  30 -15.859  -5.776   8.418
  373    HB   THR  30           HB       THR  30 -16.553  -3.411   8.866
  374    HG1  THR  30           HG1      THR  30 -15.411  -1.791   7.795
  375   HG21  THR  30          1HG2      THR  30 -13.533  -3.824   8.747
  376   HG22  THR  30          2HG2      THR  30 -14.423  -2.710   9.806
  377   HG23  THR  30          3HG2      THR  30 -14.606  -4.458  10.013
  Start of MODEL   24
    1    H1   GLY   1           1H       GLY   1  -3.956   0.933   6.637
    2    H2   GLY   1           2H       GLY   1  -3.298   2.414   6.410
    3    H3   GLY   1           3H       GLY   1  -3.837   1.552   5.124
    4    HA2  GLY   1           HA2      GLY   1  -2.146  -0.128   5.443
    5    HA3  GLY   1           HA3      GLY   1  -1.430   1.478   5.210
    6    H    ILE   2           H        ILE   2   0.384   0.168   6.289
    7    HA   ILE   2           HA       ILE   2   0.215  -0.351   9.148
    8    HB   ILE   2           HB       ILE   2   2.634  -0.103   7.318
    9   HG12  ILE   2          2HG1      ILE   2   1.132  -1.903   6.560
   10   HG13  ILE   2          3HG1      ILE   2   2.655  -2.505   7.152
   11   HG21  ILE   2          1HG2      ILE   2   3.413   0.141   9.572
   12   HG22  ILE   2          2HG2      ILE   2   2.371  -1.171  10.158
   13   HG23  ILE   2          3HG2      ILE   2   3.753  -1.524   9.102
   14   HD11  ILE   2          3HD1      ILE   2   0.805  -3.936   7.862
   15   HD12  ILE   2          1HD1      ILE   2   1.649  -3.240   9.251
   16   HD13  ILE   2          2HD1      ILE   2   0.066  -2.586   8.743
   17    H    VAL   3           H        VAL   3   1.755   2.204   7.204
   18    HA   VAL   3           HA       VAL   3   1.384   4.213   9.323
   19    HB   VAL   3           HB       VAL   3   3.722   5.084   8.964
   20   HG11  VAL   3          1HG1      VAL   3   3.635   2.378  10.329
   21   HG12  VAL   3          2HG1      VAL   3   4.783   3.697  10.618
   22   HG13  VAL   3          3HG1      VAL   3   3.073   3.908  11.035
   23   HG21  VAL   3          3HG2      VAL   3   4.349   2.289   7.932
   24   HG22  VAL   3          1HG2      VAL   3   4.309   3.751   6.927
   25   HG23  VAL   3          2HG2      VAL   3   5.497   3.602   8.233
   26    H    GLU   4           H        GLU   4   1.737   6.419   8.492
   27    HA   GLU   4           HA       GLU   4   0.543   6.726   5.865
   28    HB2  GLU   4           2HB      GLU   4   1.587   8.780   7.852
   29    HB3  GLU   4           3HB      GLU   4   0.651   9.149   6.397
   30    HG2  GLU   4           2HG      GLU   4  -1.231   7.767   7.252
   31    HG3  GLU   4           3HG      GLU   4  -0.334   7.470   8.741
   32    H    GLN   5           H        GLN   5   3.743   6.140   6.540
   33    HA   GLN   5           HA       GLN   5   5.182   8.161   5.250
   34    HB2  GLN   5           2HB      GLN   5   5.847   5.199   5.497
   35    HB3  GLN   5           3HB      GLN   5   6.998   6.452   5.047
   36    HG2  GLN   5           2HG      GLN   5   5.534   6.282   7.721
   37    HG3  GLN   5           3HG      GLN   5   7.207   5.834   7.418
   38   HE21  GLN   5          2HE2      GLN   5   8.708   7.653   6.639
   39   HE22  GLN   5          1HE2      GLN   5   8.353   9.264   7.250
   40    H    CYS   6           H        CYS   6   3.521   5.451   3.659
   41    HA   CYS   6           HA       CYS   6   4.701   6.193   1.049
   42    HB2  CYS   6           2HB      CYS   6   2.715   4.016   1.702
   43    HB3  CYS   6           3HB      CYS   6   3.563   4.257   0.175
   44    H    CYS   7           H        CYS   7   2.317   7.536   2.823
   45    HA   CYS   7           HA       CYS   7   0.800   8.522   0.446
   46    HB2  CYS   7           2HB      CYS   7   0.197   8.514   3.421
   47    HB3  CYS   7           3HB      CYS   7  -0.657   9.551   2.296
   48    H    THR   8           H        THR   8   2.741   9.567   3.306
   49    HA   THR   8           HA       THR   8   2.776  12.369   2.438
   50    HB   THR   8           HB       THR   8   4.341  12.680   4.316
   51    HG1  THR   8           HG1      THR   8   4.761  10.908   5.654
   52   HG21  THR   8          1HG2      THR   8   1.885  12.728   4.733
   53   HG22  THR   8          2HG2      THR   8   1.927  10.993   5.120
   54   HG23  THR   8          3HG2      THR   8   2.804  12.157   6.136
   55    H    SER   9           H        SER   9   4.884   9.577   2.084
   56    HA   SER   9           HA       SER   9   6.577  11.078   0.153
   57    HB2  SER   9           2HB      SER   9   7.697  10.749   2.420
   58    HB3  SER   9           3HB      SER   9   7.681   9.008   2.079
   59    HG   SER   9           HG       SER   9   9.634  10.106   1.415
   60    H    ILE  10           H        ILE  10   8.034   9.175  -0.911
   61    HA   ILE  10           HA       ILE  10   6.004   7.389  -2.197
   62    HB   ILE  10           HB       ILE  10   8.493   8.577  -3.469
   63   HG12  ILE  10          2HG1      ILE  10   5.603   9.545  -3.621
   64   HG13  ILE  10          3HG1      ILE  10   6.927  10.403  -2.833
   65   HG21  ILE  10          1HG2      ILE  10   7.592   6.479  -4.492
   66   HG22  ILE  10          2HG2      ILE  10   6.002   7.259  -4.653
   67   HG23  ILE  10          3HG2      ILE  10   7.406   7.859  -5.560
   68   HD11  ILE  10          3HD1      ILE  10   8.092  10.593  -5.027
   69   HD12  ILE  10          1HD1      ILE  10   6.618   9.953  -5.805
   70   HD13  ILE  10          2HD1      ILE  10   6.553  11.469  -4.900
   71    H    CYS  11           H        CYS  11   6.353   5.241  -2.254
   72    HA   CYS  11           HA       CYS  11   8.797   4.237  -0.893
   73    HB2  CYS  11           2HB      CYS  11   5.980   3.161  -1.033
   74    HB3  CYS  11           3HB      CYS  11   7.334   2.289  -0.313
   75    H    SER  12           H        SER  12  10.077   2.737  -1.665
   76    HA   SER  12           HA       SER  12   9.757   1.676  -4.408
   77    HB2  SER  12           2HB      SER  12  12.037   1.510  -2.405
   78    HB3  SER  12           3HB      SER  12  12.073   0.848  -4.051
   79    HG   SER  12           HG       SER  12  12.996   2.959  -3.923
   80    H    LEU  13           H        LEU  13  10.255  -0.634  -4.828
   81    HA   LEU  13           HA       LEU  13   8.306  -2.255  -3.645
   82    HB2  LEU  13           2HB      LEU  13  10.775  -3.288  -5.077
   83    HB3  LEU  13           3HB      LEU  13   9.201  -4.063  -4.955
   84    HG   LEU  13           HG       LEU  13   9.901  -1.569  -6.559
   85   HD11  LEU  13          1HD1      LEU  13   9.352  -2.972  -8.488
   86   HD12  LEU  13          2HD1      LEU  13  10.641  -3.714  -7.525
   87   HD13  LEU  13          3HD1      LEU  13   8.979  -4.340  -7.416
   88   HD21  LEU  13          3HD2      LEU  13   7.597  -1.312  -5.711
   89   HD22  LEU  13          1HD2      LEU  13   7.609  -1.654  -7.448
   90   HD23  LEU  13          2HD2      LEU  13   7.196  -2.937  -6.306
   91    H    TYR  14           H        TYR  14  11.771  -2.155  -2.824
   92    HA   TYR  14           HA       TYR  14  11.914  -4.359  -1.040
   93    HB2  TYR  14           2HB      TYR  14  13.895  -3.252  -1.821
   94    HB3  TYR  14           3HB      TYR  14  13.361  -1.694  -1.207
   95    HD1  TYR  14           HD1      TYR  14  14.497  -5.098  -0.123
   96    HD2  TYR  14           HD2      TYR  14  13.880  -0.973   0.996
   97    HE1  TYR  14           HE1      TYR  14  15.715  -5.489   2.021
   98    HE2  TYR  14           HE2      TYR  14  15.088  -1.365   3.128
   99    HH   TYR  14           HH       TYR  14  16.233  -2.878   4.428
  100    H    GLN  15           H        GLN  15  10.711  -1.048  -0.469
  101    HA   GLN  15           HA       GLN  15  10.521  -1.302   2.421
  102    HB2  GLN  15           2HB      GLN  15   9.039   0.585   0.544
  103    HB3  GLN  15           3HB      GLN  15   9.165   0.729   2.297
  104    HG2  GLN  15           2HG      GLN  15  11.626   0.985   2.124
  105    HG3  GLN  15           3HG      GLN  15  11.528   0.812   0.366
  106   HE21  GLN  15          2HE2      GLN  15  10.369   2.948   3.060
  107   HE22  GLN  15          1HE2      GLN  15  10.299   4.368   2.028
  108    H    LEU  16           H        LEU  16   8.436  -2.052  -0.316
  109    HA   LEU  16           HA       LEU  16   6.089  -2.619   1.294
  110    HB2  LEU  16           2HB      LEU  16   6.660  -3.585  -1.530
  111    HB3  LEU  16           3HB      LEU  16   5.109  -3.526  -0.722
  112    HG   LEU  16           HG       LEU  16   6.783  -1.229  -1.736
  113   HD11  LEU  16          1HD1      LEU  16   3.903  -2.052  -2.259
  114   HD12  LEU  16          2HD1      LEU  16   4.763  -0.690  -3.012
  115   HD13  LEU  16          3HD1      LEU  16   5.290  -2.344  -3.333
  116   HD21  LEU  16          3HD2      LEU  16   5.922  -0.436   0.436
  117   HD22  LEU  16          1HD2      LEU  16   5.009   0.318  -0.867
  118   HD23  LEU  16          2HD2      LEU  16   4.298  -1.038   0.034
  119    H    GLU  17           H        GLU  17   8.668  -4.684  -0.151
  120    HA   GLU  17           HA       GLU  17   7.752  -7.181   0.871
  121    HB2  GLU  17           2HB      GLU  17  10.590  -6.179   0.394
  122    HB3  GLU  17           3HB      GLU  17  10.181  -7.837   0.844
  123    HG2  GLU  17           2HG      GLU  17   8.709  -7.985  -1.187
  124    HG3  GLU  17           3HG      GLU  17   9.321  -6.409  -1.697
  125    H    ASN  18           H        ASN  18   9.501  -4.587   2.590
  126    HA   ASN  18           HA       ASN  18  10.069  -6.124   4.943
  127    HB2  ASN  18           2HB      ASN  18   9.766  -3.127   4.509
  128    HB3  ASN  18           3HB      ASN  18  10.333  -3.849   6.006
  129   HD21  ASN  18          2HD2      ASN  18  11.906  -2.021   4.588
  130   HD22  ASN  18          1HD2      ASN  18  13.281  -2.897   3.924
  131    H    TYR  19           H        TYR  19   7.011  -4.737   3.899
  132    HA   TYR  19           HA       TYR  19   5.776  -5.115   6.570
  133    HB2  TYR  19           2HB      TYR  19   4.515  -4.466   3.892
  134    HB3  TYR  19           3HB      TYR  19   3.710  -4.467   5.450
  135    HD1  TYR  19           HD2      TYR  19   5.130  -2.968   7.319
  136    HD2  TYR  19           HD1      TYR  19   4.906  -2.315   3.067
  137    HE1  TYR  19           HE2      TYR  19   5.570  -0.550   7.661
  138    HE2  TYR  19           HE1      TYR  19   5.432   0.078   3.390
  139    HH   TYR  19           HH       TYR  19   5.880   1.739   4.906
  140    H    CYS  20           H        CYS  20   6.218  -6.915   3.582
  141    HA   CYS  20           HA       CYS  20   4.248  -8.986   4.217
  142    HB2  CYS  20           2HB      CYS  20   6.494  -8.832   2.178
  143    HB3  CYS  20           3HB      CYS  20   5.266 -10.089   2.235
  144    H    ASN  21           H        ASN  21   7.727  -8.533   4.724
  145    HA   ASN  21           HA       ASN  21   8.431 -11.189   5.446
  146    HB2  ASN  21           2HB      ASN  21  10.011  -9.369   4.816
  147    HB3  ASN  21           3HB      ASN  21   9.636  -8.521   6.319
  148   HD21  ASN  21          2HD2      ASN  21  11.134 -11.472   4.963
  149   HD22  ASN  21          1HD2      ASN  21  12.076 -11.821   6.405
  150    H1   PHE   1           H        PHE   1   3.515   2.741 -10.973
  151    HA   PHE   1           HA       PHE   1   3.829   1.461  -8.351
  152    HB2  PHE   1           2HB      PHE   1   4.801   0.230 -10.904
  153    HB3  PHE   1           3HB      PHE   1   5.952   0.276  -9.588
  154    HD1  PHE   1           HD1      PHE   1   5.336  -0.641  -7.313
  155    HD2  PHE   1           HD2      PHE   1   3.051  -1.461 -10.878
  156    HE1  PHE   1           HE1      PHE   1   4.386  -2.659  -6.239
  157    HE2  PHE   1           HE2      PHE   1   2.097  -3.489  -9.795
  158    HZ   PHE   1           HZ       PHE   1   2.793  -4.105  -7.484
  159    H    VAL   2           H        VAL   2   5.485   2.133  -7.205
  160    HA   VAL   2           HA       VAL   2   6.979   3.470  -6.286
  161    HB   VAL   2           HB       VAL   2   9.210   3.322  -7.080
  162   HG11  VAL   2          1HG1      VAL   2   9.429   0.930  -7.199
  163   HG12  VAL   2          2HG1      VAL   2   8.102   1.328  -6.090
  164   HG13  VAL   2          3HG1      VAL   2   7.747   0.743  -7.730
  165   HG21  VAL   2          3HG2      VAL   2   8.863   3.805  -9.510
  166   HG22  VAL   2          1HG2      VAL   2   9.868   2.380  -9.202
  167   HG23  VAL   2          2HG2      VAL   2   8.183   2.173  -9.704
  168    H    ASN   3           H        ASN   3   5.679   4.943  -8.997
  169    HA   ASN   3           HA       ASN   3   6.116   7.485  -7.672
  170    HB2  ASN   3           2HB      ASN   3   8.082   7.371  -9.227
  171    HB3  ASN   3           3HB      ASN   3   6.982   7.139 -10.586
  172   HD21  ASN   3          2HD2      ASN   3   8.073   9.447  -8.101
  173   HD22  ASN   3          1HD2      ASN   3   7.444  10.860  -8.933
  174    H    GLN   4           H        GLN   4   2.889   8.234  -9.152
  175    HA   GLN   4           HA       GLN   4   5.021   9.303  -7.423
  176    HB2  GLN   4           2HB      GLN   4   2.085  10.019  -7.750
  177    HB3  GLN   4           3HB      GLN   4   3.265  10.904  -6.773
  178    HG2  GLN   4           2HG      GLN   4   4.635  11.339  -8.804
  179    HG3  GLN   4           3HG      GLN   4   3.390  10.569  -9.796
  180   HE21  GLN   4          2HE2      GLN   4   1.154  11.594  -9.752
  181   HE22  GLN   4          1HE2      GLN   4   1.080  13.327  -9.464
  182    H    HIS   5           H        HIS   5   3.181   9.879  -5.206
  183    HA   HIS   5           HA       HIS   5   3.680   7.870  -3.355
  184    HB2  HIS   5           2HB      HIS   5   1.289   9.755  -3.367
  185    HB3  HIS   5           3HB      HIS   5   2.058   9.025  -1.961
  186    HD2  HIS   5           HD2      HIS   5   3.766  10.545  -0.754
  187    HE1  HIS   5           HE1      HIS   5   4.776  13.225  -3.905
  188    HE2  HIS   5           HE2      HIS   5   5.118  12.702  -1.432
  189    H    LEU   6           H        LEU   6   2.426   6.235  -2.353
  190    HA   LEU   6           HA       LEU   6   0.672   4.811  -4.260
  191    HB2  LEU   6           2HB      LEU   6   1.903   3.872  -1.654
  192    HB3  LEU   6           3HB      LEU   6   1.043   2.879  -2.828
  193    HG   LEU   6           HG       LEU   6   3.705   4.249  -3.329
  194   HD11  LEU   6          1HD1      LEU   6   3.833   2.360  -1.753
  195   HD12  LEU   6          2HD1      LEU   6   3.006   1.314  -2.928
  196   HD13  LEU   6          3HD1      LEU   6   4.615   1.977  -3.293
  197   HD21  LEU   6          3HD2      LEU   6   2.113   2.324  -5.077
  198   HD22  LEU   6          1HD2      LEU   6   2.462   4.032  -5.435
  199   HD23  LEU   6          2HD2      LEU   6   3.782   2.861  -5.380
  200    H    CYS   7           H        CYS   7  -0.199   7.144  -2.333
  201    HA   CYS   7           HA       CYS   7  -2.096   5.940  -0.550
  202    HB2  CYS   7           2HB      CYS   7  -0.954   8.370  -0.740
  203    HB3  CYS   7           3HB      CYS   7  -2.510   8.741  -1.476
  204    H    GLY   8           H        GLY   8  -4.504   6.437  -0.616
  205    HA2  GLY   8           HA2      GLY   8  -6.577   6.220  -1.643
  206    HA3  GLY   8           HA3      GLY   8  -5.839   6.546  -3.214
  207    H    SER   9           H        SER   9  -5.139   3.982  -0.846
  208    HA   SER   9           HA       SER   9  -5.023   1.754  -0.897
  209    HB2  SER   9           2HB      SER   9  -7.379   1.862  -2.793
  210    HB3  SER   9           3HB      SER   9  -6.833   0.455  -1.871
  211    HG   SER   9           HG       SER   9  -7.778   2.932  -0.815
  212    H    HIS  10           H        HIS  10  -3.753   3.295  -3.440
  213    HA   HIS  10           HA       HIS  10  -3.143   1.037  -5.173
  214    HB2  HIS  10           2HB      HIS  10  -2.979   3.364  -5.918
  215    HB3  HIS  10           3HB      HIS  10  -1.726   3.689  -4.730
  216    HD2  HIS  10           HD2      HIS  10  -1.608   0.491  -6.949
  217    HE1  HIS  10           HE1      HIS  10   1.471   3.104  -8.312
  218    HE2  HIS  10           HE2      HIS  10   0.464   0.778  -8.548
  219    H    LEU  11           H        LEU  11  -1.759   2.270  -2.170
  220    HA   LEU  11           HA       LEU  11   0.622   0.858  -2.006
  221    HB2  LEU  11           2HB      LEU  11  -0.123   2.625  -0.470
  222    HB3  LEU  11           3HB      LEU  11  -1.407   1.592   0.149
  223    HG   LEU  11           HG       LEU  11   0.268   0.082   1.151
  224   HD11  LEU  11          1HD1      LEU  11   2.167   0.373  -0.375
  225   HD12  LEU  11          2HD1      LEU  11   2.306   2.082   0.091
  226   HD13  LEU  11          3HD1      LEU  11   2.650   0.797   1.269
  227   HD21  LEU  11          3HD2      LEU  11  -0.617   1.942   2.463
  228   HD22  LEU  11          1HD2      LEU  11   1.080   1.650   2.883
  229   HD23  LEU  11          2HD2      LEU  11   0.644   3.023   1.839
  230    H    VAL  12           H        VAL  12  -2.615  -0.403  -0.930
  231    HA   VAL  12           HA       VAL  12  -1.477  -2.924  -0.121
  232    HB   VAL  12           HB       VAL  12  -3.743  -3.679   0.158
  233   HG11  VAL  12          1HG1      VAL  12  -4.342  -2.185   1.964
  234   HG12  VAL  12          2HG1      VAL  12  -2.575  -2.312   1.889
  235   HG13  VAL  12          3HG1      VAL  12  -3.386  -0.867   1.259
  236   HG21  VAL  12          3HG2      VAL  12  -4.925  -2.520  -1.694
  237   HG22  VAL  12          1HG2      VAL  12  -5.689  -2.247  -0.127
  238   HG23  VAL  12          2HG2      VAL  12  -4.696  -0.972  -0.844
  239    H    GLU  13           H        GLU  13  -3.023  -1.805  -3.129
  240    HA   GLU  13           HA       GLU  13  -2.984  -4.350  -4.483
  241    HB2  GLU  13           2HB      GLU  13  -2.796  -1.500  -5.538
  242    HB3  GLU  13           3HB      GLU  13  -2.956  -2.919  -6.566
  243    HG2  GLU  13           2HG      GLU  13  -4.989  -2.132  -4.430
  244    HG3  GLU  13           3HG      GLU  13  -5.092  -1.668  -6.121
  245    H    ALA  14           H        ALA  14  -0.501  -1.716  -4.303
  246    HA   ALA  14           HA       ALA  14   1.450  -3.039  -5.870
  247    HB1  ALA  14           3HB      ALA  14   3.000  -1.442  -4.776
  248    HB2  ALA  14           1HB      ALA  14   1.510  -0.648  -5.310
  249    HB3  ALA  14           2HB      ALA  14   1.750  -1.032  -3.591
  250    H    LEU  15           H        LEU  15   0.807  -3.225  -2.336
  251    HA   LEU  15           HA       LEU  15   3.009  -4.918  -1.671
  252    HB2  LEU  15           2HB      LEU  15   0.318  -4.229  -0.441
  253    HB3  LEU  15           3HB      LEU  15   1.215  -5.558   0.251
  254    HG   LEU  15           HG       LEU  15   2.632  -2.921  -0.206
  255   HD11  LEU  15          1HD1      LEU  15   2.035  -2.236   2.086
  256   HD12  LEU  15          2HD1      LEU  15   0.602  -2.318   1.049
  257   HD13  LEU  15          3HD1      LEU  15   0.922  -3.616   2.207
  258   HD21  LEU  15          3HD2      LEU  15   3.973  -3.722   1.653
  259   HD22  LEU  15          1HD2      LEU  15   2.870  -5.077   1.945
  260   HD23  LEU  15          2HD2      LEU  15   3.851  -5.037   0.476
  261    H    TYR  16           H        TYR  16  -0.374  -5.810  -2.547
  262    HA   TYR  16           HA       TYR  16   0.009  -8.619  -2.346
  263    HB2  TYR  16           2HB      TYR  16  -1.869  -6.983  -4.075
  264    HB3  TYR  16           3HB      TYR  16  -1.987  -8.731  -3.865
  265    HD1  TYR  16           HD2      TYR  16  -1.422  -8.974  -0.884
  266    HD2  TYR  16           HD1      TYR  16  -3.928  -6.254  -3.118
  267    HE1  TYR  16           HE2      TYR  16  -2.772  -8.606   1.111
  268    HE2  TYR  16           HE1      TYR  16  -5.321  -5.897  -1.086
  269    HH   TYR  16           HH       TYR  16  -4.603  -7.526   2.029
  270    H    LEU  17           H        LEU  17   0.414  -6.472  -5.224
  271    HA   LEU  17           HA       LEU  17   1.165  -8.643  -6.974
  272    HB2  LEU  17           2HB      LEU  17   1.069  -5.642  -7.121
  273    HB3  LEU  17           3HB      LEU  17   2.087  -6.489  -8.278
  274    HG   LEU  17           HG       LEU  17   0.221  -7.830  -9.074
  275   HD11  LEU  17          1HD1      LEU  17  -2.110  -7.302  -8.486
  276   HD12  LEU  17          2HD1      LEU  17  -1.238  -7.942  -7.091
  277   HD13  LEU  17          3HD1      LEU  17  -1.552  -6.196  -7.216
  278   HD21  LEU  17          3HD2      LEU  17   0.730  -5.667 -10.133
  279   HD22  LEU  17          1HD2      LEU  17  -1.003  -6.017 -10.208
  280   HD23  LEU  17          2HD2      LEU  17  -0.387  -4.845  -9.019
  281    H    VAL  18           H        VAL  18   3.135  -6.494  -4.924
  282    HA   VAL  18           HA       VAL  18   5.694  -7.356  -6.000
  283    HB   VAL  18           HB       VAL  18   4.832  -5.946  -3.454
  284   HG11  VAL  18          1HG1      VAL  18   7.707  -6.580  -4.241
  285   HG12  VAL  18          2HG1      VAL  18   7.204  -5.395  -3.014
  286   HG13  VAL  18          3HG1      VAL  18   6.870  -7.110  -2.763
  287   HG21  VAL  18          3HG2      VAL  18   6.537  -5.105  -5.840
  288   HG22  VAL  18          1HG2      VAL  18   4.805  -4.782  -5.680
  289   HG23  VAL  18          2HG2      VAL  18   5.936  -4.063  -4.524
  290    H    CYS  19           H        CYS  19   3.817  -8.346  -3.124
  291    HA   CYS  19           HA       CYS  19   5.891 -10.259  -2.411
  292    HB2  CYS  19           2HB      CYS  19   3.282  -9.591  -1.066
  293    HB3  CYS  19           3HB      CYS  19   4.622 -10.550  -0.405
  294    H    GLY  20           H        GLY  20   2.612 -10.577  -3.791
  295    HA2  GLY  20           HA2      GLY  20   1.604 -12.357  -4.847
  296    HA3  GLY  20           HA3      GLY  20   3.231 -12.531  -5.480
  297    H    GLU  21           H        GLU  21   3.609 -14.626  -5.652
  298    HA   GLU  21           HA       GLU  21   2.216 -16.671  -4.308
  299    HB2  GLU  21           2HB      GLU  21   3.267 -16.745  -6.565
  300    HB3  GLU  21           3HB      GLU  21   4.860 -16.847  -5.806
  301    HG2  GLU  21           2HG      GLU  21   4.260 -19.009  -4.790
  302    HG3  GLU  21           3HG      GLU  21   2.605 -18.862  -5.392
  303    H    ARG  22           H        ARG  22   5.269 -15.166  -3.376
  304    HA   ARG  22           HA       ARG  22   5.700 -17.188  -1.245
  305    HB2  ARG  22           2HB      ARG  22   7.868 -16.171  -0.832
  306    HB3  ARG  22           3HB      ARG  22   7.639 -16.790  -2.449
  307    HG2  ARG  22           2HG      ARG  22   8.914 -14.830  -2.629
  308    HG3  ARG  22           3HG      ARG  22   7.331 -14.478  -3.309
  309    HD2  ARG  22           2HD      ARG  22   6.734 -13.172  -1.301
  310    HD3  ARG  22           3HD      ARG  22   8.181 -13.735  -0.476
  311    HE   ARG  22           HE       ARG  22   9.341 -12.002  -1.406
  312   HH11  ARG  22          1HH1      ARG  22   6.665 -12.513  -3.595
  313   HH12  ARG  22          2HH1      ARG  22   7.139 -11.162  -4.590
  314   HH21  ARG  22          1HH2      ARG  22   9.820 -10.263  -2.726
  315   HH22  ARG  22          2HH2      ARG  22   8.897 -10.051  -4.197
  316    H    GLY  23           H        GLY  23   3.664 -14.797  -1.391
  317    HA2  GLY  23           HA2      GLY  23   2.227 -14.193   0.274
  318    HA3  GLY  23           HA3      GLY  23   3.319 -14.802   1.503
  319    H    DHI  24           H        DHI  24   3.199 -10.865   1.264
  320    HA   DHI  24           HA       DHI  24   0.939 -12.762   1.131
  321    HB2  DHI  24           2HB      DHI  24   1.285 -10.624  -1.012
  322    HB3  DHI  24           3HB      DHI  24   1.896 -12.251  -1.242
  323    HD2  DHI  24           HD2      DHI  24  -0.375 -14.145  -0.432
  324    HE1  DHI  24           HE1      DHI  24  -2.920 -11.896  -3.013
  325    HE2  DHI  24           HE2      DHI  24  -2.638 -14.107  -1.780
  326    H    PHE  25           H        PHE  25   2.148 -10.404   2.760
  327    HA   PHE  25           HA       PHE  25   1.567  -8.671   4.011
  328    HB2  PHE  25           2HB      PHE  25   1.474  -7.519   1.880
  329    HB3  PHE  25           3HB      PHE  25  -0.223  -7.918   1.693
  330    HD1  PHE  25           HD2      PHE  25   2.020  -6.308   4.284
  331    HD2  PHE  25           HD1      PHE  25  -1.737  -6.220   2.158
  332    HE1  PHE  25           HE2      PHE  25   1.370  -4.243   5.496
  333    HE2  PHE  25           HE1      PHE  25  -2.364  -4.149   3.354
  334    HZ   PHE  25           HZ       PHE  25  -0.821  -3.162   5.046
  335    H    TYR  26           H        TYR  26   0.066  -7.662   5.449
  336    HA   TYR  26           HA       TYR  26  -2.544  -8.891   5.940
  337    HB2  TYR  26           2HB      TYR  26  -0.976 -10.566   6.898
  338    HB3  TYR  26           3HB      TYR  26  -0.219  -9.311   7.869
  339    HD1  TYR  26           HD1      TYR  26  -3.506 -10.996   7.218
  340    HD2  TYR  26           HD2      TYR  26  -1.091  -8.812  10.060
  341    HE1  TYR  26           HE1      TYR  26  -5.194 -11.427   8.997
  342    HE2  TYR  26           HE2      TYR  26  -2.753  -9.288  11.836
  343    HH   TYR  26           HH       TYR  26  -4.725 -10.334  12.380
  344    H    THR  27           H        THR  27  -3.804  -7.690   7.335
  345    HA   THR  27           HA       THR  27  -2.516  -5.739   9.112
  346    HB   THR  27           HB       THR  27  -4.383  -4.118   8.881
  347    HG1  THR  27           HG1      THR  27  -4.854  -5.449   6.425
  348   HG21  THR  27          1HG2      THR  27  -2.771  -4.475   6.326
  349   HG22  THR  27          2HG2      THR  27  -3.561  -2.986   6.889
  350   HG23  THR  27          3HG2      THR  27  -2.203  -3.670   7.804
  351    HA   PRO  28           HA       PRO  28  -5.405  -7.921  11.792
  352    HB2  PRO  28           2HB      PRO  28  -5.023  -6.580  14.138
  353    HB3  PRO  28           3HB      PRO  28  -3.819  -7.715  13.454
  354    HG2  PRO  28           2HG      PRO  28  -3.851  -4.693  13.258
  355    HG3  PRO  28           3HG      PRO  28  -2.472  -5.774  13.649
  356    HD2  PRO  28           2HD      PRO  28  -2.917  -4.755  11.139
  357    HD3  PRO  28           3HD      PRO  28  -2.163  -6.354  11.413
  358    H    LYS  29           H        LYS  29  -7.532  -7.661  12.395
  359    HA   LYS  29           HA       LYS  29  -8.880  -5.152  11.551
  360    HB2  LYS  29           2HB      LYS  29 -10.074  -7.812  12.400
  361    HB3  LYS  29           3HB      LYS  29 -10.942  -6.456  11.698
  362    HG2  LYS  29           2HG      LYS  29  -8.902  -8.230  10.293
  363    HG3  LYS  29           3HG      LYS  29 -10.641  -8.203  10.080
  364    HD2  LYS  29           2HD      LYS  29 -10.009  -7.037   8.229
  365    HD3  LYS  29           3HD      LYS  29 -10.281  -5.688   9.340
  366    HE2  LYS  29           2HE      LYS  29  -7.832  -5.595   9.797
  367    HE3  LYS  29           3HE      LYS  29  -7.586  -7.024   8.789
  368    HZ1  LYS  29           HZ1      LYS  29  -8.539  -4.385   7.818
  369    HZ2  LYS  29           HZ2      LYS  29  -7.059  -5.045   7.559
  370    HZ3  LYS  29           HZ3      LYS  29  -8.380  -5.721   6.883
  371    H    THR  30           H        THR  30 -10.529  -4.159  12.773
  372    HA   THR  30           HA       THR  30  -9.834  -3.658  15.555
  373    HB   THR  30           HB       THR  30 -11.859  -2.135  15.448
  374    HG1  THR  30           HG1      THR  30 -12.848  -3.263  13.690
  375   HG21  THR  30          1HG2      THR  30 -10.732  -0.470  14.039
  376   HG22  THR  30          2HG2      THR  30  -9.560  -1.314  15.065
  377   HG23  THR  30          3HG2      THR  30  -9.687  -1.726  13.340
  Start of MODEL   25
    1    H1   GLY   1           1H       GLY   1   3.496  -4.142  15.643
    2    H2   GLY   1           2H       GLY   1   2.110  -3.362  16.032
    3    H3   GLY   1           3H       GLY   1   2.131  -4.999  15.946
    4    HA2  GLY   1           HA2      GLY   1   2.550  -4.939  13.579
    5    HA3  GLY   1           HA3      GLY   1   1.044  -4.103  14.002
    6    H    ILE   2           H        ILE   2   2.105  -3.493  11.620
    7    HA   ILE   2           HA       ILE   2   3.939  -1.256  11.686
    8    HB   ILE   2           HB       ILE   2   3.564  -0.995   9.360
    9   HG12  ILE   2          2HG1      ILE   2   1.145  -1.345   9.148
   10   HG13  ILE   2          3HG1      ILE   2   2.097  -2.193   7.957
   11   HG21  ILE   2          1HG2      ILE   2   5.120  -2.691  10.109
   12   HG22  ILE   2          2HG2      ILE   2   3.854  -3.932  10.075
   13   HG23  ILE   2          3HG2      ILE   2   4.377  -3.149   8.571
   14   HD11  ILE   2          3HD1      ILE   2   0.707  -3.477  10.336
   15   HD12  ILE   2          1HD1      ILE   2   0.243  -3.567   8.635
   16   HD13  ILE   2          2HD1      ILE   2   1.743  -4.340   9.164
   17    H    VAL   3           H        VAL   3   3.562   0.896  11.041
   18    HA   VAL   3           HA       VAL   3   0.776   1.914  11.281
   19    HB   VAL   3           HB       VAL   3   1.848   2.019  13.496
   20   HG11  VAL   3          1HG1      VAL   3   4.201   2.444  12.835
   21   HG12  VAL   3          2HG1      VAL   3   3.747   4.081  12.298
   22   HG13  VAL   3          3HG1      VAL   3   3.601   3.625  14.004
   23   HG21  VAL   3          3HG2      VAL   3   1.313   4.783  12.349
   24   HG22  VAL   3          1HG2      VAL   3   0.070   3.616  12.858
   25   HG23  VAL   3          2HG2      VAL   3   1.205   4.279  14.045
   26    H    GLU   4           H        GLU   4   4.057   2.522  10.021
   27    HA   GLU   4           HA       GLU   4   3.443   5.075   8.881
   28    HB2  GLU   4           2HB      GLU   4   5.578   3.030   8.151
   29    HB3  GLU   4           3HB      GLU   4   5.507   4.687   7.535
   30    HG2  GLU   4           2HG      GLU   4   5.639   5.555   9.871
   31    HG3  GLU   4           3HG      GLU   4   5.795   3.903  10.470
   32    H    GLN   5           H        GLN   5   3.052   1.821   7.584
   33    HA   GLN   5           HA       GLN   5   2.047   0.995   5.688
   34    HB2  GLN   5           2HB      GLN   5   0.218   3.284   6.476
   35    HB3  GLN   5           3HB      GLN   5  -0.264   1.948   5.435
   36    HG2  GLN   5           2HG      GLN   5  -0.076   0.334   7.175
   37    HG3  GLN   5           3HG      GLN   5   0.766   1.448   8.250
   38   HE21  GLN   5          2HE2      GLN   5  -0.442   3.336   9.117
   39   HE22  GLN   5          1HE2      GLN   5  -2.187   3.198   9.280
   40    H    CYS   6           H        CYS   6   4.156   2.699   4.817
   41    HA   CYS   6           HA       CYS   6   4.976   4.052   3.239
   42    HB2  CYS   6           2HB      CYS   6   2.707   3.043   1.528
   43    HB3  CYS   6           3HB      CYS   6   4.091   3.961   0.945
   44    H    CYS   7           H        CYS   7   1.606   4.713   2.341
   45    HA   CYS   7           HA       CYS   7   0.508   6.660   2.010
   46    HB2  CYS   7           2HB      CYS   7   0.861   6.275   4.966
   47    HB3  CYS   7           3HB      CYS   7  -0.251   7.475   4.315
   48    H    THR   8           H        THR   8   2.528   7.943   4.684
   49    HA   THR   8           HA       THR   8   2.564  10.632   3.706
   50    HB   THR   8           HB       THR   8   4.598   9.315   5.542
   51    HG1  THR   8           HG1      THR   8   3.163   9.809   7.204
   52   HG21  THR   8          1HG2      THR   8   4.554  11.539   6.688
   53   HG22  THR   8          2HG2      THR   8   5.145  11.656   5.031
   54   HG23  THR   8          3HG2      THR   8   3.481  12.156   5.411
   55    H    SER   9           H        SER   9   4.483   7.844   2.833
   56    HA   SER   9           HA       SER   9   6.117   9.515   0.978
   57    HB2  SER   9           2HB      SER   9   8.053   8.101   1.345
   58    HB3  SER   9           3HB      SER   9   7.555   8.881   2.849
   59    HG   SER   9           HG       SER   9   6.578   6.928   3.488
   60    H    ILE  10           H        ILE  10   6.976   8.374  -0.860
   61    HA   ILE  10           HA       ILE  10   5.098   6.335  -1.943
   62    HB   ILE  10           HB       ILE  10   7.302   7.804  -3.438
   63   HG12  ILE  10          2HG1      ILE  10   4.354   8.532  -3.210
   64   HG13  ILE  10          3HG1      ILE  10   5.710   9.464  -2.562
   65   HG21  ILE  10          1HG2      ILE  10   6.418   5.641  -4.416
   66   HG22  ILE  10          2HG2      ILE  10   4.793   6.365  -4.421
   67   HG23  ILE  10          3HG2      ILE  10   6.081   7.043  -5.424
   68   HD11  ILE  10          3HD1      ILE  10   4.999  10.546  -4.554
   69   HD12  ILE  10          1HD1      ILE  10   6.569   9.794  -4.888
   70   HD13  ILE  10          2HD1      ILE  10   5.063   9.053  -5.494
   71    H    CYS  11           H        CYS  11   5.666   4.303  -1.372
   72    HA   CYS  11           HA       CYS  11   8.370   3.552  -0.702
   73    HB2  CYS  11           2HB      CYS  11   5.788   2.037  -1.043
   74    HB3  CYS  11           3HB      CYS  11   7.301   1.199  -0.761
   75    H    SER  12           H        SER  12   9.895   2.510  -1.792
   76    HA   SER  12           HA       SER  12   9.529   1.624  -4.610
   77    HB2  SER  12           2HB      SER  12  11.574   2.880  -3.946
   78    HB3  SER  12           3HB      SER  12  11.994   1.565  -2.831
   79    HG   SER  12           HG       SER  12  12.998   1.409  -4.938
   80    H    LEU  13           H        LEU  13  10.352  -0.605  -5.117
   81    HA   LEU  13           HA       LEU  13   8.763  -2.586  -3.918
   82    HB2  LEU  13           2HB      LEU  13  10.020  -2.389  -6.211
   83    HB3  LEU  13           3HB      LEU  13  11.345  -3.201  -5.392
   84    HG   LEU  13           HG       LEU  13   8.506  -4.261  -5.785
   85   HD11  LEU  13          1HD1      LEU  13   9.535  -5.788  -7.399
   86   HD12  LEU  13          2HD1      LEU  13   9.882  -4.113  -7.854
   87   HD13  LEU  13          3HD1      LEU  13  11.140  -5.094  -7.074
   88   HD21  LEU  13          3HD2      LEU  13   9.495  -6.484  -5.131
   89   HD22  LEU  13          1HD2      LEU  13  10.942  -5.621  -4.560
   90   HD23  LEU  13          2HD2      LEU  13   9.352  -5.339  -3.807
   91    H    TYR  14           H        TYR  14  12.214  -1.862  -3.298
   92    HA   TYR  14           HA       TYR  14  12.872  -3.905  -1.476
   93    HB2  TYR  14           2HB      TYR  14  14.507  -2.385  -2.414
   94    HB3  TYR  14           3HB      TYR  14  13.724  -0.992  -1.677
   95    HD1  TYR  14           HD2      TYR  14  15.768  -4.028  -0.979
   96    HD2  TYR  14           HD1      TYR  14  14.113  -0.378   0.626
   97    HE1  TYR  14           HE2      TYR  14  17.188  -4.274   1.052
   98    HE2  TYR  14           HE1      TYR  14  15.507  -0.644   2.669
   99    HH   TYR  14           HH       TYR  14  17.770  -3.400   3.089
  100    H    GLN  15           H        GLN  15  11.001  -0.938  -0.861
  101    HA   GLN  15           HA       GLN  15  10.990  -1.290   2.063
  102    HB2  GLN  15           2HB      GLN  15   9.364   0.575   0.285
  103    HB3  GLN  15           3HB      GLN  15   9.488   0.648   2.041
  104    HG2  GLN  15           2HG      GLN  15  11.885   1.173   1.895
  105    HG3  GLN  15           3HG      GLN  15  11.847   0.984   0.135
  106   HE21  GLN  15          2HE2      GLN  15  10.585   3.059   2.804
  107   HE22  GLN  15          1HE2      GLN  15  10.297   4.429   1.742
  108    H    LEU  16           H        LEU  16   8.846  -1.908  -0.702
  109    HA   LEU  16           HA       LEU  16   6.523  -2.712   0.777
  110    HB2  LEU  16           2HB      LEU  16   7.445  -3.573  -1.980
  111    HB3  LEU  16           3HB      LEU  16   5.835  -3.858  -1.307
  112    HG   LEU  16           HG       LEU  16   7.139  -1.234  -1.996
  113   HD11  LEU  16          1HD1      LEU  16   6.352  -2.359  -3.943
  114   HD12  LEU  16          2HD1      LEU  16   4.766  -2.655  -3.194
  115   HD13  LEU  16          3HD1      LEU  16   5.291  -0.999  -3.593
  116   HD21  LEU  16          3HD2      LEU  16   5.713  -0.858   0.000
  117   HD22  LEU  16          1HD2      LEU  16   4.979  -0.149  -1.427
  118   HD23  LEU  16          2HD2      LEU  16   4.362  -1.692  -0.807
  119    H    GLU  17           H        GLU  17   9.402  -4.568  -0.205
  120    HA   GLU  17           HA       GLU  17   8.510  -7.136   0.585
  121    HB2  GLU  17           2HB      GLU  17  11.285  -5.914   0.548
  122    HB3  GLU  17           3HB      GLU  17  10.977  -7.605   0.947
  123    HG2  GLU  17           2HG      GLU  17   9.842  -7.927  -1.238
  124    HG3  GLU  17           3HG      GLU  17  10.239  -6.271  -1.683
  125    H    ASN  18           H        ASN  18   9.355  -4.453   2.707
  126    HA   ASN  18           HA       ASN  18   9.929  -6.059   5.049
  127    HB2  ASN  18           2HB      ASN  18  10.653  -3.682   4.707
  128    HB3  ASN  18           3HB      ASN  18   8.965  -3.173   4.840
  129   HD21  ASN  18          1HD2      ASN  18  11.612  -4.793   6.647
  130   HD22  ASN  18          2HD2      ASN  18  10.979  -4.339   8.222
  131    H    TYR  19           H        TYR  19   6.922  -4.841   3.613
  132    HA   TYR  19           HA       TYR  19   5.253  -5.453   5.927
  133    HB2  TYR  19           2HB      TYR  19   4.571  -4.809   3.050
  134    HB3  TYR  19           3HB      TYR  19   3.397  -4.940   4.350
  135    HD1  TYR  19           HD2      TYR  19   3.441  -3.291   6.263
  136    HD2  TYR  19           HD1      TYR  19   5.891  -2.809   2.764
  137    HE1  TYR  19           HE2      TYR  19   3.846  -0.906   6.871
  138    HE2  TYR  19           HE1      TYR  19   6.267  -0.415   3.341
  139    HH   TYR  19           HH       TYR  19   5.000   1.005   6.376
  140    H    CYS  20           H        CYS  20   6.661  -7.468   3.532
  141    HA   CYS  20           HA       CYS  20   4.558  -9.465   3.425
  142    HB2  CYS  20           2HB      CYS  20   7.507  -9.860   2.862
  143    HB3  CYS  20           3HB      CYS  20   6.161 -10.818   2.284
  144    H    ASN  21           H        ASN  21   6.814  -8.656   5.891
  145    HA   ASN  21           HA       ASN  21   7.336 -11.275   6.971
  146    HB2  ASN  21           2HB      ASN  21   8.773  -9.278   7.318
  147    HB3  ASN  21           3HB      ASN  21   7.484  -8.505   8.245
  148   HD21  ASN  21          2HD2      ASN  21   9.549  -8.495   9.719
  149   HD22  ASN  21          1HD2      ASN  21   9.646  -9.855  10.830
  150    H1   PHE   1           H        PHE   1   6.567   3.164  -5.525
  151    HA   PHE   1           HA       PHE   1   6.847   1.813  -7.873
  152    HB2  PHE   1           2HB      PHE   1   7.232   0.854  -5.698
  153    HB3  PHE   1           3HB      PHE   1   5.538   0.977  -5.265
  154    HD1  PHE   1           HD1      PHE   1   7.993  -0.888  -7.361
  155    HD2  PHE   1           HD2      PHE   1   3.961  -0.718  -5.852
  156    HE1  PHE   1           HE1      PHE   1   7.618  -3.242  -8.071
  157    HE2  PHE   1           HE2      PHE   1   3.587  -3.059  -6.561
  158    HZ   PHE   1           HZ       PHE   1   5.421  -4.334  -7.672
  159    H    VAL   2           H        VAL   2   3.830   3.068  -6.754
  160    HA   VAL   2           HA       VAL   2   2.338   1.966  -9.103
  161    HB   VAL   2           HB       VAL   2   1.702   1.521  -6.201
  162   HG11  VAL   2          1HG1      VAL   2  -0.654   0.974  -6.720
  163   HG12  VAL   2          2HG1      VAL   2  -0.329   2.699  -6.825
  164   HG13  VAL   2          3HG1      VAL   2  -0.475   1.733  -8.317
  165   HG21  VAL   2          3HG2      VAL   2   2.614  -0.280  -7.700
  166   HG22  VAL   2          1HG2      VAL   2   1.030  -0.674  -7.018
  167   HG23  VAL   2          2HG2      VAL   2   1.169  -0.135  -8.705
  168    H    ASN   3           H        ASN   3   2.285   4.432  -6.459
  169    HA   ASN   3           HA       ASN   3   1.039   6.379  -8.271
  170    HB2  ASN   3           2HB      ASN   3  -0.873   4.992  -7.431
  171    HB3  ASN   3           3HB      ASN   3  -0.363   5.299  -5.770
  172   HD21  ASN   3          2HD2      ASN   3  -1.603   6.864  -4.786
  173   HD22  ASN   3          1HD2      ASN   3  -2.320   8.217  -5.650
  174    H    GLN   4           H        GLN   4   0.903   8.509  -7.392
  175    HA   GLN   4           HA       GLN   4   2.546   9.098  -4.976
  176    HB2  GLN   4           2HB      GLN   4   2.335  11.456  -5.691
  177    HB3  GLN   4           3HB      GLN   4   3.312  10.403  -6.707
  178    HG2  GLN   4           2HG      GLN   4   1.527  10.281  -8.397
  179    HG3  GLN   4           3HG      GLN   4   0.476  11.283  -7.398
  180   HE21  GLN   4          2HE2      GLN   4   0.670  12.350  -9.753
  181   HE22  GLN   4          1HE2      GLN   4   1.868  13.637  -9.820
  182    H    HIS   5           H        HIS   5  -0.634   9.197  -3.228
  183    HA   HIS   5           HA       HIS   5   2.087   7.935  -3.397
  184    HB2  HIS   5           2HB      HIS   5   0.544   9.089  -1.067
  185    HB3  HIS   5           3HB      HIS   5   1.922   8.012  -0.885
  186    HD2  HIS   5           HD2      HIS   5   3.522   9.702   0.228
  187    HE1  HIS   5           HE1      HIS   5   4.005  12.371  -3.048
  188    HE2  HIS   5           HE2      HIS   5   4.852  11.772  -0.717
  189    H    LEU   6           H        LEU   6   2.228   5.994  -1.888
  190    HA   LEU   6           HA       LEU   6   0.114   4.041  -2.542
  191    HB2  LEU   6           2HB      LEU   6   2.897   3.902  -1.374
  192    HB3  LEU   6           3HB      LEU   6   1.760   2.596  -1.060
  193    HG   LEU   6           HG       LEU   6   1.439   2.164  -3.423
  194   HD11  LEU   6          1HD1      LEU   6   1.790   4.313  -4.452
  195   HD12  LEU   6          2HD1      LEU   6   3.463   4.397  -3.843
  196   HD13  LEU   6          3HD1      LEU   6   3.022   3.195  -5.067
  197   HD21  LEU   6          3HD2      LEU   6   4.391   2.337  -2.712
  198   HD22  LEU   6          1HD2      LEU   6   3.265   1.070  -2.152
  199   HD23  LEU   6          2HD2      LEU   6   3.640   1.233  -3.876
  200    H    CYS   7           H        CYS   7  -1.634   4.938  -1.407
  201    HA   CYS   7           HA       CYS   7  -1.710   4.015   1.404
  202    HB2  CYS   7           2HB      CYS   7  -1.336   6.623   1.044
  203    HB3  CYS   7           3HB      CYS   7  -3.047   6.618   0.678
  204    H    GLY   8           H        GLY   8  -3.860   3.380   2.093
  205    HA2  GLY   8           HA2      GLY   8  -5.887   2.306   1.757
  206    HA3  GLY   8           HA3      GLY   8  -6.226   3.547   0.551
  207    H    SER   9           H        SER   9  -6.910   2.568  -1.292
  208    HA   SER   9           HA       SER   9  -6.441  -0.133  -2.020
  209    HB2  SER   9           2HB      SER   9  -7.363   0.561  -4.234
  210    HB3  SER   9           3HB      SER   9  -8.357   1.027  -2.843
  211    HG   SER   9           HG       SER   9  -8.112   2.746  -4.355
  212    H    HIS  10           H        HIS  10  -4.557   2.788  -2.893
  213    HA   HIS  10           HA       HIS  10  -2.956   1.468  -4.907
  214    HB2  HIS  10           2HB      HIS  10  -2.370   3.927  -3.213
  215    HB3  HIS  10           3HB      HIS  10  -1.428   3.402  -4.605
  216    HD2  HIS  10           HD2      HIS  10  -2.987   3.184  -7.012
  217    HE1  HIS  10           HE1      HIS  10  -5.543   6.411  -5.895
  218    HE2  HIS  10           HE2      HIS  10  -4.762   4.952  -7.831
  219    H    LEU  11           H        LEU  11  -2.620   1.694  -1.379
  220    HA   LEU  11           HA       LEU  11   0.018   0.445  -1.284
  221    HB2  LEU  11           2HB      LEU  11  -0.847   1.811   0.588
  222    HB3  LEU  11           3HB      LEU  11  -2.197   0.699   0.792
  223    HG   LEU  11           HG       LEU  11  -0.539  -1.135   1.350
  224   HD11  LEU  11          1HD1      LEU  11   1.409   1.204   1.423
  225   HD12  LEU  11          2HD1      LEU  11   1.729  -0.420   2.064
  226   HD13  LEU  11          3HD1      LEU  11   1.497  -0.196   0.326
  227   HD21  LEU  11          3HD2      LEU  11  -0.097  -0.254   3.629
  228   HD22  LEU  11          1HD2      LEU  11  -0.614   1.356   3.072
  229   HD23  LEU  11          2HD2      LEU  11  -1.763   0.007   3.087
  230    H    VAL  12           H        VAL  12  -3.371  -0.714  -1.033
  231    HA   VAL  12           HA       VAL  12  -2.759  -3.462  -0.575
  232    HB   VAL  12           HB       VAL  12  -5.193  -2.131  -1.814
  233   HG11  VAL  12          1HG1      VAL  12  -5.242  -4.429  -2.589
  234   HG12  VAL  12          2HG1      VAL  12  -4.838  -5.031  -0.961
  235   HG13  VAL  12          3HG1      VAL  12  -6.403  -4.250  -1.277
  236   HG21  VAL  12          3HG2      VAL  12  -6.196  -2.551   0.388
  237   HG22  VAL  12          1HG2      VAL  12  -4.704  -3.341   0.945
  238   HG23  VAL  12          2HG2      VAL  12  -4.719  -1.606   0.586
  239    H    GLU  13           H        GLU  13  -3.354  -1.786  -3.731
  240    HA   GLU  13           HA       GLU  13  -2.786  -4.075  -5.369
  241    HB2  GLU  13           2HB      GLU  13  -2.479  -1.086  -5.879
  242    HB3  GLU  13           3HB      GLU  13  -2.141  -2.319  -7.096
  243    HG2  GLU  13           3HG      GLU  13  -4.461  -3.201  -6.853
  244    HG3  GLU  13           2HG      GLU  13  -4.832  -1.910  -5.715
  245    H    ALA  14           H        ALA  14  -0.558  -1.513  -4.134
  246    HA   ALA  14           HA       ALA  14   1.766  -2.464  -5.427
  247    HB1  ALA  14           3HB      ALA  14   1.571  -0.250  -4.396
  248    HB2  ALA  14           1HB      ALA  14   1.442  -0.983  -2.781
  249    HB3  ALA  14           2HB      ALA  14   2.943  -1.130  -3.702
  250    H    LEU  15           H        LEU  15   0.421  -3.380  -2.219
  251    HA   LEU  15           HA       LEU  15   2.604  -5.228  -1.685
  252    HB2  LEU  15           2HB      LEU  15  -0.102  -4.797  -0.355
  253    HB3  LEU  15           3HB      LEU  15   1.125  -5.917   0.229
  254    HG   LEU  15           HG       LEU  15   1.502  -2.899   0.023
  255   HD11  LEU  15          1HD1      LEU  15   1.444  -2.980   2.478
  256   HD12  LEU  15          2HD1      LEU  15  -0.071  -3.599   1.800
  257   HD13  LEU  15          3HD1      LEU  15   1.145  -4.731   2.432
  258   HD21  LEU  15          3HD2      LEU  15   3.313  -5.079   1.122
  259   HD22  LEU  15          1HD2      LEU  15   3.654  -4.006  -0.252
  260   HD23  LEU  15          2HD2      LEU  15   3.548  -3.330   1.371
  261    H    TYR  16           H        TYR  16  -0.678  -5.722  -3.120
  262    HA   TYR  16           HA       TYR  16  -0.484  -8.579  -3.193
  263    HB2  TYR  16           2HB      TYR  16  -1.970  -6.517  -4.803
  264    HB3  TYR  16           3HB      TYR  16  -1.847  -8.141  -5.447
  265    HD1  TYR  16           HD1      TYR  16  -2.236 -10.085  -3.557
  266    HD2  TYR  16           HD2      TYR  16  -4.000  -6.152  -3.650
  267    HE1  TYR  16           HE1      TYR  16  -4.121 -10.904  -2.169
  268    HE2  TYR  16           HE2      TYR  16  -5.914  -6.986  -2.288
  269    HH   TYR  16           HH       TYR  16  -6.167 -10.395  -1.236
  270    H    LEU  17           H        LEU  17   1.010  -6.126  -5.289
  271    HA   LEU  17           HA       LEU  17   2.046  -8.035  -7.219
  272    HB2  LEU  17           2HB      LEU  17   2.620  -5.123  -6.597
  273    HB3  LEU  17           3HB      LEU  17   3.403  -5.975  -7.918
  274    HG   LEU  17           HG       LEU  17   0.374  -5.692  -7.709
  275   HD11  LEU  17          1HD1      LEU  17   2.382  -4.021  -9.282
  276   HD12  LEU  17          2HD1      LEU  17   0.610  -3.915  -9.406
  277   HD13  LEU  17          3HD1      LEU  17   1.414  -3.471  -7.895
  278   HD21  LEU  17          3HD2      LEU  17   2.204  -6.454 -10.024
  279   HD22  LEU  17          1HD2      LEU  17   1.099  -7.546  -9.158
  280   HD23  LEU  17          2HD2      LEU  17   0.446  -6.219 -10.122
  281    H    VAL  18           H        VAL  18   3.166  -7.190  -4.065
  282    HA   VAL  18           HA       VAL  18   5.949  -8.134  -4.688
  283    HB   VAL  18           HB       VAL  18   4.948  -6.100  -2.665
  284   HG11  VAL  18          1HG1      VAL  18   7.375  -5.688  -2.217
  285   HG12  VAL  18          2HG1      VAL  18   6.807  -7.247  -1.619
  286   HG13  VAL  18          3HG1      VAL  18   7.762  -7.167  -3.120
  287   HG21  VAL  18          3HG2      VAL  18   6.439  -4.592  -4.016
  288   HG22  VAL  18          1HG2      VAL  18   6.674  -5.910  -5.176
  289   HG23  VAL  18          2HG2      VAL  18   5.061  -5.204  -4.924
  290    H    CYS  19           H        CYS  19   3.427  -8.240  -2.166
  291    HA   CYS  19           HA       CYS  19   4.807 -10.532  -0.845
  292    HB2  CYS  19           2HB      CYS  19   2.553  -8.753   0.116
  293    HB3  CYS  19           3HB      CYS  19   3.427  -9.940   1.076
  294    H    GLY  20           H        GLY  20   1.958  -9.809  -2.741
  295    HA2  GLY  20           HA2      GLY  20   0.001 -11.334  -1.546
  296    HA3  GLY  20           HA3      GLY  20   0.041 -10.976  -3.266
  297    H    GLU  21           H        GLU  21   0.079 -14.770  -2.676
  298    HA   GLU  21           HA       GLU  21  -1.921 -12.730  -2.277
  299    HB2  GLU  21           2HB      GLU  21  -2.242 -15.077  -3.079
  300    HB3  GLU  21           3HB      GLU  21  -1.876 -15.659  -1.452
  301    HG2  GLU  21           2HG      GLU  21  -3.871 -14.510  -0.573
  302    HG3  GLU  21           3HG      GLU  21  -4.161 -13.772  -2.156
  303    H    ARG  22           H        ARG  22   0.493 -14.001  -0.155
  304    HA   ARG  22           HA       ARG  22   0.932 -13.863   2.069
  305    HB2  ARG  22           2HB      ARG  22   0.935 -11.440   1.059
  306    HB3  ARG  22           3HB      ARG  22  -0.496 -11.185   2.018
  307    HG2  ARG  22           2HG      ARG  22   1.639 -10.352   3.020
  308    HG3  ARG  22           3HG      ARG  22   0.730 -11.418   4.076
  309    HD2  ARG  22           2HD      ARG  22   3.220 -11.739   4.073
  310    HD3  ARG  22           3HD      ARG  22   2.277 -13.203   3.800
  311    HE   ARG  22           HE       ARG  22   2.801 -12.323   1.235
  312   HH11  ARG  22          1HH2      ARG  22   5.049 -12.971   3.854
  313   HH12  ARG  22          2HH2      ARG  22   6.121 -13.856   2.799
  314   HH21  ARG  22          1HH1      ARG  22   4.238 -13.244  -0.029
  315   HH22  ARG  22          2HH1      ARG  22   5.720 -13.924   0.609
  316    H    GLY  23           H        GLY  23  -1.564 -15.222   1.550
  317    HA2  GLY  23           HA2      GLY  23  -3.327 -16.167   2.679
  318    HA3  GLY  23           HA3      GLY  23  -2.573 -15.620   4.179
  319    H    DHI  24           H        DHI  24  -3.499 -13.165   1.822
  320    HA   DHI  24           HA       DHI  24  -6.024 -12.511   3.243
  321    HB2  DHI  24           2HB      DHI  24  -6.196 -10.743   1.517
  322    HB3  DHI  24           3HB      DHI  24  -4.630 -11.221   0.871
  323    HD2  DHI  24           HD2      DHI  24  -6.853 -14.183   1.802
  324    HE1  DHI  24           HE1      DHI  24  -7.392 -13.606  -2.386
  325    HE2  DHI  24           HE2      DHI  24  -7.845 -15.168  -0.427
  326    H    PHE  25           H        PHE  25  -2.763 -11.765   3.663
  327    HA   PHE  25           HA       PHE  25  -1.546 -10.382   4.887
  328    HB2  PHE  25           2HB      PHE  25  -3.537  -8.271   4.015
  329    HB3  PHE  25           3HB      PHE  25  -2.064  -7.946   4.898
  330    HD1  PHE  25           HD2      PHE  25  -3.377  -9.229   1.652
  331    HD2  PHE  25           HD1      PHE  25   0.073  -7.842   3.848
  332    HE1  PHE  25           HE2      PHE  25  -2.067  -9.148  -0.452
  333    HE2  PHE  25           HE1      PHE  25   1.364  -7.742   1.758
  334    HZ   PHE  25           HZ       PHE  25   0.306  -8.427  -0.410
  335    H    TYR  26           H        TYR  26  -4.931  -9.749   5.796
  336    HA   TYR  26           HA       TYR  26  -5.906  -8.986   7.656
  337    HB2  TYR  26           2HB      TYR  26  -5.591 -11.286   8.373
  338    HB3  TYR  26           3HB      TYR  26  -4.043 -10.875   9.107
  339    HD1  TYR  26           HD1      TYR  26  -7.680  -9.863   9.162
  340    HD2  TYR  26           HD2      TYR  26  -3.989 -10.171  11.375
  341    HE1  TYR  26           HE1      TYR  26  -8.857  -9.133  11.235
  342    HE2  TYR  26           HE2      TYR  26  -5.178  -9.494  13.455
  343    HH   TYR  26           HH       TYR  26  -7.177  -8.873  14.393
  344    H    THR  27           H        THR  27  -5.234  -6.894   7.248
  345    HA   THR  27           HA       THR  27  -3.359  -5.733   9.275
  346    HB   THR  27           HB       THR  27  -3.189  -3.793   7.684
  347    HG1  THR  27           HG1      THR  27  -4.936  -4.281   6.348
  348   HG21  THR  27          1HG2      THR  27  -2.162  -6.487   6.690
  349   HG22  THR  27          2HG2      THR  27  -1.544  -4.895   6.210
  350   HG23  THR  27          3HG2      THR  27  -1.375  -5.441   7.888
  351    HA   PRO  28           HA       PRO  28  -7.728  -4.636  10.315
  352    HB2  PRO  28           2HB      PRO  28  -7.540  -4.689  13.049
  353    HB3  PRO  28           3HB      PRO  28  -7.718  -6.159  12.041
  354    HG2  PRO  28           2HG      PRO  28  -5.144  -4.951  13.116
  355    HG3  PRO  28           3HG      PRO  28  -5.706  -6.648  13.257
  356    HD2  PRO  28           2HD      PRO  28  -3.987  -5.920  11.314
  357    HD3  PRO  28           3HD      PRO  28  -5.320  -7.058  10.950
  358    H    LYS  29           H        LYS  29  -8.710  -2.783  11.268
  359    HA   LYS  29           HA       LYS  29  -7.006  -0.495  12.056
  360    HB2  LYS  29           2HB      LYS  29  -7.269  -0.596   9.506
  361    HB3  LYS  29           3HB      LYS  29  -8.990  -0.362   9.740
  362    HG2  LYS  29           2HG      LYS  29  -7.916   1.726   9.126
  363    HG3  LYS  29           3HG      LYS  29  -8.593   1.852  10.737
  364    HD2  LYS  29           2HD      LYS  29  -6.388   2.947  10.567
  365    HD3  LYS  29           3HD      LYS  29  -6.390   1.666  11.760
  366    HE2  LYS  29           2HE      LYS  29  -4.321   1.587  10.539
  367    HE3  LYS  29           3HE      LYS  29  -5.250   0.139  10.161
  368    HZ1  LYS  29           HZ1      LYS  29  -5.174   2.552   8.421
  369    HZ2  LYS  29           HZ2      LYS  29  -4.214   1.251   8.201
  370    HZ3  LYS  29           HZ3      LYS  29  -5.840   1.107   8.036
  371    H    THR  30           H        THR  30  -8.062   1.109  13.200
  372    HA   THR  30           HA       THR  30 -10.185   0.364  14.910
  373    HB   THR  30           HB       THR  30  -9.215   3.188  14.352
  374    HG1  THR  30           HG1      THR  30  -7.669   2.718  15.936
  375   HG21  THR  30          1HG2      THR  30  -9.712   3.515  16.768
  376   HG22  THR  30          2HG2      THR  30 -11.169   3.083  15.866
  377   HG23  THR  30          3HG2      THR  30 -10.351   1.856  16.860
  Start of MODEL   26
    1    H1   GLY   1           1H       GLY   1  -1.372 -11.022   8.768
    2    H2   GLY   1           2H       GLY   1  -0.148 -10.027   9.211
    3    H3   GLY   1           3H       GLY   1  -1.593  -9.934   9.974
    4    HA2  GLY   1           HA2      GLY   1  -1.108  -9.254   7.143
    5    HA3  GLY   1           HA3      GLY   1  -2.683  -9.176   7.953
    6    H    ILE   2           H        ILE   2  -1.144  -7.020   6.648
    7    HA   ILE   2           HA       ILE   2  -1.173  -5.024   8.806
    8    HB   ILE   2           HB       ILE   2   1.046  -5.918   9.064
    9   HG12  ILE   2          2HG1      ILE   2   1.302  -3.228   7.672
   10   HG13  ILE   2          3HG1      ILE   2   0.629  -3.452   9.291
   11   HG21  ILE   2          1HG2      ILE   2   1.407  -6.905   6.835
   12   HG22  ILE   2          2HG2      ILE   2   1.575  -5.285   6.133
   13   HG23  ILE   2          3HG2      ILE   2   2.761  -5.899   7.304
   14   HD11  ILE   2          3HD1      ILE   2   2.953  -2.788   9.473
   15   HD12  ILE   2          1HD1      ILE   2   2.780  -4.456  10.046
   16   HD13  ILE   2          2HD1      ILE   2   3.482  -4.120   8.446
   17    H    VAL   3           H        VAL   3  -1.642  -2.988   8.107
   18    HA   VAL   3           HA       VAL   3  -1.317  -2.178   5.318
   19    HB   VAL   3           HB       VAL   3  -3.394  -3.536   5.335
   20   HG11  VAL   3          1HG1      VAL   3  -4.760  -1.293   6.836
   21   HG12  VAL   3          2HG1      VAL   3  -5.449  -2.811   6.242
   22   HG13  VAL   3          3HG1      VAL   3  -4.278  -2.835   7.570
   23   HG21  VAL   3          3HG2      VAL   3  -2.980  -1.895   3.581
   24   HG22  VAL   3          1HG2      VAL   3  -4.704  -2.108   3.925
   25   HG23  VAL   3          2HG2      VAL   3  -3.868  -0.666   4.506
   26    H    GLU   4           H        GLU   4  -0.136  -1.231   7.684
   27    HA   GLU   4           HA       GLU   4  -1.628   0.957   8.804
   28    HB2  GLU   4           2HB      GLU   4   0.240   1.306  10.255
   29    HB3  GLU   4           3HB      GLU   4  -0.128  -0.410  10.129
   30    HG2  GLU   4           2HG      GLU   4   1.792  -0.785   8.678
   31    HG3  GLU   4           3HG      GLU   4   2.090   0.946   8.537
   32    H    GLN   5           H        GLN   5  -0.378   1.064   5.877
   33    HA   GLN   5           HA       GLN   5   0.026   2.623   4.351
   34    HB2  GLN   5           2HB      GLN   5  -0.766   4.742   6.343
   35    HB3  GLN   5           3HB      GLN   5  -0.695   4.885   4.588
   36    HG2  GLN   5           2HG      GLN   5  -2.498   3.199   4.353
   37    HG3  GLN   5           3HG      GLN   5  -2.566   3.010   6.106
   38   HE21  GLN   5          2HE2      GLN   5  -4.916   3.565   5.687
   39   HE22  GLN   5          1HE2      GLN   5  -5.312   5.280   5.675
   40    H    CYS   6           H        CYS   6   1.525   3.958   3.405
   41    HA   CYS   6           HA       CYS   6   4.002   4.521   4.988
   42    HB2  CYS   6           2HB      CYS   6   3.966   2.851   3.108
   43    HB3  CYS   6           3HB      CYS   6   3.689   4.170   1.984
   44    H    CYS   7           H        CYS   7   1.785   5.850   2.613
   45    HA   CYS   7           HA       CYS   7   1.184   7.887   1.951
   46    HB2  CYS   7           2HB      CYS   7   0.107   7.289   4.197
   47    HB3  CYS   7           3HB      CYS   7   1.111   8.551   4.888
   48    H    THR   8           H        THR   8   2.924   9.384   4.697
   49    HA   THR   8           HA       THR   8   3.830  11.554   2.977
   50    HB   THR   8           HB       THR   8   4.956  12.339   5.083
   51    HG1  THR   8           HG1      THR   8   4.459  11.213   6.972
   52   HG21  THR   8          1HG2      THR   8   2.895  12.884   6.278
   53   HG22  THR   8          2HG2      THR   8   2.626  13.013   4.532
   54   HG23  THR   8          3HG2      THR   8   2.012  11.602   5.420
   55    H    SER   9           H        SER   9   5.151   8.499   3.820
   56    HA   SER   9           HA       SER   9   7.861   9.284   2.836
   57    HB2  SER   9           2HB      SER   9   7.687   8.234   5.106
   58    HB3  SER   9           3HB      SER   9   7.105   6.753   4.319
   59    HG   SER   9           HG       SER   9   9.407   6.800   4.671
   60    H    ILE  10           H        ILE  10   8.943   7.657   1.548
   61    HA   ILE  10           HA       ILE  10   7.204   6.664  -0.660
   62    HB   ILE  10           HB       ILE  10  10.184   7.226  -0.499
   63   HG12  ILE  10          2HG1      ILE  10   7.888   8.497  -2.067
   64   HG13  ILE  10          3HG1      ILE  10   8.690   9.192  -0.656
   65   HG21  ILE  10          1HG2      ILE  10   9.817   5.234  -1.947
   66   HG22  ILE  10          2HG2      ILE  10   8.614   6.150  -2.880
   67   HG23  ILE  10          3HG2      ILE  10  10.321   6.622  -2.884
   68   HD11  ILE  10          3HD1      ILE  10   9.528  10.310  -2.566
   69   HD12  ILE  10          1HD1      ILE  10  10.831   9.272  -1.950
   70   HD13  ILE  10          2HD1      ILE  10   9.904   8.797  -3.402
   71    H    CYS  11           H        CYS  11   6.844   4.577  -0.977
   72    HA   CYS  11           HA       CYS  11   8.525   2.565   0.465
   73    HB2  CYS  11           2HB      CYS  11   5.534   2.679   0.183
   74    HB3  CYS  11           3HB      CYS  11   6.382   1.136   0.273
   75    H    SER  12           H        SER  12   9.931   2.614  -1.279
   76    HA   SER  12           HA       SER  12   9.276   1.663  -3.896
   77    HB2  SER  12           2HB      SER  12  11.900   1.363  -2.382
   78    HB3  SER  12           3HB      SER  12  11.672   1.350  -4.143
   79    HG   SER  12           HG       SER  12  12.385   3.397  -3.399
   80    H    LEU  13           H        LEU  13  10.245  -0.470  -4.739
   81    HA   LEU  13           HA       LEU  13   8.890  -2.688  -3.850
   82    HB2  LEU  13           2HB      LEU  13  11.637  -2.564  -5.159
   83    HB3  LEU  13           3HB      LEU  13  10.695  -4.043  -5.010
   84    HG   LEU  13           HG       LEU  13   9.796  -1.573  -6.550
   85   HD11  LEU  13          1HD1      LEU  13  10.835  -4.261  -7.535
   86   HD12  LEU  13          2HD1      LEU  13  10.239  -2.926  -8.549
   87   HD13  LEU  13          3HD1      LEU  13  11.717  -2.718  -7.597
   88   HD21  LEU  13          3HD2      LEU  13   8.584  -4.354  -6.260
   89   HD22  LEU  13          1HD2      LEU  13   7.842  -2.800  -5.808
   90   HD23  LEU  13          2HD2      LEU  13   8.105  -3.191  -7.507
   91    H    TYR  14           H        TYR  14  12.180  -1.849  -2.657
   92    HA   TYR  14           HA       TYR  14  12.548  -4.143  -1.009
   93    HB2  TYR  14           2HB      TYR  14  14.382  -2.680  -1.571
   94    HB3  TYR  14           3HB      TYR  14  13.584  -1.288  -0.847
   95    HD1  TYR  14           HD1      TYR  14  15.239  -4.548  -0.069
   96    HD2  TYR  14           HD2      TYR  14  13.745  -0.813   1.496
   97    HE1  TYR  14           HE1      TYR  14  16.307  -5.035   2.134
   98    HE2  TYR  14           HE2      TYR  14  14.786  -1.312   3.695
   99    HH   TYR  14           HH       TYR  14  16.048  -2.789   4.917
  100    H    GLN  15           H        GLN  15  10.819  -1.091  -0.295
  101    HA   GLN  15           HA       GLN  15  10.363  -1.818   2.521
  102    HB2  GLN  15           2HB      GLN  15   9.109   0.349   0.806
  103    HB3  GLN  15           3HB      GLN  15   8.874   0.162   2.541
  104    HG2  GLN  15           2HG      GLN  15  11.538   0.706   1.178
  105    HG3  GLN  15           3HG      GLN  15  10.530   1.920   1.954
  106   HE21  GLN  15          2HE2      GLN  15  12.998   1.944   2.930
  107   HE22  GLN  15          1HE2      GLN  15  13.080   1.128   4.484
  108    H    LEU  16           H        LEU  16   8.633  -2.011  -0.552
  109    HA   LEU  16           HA       LEU  16   6.173  -3.007   0.576
  110    HB2  LEU  16           2HB      LEU  16   7.355  -3.422  -2.162
  111    HB3  LEU  16           3HB      LEU  16   5.711  -3.881  -1.676
  112    HG   LEU  16           HG       LEU  16   6.862  -1.080  -1.768
  113   HD11  LEU  16          1HD1      LEU  16   5.284  -0.732  -3.614
  114   HD12  LEU  16          2HD1      LEU  16   6.486  -1.974  -3.982
  115   HD13  LEU  16          3HD1      LEU  16   4.829  -2.456  -3.543
  116   HD21  LEU  16          3HD2      LEU  16   5.119  -1.218  -0.005
  117   HD22  LEU  16          1HD2      LEU  16   4.539  -0.309  -1.391
  118   HD23  LEU  16          2HD2      LEU  16   4.010  -1.984  -1.173
  119    H    GLU  17           H        GLU  17   9.183  -4.706  -0.337
  120    HA   GLU  17           HA       GLU  17   8.228  -7.312   0.560
  121    HB2  GLU  17           2HB      GLU  17  11.026  -6.185   0.160
  122    HB3  GLU  17           3HB      GLU  17  10.685  -7.845   0.649
  123    HG2  GLU  17           2HG      GLU  17   9.346  -8.179  -1.421
  124    HG3  GLU  17           3HG      GLU  17   9.779  -6.561  -1.958
  125    H    ASN  18           H        ASN  18   9.493  -4.496   2.291
  126    HA   ASN  18           HA       ASN  18  10.255  -5.869   4.680
  127    HB2  ASN  18           2HB      ASN  18  10.890  -3.521   3.893
  128    HB3  ASN  18           3HB      ASN  18   9.308  -2.985   4.478
  129   HD21  ASN  18          2HD2      ASN  18  11.030  -1.564   5.588
  130   HD22  ASN  18          1HD2      ASN  18  11.509  -2.140   7.187
  131    H    TYR  19           H        TYR  19   7.067  -4.750   3.553
  132    HA   TYR  19           HA       TYR  19   5.633  -5.152   6.008
  133    HB2  TYR  19           2HB      TYR  19   4.805  -5.273   3.097
  134    HB3  TYR  19           3HB      TYR  19   3.664  -5.529   4.400
  135    HD1  TYR  19           HD1      TYR  19   3.230  -3.679   6.091
  136    HD2  TYR  19           HD2      TYR  19   5.541  -3.048   2.528
  137    HE1  TYR  19           HE1      TYR  19   2.913  -1.223   6.333
  138    HE2  TYR  19           HE2      TYR  19   5.265  -0.583   2.775
  139    HH   TYR  19           HH       TYR  19   3.397   0.845   5.487
  140    H    CYS  20           H        CYS  20   7.119  -7.543   3.944
  141    HA   CYS  20           HA       CYS  20   5.383  -9.733   4.759
  142    HB2  CYS  20           2HB      CYS  20   8.195  -9.928   3.665
  143    HB3  CYS  20           3HB      CYS  20   6.922 -11.132   3.622
  144    H    ASN  21           H        ASN  21   7.885  -8.018   6.387
  145    HA   ASN  21           HA       ASN  21   8.910 -10.240   7.992
  146    HB2  ASN  21           2HB      ASN  21   9.239  -7.215   8.215
  147    HB3  ASN  21           3HB      ASN  21  10.067  -8.384   9.230
  148   HD21  ASN  21          2HD2      ASN  21  11.016  -6.373   7.049
  149   HD22  ASN  21          1HD2      ASN  21  12.100  -7.403   6.121
  150    H1   PHE   1           H        PHE   1   3.365   1.634  -9.288
  151    HA   PHE   1           HA       PHE   1   3.781   3.151  -6.902
  152    HB2  PHE   1           2HB      PHE   1   3.134   1.106  -5.750
  153    HB3  PHE   1           3HB      PHE   1   2.076   1.424  -7.105
  154    HD1  PHE   1           HD1      PHE   1   4.938  -0.685  -5.948
  155    HD2  PHE   1           HD2      PHE   1   1.803  -0.205  -8.867
  156    HE1  PHE   1           HE1      PHE   1   5.366  -2.974  -6.777
  157    HE2  PHE   1           HE2      PHE   1   2.237  -2.500  -9.702
  158    HZ   PHE   1           HZ       PHE   1   4.013  -3.897  -8.655
  159    H    VAL   2           H        VAL   2   6.050   1.441  -8.746
  160    HA   VAL   2           HA       VAL   2   7.474  -0.009  -6.816
  161    HB   VAL   2           HB       VAL   2   9.192  -0.331  -8.512
  162   HG11  VAL   2          1HG1      VAL   2   7.838  -1.337 -10.227
  163   HG12  VAL   2          2HG1      VAL   2   6.998  -1.532  -8.680
  164   HG13  VAL   2          3HG1      VAL   2   6.449  -0.308  -9.836
  165   HG21  VAL   2          3HG2      VAL   2   7.772   1.818 -10.151
  166   HG22  VAL   2          1HG2      VAL   2   9.399   1.946  -9.441
  167   HG23  VAL   2          2HG2      VAL   2   9.082   0.760 -10.711
  168    H    ASN   3           H        ASN   3   7.720   3.345  -7.317
  169    HA   ASN   3           HA       ASN   3   9.791   3.641  -5.258
  170    HB2  ASN   3           2HB      ASN   3  11.044   3.400  -7.425
  171    HB3  ASN   3           3HB      ASN   3  10.159   4.781  -8.070
  172   HD21  ASN   3          2HD2      ASN   3  12.502   5.460  -8.405
  173   HD22  ASN   3          1HD2      ASN   3  13.259   6.318  -7.071
  174    H    GLN   4           H        GLN   4   7.199   4.154  -4.820
  175    HA   GLN   4           HA       GLN   4   6.783   7.101  -5.192
  176    HB2  GLN   4           2HB      GLN   4   4.751   4.879  -5.618
  177    HB3  GLN   4           3HB      GLN   4   4.410   6.612  -5.649
  178    HG2  GLN   4           2HG      GLN   4   6.018   6.869  -7.557
  179    HG3  GLN   4           3HG      GLN   4   6.202   5.114  -7.604
  180   HE21  GLN   4          2HE2      GLN   4   5.417   6.068  -9.941
  181   HE22  GLN   4          1HE2      GLN   4   3.689   5.840 -10.179
  182    H    HIS   5           H        HIS   5   5.250   8.116  -3.842
  183    HA   HIS   5           HA       HIS   5   4.989   7.280  -1.064
  184    HB2  HIS   5           2HB      HIS   5   3.502   9.356  -2.729
  185    HB3  HIS   5           3HB      HIS   5   3.378   9.174  -0.989
  186    HD2  HIS   5           HD2      HIS   5   5.509   9.950   0.507
  187    HE1  HIS   5           HE1      HIS   5   7.492  12.107  -2.588
  188    HE2  HIS   5           HE2      HIS   5   7.389  11.701  -0.073
  189    H    LEU   6           H        LEU   6   3.401   6.041  -0.169
  190    HA   LEU   6           HA       LEU   6   1.025   5.227  -1.802
  191    HB2  LEU   6           2HB      LEU   6   3.097   3.431  -0.492
  192    HB3  LEU   6           3HB      LEU   6   1.519   2.870  -1.027
  193    HG   LEU   6           HG       LEU   6   3.571   4.072  -2.911
  194   HD11  LEU   6          1HD1      LEU   6   3.973   1.778  -3.633
  195   HD12  LEU   6          2HD1      LEU   6   4.346   1.960  -1.922
  196   HD13  LEU   6          3HD1      LEU   6   2.831   1.163  -2.416
  197   HD21  LEU   6          3HD2      LEU   6   2.163   3.057  -4.663
  198   HD22  LEU   6          1HD2      LEU   6   0.993   2.523  -3.440
  199   HD23  LEU   6          2HD2      LEU   6   1.249   4.254  -3.755
  200    H    CYS   7           H        CYS   7  -0.473   6.238  -0.625
  201    HA   CYS   7           HA       CYS   7  -0.505   6.101   2.325
  202    HB2  CYS   7           2HB      CYS   7  -0.875   8.183   0.795
  203    HB3  CYS   7           3HB      CYS   7  -2.484   7.525   0.547
  204    H    GLY   8           H        GLY   8  -3.460   6.324   2.470
  205    HA2  GLY   8           HA2      GLY   8  -4.341   3.558   2.477
  206    HA3  GLY   8           HA3      GLY   8  -5.357   4.992   2.655
  207    H    SER   9           H        SER   9  -5.417   2.449   0.940
  208    HA   SER   9           HA       SER   9  -5.769   1.622  -1.097
  209    HB2  SER   9           2HB      SER   9  -7.038   2.672  -2.734
  210    HB3  SER   9           3HB      SER   9  -7.619   3.309  -1.193
  211    HG   SER   9           HG       SER   9  -6.107   5.107  -1.613
  212    H    HIS  10           H        HIS  10  -5.043   1.580  -3.397
  213    HA   HIS  10           HA       HIS  10  -3.367   1.188  -4.809
  214    HB2  HIS  10           2HB      HIS  10  -3.534   3.642  -5.088
  215    HB3  HIS  10           3HB      HIS  10  -2.197   3.842  -3.958
  216    HD2  HIS  10           HD2      HIS  10  -2.450   1.328  -6.965
  217    HE1  HIS  10           HE1      HIS  10   0.858   3.923  -7.694
  218    HE2  HIS  10           HE2      HIS  10  -0.437   1.904  -8.561
  219    H    LEU  11           H        LEU  11  -1.947   2.120  -1.638
  220    HA   LEU  11           HA       LEU  11   0.423   0.544  -1.804
  221    HB2  LEU  11           2HB      LEU  11  -0.143   2.115   0.069
  222    HB3  LEU  11           3HB      LEU  11  -1.445   1.056   0.559
  223    HG   LEU  11           HG       LEU  11   0.129  -0.720   1.160
  224   HD11  LEU  11          1HD1      LEU  11   2.556  -0.336   1.243
  225   HD12  LEU  11          2HD1      LEU  11   1.988  -0.301  -0.424
  226   HD13  LEU  11          3HD1      LEU  11   2.363   1.220   0.424
  227   HD21  LEU  11          3HD2      LEU  11   1.169   0.377   3.083
  228   HD22  LEU  11          1HD2      LEU  11   0.913   1.966   2.319
  229   HD23  LEU  11          2HD2      LEU  11  -0.482   0.972   2.816
  230    H    VAL  12           H        VAL  12  -2.904  -0.346  -0.974
  231    HA   VAL  12           HA       VAL  12  -2.579  -3.073  -0.264
  232    HB   VAL  12           HB       VAL  12  -4.887  -1.669  -1.685
  233   HG11  VAL  12          1HG1      VAL  12  -6.332  -3.430  -0.779
  234   HG12  VAL  12          2HG1      VAL  12  -5.135  -4.120  -1.871
  235   HG13  VAL  12          3HG1      VAL  12  -4.917  -4.269  -0.109
  236   HG21  VAL  12          3HG2      VAL  12  -4.361  -0.623   0.499
  237   HG22  VAL  12          1HG2      VAL  12  -5.889  -1.499   0.570
  238   HG23  VAL  12          2HG2      VAL  12  -4.427  -2.213   1.281
  239    H    GLU  13           H        GLU  13  -3.218  -1.626  -3.488
  240    HA   GLU  13           HA       GLU  13  -3.144  -4.118  -4.927
  241    HB2  GLU  13           2HB      GLU  13  -2.714  -1.255  -5.889
  242    HB3  GLU  13           3HB      GLU  13  -2.973  -2.658  -6.929
  243    HG2  GLU  13           2HG      GLU  13  -5.208  -3.013  -5.928
  244    HG3  GLU  13           3HG      GLU  13  -4.974  -1.616  -4.873
  245    H    ALA  14           H        ALA  14  -0.620  -1.632  -4.253
  246    HA   ALA  14           HA       ALA  14   1.462  -2.791  -5.797
  247    HB1  ALA  14           3HB      ALA  14   1.613  -1.193  -3.198
  248    HB2  ALA  14           1HB      ALA  14   2.906  -1.402  -4.389
  249    HB3  ALA  14           2HB      ALA  14   1.444  -0.502  -4.827
  250    H    LEU  15           H        LEU  15   0.518  -3.422  -2.361
  251    HA   LEU  15           HA       LEU  15   2.681  -5.278  -1.940
  252    HB2  LEU  15           2HB      LEU  15   0.064  -4.755  -0.458
  253    HB3  LEU  15           3HB      LEU  15   1.284  -5.889   0.123
  254    HG   LEU  15           HG       LEU  15   1.919  -2.956  -0.405
  255   HD11  LEU  15          1HD1      LEU  15   1.223  -4.266   2.246
  256   HD12  LEU  15          2HD1      LEU  15   1.727  -2.589   1.996
  257   HD13  LEU  15          3HD1      LEU  15   0.172  -3.148   1.350
  258   HD21  LEU  15          3HD2      LEU  15   3.867  -4.493  -0.333
  259   HD22  LEU  15          1HD2      LEU  15   3.823  -3.401   1.046
  260   HD23  LEU  15          2HD2      LEU  15   3.324  -5.096   1.243
  261    H    TYR  16           H        TYR  16  -0.680  -5.813  -3.011
  262    HA   TYR  16           HA       TYR  16  -0.368  -8.701  -3.183
  263    HB2  TYR  16           2HB      TYR  16  -2.362  -6.760  -4.354
  264    HB3  TYR  16           3HB      TYR  16  -2.462  -8.499  -4.601
  265    HD1  TYR  16           HD2      TYR  16  -1.915  -9.811  -2.134
  266    HD2  TYR  16           HD1      TYR  16  -4.065  -6.136  -2.830
  267    HE1  TYR  16           HE2      TYR  16  -3.090 -10.091   0.020
  268    HE2  TYR  16           HE1      TYR  16  -5.276  -6.447  -0.682
  269    HH   TYR  16           HH       TYR  16  -5.474  -7.663   1.193
  270    H    LEU  17           H        LEU  17   1.279  -6.450  -4.860
  271    HA   LEU  17           HA       LEU  17   1.763  -8.365  -7.112
  272    HB2  LEU  17           2HB      LEU  17   2.050  -5.342  -6.989
  273    HB3  LEU  17           3HB      LEU  17   2.725  -6.321  -8.278
  274    HG   LEU  17           HG       LEU  17  -0.254  -6.236  -7.609
  275   HD11  LEU  17          1HD1      LEU  17   1.296  -4.824  -9.815
  276   HD12  LEU  17          2HD1      LEU  17  -0.471  -4.823  -9.604
  277   HD13  LEU  17          3HD1      LEU  17   0.559  -4.049  -8.391
  278   HD21  LEU  17          3HD2      LEU  17   1.254  -7.360 -10.009
  279   HD22  LEU  17          1HD2      LEU  17   0.361  -8.298  -8.789
  280   HD23  LEU  17          2HD2      LEU  17  -0.513  -7.217  -9.874
  281    H    VAL  18           H        VAL  18   3.122  -7.192  -4.237
  282    HA   VAL  18           HA       VAL  18   5.891  -7.917  -5.121
  283    HB   VAL  18           HB       VAL  18   5.049  -5.743  -3.175
  284   HG11  VAL  18          1HG1      VAL  18   7.776  -6.766  -4.055
  285   HG12  VAL  18          2HG1      VAL  18   7.535  -5.180  -3.311
  286   HG13  VAL  18          3HG1      VAL  18   7.133  -6.637  -2.397
  287   HG21  VAL  18          3HG2      VAL  18   6.352  -5.586  -5.929
  288   HG22  VAL  18          1HG2      VAL  18   4.696  -5.086  -5.523
  289   HG23  VAL  18          2HG2      VAL  18   6.056  -4.221  -4.821
  290    H    CYS  19           H        CYS  19   3.868  -7.694  -2.115
  291    HA   CYS  19           HA       CYS  19   5.730  -9.559  -0.784
  292    HB2  CYS  19           2HB      CYS  19   4.825  -7.517   0.346
  293    HB3  CYS  19           3HB      CYS  19   3.214  -8.241   0.289
  294    H    GLY  20           H        GLY  20   2.468  -9.545  -2.127
  295    HA2  GLY  20           HA2      GLY  20   2.447 -12.524  -2.093
  296    HA3  GLY  20           HA3      GLY  20   1.027 -11.657  -1.511
  297    H    GLU  21           H        GLU  21   0.325 -13.133  -3.365
  298    HA   GLU  21           HA       GLU  21  -0.122 -11.391  -5.751
  299    HB2  GLU  21           2HB      GLU  21   0.509 -14.359  -5.893
  300    HB3  GLU  21           3HB      GLU  21  -0.142 -13.383  -7.221
  301    HG2  GLU  21           2HG      GLU  21   1.866 -11.911  -7.110
  302    HG3  GLU  21           3HG      GLU  21   2.547 -12.955  -5.857
  303    H    ARG  22           H        ARG  22  -1.610 -14.467  -5.944
  304    HA   ARG  22           HA       ARG  22  -4.250 -13.498  -5.070
  305    HB2  ARG  22           2HB      ARG  22  -3.270 -16.254  -5.934
  306    HB3  ARG  22           3HB      ARG  22  -4.950 -15.842  -5.565
  307    HG2  ARG  22           2HG      ARG  22  -4.934 -14.131  -7.375
  308    HG3  ARG  22           3HG      ARG  22  -3.277 -14.603  -7.796
  309    HD2  ARG  22           2HD      ARG  22  -4.043 -16.912  -8.251
  310    HD3  ARG  22           3HD      ARG  22  -5.698 -16.461  -7.847
  311    HE   ARG  22           HE       ARG  22  -4.190 -15.813 -10.295
  312   HH11  ARG  22          1HH1      ARG  22  -7.097 -15.029  -8.493
  313   HH12  ARG  22          2HH1      ARG  22  -7.880 -14.342  -9.891
  314   HH21  ARG  22          1HH2      ARG  22  -5.249 -14.924 -12.025
  315   HH22  ARG  22          2HH2      ARG  22  -6.857 -14.289 -11.832
  316    H    GLY  23           H        GLY  23  -1.566 -14.758  -3.472
  317    HA2  GLY  23           HA2      GLY  23  -2.855 -14.662  -0.878
  318    HA3  GLY  23           HA3      GLY  23  -2.345 -16.296  -1.327
  319    H    DHI  24           H        DHI  24  -1.060 -15.759   0.730
  320    HA   DHI  24           HA       DHI  24   1.702 -15.085  -0.035
  321    HB2  DHI  24           2HB      DHI  24   1.354 -17.166   1.072
  322    HB3  DHI  24           3HB      DHI  24   2.286 -16.117   2.127
  323    HD2  DHI  24           HD2      DHI  24  -1.011 -17.953   1.842
  324    HE1  DHI  24           HE1      DHI  24  -1.157 -16.004   5.640
  325    HE2  DHI  24           HE2      DHI  24  -2.314 -17.705   4.136
  326    H    PHE  25           H        PHE  25  -0.719 -13.169   0.964
  327    HA   PHE  25           HA       PHE  25   0.512 -11.694   3.146
  328    HB2  PHE  25           2HB      PHE  25   1.709 -10.787   1.151
  329    HB3  PHE  25           3HB      PHE  25   0.163 -10.383   0.413
  330    HD1  PHE  25           HD1      PHE  25   2.197  -9.762   3.536
  331    HD2  PHE  25           HD2      PHE  25  -0.733  -8.215   0.764
  332    HE1  PHE  25           HE1      PHE  25   2.216  -7.602   4.725
  333    HE2  PHE  25           HE2      PHE  25  -0.698  -6.046   1.969
  334    HZ   PHE  25           HZ       PHE  25   0.747  -5.745   3.963
  335    H    TYR  26           H        TYR  26  -0.997  -9.959   3.929
  336    HA   TYR  26           HA       TYR  26  -3.699  -9.916   2.823
  337    HB2  TYR  26           2HB      TYR  26  -3.869 -11.899   4.224
  338    HB3  TYR  26           3HB      TYR  26  -3.171 -11.043   5.592
  339    HD1  TYR  26           HD2      TYR  26  -6.022 -10.581   3.142
  340    HD2  TYR  26           HD1      TYR  26  -4.690 -10.360   7.245
  341    HE1  TYR  26           HE2      TYR  26  -8.299  -9.858   3.852
  342    HE2  TYR  26           HE1      TYR  26  -6.969  -9.659   7.947
  343    HH   TYR  26           HH       TYR  26  -9.116  -9.207   7.283
  344    H    THR  27           H        THR  27  -4.701  -8.065   3.139
  345    HA   THR  27           HA       THR  27  -3.584  -5.999   4.965
  346    HB   THR  27           HB       THR  27  -4.928  -4.418   3.613
  347    HG1  THR  27           HG1      THR  27  -6.357  -6.086   2.789
  348   HG21  THR  27          1HG2      THR  27  -3.023  -6.077   1.928
  349   HG22  THR  27          2HG2      THR  27  -3.439  -4.367   1.715
  350   HG23  THR  27          3HG2      THR  27  -2.512  -4.870   3.137
  351    HA   PRO  28           HA       PRO  28  -7.409  -7.000   7.243
  352    HB2  PRO  28           2HB      PRO  28  -6.757  -6.047   9.701
  353    HB3  PRO  28           3HB      PRO  28  -6.025  -7.522   9.013
  354    HG2  PRO  28           2HG      PRO  28  -4.875  -4.713   8.991
  355    HG3  PRO  28           3HG      PRO  28  -4.074  -6.231   9.506
  356    HD2  PRO  28           2HD      PRO  28  -3.758  -5.203   6.998
  357    HD3  PRO  28           3HD      PRO  28  -3.825  -6.968   7.282
  358    H    LYS  29           H        LYS  29  -8.294  -5.501   5.643
  359    HA   LYS  29           HA       LYS  29  -9.551  -3.140   6.929
  360    HB2  LYS  29           2HB      LYS  29  -9.174  -1.741   4.927
  361    HB3  LYS  29           3HB      LYS  29  -7.714  -2.146   5.789
  362    HG2  LYS  29           2HG      LYS  29  -7.317  -2.172   3.410
  363    HG3  LYS  29           3HG      LYS  29  -7.081  -3.792   4.065
  364    HD2  LYS  29           2HD      LYS  29  -9.180  -4.555   3.159
  365    HD3  LYS  29           3HD      LYS  29  -9.671  -2.888   2.768
  366    HE2  LYS  29           2HE      LYS  29  -7.937  -2.749   1.059
  367    HE3  LYS  29           3HE      LYS  29  -7.362  -4.377   1.460
  368    HZ1  LYS  29           HZ1      LYS  29 -10.132  -3.790   0.553
  369    HZ2  LYS  29           HZ2      LYS  29  -8.951  -4.330  -0.450
  370    HZ3  LYS  29           HZ3      LYS  29  -9.493  -5.265   0.777
  371    H    THR  30           H        THR  30 -11.247  -2.225   5.240
  372    HA   THR  30           HA       THR  30 -13.402  -4.008   5.119
  373    HB   THR  30           HB       THR  30 -13.038  -1.537   3.392
  374    HG1  THR  30           HG1      THR  30 -13.876  -0.451   5.189
  375   HG21  THR  30          1HG2      THR  30 -15.494  -1.309   3.720
  376   HG22  THR  30          2HG2      THR  30 -15.095  -2.809   2.877
  377   HG23  THR  30          3HG2      THR  30 -15.517  -2.854   4.603
  Start of MODEL   27
    1    H1   GLY   1           1H       GLY   1  -2.647  -5.339   5.594
    2    H2   GLY   1           2H       GLY   1  -3.319  -5.295   7.088
    3    H3   GLY   1           3H       GLY   1  -4.268  -5.146   5.757
    4    HA2  GLY   1           HA2      GLY   1  -3.216  -3.048   5.179
    5    HA3  GLY   1           HA3      GLY   1  -3.996  -2.994   6.773
    6    H    ILE   2           H        ILE   2  -2.022  -1.168   6.121
    7    HA   ILE   2           HA       ILE   2   0.052  -1.821   8.104
    8    HB   ILE   2           HB       ILE   2   1.044  -2.505   5.986
    9   HG12  ILE   2          2HG1      ILE   2   3.089  -1.117   5.948
   10   HG13  ILE   2          3HG1      ILE   2   2.333   0.050   7.017
   11   HG21  ILE   2          1HG2      ILE   2   1.534  -0.956   4.168
   12   HG22  ILE   2          2HG2      ILE   2  -0.211  -1.055   4.414
   13   HG23  ILE   2          3HG2      ILE   2   0.690   0.355   5.005
   14   HD11  ILE   2          3HD1      ILE   2   2.862  -2.871   7.697
   15   HD12  ILE   2          1HD1      ILE   2   3.864  -1.497   8.202
   16   HD13  ILE   2          2HD1      ILE   2   2.211  -1.643   8.815
   17    H    VAL   3           H        VAL   3   0.668  -0.153   9.343
   18    HA   VAL   3           HA       VAL   3  -0.948   2.288   9.197
   19    HB   VAL   3           HB       VAL   3  -0.174   2.728  11.467
   20   HG11  VAL   3          1HG1      VAL   3  -2.138   1.280  11.071
   21   HG12  VAL   3          2HG1      VAL   3  -1.090  -0.155  11.125
   22   HG13  VAL   3          3HG1      VAL   3  -1.276   0.868  12.561
   23   HG21  VAL   3          3HG2      VAL   3   1.426   0.140  11.238
   24   HG22  VAL   3          1HG2      VAL   3   2.111   1.781  11.349
   25   HG23  VAL   3          2HG2      VAL   3   1.189   1.112  12.700
   26    H    GLU   4           H        GLU   4   1.835   1.645   7.737
   27    HA   GLU   4           HA       GLU   4   2.752   4.480   7.723
   28    HB2  GLU   4           2HB      GLU   4   4.329   3.092   9.026
   29    HB3  GLU   4           3HB      GLU   4   4.485   1.973   7.669
   30    HG2  GLU   4           2HG      GLU   4   5.428   3.869   6.298
   31    HG3  GLU   4           3HG      GLU   4   5.339   4.897   7.732
   32    H    GLN   5           H        GLN   5   2.849   5.293   5.636
   33    HA   GLN   5           HA       GLN   5   2.471   3.363   3.389
   34    HB2  GLN   5           2HB      GLN   5   0.915   5.957   3.694
   35    HB3  GLN   5           3HB      GLN   5   0.754   4.742   2.446
   36    HG2  GLN   5           2HG      GLN   5  -1.062   4.240   3.780
   37    HG3  GLN   5           3HG      GLN   5   0.126   3.088   4.369
   38   HE21  GLN   5          2HE2      GLN   5  -1.112   2.943   6.429
   39   HE22  GLN   5          1HE2      GLN   5  -1.063   4.307   7.543
   40    H    CYS   6           H        CYS   6   3.391   3.790   1.493
   41    HA   CYS   6           HA       CYS   6   5.395   5.910   1.275
   42    HB2  CYS   6           2HB      CYS   6   4.564   3.597  -0.490
   43    HB3  CYS   6           3HB      CYS   6   5.831   4.742  -0.929
   44    H    CYS   7           H        CYS   7   2.898   7.034   1.566
   45    HA   CYS   7           HA       CYS   7   1.976   8.019  -1.061
   46    HB2  CYS   7           2HB      CYS   7   0.467   7.356   0.852
   47    HB3  CYS   7           3HB      CYS   7   1.055   8.753   1.734
   48    H    THR   8           H        THR   8   4.018   9.004   1.595
   49    HA   THR   8           HA       THR   8   4.911  11.341  -0.001
   50    HB   THR   8           HB       THR   8   3.887  12.219   2.034
   51    HG1  THR   8           HG1      THR   8   5.514  13.433   1.340
   52   HG21  THR   8          1HG2      THR   8   4.290  10.339   3.614
   53   HG22  THR   8          2HG2      THR   8   6.029  10.714   3.596
   54   HG23  THR   8          3HG2      THR   8   4.868  11.893   4.232
   55    H    SER   9           H        SER   9   7.078  11.424  -0.368
   56    HA   SER   9           HA       SER   9   8.783  10.367  -1.362
   57    HB2  SER   9           2HB      SER   9   9.752  10.048   0.866
   58    HB3  SER   9           3HB      SER   9   8.969   8.456   0.976
   59    HG   SER   9           HG       SER   9  11.170   8.415   0.185
   60    H    ILE  10           H        ILE  10   9.346   8.549  -2.625
   61    HA   ILE  10           HA       ILE  10   6.887   7.195  -3.607
   62    HB   ILE  10           HB       ILE  10   9.602   7.729  -4.847
   63   HG12  ILE  10          2HG1      ILE  10   6.789   8.730  -5.514
   64   HG13  ILE  10          3HG1      ILE  10   7.959   9.632  -4.553
   65   HG21  ILE  10          1HG2      ILE  10   8.661   6.840  -6.968
   66   HG22  ILE  10          2HG2      ILE  10   8.818   5.585  -5.757
   67   HG23  ILE  10          3HG2      ILE  10   7.219   6.286  -6.087
   68   HD11  ILE  10          3HD1      ILE  10   8.221   8.961  -7.494
   69   HD12  ILE  10          1HD1      ILE  10   7.969  10.539  -6.739
   70   HD13  ILE  10          2HD1      ILE  10   9.510   9.688  -6.500
   71    H    CYS  11           H        CYS  11   9.800   6.387  -1.949
   72    HA   CYS  11           HA       CYS  11  10.727   4.536  -1.131
   73    HB2  CYS  11           2HB      CYS  11   8.033   3.247  -1.598
   74    HB3  CYS  11           3HB      CYS  11   9.325   2.553  -0.647
   75    H    SER  12           H        SER  12  11.622   2.475  -1.460
   76    HA   SER  12           HA       SER  12  11.738   1.465  -4.277
   77    HB2  SER  12           2HB      SER  12  13.517   0.889  -1.878
   78    HB3  SER  12           3HB      SER  12  13.677   0.145  -3.481
   79    HG   SER  12           HG       SER  12  15.068   1.966  -3.206
   80    H    LEU  13           H        LEU  13  11.393  -0.807  -4.662
   81    HA   LEU  13           HA       LEU  13   9.101  -1.824  -3.341
   82    HB2  LEU  13           2HB      LEU  13  11.055  -2.971  -5.346
   83    HB3  LEU  13           3HB      LEU  13   9.829  -3.997  -4.612
   84    HG   LEU  13           HG       LEU  13   8.024  -2.540  -5.414
   85   HD11  LEU  13          1HD1      LEU  13   9.102  -0.361  -5.623
   86   HD12  LEU  13          2HD1      LEU  13  10.235  -1.003  -6.844
   87   HD13  LEU  13          3HD1      LEU  13   8.502  -0.864  -7.198
   88   HD21  LEU  13          3HD2      LEU  13   9.942  -3.429  -7.605
   89   HD22  LEU  13          1HD2      LEU  13   8.790  -4.474  -6.745
   90   HD23  LEU  13          2HD2      LEU  13   8.191  -3.169  -7.778
   91    H    TYR  14           H        TYR  14  12.486  -2.429  -2.555
   92    HA   TYR  14           HA       TYR  14  12.226  -4.685  -0.858
   93    HB2  TYR  14           2HB      TYR  14  14.376  -3.746  -1.477
   94    HB3  TYR  14           3HB      TYR  14  13.991  -2.213  -0.703
   95    HD1  TYR  14           HD2      TYR  14  14.757  -5.808  -0.059
   96    HD2  TYR  14           HD1      TYR  14  14.278  -1.879   1.667
   97    HE1  TYR  14           HE2      TYR  14  15.693  -6.638   2.095
   98    HE2  TYR  14           HE1      TYR  14  15.193  -2.718   3.826
   99    HH   TYR  14           HH       TYR  14  16.254  -6.119   4.255
  100    H    GLN  15           H        GLN  15  11.302  -1.292  -0.259
  101    HA   GLN  15           HA       GLN  15  10.899  -1.623   2.616
  102    HB2  GLN  15           2HB      GLN  15   9.800   0.482   0.704
  103    HB3  GLN  15           3HB      GLN  15   9.771   0.558   2.464
  104    HG2  GLN  15           2HG      GLN  15  12.241   0.575   2.543
  105    HG3  GLN  15           3HG      GLN  15  12.319   0.426   0.782
  106   HE21  GLN  15          2HE2      GLN  15  11.117   2.651   3.379
  107   HE22  GLN  15          1HE2      GLN  15  11.292   4.078   2.369
  108    H    LEU  16           H        LEU  16   8.900  -1.857  -0.292
  109    HA   LEU  16           HA       LEU  16   6.384  -2.298   1.062
  110    HB2  LEU  16           2HB      LEU  16   7.203  -3.190  -1.723
  111    HB3  LEU  16           3HB      LEU  16   5.567  -3.058  -1.112
  112    HG   LEU  16           HG       LEU  16   7.497  -0.791  -1.707
  113   HD11  LEU  16          1HD1      LEU  16   6.448  -1.795  -3.672
  114   HD12  LEU  16          2HD1      LEU  16   4.835  -1.582  -2.950
  115   HD13  LEU  16          3HD1      LEU  16   5.817  -0.167  -3.393
  116   HD21  LEU  16          3HD2      LEU  16   4.679  -0.674  -0.553
  117   HD22  LEU  16          1HD2      LEU  16   6.170  -0.126   0.248
  118   HD23  LEU  16          2HD2      LEU  16   5.576   0.729  -1.179
  119    H    GLU  17           H        GLU  17   8.837  -4.548  -0.338
  120    HA   GLU  17           HA       GLU  17   7.656  -6.995   0.527
  121    HB2  GLU  17           2HB      GLU  17  10.582  -6.207   0.200
  122    HB3  GLU  17           3HB      GLU  17  10.039  -7.842   0.572
  123    HG2  GLU  17           2HG      GLU  17   8.704  -7.889  -1.516
  124    HG3  GLU  17           3HG      GLU  17   9.302  -6.279  -1.927
  125    H    ASN  18           H        ASN  18   9.631  -4.655   2.410
  126    HA   ASN  18           HA       ASN  18   9.931  -6.384   4.642
  127    HB2  ASN  18           2HB      ASN  18  11.298  -4.317   4.081
  128    HB3  ASN  18           3HB      ASN  18   9.977  -3.360   4.763
  129   HD21  ASN  18          1HD2      ASN  18  10.809  -2.657   6.741
  130   HD22  ASN  18          2HD2      ASN  18  11.543  -3.736   7.918
  131    H    TYR  19           H        TYR  19   7.138  -4.419   3.729
  132    HA   TYR  19           HA       TYR  19   5.805  -4.683   6.309
  133    HB2  TYR  19           2HB      TYR  19   4.622  -4.167   3.569
  134    HB3  TYR  19           3HB      TYR  19   3.822  -3.915   5.107
  135    HD1  TYR  19           HD1      TYR  19   5.995  -2.502   6.693
  136    HD2  TYR  19           HD2      TYR  19   4.642  -2.010   2.625
  137    HE1  TYR  19           HE1      TYR  19   6.744  -0.136   6.725
  138    HE2  TYR  19           HE2      TYR  19   5.392   0.363   2.667
  139    HH   TYR  19           HH       TYR  19   6.928   1.828   5.558
  140    H    CYS  20           H        CYS  20   6.493  -6.912   3.843
  141    HA   CYS  20           HA       CYS  20   4.444  -8.881   4.748
  142    HB2  CYS  20           2HB      CYS  20   6.194  -8.780   2.279
  143    HB3  CYS  20           3HB      CYS  20   4.967  -9.989   2.630
  144    H    ASN  21           H        ASN  21   7.564  -8.051   5.469
  145    HA   ASN  21           HA       ASN  21   8.858 -10.667   5.430
  146    HB2  ASN  21           2HB      ASN  21  10.040  -8.607   4.823
  147    HB3  ASN  21           3HB      ASN  21   9.711  -7.921   6.423
  148   HD21  ASN  21          1HD2      ASN  21  11.993  -7.574   6.615
  149   HD22  ASN  21          2HD2      ASN  21  13.043  -8.932   7.032
  150    H1   PHE   1           H        PHE   1   4.238   3.476 -10.673
  151    HA   PHE   1           HA       PHE   1   4.238   2.548  -8.322
  152    HB2  PHE   1           2HB      PHE   1   3.947   1.170 -10.465
  153    HB3  PHE   1           3HB      PHE   1   5.631   0.712 -10.315
  154    HD1  PHE   1           HD2      PHE   1   6.332  -0.500  -8.062
  155    HD2  PHE   1           HD1      PHE   1   2.251  -0.056  -9.405
  156    HE1  PHE   1           HE2      PHE   1   5.665  -2.442  -6.693
  157    HE2  PHE   1           HE1      PHE   1   1.595  -2.015  -8.045
  158    HZ   PHE   1           HZ       PHE   1   3.300  -3.228  -6.704
  159    H    VAL   2           H        VAL   2   7.350   2.603  -9.987
  160    HA   VAL   2           HA       VAL   2   8.715   2.962  -7.350
  161    HB   VAL   2           HB       VAL   2   9.404   0.931  -8.671
  162   HG11  VAL   2          1HG1      VAL   2   9.425   1.938 -10.938
  163   HG12  VAL   2          2HG1      VAL   2  10.825   2.929 -10.468
  164   HG13  VAL   2          3HG1      VAL   2  10.956   1.162 -10.511
  165   HG21  VAL   2          3HG2      VAL   2  11.650   2.877  -8.064
  166   HG22  VAL   2          1HG2      VAL   2  10.777   1.901  -6.862
  167   HG23  VAL   2          2HG2      VAL   2  11.733   1.108  -8.126
  168    H    ASN   3           H        ASN   3   7.480   4.547  -9.943
  169    HA   ASN   3           HA       ASN   3   9.158   6.971  -9.463
  170    HB2  ASN   3           2HB      ASN   3   7.849   6.062 -12.068
  171    HB3  ASN   3           3HB      ASN   3   8.642   7.617 -11.822
  172   HD21  ASN   3          2HD2      ASN   3  11.011   7.568 -11.222
  173   HD22  ASN   3          1HD2      ASN   3  11.958   6.251 -11.899
  174    H    GLN   4           H        GLN   4   6.300   5.682  -8.628
  175    HA   GLN   4           HA       GLN   4   4.983   8.300  -8.327
  176    HB2  GLN   4           2HB      GLN   4   4.103   7.276 -10.440
  177    HB3  GLN   4           3HB      GLN   4   3.561   5.874  -9.509
  178    HG2  GLN   4           2HG      GLN   4   2.028   7.323  -8.205
  179    HG3  GLN   4           3HG      GLN   4   2.635   8.750  -9.059
  180   HE21  GLN   4          2HE2      GLN   4   0.811   5.675  -9.497
  181   HE22  GLN   4          1HE2      GLN   4  -0.001   6.215 -10.959
  182    H    HIS   5           H        HIS   5   3.800   8.461  -6.479
  183    HA   HIS   5           HA       HIS   5   4.503   6.863  -4.271
  184    HB2  HIS   5           2HB      HIS   5   2.176   8.809  -4.458
  185    HB3  HIS   5           3HB      HIS   5   3.101   8.381  -3.025
  186    HD2  HIS   5           HD2      HIS   5   5.207   9.862  -2.492
  187    HE1  HIS   5           HE1      HIS   5   5.435  12.076  -6.127
  188    HE2  HIS   5           HE2      HIS   5   6.373  11.853  -3.774
  189    H    LEU   6           H        LEU   6   3.265   5.660  -2.799
  190    HA   LEU   6           HA       LEU   6   0.858   4.242  -3.886
  191    HB2  LEU   6           2HB      LEU   6   2.968   3.212  -1.953
  192    HB3  LEU   6           3HB      LEU   6   1.483   2.406  -2.385
  193    HG   LEU   6           HG       LEU   6   3.105   1.268  -3.531
  194   HD11  LEU   6          1HD1      LEU   6   2.049   3.191  -5.635
  195   HD12  LEU   6          2HD1      LEU   6   2.624   1.532  -5.880
  196   HD13  LEU   6          3HD1      LEU   6   1.143   1.819  -4.948
  197   HD21  LEU   6          3HD2      LEU   6   4.859   2.147  -4.891
  198   HD22  LEU   6          1HD2      LEU   6   4.284   3.807  -4.695
  199   HD23  LEU   6          2HD2      LEU   6   4.942   2.919  -3.303
  200    H    CYS   7           H        CYS   7  -0.699   5.541  -3.097
  201    HA   CYS   7           HA       CYS   7  -0.871   6.140  -0.192
  202    HB2  CYS   7           2HB      CYS   7  -2.463   7.078  -2.589
  203    HB3  CYS   7           3HB      CYS   7  -2.708   7.642  -0.939
  204    H    GLY   8           H        GLY   8  -3.590   6.222   0.216
  205    HA2  GLY   8           HA2      GLY   8  -4.268   3.638   1.015
  206    HA3  GLY   8           HA3      GLY   8  -5.432   4.937   0.760
  207    H    SER   9           H        SER   9  -5.417   1.971   0.226
  208    HA   SER   9           HA       SER   9  -5.996   0.360  -1.208
  209    HB2  SER   9           2HB      SER   9  -7.139   2.530  -2.980
  210    HB3  SER   9           3HB      SER   9  -7.425   0.790  -3.127
  211    HG   SER   9           HG       SER   9  -9.083   1.859  -1.932
  212    H    HIS  10           H        HIS  10  -4.268   2.964  -3.001
  213    HA   HIS  10           HA       HIS  10  -3.280   1.299  -5.112
  214    HB2  HIS  10           2HB      HIS  10  -1.806   3.638  -3.849
  215    HB3  HIS  10           3HB      HIS  10  -1.642   3.029  -5.489
  216    HD2  HIS  10           HD2      HIS  10  -4.541   3.045  -6.606
  217    HE1  HIS  10           HE1      HIS  10  -4.869   7.072  -5.235
  218    HE2  HIS  10           HE2      HIS  10  -5.861   5.318  -6.794
  219    H    LEU  11           H        LEU  11  -1.912   2.041  -1.906
  220    HA   LEU  11           HA       LEU  11   0.457   0.459  -2.122
  221    HB2  LEU  11           2HB      LEU  11   0.054   2.278  -0.486
  222    HB3  LEU  11           3HB      LEU  11  -1.219   1.331   0.273
  223    HG   LEU  11           HG       LEU  11   0.427  -0.346   1.022
  224   HD11  LEU  11          1HD1      LEU  11   2.848   0.125   0.858
  225   HD12  LEU  11          2HD1      LEU  11   2.151  -0.152  -0.741
  226   HD13  LEU  11          3HD1      LEU  11   2.519   1.508  -0.207
  227   HD21  LEU  11          3HD2      LEU  11   1.154   2.531   1.659
  228   HD22  LEU  11          1HD2      LEU  11  -0.105   1.558   2.453
  229   HD23  LEU  11          2HD2      LEU  11   1.601   1.116   2.645
  230    H    VAL  12           H        VAL  12  -2.848  -0.395  -1.121
  231    HA   VAL  12           HA       VAL  12  -2.192  -3.032  -0.116
  232    HB   VAL  12           HB       VAL  12  -4.853  -1.966  -1.153
  233   HG11  VAL  12          1HG1      VAL  12  -5.833  -3.742   0.283
  234   HG12  VAL  12          2HG1      VAL  12  -4.879  -4.405  -1.044
  235   HG13  VAL  12          3HG1      VAL  12  -4.201  -4.370   0.602
  236   HG21  VAL  12          3HG2      VAL  12  -5.385  -1.615   1.245
  237   HG22  VAL  12          1HG2      VAL  12  -3.725  -2.074   1.680
  238   HG23  VAL  12          2HG2      VAL  12  -4.034  -0.602   0.737
  239    H    GLU  13           H        GLU  13  -3.475  -1.874  -3.277
  240    HA   GLU  13           HA       GLU  13  -3.351  -4.419  -4.604
  241    HB2  GLU  13           2HB      GLU  13  -3.190  -1.562  -5.647
  242    HB3  GLU  13           3HB      GLU  13  -3.284  -2.976  -6.693
  243    HG2  GLU  13           2HG      GLU  13  -5.398  -2.243  -4.617
  244    HG3  GLU  13           3HG      GLU  13  -5.469  -1.813  -6.320
  245    H    ALA  14           H        ALA  14  -0.872  -1.818  -4.297
  246    HA   ALA  14           HA       ALA  14   1.090  -3.080  -5.914
  247    HB1  ALA  14           3HB      ALA  14   1.205  -0.724  -5.276
  248    HB2  ALA  14           1HB      ALA  14   1.398  -1.163  -3.561
  249    HB3  ALA  14           2HB      ALA  14   2.668  -1.561  -4.730
  250    H    LEU  15           H        LEU  15   0.520  -3.387  -2.356
  251    HA   LEU  15           HA       LEU  15   2.739  -5.143  -1.926
  252    HB2  LEU  15           2HB      LEU  15   0.181  -4.573  -0.391
  253    HB3  LEU  15           3HB      LEU  15   1.364  -5.740   0.195
  254    HG   LEU  15           HG       LEU  15   2.150  -2.871  -0.476
  255   HD11  LEU  15          1HD1      LEU  15   1.418  -4.014   2.244
  256   HD12  LEU  15          2HD1      LEU  15   2.016  -2.374   1.910
  257   HD13  LEU  15          3HD1      LEU  15   0.423  -2.868   1.314
  258   HD21  LEU  15          3HD2      LEU  15   3.988  -4.578  -0.310
  259   HD22  LEU  15          1HD2      LEU  15   4.061  -3.337   0.938
  260   HD23  LEU  15          2HD2      LEU  15   3.444  -4.953   1.330
  261    H    TYR  16           H        TYR  16  -0.677  -5.920  -2.747
  262    HA   TYR  16           HA       TYR  16  -0.252  -8.762  -2.675
  263    HB2  TYR  16           2HB      TYR  16  -2.325  -6.999  -4.004
  264    HB3  TYR  16           3HB      TYR  16  -2.321  -8.742  -4.220
  265    HD1  TYR  16           HD2      TYR  16  -1.863 -10.063  -1.854
  266    HD2  TYR  16           HD1      TYR  16  -3.936  -6.326  -2.379
  267    HE1  TYR  16           HE2      TYR  16  -3.037 -10.429   0.296
  268    HE2  TYR  16           HE1      TYR  16  -5.151  -6.710  -0.231
  269    HH   TYR  16           HH       TYR  16  -4.589  -9.614   1.788
  270    H    LEU  17           H        LEU  17   0.829  -6.460  -5.034
  271    HA   LEU  17           HA       LEU  17   1.372  -8.568  -7.064
  272    HB2  LEU  17           2HB      LEU  17   1.845  -5.566  -6.993
  273    HB3  LEU  17           3HB      LEU  17   2.387  -6.599  -8.305
  274    HG   LEU  17           HG       LEU  17  -0.543  -6.366  -7.485
  275   HD11  LEU  17          1HD1      LEU  17   0.301  -4.185  -8.236
  276   HD12  LEU  17          2HD1      LEU  17   0.979  -4.932  -9.702
  277   HD13  LEU  17          3HD1      LEU  17  -0.781  -4.889  -9.445
  278   HD21  LEU  17          3HD2      LEU  17  -0.953  -7.280  -9.746
  279   HD22  LEU  17          1HD2      LEU  17   0.797  -7.461  -9.995
  280   HD23  LEU  17          2HD2      LEU  17  -0.042  -8.415  -8.750
  281    H    VAL  18           H        VAL  18   3.183  -6.397  -4.875
  282    HA   VAL  18           HA       VAL  18   5.791  -7.294  -5.729
  283    HB   VAL  18           HB       VAL  18   4.815  -5.665  -3.355
  284   HG11  VAL  18          1HG1      VAL  18   7.203  -4.889  -3.139
  285   HG12  VAL  18          2HG1      VAL  18   6.933  -6.549  -2.609
  286   HG13  VAL  18          3HG1      VAL  18   7.692  -6.232  -4.190
  287   HG21  VAL  18          3HG2      VAL  18   6.357  -4.882  -5.868
  288   HG22  VAL  18          1HG2      VAL  18   4.606  -4.722  -5.673
  289   HG23  VAL  18          2HG2      VAL  18   5.683  -3.794  -4.626
  290    H    CYS  19           H        CYS  19   3.751  -8.168  -2.944
  291    HA   CYS  19           HA       CYS  19   5.885  -9.776  -1.774
  292    HB2  CYS  19           2HB      CYS  19   3.040  -9.286  -0.896
  293    HB3  CYS  19           3HB      CYS  19   4.263 -10.154   0.031
  294    H    GLY  20           H        GLY  20   4.036 -10.686  -4.339
  295    HA2  GLY  20           HA2      GLY  20   3.259 -13.359  -3.582
  296    HA3  GLY  20           HA3      GLY  20   3.585 -12.804  -5.224
  297    H    GLU  21           H        GLU  21   6.460 -15.100  -3.735
  298    HA   GLU  21           HA       GLU  21   3.524 -15.332  -3.277
  299    HB2  GLU  21           2HB      GLU  21   3.820 -17.708  -3.538
  300    HB3  GLU  21           3HB      GLU  21   4.380 -16.824  -4.949
  301    HG2  GLU  21           2HG      GLU  21   6.736 -17.102  -4.228
  302    HG3  GLU  21           3HG      GLU  21   6.209 -17.956  -2.782
  303    H    ARG  22           H        ARG  22   5.226 -13.969  -1.346
  304    HA   ARG  22           HA       ARG  22   5.947 -15.642   0.871
  305    HB2  ARG  22           2HB      ARG  22   6.803 -13.339   0.404
  306    HB3  ARG  22           3HB      ARG  22   5.209 -12.681   0.761
  307    HG2  ARG  22           2HG      ARG  22   6.729 -12.306   2.593
  308    HG3  ARG  22           3HG      ARG  22   5.389 -13.329   3.102
  309    HD2  ARG  22           2HD      ARG  22   6.871 -15.331   2.887
  310    HD3  ARG  22           3HD      ARG  22   8.203 -14.264   2.390
  311    HE   ARG  22           HE       ARG  22   7.122 -13.352   4.876
  312   HH11  ARG  22          1HH1      ARG  22   9.114 -15.976   3.675
  313   HH12  ARG  22          2HH1      ARG  22   9.852 -16.255   5.228
  314   HH21  ARG  22          1HH2      ARG  22   8.052 -13.819   6.854
  315   HH22  ARG  22          2HH2      ARG  22   9.280 -15.044   6.969
  316    H    GLY  23           H        GLY  23   2.855 -14.415  -0.105
  317    HA2  GLY  23           HA2      GLY  23   0.871 -15.559   0.630
  318    HA3  GLY  23           HA3      GLY  23   1.557 -15.747   2.239
  319    H    DHI  24           H        DHI  24   2.279 -12.613   1.516
  320    HA   DHI  24           HA       DHI  24  -0.411 -11.508   2.242
  321    HB2  DHI  24           2HB      DHI  24  -0.005  -9.670   0.800
  322    HB3  DHI  24           3HB      DHI  24   1.696 -10.073   0.640
  323    HD2  DHI  24           HD2      DHI  24  -1.289 -12.518  -0.041
  324    HE1  DHI  24           HE1      DHI  24   0.844 -11.989  -3.697
  325    HE2  DHI  24           HE2      DHI  24  -1.060 -13.248  -2.561
  326    H    PHE  25           H        PHE  25  -0.528  -9.632   3.503
  327    HA   PHE  25           HA       PHE  25   1.600  -8.105   4.515
  328    HB2  PHE  25           2HB      PHE  25  -1.198  -8.651   5.571
  329    HB3  PHE  25           3HB      PHE  25  -0.097  -7.543   6.360
  330    HD1  PHE  25           HD2      PHE  25  -2.193  -8.046   3.343
  331    HD2  PHE  25           HD1      PHE  25   0.483  -5.386   5.438
  332    HE1  PHE  25           HE2      PHE  25  -2.930  -6.168   1.904
  333    HE2  PHE  25           HE1      PHE  25  -0.278  -3.504   4.012
  334    HZ   PHE  25           HZ       PHE  25  -1.983  -3.890   2.239
  335    H    TYR  26           H        TYR  26   2.885  -8.131   6.228
  336    HA   TYR  26           HA       TYR  26   2.613 -10.240   8.353
  337    HB2  TYR  26           2HB      TYR  26   4.683 -10.477   7.118
  338    HB3  TYR  26           3HB      TYR  26   5.059  -8.765   7.333
  339    HD1  TYR  26           HD1      TYR  26   4.612 -12.001   9.145
  340    HD2  TYR  26           HD2      TYR  26   6.065  -7.943   9.337
  341    HE1  TYR  26           HE1      TYR  26   5.657 -12.478  11.347
  342    HE2  TYR  26           HE2      TYR  26   7.100  -8.415  11.540
  343    HH   TYR  26           HH       TYR  26   6.890 -11.646  13.099
  344    H    THR  27           H        THR  27   3.176  -6.809   7.637
  345    HA   THR  27           HA       THR  27   2.786  -4.899   8.768
  346    HB   THR  27           HB       THR  27   0.865  -6.411  10.543
  347    HG1  THR  27           HG1      THR  27  -0.161  -5.170   8.361
  348   HG21  THR  27          1HG2      THR  27   0.879  -3.557   9.452
  349   HG22  THR  27          2HG2      THR  27  -0.397  -4.288  10.449
  350   HG23  THR  27          3HG2      THR  27   1.209  -4.018  11.137
  351    HA   PRO  28           HA       PRO  28   5.840  -6.346  11.945
  352    HB2  PRO  28           2HB      PRO  28   7.968  -4.742  11.283
  353    HB3  PRO  28           3HB      PRO  28   7.550  -6.231  10.389
  354    HG2  PRO  28           2HG      PRO  28   6.768  -3.377   9.705
  355    HG3  PRO  28           3HG      PRO  28   7.529  -4.601   8.636
  356    HD2  PRO  28           2HD      PRO  28   4.857  -4.195   8.614
  357    HD3  PRO  28           3HD      PRO  28   5.519  -5.853   8.493
  358    H    LYS  29           H        LYS  29   4.437  -3.233  11.410
  359    HA   LYS  29           HA       LYS  29   5.601  -1.969  13.780
  360    HB2  LYS  29           2HB      LYS  29   3.422  -1.003  11.889
  361    HB3  LYS  29           3HB      LYS  29   4.216  -0.027  13.129
  362    HG2  LYS  29           2HG      LYS  29   6.413  -0.359  11.945
  363    HG3  LYS  29           3HG      LYS  29   5.561  -1.255  10.681
  364    HD2  LYS  29           2HD      LYS  29   5.792   0.936   9.817
  365    HD3  LYS  29           3HD      LYS  29   4.110   0.771  10.296
  366    HE2  LYS  29           2HE      LYS  29   4.611   2.877  11.140
  367    HE3  LYS  29           3HE      LYS  29   4.875   1.873  12.564
  368    HZ1  LYS  29           HZ1      LYS  29   6.722   3.395  12.237
  369    HZ2  LYS  29           HZ2      LYS  29   7.287   1.888  11.952
  370    HZ3  LYS  29           HZ3      LYS  29   6.956   2.901  10.698
  371    H    THR  30           H        THR  30   3.550  -4.270  13.715
  372    HA   THR  30           HA       THR  30   1.806  -5.142  14.898
  373    HB   THR  30           HB       THR  30   3.022  -3.664  17.245
  374    HG1  THR  30           HG1      THR  30   4.586  -4.752  16.023
  375   HG21  THR  30          1HG2      THR  30   1.586  -6.358  16.999
  376   HG22  THR  30          2HG2      THR  30   2.353  -5.721  18.470
  377   HG23  THR  30          3HG2      THR  30   0.935  -4.911  17.795
  Start of MODEL   28
    1    H1   GLY   1           1H       GLY   1   9.570   3.922   8.480
    2    H2   GLY   1           2H       GLY   1   8.532   3.799   7.215
    3    H3   GLY   1           3H       GLY   1   8.066   4.561   8.591
    4    HA2  GLY   1           HA2      GLY   1   8.731   1.690   8.393
    5    HA3  GLY   1           HA3      GLY   1   8.152   2.522   9.847
    6    H    ILE   2           H        ILE   2   6.674   0.489   9.380
    7    HA   ILE   2           HA       ILE   2   4.706   0.578   7.323
    8    HB   ILE   2           HB       ILE   2   4.879  -0.869   9.983
    9   HG12  ILE   2          2HG1      ILE   2   5.202  -1.785   7.083
   10   HG13  ILE   2          3HG1      ILE   2   6.518  -1.452   8.202
   11   HG21  ILE   2          1HG2      ILE   2   3.013  -2.328   9.279
   12   HG22  ILE   2          2HG2      ILE   2   2.478  -0.682   9.508
   13   HG23  ILE   2          3HG2      ILE   2   2.733  -1.299   7.861
   14   HD11  ILE   2          3HD1      ILE   2   4.516  -3.728   8.399
   15   HD12  ILE   2          1HD1      ILE   2   6.250  -3.817   8.090
   16   HD13  ILE   2          2HD1      ILE   2   5.674  -3.302   9.687
   17    H    VAL   3           H        VAL   3   4.637   1.943  10.584
   18    HA   VAL   3           HA       VAL   3   1.868   2.310  10.879
   19    HB   VAL   3           HB       VAL   3   4.110   3.939  12.118
   20   HG11  VAL   3          1HG1      VAL   3   1.238   3.482  13.043
   21   HG12  VAL   3          2HG1      VAL   3   2.517   4.241  14.015
   22   HG13  VAL   3          3HG1      VAL   3   1.955   5.032  12.547
   23   HG21  VAL   3          3HG2      VAL   3   3.884   2.335  14.014
   24   HG22  VAL   3          1HG2      VAL   3   2.728   1.382  13.059
   25   HG23  VAL   3          2HG2      VAL   3   4.424   1.525  12.546
   26    H    GLU   4           H        GLU   4   4.158   4.449   9.243
   27    HA   GLU   4           HA       GLU   4   2.127   6.600   9.040
   28    HB2  GLU   4           2HB      GLU   4   3.915   8.074   8.605
   29    HB3  GLU   4           3HB      GLU   4   4.424   7.009   9.913
   30    HG2  GLU   4           2HG      GLU   4   5.485   5.586   7.929
   31    HG3  GLU   4           3HG      GLU   4   5.371   7.104   7.043
   32    H    GLN   5           H        GLN   5   2.817   3.993   7.168
   33    HA   GLN   5           HA       GLN   5   2.701   3.366   5.010
   34    HB2  GLN   5           2HB      GLN   5   0.991   5.826   4.538
   35    HB3  GLN   5           3HB      GLN   5   1.134   4.418   3.491
   36    HG2  GLN   5           2HG      GLN   5   0.228   2.970   5.313
   37    HG3  GLN   5           3HG      GLN   5   0.004   4.398   6.321
   38   HE21  GLN   5          2HE2      GLN   5  -2.278   3.198   6.148
   39   HE22  GLN   5          1HE2      GLN   5  -3.306   3.869   4.881
   40    H    CYS   6           H        CYS   6   3.066   4.194   2.561
   41    HA   CYS   6           HA       CYS   6   5.718   5.515   2.574
   42    HB2  CYS   6           2HB      CYS   6   5.550   3.471   1.399
   43    HB3  CYS   6           3HB      CYS   6   4.130   4.004   0.519
   44    H    CYS   7           H        CYS   7   4.627   7.420   3.436
   45    HA   CYS   7           HA       CYS   7   3.152   9.091   1.465
   46    HB2  CYS   7           2HB      CYS   7   2.453   8.270   4.016
   47    HB3  CYS   7           3HB      CYS   7   3.145   9.850   4.329
   48    H    THR   8           H        THR   8   3.524  11.309   1.381
   49    HA   THR   8           HA       THR   8   4.678  13.080   0.832
   50    HB   THR   8           HB       THR   8   4.388  13.490   3.217
   51    HG1  THR   8           HG1      THR   8   5.678  15.291   3.137
   52   HG21  THR   8          1HG2      THR   8   7.343  12.782   3.471
   53   HG22  THR   8          2HG2      THR   8   6.419  13.742   4.640
   54   HG23  THR   8          3HG2      THR   8   5.978  12.065   4.361
   55    H    SER   9           H        SER   9   7.118  10.716   1.926
   56    HA   SER   9           HA       SER   9   8.774  11.479  -0.443
   57    HB2  SER   9           2HB      SER   9  10.651  10.351   0.668
   58    HB3  SER   9           3HB      SER   9  10.060  11.759   1.556
   59    HG   SER   9           HG       SER   9  10.434   9.967   2.942
   60    H    ILE  10           H        ILE  10   9.693   9.770  -1.667
   61    HA   ILE  10           HA       ILE  10   7.781   7.533  -1.993
   62    HB   ILE  10           HB       ILE  10   9.853   8.741  -3.844
   63   HG12  ILE  10          2HG1      ILE  10   6.799   8.697  -3.735
   64   HG13  ILE  10          3HG1      ILE  10   7.856  10.089  -3.488
   65   HG21  ILE  10          1HG2      ILE  10   9.755   6.324  -4.289
   66   HG22  ILE  10          2HG2      ILE  10   7.979   6.394  -4.355
   67   HG23  ILE  10          3HG2      ILE  10   8.971   7.212  -5.580
   68   HD11  ILE  10          3HD1      ILE  10   6.868  10.294  -5.631
   69   HD12  ILE  10          1HD1      ILE  10   8.589   9.919  -5.867
   70   HD13  ILE  10          2HD1      ILE  10   7.342   8.659  -6.109
   71    H    CYS  11           H        CYS  11   8.141   5.605  -1.357
   72    HA   CYS  11           HA       CYS  11  10.684   4.610  -0.329
   73    HB2  CYS  11           2HB      CYS  11   9.309   2.532  -0.010
   74    HB3  CYS  11           3HB      CYS  11   8.686   3.954   0.818
   75    H    SER  12           H        SER  12  11.826   2.749  -1.182
   76    HA   SER  12           HA       SER  12  11.573   2.277  -4.090
   77    HB2  SER  12           2HB      SER  12  13.495   0.784  -3.804
   78    HB3  SER  12           3HB      SER  12  13.811   2.430  -3.235
   79    HG   SER  12           HG       SER  12  14.584   0.871  -1.765
   80    H    LEU  13           H        LEU  13  11.156   0.174  -4.965
   81    HA   LEU  13           HA       LEU  13   8.848  -1.068  -3.922
   82    HB2  LEU  13           2HB      LEU  13   9.557  -0.938  -6.257
   83    HB3  LEU  13           3HB      LEU  13  10.877  -2.063  -5.961
   84    HG   LEU  13           HG       LEU  13   8.054  -2.951  -5.319
   85   HD11  LEU  13          1HD1      LEU  13   7.715  -3.665  -7.659
   86   HD12  LEU  13          2HD1      LEU  13   7.833  -1.906  -7.532
   87   HD13  LEU  13          3HD1      LEU  13   9.220  -2.842  -8.134
   88   HD21  LEU  13          3HD2      LEU  13   8.922  -5.126  -6.193
   89   HD22  LEU  13          1HD2      LEU  13  10.476  -4.357  -6.557
   90   HD23  LEU  13          2HD2      LEU  13   9.930  -4.528  -4.877
   91    H    TYR  14           H        TYR  14  12.229  -1.910  -3.436
   92    HA   TYR  14           HA       TYR  14  12.086  -4.428  -2.173
   93    HB2  TYR  14           2HB      TYR  14  14.193  -3.520  -2.735
   94    HB3  TYR  14           3HB      TYR  14  13.854  -1.983  -1.957
   95    HD1  TYR  14           HD2      TYR  14  14.713  -5.556  -1.271
   96    HD2  TYR  14           HD1      TYR  14  14.329  -1.564   0.323
   97    HE1  TYR  14           HE2      TYR  14  15.860  -6.274   0.828
   98    HE2  TYR  14           HE1      TYR  14  15.444  -2.281   2.418
   99    HH   TYR  14           HH       TYR  14  16.443  -4.016   3.552
  100    H    GLN  15           H        GLN  15  11.157  -1.245  -0.847
  101    HA   GLN  15           HA       GLN  15  11.211  -2.094   1.942
  102    HB2  GLN  15           2HB      GLN  15   9.690   0.217   0.672
  103    HB3  GLN  15           3HB      GLN  15  10.049   0.029   2.383
  104    HG2  GLN  15           2HG      GLN  15  12.132   0.352   0.194
  105    HG3  GLN  15           3HG      GLN  15  11.518   1.666   1.180
  106   HE21  GLN  15          2HE2      GLN  15  14.223   1.289   1.118
  107   HE22  GLN  15          1HE2      GLN  15  14.754   0.643   2.666
  108    H    LEU  16           H        LEU  16   8.864  -2.286  -0.617
  109    HA   LEU  16           HA       LEU  16   6.479  -2.530   0.958
  110    HB2  LEU  16           2HB      LEU  16   7.053  -3.583  -1.831
  111    HB3  LEU  16           3HB      LEU  16   5.484  -3.369  -1.107
  112    HG   LEU  16           HG       LEU  16   7.490  -1.231  -1.921
  113   HD11  LEU  16          1HD1      LEU  16   5.650  -0.421  -3.368
  114   HD12  LEU  16          2HD1      LEU  16   6.136  -2.072  -3.748
  115   HD13  LEU  16          3HD1      LEU  16   4.642  -1.782  -2.827
  116   HD21  LEU  16          3HD2      LEU  16   6.477  -0.407   0.167
  117   HD22  LEU  16          1HD2      LEU  16   5.881   0.503  -1.217
  118   HD23  LEU  16          2HD2      LEU  16   4.850  -0.731  -0.477
  119    H    GLU  17           H        GLU  17   8.904  -4.895   0.109
  120    HA   GLU  17           HA       GLU  17   7.564  -7.315   0.838
  121    HB2  GLU  17           2HB      GLU  17  10.471  -6.454   1.133
  122    HB3  GLU  17           3HB      GLU  17   9.922  -8.097   1.409
  123    HG2  GLU  17           2HG      GLU  17   9.436  -6.736  -1.266
  124    HG3  GLU  17           3HG      GLU  17  10.976  -7.479  -0.869
  125    H    ASN  18           H        ASN  18   8.924  -4.756   2.921
  126    HA   ASN  18           HA       ASN  18   9.159  -6.351   5.279
  127    HB2  ASN  18           2HB      ASN  18  10.325  -4.185   4.843
  128    HB3  ASN  18           3HB      ASN  18   8.781  -3.340   5.020
  129   HD21  ASN  18          2HD2      ASN  18  10.928  -5.634   6.819
  130   HD22  ASN  18          1HD2      ASN  18  10.572  -4.914   8.380
  131    H    TYR  19           H        TYR  19   6.386  -4.726   3.873
  132    HA   TYR  19           HA       TYR  19   4.604  -4.860   6.151
  133    HB2  TYR  19           2HB      TYR  19   4.131  -4.705   3.167
  134    HB3  TYR  19           3HB      TYR  19   2.858  -4.641   4.369
  135    HD1  TYR  19           HD2      TYR  19   5.874  -2.831   3.105
  136    HD2  TYR  19           HD1      TYR  19   2.306  -2.654   5.527
  137    HE1  TYR  19           HE2      TYR  19   6.136  -0.367   3.310
  138    HE2  TYR  19           HE1      TYR  19   2.557  -0.191   5.709
  139    HH   TYR  19           HH       TYR  19   3.829   1.625   5.194
  140    H    CYS  20           H        CYS  20   5.694  -7.227   3.766
  141    HA   CYS  20           HA       CYS  20   3.518  -9.132   4.276
  142    HB2  CYS  20           2HB      CYS  20   4.853  -8.680   2.073
  143    HB3  CYS  20           3HB      CYS  20   6.087  -9.706   2.792
  144    H    ASN  21           H        ASN  21   6.752  -8.493   5.497
  145    HA   ASN  21           HA       ASN  21   6.469 -10.701   7.466
  146    HB2  ASN  21           2HB      ASN  21   8.766 -11.346   7.176
  147    HB3  ASN  21           3HB      ASN  21   7.951 -11.452   5.624
  148   HD21  ASN  21          2HD2      ASN  21  10.231 -11.498   4.823
  149   HD22  ASN  21          1HD2      ASN  21  11.041  -9.955   4.592
  150    H1   PHE   1           H        PHE   1   1.086   0.534 -10.653
  151    HA   PHE   1           HA       PHE   1   1.855   2.044  -8.944
  152    HB2  PHE   1           2HB      PHE   1   2.067   0.646  -6.993
  153    HB3  PHE   1           3HB      PHE   1   0.861  -0.030  -8.070
  154    HD1  PHE   1           HD1      PHE   1   4.227  -0.486  -6.597
  155    HD2  PHE   1           HD2      PHE   1   1.250  -2.183  -9.214
  156    HE1  PHE   1           HE1      PHE   1   5.413  -2.666  -6.534
  157    HE2  PHE   1           HE2      PHE   1   2.446  -4.361  -9.159
  158    HZ   PHE   1           HZ       PHE   1   4.527  -4.607  -7.818
  159    H    VAL   2           H        VAL   2   4.326   0.641 -10.679
  160    HA   VAL   2           HA       VAL   2   6.510   1.516  -8.865
  161    HB   VAL   2           HB       VAL   2   6.708  -0.690  -9.588
  162   HG11  VAL   2          1HG1      VAL   2   7.132  -1.434 -11.833
  163   HG12  VAL   2          2HG1      VAL   2   5.549  -0.654 -11.781
  164   HG13  VAL   2          3HG1      VAL   2   6.942   0.200 -12.484
  165   HG21  VAL   2          3HG2      VAL   2   8.738   0.632  -9.205
  166   HG22  VAL   2          1HG2      VAL   2   8.993  -0.640 -10.407
  167   HG23  VAL   2          2HG2      VAL   2   8.808   1.043 -10.937
  168    H    ASN   3           H        ASN   3   7.064   4.541 -10.729
  169    HA   ASN   3           HA       ASN   3   6.355   3.336  -8.123
  170    HB2  ASN   3           2HB      ASN   3   8.876   3.098  -8.640
  171    HB3  ASN   3           3HB      ASN   3   8.948   4.856  -8.515
  172   HD21  ASN   3          2HD2      ASN   3  10.509   4.227  -6.711
  173   HD22  ASN   3          1HD2      ASN   3   9.764   3.927  -5.131
  174    H    GLN   4           H        GLN   4   5.872   4.749  -6.487
  175    HA   GLN   4           HA       GLN   4   5.296   7.576  -6.980
  176    HB2  GLN   4           2HB      GLN   4   2.840   7.292  -6.794
  177    HB3  GLN   4           3HB      GLN   4   3.466   6.548  -8.256
  178    HG2  GLN   4           2HG      GLN   4   3.259   4.324  -7.333
  179    HG3  GLN   4           3HG      GLN   4   2.920   4.946  -5.722
  180   HE21  GLN   4          2HE2      GLN   4   0.820   5.942  -5.299
  181   HE22  GLN   4          1HE2      GLN   4  -0.538   5.538  -6.355
  182    H    HIS   5           H        HIS   5   3.721   8.296  -5.030
  183    HA   HIS   5           HA       HIS   5   4.594   7.182  -2.454
  184    HB2  HIS   5           2HB      HIS   5   2.278   9.042  -3.123
  185    HB3  HIS   5           3HB      HIS   5   2.926   8.706  -1.519
  186    HD2  HIS   5           HD2      HIS   5   5.193   9.940  -0.814
  187    HE1  HIS   5           HE1      HIS   5   5.726  12.286  -4.326
  188    HE2  HIS   5           HE2      HIS   5   6.444  11.994  -1.897
  189    H    LEU   6           H        LEU   6   3.635   5.530  -1.375
  190    HA   LEU   6           HA       LEU   6   0.994   4.469  -2.328
  191    HB2  LEU   6           2HB      LEU   6   3.271   2.915  -1.035
  192    HB3  LEU   6           3HB      LEU   6   1.636   2.350  -1.225
  193    HG   LEU   6           HG       LEU   6   2.854   1.287  -2.865
  194   HD11  LEU   6          1HD1      LEU   6   0.695   2.134  -3.687
  195   HD12  LEU   6          2HD1      LEU   6   1.492   3.598  -4.303
  196   HD13  LEU   6          3HD1      LEU   6   1.892   2.020  -4.988
  197   HD21  LEU   6          3HD2      LEU   6   3.960   3.907  -3.878
  198   HD22  LEU   6          1HD2      LEU   6   4.850   2.727  -2.899
  199   HD23  LEU   6          2HD2      LEU   6   4.288   2.292  -4.522
  200    H    CYS   7           H        CYS   7   0.054   6.161  -1.201
  201    HA   CYS   7           HA       CYS   7  -0.329   5.648   1.685
  202    HB2  CYS   7           2HB      CYS   7   1.498   7.296   1.455
  203    HB3  CYS   7           3HB      CYS   7   0.439   8.344   0.507
  204    H    GLY   8           H        GLY   8  -2.427   5.811   2.226
  205    HA2  GLY   8           HA2      GLY   8  -4.669   6.330   2.232
  206    HA3  GLY   8           HA3      GLY   8  -4.342   7.649   1.111
  207    H    SER   9           H        SER   9  -3.287   5.958  -1.017
  208    HA   SER   9           HA       SER   9  -5.382   4.013  -1.758
  209    HB2  SER   9           2HB      SER   9  -6.041   6.316  -2.634
  210    HB3  SER   9           3HB      SER   9  -4.595   6.248  -3.663
  211    HG   SER   9           HG       SER   9  -6.526   5.452  -4.693
  212    H    HIS  10           H        HIS  10  -4.727   3.030  -3.921
  213    HA   HIS  10           HA       HIS  10  -3.445   1.504  -4.982
  214    HB2  HIS  10           2HB      HIS  10  -1.220   3.543  -4.705
  215    HB3  HIS  10           3HB      HIS  10  -1.313   2.238  -5.881
  216    HD2  HIS  10           HD2      HIS  10  -3.725   2.422  -7.512
  217    HE1  HIS  10           HE1      HIS  10  -3.526   6.683  -7.562
  218    HE2  HIS  10           HE2      HIS  10  -4.549   4.637  -8.680
  219    H    LEU  11           H        LEU  11  -2.137   2.362  -1.879
  220    HA   LEU  11           HA       LEU  11   0.094   0.834  -1.637
  221    HB2  LEU  11           2HB      LEU  11  -0.695   2.378   0.075
  222    HB3  LEU  11           3HB      LEU  11  -2.084   1.352   0.420
  223    HG   LEU  11           HG       LEU  11  -0.583  -0.410   1.319
  224   HD11  LEU  11          1HD1      LEU  11   1.655   1.634   1.000
  225   HD12  LEU  11          2HD1      LEU  11   1.764   0.063   1.809
  226   HD13  LEU  11          3HD1      LEU  11   1.509   0.129   0.061
  227   HD21  LEU  11          3HD2      LEU  11   0.046   0.791   3.373
  228   HD22  LEU  11          1HD2      LEU  11  -0.162   2.347   2.536
  229   HD23  LEU  11          2HD2      LEU  11  -1.561   1.283   2.811
  230    H    VAL  12           H        VAL  12  -3.200  -0.540  -0.924
  231    HA   VAL  12           HA       VAL  12  -2.199  -3.015  -0.064
  232    HB   VAL  12           HB       VAL  12  -4.459  -3.889  -0.440
  233   HG11  VAL  12          1HG1      VAL  12  -3.833  -2.658   1.608
  234   HG12  VAL  12          2HG1      VAL  12  -4.409  -1.147   0.871
  235   HG13  VAL  12          3HG1      VAL  12  -5.545  -2.468   1.206
  236   HG21  VAL  12          3HG2      VAL  12  -5.126  -1.154  -1.612
  237   HG22  VAL  12          1HG2      VAL  12  -5.231  -2.725  -2.444
  238   HG23  VAL  12          2HG2      VAL  12  -6.300  -2.374  -1.094
  239    H    GLU  13           H        GLU  13  -3.291  -2.218  -3.407
  240    HA   GLU  13           HA       GLU  13  -2.585  -4.832  -4.443
  241    HB2  GLU  13           2HB      GLU  13  -3.035  -2.134  -5.769
  242    HB3  GLU  13           3HB      GLU  13  -2.654  -3.594  -6.679
  243    HG2  GLU  13           2HG      GLU  13  -5.066  -3.320  -4.833
  244    HG3  GLU  13           3HG      GLU  13  -5.097  -3.045  -6.568
  245    H    ALA  14           H        ALA  14  -0.743  -1.761  -4.164
  246    HA   ALA  14           HA       ALA  14   1.548  -2.627  -5.635
  247    HB1  ALA  14           3HB      ALA  14   1.025  -0.281  -5.046
  248    HB2  ALA  14           1HB      ALA  14   1.336  -0.639  -3.335
  249    HB3  ALA  14           2HB      ALA  14   2.656  -0.748  -4.515
  250    H    LEU  15           H        LEU  15   0.686  -3.065  -2.178
  251    HA   LEU  15           HA       LEU  15   3.156  -4.426  -1.461
  252    HB2  LEU  15           2HB      LEU  15   0.350  -4.506  -0.250
  253    HB3  LEU  15           3HB      LEU  15   1.767  -5.254   0.448
  254    HG   LEU  15           HG       LEU  15   1.316  -2.273   0.127
  255   HD11  LEU  15          1HD1      LEU  15   0.024  -3.328   1.907
  256   HD12  LEU  15          2HD1      LEU  15   1.494  -4.081   2.552
  257   HD13  LEU  15          3HD1      LEU  15   1.313  -2.313   2.579
  258   HD21  LEU  15          3HD2      LEU  15   3.733  -3.757   1.154
  259   HD22  LEU  15          1HD2      LEU  15   3.630  -2.610  -0.199
  260   HD23  LEU  15          2HD2      LEU  15   3.401  -2.030   1.450
  261    H    TYR  16           H        TYR  16  -0.111  -5.616  -2.371
  262    HA   TYR  16           HA       TYR  16   0.417  -8.337  -1.994
  263    HB2  TYR  16           2HB      TYR  16  -1.530  -7.030  -3.914
  264    HB3  TYR  16           3HB      TYR  16  -1.545  -8.718  -3.428
  265    HD1  TYR  16           HD1      TYR  16  -0.696  -7.689  -0.374
  266    HD2  TYR  16           HD2      TYR  16  -3.915  -6.961  -3.153
  267    HE1  TYR  16           HE1      TYR  16  -2.150  -7.120   1.479
  268    HE2  TYR  16           HE2      TYR  16  -5.416  -6.415  -1.252
  269    HH   TYR  16           HH       TYR  16  -5.606  -6.195   1.032
  270    H    LEU  17           H        LEU  17   0.795  -6.439  -5.026
  271    HA   LEU  17           HA       LEU  17   1.539  -8.736  -6.619
  272    HB2  LEU  17           2HB      LEU  17   1.470  -5.744  -6.987
  273    HB3  LEU  17           3HB      LEU  17   2.414  -6.686  -8.111
  274    HG   LEU  17           HG       LEU  17   0.144  -6.171  -8.918
  275   HD11  LEU  17          1HD1      LEU  17   1.423  -8.098  -9.793
  276   HD12  LEU  17          2HD1      LEU  17   0.640  -9.159  -8.601
  277   HD13  LEU  17          3HD1      LEU  17  -0.326  -8.358  -9.855
  278   HD21  LEU  17          3HD2      LEU  17  -1.155  -6.417  -6.827
  279   HD22  LEU  17          1HD2      LEU  17  -1.808  -7.394  -8.144
  280   HD23  LEU  17          2HD2      LEU  17  -0.868  -8.171  -6.855
  281    H    VAL  18           H        VAL  18   3.407  -6.864  -4.392
  282    HA   VAL  18           HA       VAL  18   6.001  -7.585  -5.622
  283    HB   VAL  18           HB       VAL  18   5.268  -6.077  -3.093
  284   HG11  VAL  18          1HG1      VAL  18   8.041  -6.690  -4.208
  285   HG12  VAL  18          2HG1      VAL  18   7.687  -5.454  -2.981
  286   HG13  VAL  18          3HG1      VAL  18   7.398  -7.158  -2.617
  287   HG21  VAL  18          3HG2      VAL  18   4.918  -4.951  -5.293
  288   HG22  VAL  18          1HG2      VAL  18   6.190  -4.192  -4.337
  289   HG23  VAL  18          2HG2      VAL  18   6.610  -5.248  -5.707
  290    H    CYS  19           H        CYS  19   4.152  -8.492  -2.679
  291    HA   CYS  19           HA       CYS  19   6.056 -10.652  -2.100
  292    HB2  CYS  19           2HB      CYS  19   4.804  -9.246  -0.418
  293    HB3  CYS  19           3HB      CYS  19   3.374 -10.226  -0.789
  294    H    GLY  20           H        GLY  20   3.204 -10.412  -4.063
  295    HA2  GLY  20           HA2      GLY  20   2.673 -11.911  -5.754
  296    HA3  GLY  20           HA3      GLY  20   3.592 -13.188  -4.960
  297    H    GLU  21           H        GLU  21   1.340 -11.635  -2.848
  298    HA   GLU  21           HA       GLU  21  -0.963 -13.309  -3.491
  299    HB2  GLU  21           2HB      GLU  21   0.683 -14.779  -2.152
  300    HB3  GLU  21           3HB      GLU  21   0.360 -13.722  -0.776
  301    HG2  GLU  21           2HG      GLU  21  -2.057 -14.313  -0.920
  302    HG3  GLU  21           3HG      GLU  21  -1.735 -15.306  -2.337
  303    H    ARG  22           H        ARG  22  -2.891 -12.598  -2.405
  304    HA   ARG  22           HA       ARG  22  -2.731  -9.889  -1.231
  305    HB2  ARG  22           2HB      ARG  22  -5.174 -11.574  -1.908
  306    HB3  ARG  22           3HB      ARG  22  -5.168  -9.898  -1.344
  307    HG2  ARG  22           2HG      ARG  22  -3.638  -9.412  -3.384
  308    HG3  ARG  22           3HG      ARG  22  -4.163 -10.970  -4.004
  309    HD2  ARG  22           2HD      ARG  22  -6.485 -10.210  -4.068
  310    HD3  ARG  22           3HD      ARG  22  -6.080  -8.763  -3.146
  311    HE   ARG  22           HE       ARG  22  -5.337  -7.685  -5.040
  312   HH11  ARG  22          1HH1      ARG  22  -5.666 -11.073  -5.927
  313   HH12  ARG  22          2HH1      ARG  22  -5.355 -10.738  -7.607
  314   HH21  ARG  22          2HH2      ARG  22  -4.945  -7.337  -7.155
  315   HH22  ARG  22          1HH2      ARG  22  -4.970  -8.675  -8.284
  316    H    GLY  23           H        GLY  23  -2.867 -13.049   0.041
  317    HA2  GLY  23           HA2      GLY  23  -3.848 -12.237   2.715
  318    HA3  GLY  23           HA3      GLY  23  -3.325 -13.844   2.222
  319    H    DHI  24           H        DHI  24  -2.515 -12.757   4.631
  320    HA   DHI  24           HA       DHI  24   0.383 -12.959   4.342
  321    HB2  DHI  24           2HB      DHI  24  -0.758 -14.238   6.047
  322    HB3  DHI  24           3HB      DHI  24   0.425 -13.144   6.755
  323    HD2  DHI  24           HD2      DHI  24  -3.348 -13.741   6.486
  324    HE1  DHI  24           HE1      DHI  24  -2.850 -10.652   9.393
  325    HE2  DHI  24           HE2      DHI  24  -4.535 -12.221   8.302
  326    H    PHE  25           H        PHE  25  -1.837 -10.330   5.095
  327    HA   PHE  25           HA       PHE  25   0.442  -8.439   5.496
  328    HB2  PHE  25           2HB      PHE  25  -1.775  -8.380   3.440
  329    HB3  PHE  25           3HB      PHE  25  -1.079  -6.884   4.025
  330    HD1  PHE  25           HD2      PHE  25   1.360  -6.407   3.797
  331    HD2  PHE  25           HD1      PHE  25  -0.567  -9.690   1.776
  332    HE1  PHE  25           HE2      PHE  25   3.187  -6.449   2.106
  333    HE2  PHE  25           HE1      PHE  25   1.256  -9.722   0.095
  334    HZ   PHE  25           HZ       PHE  25   3.100  -8.049   0.231
  335    H    TYR  26           H        TYR  26   0.014  -6.508   6.479
  336    HA   TYR  26           HA       TYR  26  -2.705  -5.795   7.311
  337    HB2  TYR  26           2HB      TYR  26  -1.884  -6.887   9.327
  338    HB3  TYR  26           3HB      TYR  26  -0.380  -5.973   9.262
  339    HD1  TYR  26           HD2      TYR  26  -4.109  -5.486   9.482
  340    HD2  TYR  26           HD1      TYR  26  -0.198  -3.928  10.447
  341    HE1  TYR  26           HE2      TYR  26  -5.162  -3.625  10.754
  342    HE2  TYR  26           HE1      TYR  26  -1.258  -2.087  11.746
  343    HH   TYR  26           HH       TYR  26  -4.816  -1.752  12.031
  344    H    THR  27           H        THR  27  -3.038  -3.596   7.305
  345    HA   THR  27           HA       THR  27  -0.749  -1.751   6.865
  346    HB   THR  27           HB       THR  27  -2.181  -0.481   5.219
  347    HG1  THR  27           HG1      THR  27  -4.115  -1.662   5.594
  348   HG21  THR  27          1HG2      THR  27  -1.488  -1.810   3.303
  349   HG22  THR  27          2HG2      THR  27  -0.205  -1.789   4.527
  350   HG23  THR  27          3HG2      THR  27  -1.226  -3.232   4.334
  351    HA   PRO  28           HA       PRO  28  -3.408   0.250   9.984
  352    HB2  PRO  28           2HB      PRO  28  -1.591   2.001  11.015
  353    HB3  PRO  28           3HB      PRO  28  -1.596   0.257  11.419
  354    HG2  PRO  28           2HG      PRO  28   0.112   1.696   9.375
  355    HG3  PRO  28           3HG      PRO  28   0.619   0.487  10.603
  356    HD2  PRO  28           2HD      PRO  28   0.122  -0.138   7.981
  357    HD3  PRO  28           3HD      PRO  28  -0.181  -1.292   9.316
  358    H    LYS  29           H        LYS  29  -4.454   2.256  10.058
  359    HA   LYS  29           HA       LYS  29  -3.806   4.413   8.164
  360    HB2  LYS  29           2HB      LYS  29  -5.934   4.320   6.992
  361    HB3  LYS  29           3HB      LYS  29  -5.049   2.819   6.752
  362    HG2  LYS  29           2HG      LYS  29  -6.451   1.679   8.440
  363    HG3  LYS  29           3HG      LYS  29  -7.339   3.175   8.750
  364    HD2  LYS  29           2HD      LYS  29  -7.247   1.731   6.065
  365    HD3  LYS  29           3HD      LYS  29  -8.534   1.569   7.270
  366    HE2  LYS  29           2HE      LYS  29  -8.968   4.026   7.121
  367    HE3  LYS  29           3HE      LYS  29  -7.743   4.155   5.854
  368    HZ1  LYS  29           HZ1      LYS  29  -9.967   3.945   4.910
  369    HZ2  LYS  29           HZ2      LYS  29  -9.086   2.637   4.495
  370    HZ3  LYS  29           HZ3      LYS  29 -10.221   2.524   5.667
  371    H    THR  30           H        THR  30  -5.379   6.175   8.273
  372    HA   THR  30           HA       THR  30  -6.247   7.927   9.416
  373    HB   THR  30           HB       THR  30  -8.084   5.892  10.693
  374    HG1  THR  30           HG1      THR  30  -9.253   6.126   8.747
  375   HG21  THR  30          1HG2      THR  30  -8.437   8.279  11.367
  376   HG22  THR  30          2HG2      THR  30  -8.517   8.742   9.656
  377   HG23  THR  30          3HG2      THR  30  -9.761   7.685  10.360
  Start of MODEL   29
    1    H1   GLY   1           1H       GLY   1  -1.073  -3.173  12.073
    2    H2   GLY   1           2H       GLY   1  -1.553  -4.740  12.022
    3    H3   GLY   1           3H       GLY   1  -0.050  -4.324  11.520
    4    HA2  GLY   1           HA2      GLY   1  -1.454  -4.759   9.613
    5    HA3  GLY   1           HA3      GLY   1  -2.576  -3.525  10.217
    6    H    ILE   2           H        ILE   2  -1.496  -3.379   7.661
    7    HA   ILE   2           HA       ILE   2   0.718  -1.405   7.682
    8    HB   ILE   2           HB       ILE   2  -0.752  -2.900   5.507
    9   HG12  ILE   2          2HG1      ILE   2   1.593  -3.418   4.795
   10   HG13  ILE   2          3HG1      ILE   2   2.202  -2.508   6.169
   11   HG21  ILE   2          1HG2      ILE   2   0.541  -1.632   3.807
   12   HG22  ILE   2          2HG2      ILE   2  -0.660  -0.633   4.610
   13   HG23  ILE   2          3HG2      ILE   2   1.057  -0.488   5.059
   14   HD11  ILE   2          3HD1      ILE   2   1.343  -4.157   7.727
   15   HD12  ILE   2          1HD1      ILE   2   0.451  -4.989   6.423
   16   HD13  ILE   2          2HD1      ILE   2   2.226  -5.000   6.457
   17    H    VAL   3           H        VAL   3   0.484   0.709   7.514
   18    HA   VAL   3           HA       VAL   3  -2.203   1.905   7.793
   19    HB   VAL   3           HB       VAL   3  -0.938   3.963   8.372
   20   HG11  VAL   3          1HG1      VAL   3  -0.188   3.196  10.556
   21   HG12  VAL   3          2HG1      VAL   3  -1.697   2.385  10.103
   22   HG13  VAL   3          3HG1      VAL   3  -0.153   1.512   9.996
   23   HG21  VAL   3          3HG2      VAL   3   1.564   2.220   8.318
   24   HG22  VAL   3          1HG2      VAL   3   1.172   3.446   7.098
   25   HG23  VAL   3          2HG2      VAL   3   1.436   3.924   8.783
   26    H    GLU   4           H        GLU   4  -2.258   4.289   6.766
   27    HA   GLU   4           HA       GLU   4  -2.613   3.846   3.944
   28    HB2  GLU   4           2HB      GLU   4  -2.697   6.389   5.612
   29    HB3  GLU   4           3HB      GLU   4  -3.213   6.271   3.930
   30    HG2  GLU   4           2HG      GLU   4  -4.912   4.555   4.578
   31    HG3  GLU   4           3HG      GLU   4  -4.445   4.748   6.267
   32    H    GLN   5           H        GLN   5   0.174   4.961   5.667
   33    HA   GLN   5           HA       GLN   5   1.422   5.993   3.199
   34    HB2  GLN   5           2HB      GLN   5   3.224   6.843   4.635
   35    HB3  GLN   5           3HB      GLN   5   1.644   7.482   5.085
   36    HG2  GLN   5           2HG      GLN   5   1.527   5.920   6.995
   37    HG3  GLN   5           3HG      GLN   5   3.088   5.222   6.538
   38   HE21  GLN   5          2HE2      GLN   5   5.043   6.635   6.728
   39   HE22  GLN   5          1HE2      GLN   5   4.971   8.004   7.828
   40    H    CYS   6           H        CYS   6   3.853   3.294   3.032
   41    HA   CYS   6           HA       CYS   6   4.907   5.581   2.551
   42    HB2  CYS   6           2HB      CYS   6   5.272   3.589   1.291
   43    HB3  CYS   6           3HB      CYS   6   3.681   3.680   0.544
   44    H    CYS   7           H        CYS   7   4.305   7.627   2.578
   45    HA   CYS   7           HA       CYS   7   2.519   8.727   0.520
   46    HB2  CYS   7           2HB      CYS   7   2.228   9.250   3.504
   47    HB3  CYS   7           3HB      CYS   7   1.575  10.329   2.289
   48    H    THR   8           H        THR   8   2.881  11.004   0.238
   49    HA   THR   8           HA       THR   8   4.075  12.735  -0.351
   50    HB   THR   8           HB       THR   8   3.581  13.293   1.983
   51    HG1  THR   8           HG1      THR   8   4.826  15.126   1.864
   52   HG21  THR   8          1HG2      THR   8   5.485  13.701   3.527
   53   HG22  THR   8          2HG2      THR   8   5.139  11.990   3.320
   54   HG23  THR   8          3HG2      THR   8   6.535  12.719   2.488
   55    H    SER   9           H        SER   9   6.398  10.481   1.111
   56    HA   SER   9           HA       SER   9   8.382  11.154  -1.014
   57    HB2  SER   9           2HB      SER   9   8.582   9.233   1.330
   58    HB3  SER   9           3HB      SER   9   9.858   9.570   0.149
   59    HG   SER   9           HG       SER   9  10.098  10.814   2.073
   60    H    ILE  10           H        ILE  10   9.142   9.476  -2.415
   61    HA   ILE  10           HA       ILE  10   7.017   7.514  -3.120
   62    HB   ILE  10           HB       ILE  10   9.372   8.481  -4.772
   63   HG12  ILE  10          2HG1      ILE  10   6.390   9.118  -4.979
   64   HG13  ILE  10          3HG1      ILE  10   7.598  10.217  -4.311
   65   HG21  ILE  10          1HG2      ILE  10   8.176   7.304  -6.627
   66   HG22  ILE  10          2HG2      ILE  10   8.665   6.176  -5.374
   67   HG23  ILE  10          3HG2      ILE  10   6.973   6.711  -5.468
   68   HD11  ILE  10          3HD1      ILE  10   7.099  10.913  -6.528
   69   HD12  ILE  10          1HD1      ILE  10   8.764  10.294  -6.492
   70   HD13  ILE  10          2HD1      ILE  10   7.453   9.318  -7.200
   71    H    CYS  11           H        CYS  11   7.197   5.574  -2.321
   72    HA   CYS  11           HA       CYS  11   9.638   4.516  -1.185
   73    HB2  CYS  11           2HB      CYS  11   8.069   2.477  -0.879
   74    HB3  CYS  11           3HB      CYS  11   7.774   3.947   0.038
   75    H    SER  12           H        SER  12  10.823   2.762  -1.755
   76    HA   SER  12           HA       SER  12  10.687   1.724  -4.539
   77    HB2  SER  12           2HB      SER  12  12.856   2.512  -3.637
   78    HB3  SER  12           3HB      SER  12  12.768   1.266  -2.375
   79    HG   SER  12           HG       SER  12  13.992   0.659  -4.281
   80    H    LEU  13           H        LEU  13  11.038  -0.689  -4.759
   81    HA   LEU  13           HA       LEU  13   8.910  -2.168  -3.533
   82    HB2  LEU  13           2HB      LEU  13  11.425  -3.221  -4.890
   83    HB3  LEU  13           3HB      LEU  13   9.964  -4.144  -4.553
   84    HG   LEU  13           HG       LEU  13  10.247  -1.850  -6.523
   85   HD11  LEU  13          1HD1      LEU  13  11.185  -4.010  -7.249
   86   HD12  LEU  13          2HD1      LEU  13   9.626  -4.801  -6.920
   87   HD13  LEU  13          3HD1      LEU  13   9.755  -3.568  -8.195
   88   HD21  LEU  13          3HD2      LEU  13   7.909  -2.373  -7.196
   89   HD22  LEU  13          1HD2      LEU  13   7.770  -3.463  -5.798
   90   HD23  LEU  13          2HD2      LEU  13   7.999  -1.713  -5.562
   91    H    TYR  14           H        TYR  14  12.289  -1.782  -2.553
   92    HA   TYR  14           HA       TYR  14  12.564  -3.801  -0.611
   93    HB2  TYR  14           2HB      TYR  14  14.409  -2.413  -1.252
   94    HB3  TYR  14           3HB      TYR  14  13.560  -0.939  -0.808
   95    HD1  TYR  14           HD1      TYR  14  15.146  -4.020   0.616
   96    HD2  TYR  14           HD2      TYR  14  13.666  -0.039   1.389
   97    HE1  TYR  14           HE1      TYR  14  16.129  -4.095   2.904
   98    HE2  TYR  14           HE2      TYR  14  14.633  -0.122   3.678
   99    HH   TYR  14           HH       TYR  14  16.435  -2.984   4.884
  100    H    GLN  15           H        GLN  15  10.756  -0.728  -0.347
  101    HA   GLN  15           HA       GLN  15  10.307  -0.973   2.540
  102    HB2  GLN  15           2HB      GLN  15   8.873   0.720   0.455
  103    HB3  GLN  15           3HB      GLN  15   8.737   0.909   2.197
  104    HG2  GLN  15           2HG      GLN  15  11.309   1.288   0.594
  105    HG3  GLN  15           3HG      GLN  15  10.237   2.582   1.104
  106   HE21  GLN  15          2HE2      GLN  15  12.802   2.898   1.883
  107   HE22  GLN  15          1HE2      GLN  15  12.961   2.535   3.595
  108    H    LEU  16           H        LEU  16   8.576  -1.851  -0.409
  109    HA   LEU  16           HA       LEU  16   6.158  -2.713   0.953
  110    HB2  LEU  16           2HB      LEU  16   7.162  -3.446  -1.818
  111    HB3  LEU  16           3HB      LEU  16   5.518  -3.661  -1.213
  112    HG   LEU  16           HG       LEU  16   6.998  -1.104  -1.814
  113   HD11  LEU  16          1HD1      LEU  16   6.127  -2.130  -3.787
  114   HD12  LEU  16          2HD1      LEU  16   4.518  -2.337  -3.042
  115   HD13  LEU  16          3HD1      LEU  16   5.145  -0.718  -3.425
  116   HD21  LEU  16          3HD2      LEU  16   4.888   0.127  -1.244
  117   HD22  LEU  16          1HD2      LEU  16   4.192  -1.389  -0.630
  118   HD23  LEU  16          2HD2      LEU  16   5.596  -0.644   0.174
  119    H    GLU  17           H        GLU  17   9.083  -4.401  -0.249
  120    HA   GLU  17           HA       GLU  17   8.386  -7.030   0.600
  121    HB2  GLU  17           2HB      GLU  17  11.066  -5.643   0.243
  122    HB3  GLU  17           3HB      GLU  17  10.913  -7.341   0.702
  123    HG2  GLU  17           2HG      GLU  17   9.595  -7.802  -1.340
  124    HG3  GLU  17           3HG      GLU  17   9.777  -6.128  -1.850
  125    H    ASN  18           H        ASN  18   9.602  -4.286   2.529
  126    HA   ASN  18           HA       ASN  18  10.156  -5.834   4.891
  127    HB2  ASN  18           2HB      ASN  18  11.015  -3.526   4.416
  128    HB3  ASN  18           3HB      ASN  18   9.382  -2.896   4.656
  129   HD21  ASN  18          2HD2      ASN  18  12.017  -4.691   6.315
  130   HD22  ASN  18          1HD2      ASN  18  11.549  -4.141   7.916
  131    H    TYR  19           H        TYR  19   7.110  -4.497   3.604
  132    HA   TYR  19           HA       TYR  19   5.554  -5.238   5.984
  133    HB2  TYR  19           2HB      TYR  19   4.643  -4.630   3.162
  134    HB3  TYR  19           3HB      TYR  19   3.614  -4.751   4.564
  135    HD1  TYR  19           HD1      TYR  19   4.954  -3.124   6.633
  136    HD2  TYR  19           HD2      TYR  19   4.584  -2.438   2.394
  137    HE1  TYR  19           HE1      TYR  19   5.208  -0.685   6.998
  138    HE2  TYR  19           HE2      TYR  19   4.876  -0.010   2.749
  139    HH   TYR  19           HH       TYR  19   5.338   1.393   6.022
  140    H    CYS  20           H        CYS  20   6.359  -6.739   2.845
  141    HA   CYS  20           HA       CYS  20   4.713  -9.069   3.130
  142    HB2  CYS  20           2HB      CYS  20   7.351  -8.674   1.674
  143    HB3  CYS  20           3HB      CYS  20   6.264 -10.030   1.448
  144    H    ASN  21           H        ASN  21   8.048  -8.387   4.212
  145    HA   ASN  21           HA       ASN  21   7.911 -10.616   6.174
  146    HB2  ASN  21           2HB      ASN  21   9.002 -11.483   4.107
  147    HB3  ASN  21           3HB      ASN  21  10.189 -10.183   4.179
  148   HD21  ASN  21          2HD2      ASN  21  11.685 -10.175   6.070
  149   HD22  ASN  21          1HD2      ASN  21  12.051 -11.721   6.837
  150    H1   PHE   1           H        PHE   1   3.948   4.324  -7.451
  151    HA   PHE   1           HA       PHE   1   4.417   2.091  -6.880
  152    HB2  PHE   1           2HB      PHE   1   2.668   1.524  -8.697
  153    HB3  PHE   1           3HB      PHE   1   4.019   1.266  -9.774
  154    HD1  PHE   1           HD1      PHE   1   5.549  -0.028  -6.993
  155    HD2  PHE   1           HD2      PHE   1   2.015  -0.743  -9.371
  156    HE1  PHE   1           HE1      PHE   1   5.520  -2.387  -6.264
  157    HE2  PHE   1           HE2      PHE   1   2.006  -3.107  -8.635
  158    HZ   PHE   1           HZ       PHE   1   3.770  -3.940  -7.088
  159    H    VAL   2           H        VAL   2   6.362   3.212  -6.494
  160    HA   VAL   2           HA       VAL   2   8.513   3.785  -6.551
  161    HB   VAL   2           HB       VAL   2   9.069   1.887  -8.839
  162   HG11  VAL   2          1HG1      VAL   2  11.293   1.743  -7.733
  163   HG12  VAL   2          2HG1      VAL   2  10.931   3.379  -8.275
  164   HG13  VAL   2          3HG1      VAL   2  10.776   2.968  -6.555
  165   HG21  VAL   2          3HG2      VAL   2   7.937   0.534  -7.179
  166   HG22  VAL   2          1HG2      VAL   2   9.666   0.237  -7.048
  167   HG23  VAL   2          2HG2      VAL   2   8.858   1.284  -5.859
  168    H    ASN   3           H        ASN   3   7.081   3.764  -9.793
  169    HA   ASN   3           HA       ASN   3   8.476   6.088 -10.817
  170    HB2  ASN   3           2HB      ASN   3   7.288   4.546 -12.278
  171    HB3  ASN   3           3HB      ASN   3   5.790   4.743 -11.367
  172   HD21  ASN   3          2HD2      ASN   3   8.055   6.499 -13.531
  173   HD22  ASN   3          1HD2      ASN   3   6.827   7.629 -14.083
  174    H    GLN   4           H        GLN   4   5.685   5.639  -8.694
  175    HA   GLN   4           HA       GLN   4   5.490   8.493  -8.033
  176    HB2  GLN   4           2HB      GLN   4   3.124   8.649  -8.693
  177    HB3  GLN   4           3HB      GLN   4   4.187   8.388 -10.069
  178    HG2  GLN   4           2HG      GLN   4   3.559   5.931 -10.026
  179    HG3  GLN   4           3HG      GLN   4   2.399   6.301  -8.744
  180   HE21  GLN   4          2HE2      GLN   4   3.287   7.111 -12.154
  181   HE22  GLN   4          1HE2      GLN   4   1.633   7.515 -12.620
  182    H    HIS   5           H        HIS   5   3.708   8.857  -6.397
  183    HA   HIS   5           HA       HIS   5   4.178   7.269  -4.120
  184    HB2  HIS   5           2HB      HIS   5   1.853   9.167  -4.624
  185    HB3  HIS   5           3HB      HIS   5   2.486   8.678  -3.054
  186    HD2  HIS   5           HD2      HIS   5   4.642   9.938  -2.140
  187    HE1  HIS   5           HE1      HIS   5   5.233  12.600  -5.411
  188    HE2  HIS   5           HE2      HIS   5   5.886  12.088  -2.995
  189    H    LEU   6           H        LEU   6   2.826   6.012  -2.813
  190    HA   LEU   6           HA       LEU   6   0.569   4.587  -4.154
  191    HB2  LEU   6           2HB      LEU   6   2.768   3.550  -2.331
  192    HB3  LEU   6           3HB      LEU   6   1.332   2.630  -2.749
  193    HG   LEU   6           HG       LEU   6   3.346   3.576  -4.809
  194   HD11  LEU   6          1HD1      LEU   6   2.883   0.858  -3.504
  195   HD12  LEU   6          2HD1      LEU   6   3.968   1.163  -4.871
  196   HD13  LEU   6          3HD1      LEU   6   4.305   1.897  -3.298
  197   HD21  LEU   6          3HD2      LEU   6   2.143   1.885  -6.237
  198   HD22  LEU   6          1HD2      LEU   6   0.929   1.711  -4.963
  199   HD23  LEU   6          2HD2      LEU   6   1.131   3.263  -5.812
  200    H    CYS   7           H        CYS   7   0.557   6.971  -2.363
  201    HA   CYS   7           HA       CYS   7  -0.139   6.319   0.287
  202    HB2  CYS   7           2HB      CYS   7   0.737   8.449  -0.638
  203    HB3  CYS   7           3HB      CYS   7  -0.834   8.759  -1.369
  204    H    GLY   8           H        GLY   8  -2.018   6.349   1.474
  205    HA2  GLY   8           HA2      GLY   8  -4.336   6.400   1.914
  206    HA3  GLY   8           HA3      GLY   8  -4.688   6.498   0.191
  207    H    SER   9           H        SER   9  -4.567   4.570  -1.077
  208    HA   SER   9           HA       SER   9  -4.569   1.961   0.407
  209    HB2  SER   9           2HB      SER   9  -6.665   2.955  -1.554
  210    HB3  SER   9           3HB      SER   9  -6.526   1.273  -1.004
  211    HG   SER   9           HG       SER   9  -8.027   2.643   0.200
  212    H    HIS  10           H        HIS  10  -3.419   3.639  -2.410
  213    HA   HIS  10           HA       HIS  10  -3.402   1.465  -4.253
  214    HB2  HIS  10           2HB      HIS  10  -1.562   3.870  -4.040
  215    HB3  HIS  10           3HB      HIS  10  -1.660   2.791  -5.433
  216    HD2  HIS  10           HD2      HIS  10  -4.269   2.645  -6.589
  217    HE1  HIS  10           HE1      HIS  10  -5.264   6.641  -5.473
  218    HE2  HIS  10           HE2      HIS  10  -5.904   4.678  -6.966
  219    H    LEU  11           H        LEU  11  -1.109   2.190  -1.622
  220    HA   LEU  11           HA       LEU  11   0.866   0.327  -2.399
  221    HB2  LEU  11           2HB      LEU  11   1.806   0.499  -0.351
  222    HB3  LEU  11           3HB      LEU  11   1.072   2.071  -0.593
  223    HG   LEU  11           HG       LEU  11  -0.028  -0.154   1.188
  224   HD11  LEU  11          1HD1      LEU  11   2.084   0.830   1.965
  225   HD12  LEU  11          2HD1      LEU  11   1.390   2.460   1.809
  226   HD13  LEU  11          3HD1      LEU  11   0.737   1.320   3.005
  227   HD21  LEU  11          3HD2      LEU  11  -0.928   2.750   0.864
  228   HD22  LEU  11          1HD2      LEU  11  -1.874   1.309   0.422
  229   HD23  LEU  11          2HD2      LEU  11  -1.492   1.628   2.116
  230    H    VAL  12           H        VAL  12  -2.297  -0.348  -1.045
  231    HA   VAL  12           HA       VAL  12  -1.673  -3.092  -0.236
  232    HB   VAL  12           HB       VAL  12  -4.354  -1.776  -0.823
  233   HG11  VAL  12          1HG1      VAL  12  -4.603  -4.179  -1.012
  234   HG12  VAL  12          2HG1      VAL  12  -3.695  -4.440   0.492
  235   HG13  VAL  12          3HG1      VAL  12  -5.289  -3.654   0.524
  236   HG21  VAL  12          3HG2      VAL  12  -4.545  -1.734   1.671
  237   HG22  VAL  12          1HG2      VAL  12  -2.863  -2.304   1.786
  238   HG23  VAL  12          2HG2      VAL  12  -3.227  -0.714   1.086
  239    H    GLU  13           H        GLU  13  -3.089  -1.552  -3.146
  240    HA   GLU  13           HA       GLU  13  -3.405  -3.998  -4.641
  241    HB2  GLU  13           2HB      GLU  13  -3.067  -1.123  -5.601
  242    HB3  GLU  13           3HB      GLU  13  -3.547  -2.491  -6.609
  243    HG2  GLU  13           2HG      GLU  13  -5.540  -2.850  -5.139
  244    HG3  GLU  13           3HG      GLU  13  -5.103  -1.406  -4.220
  245    H    ALA  14           H        ALA  14  -0.648  -1.805  -4.208
  246    HA   ALA  14           HA       ALA  14   1.094  -3.173  -6.089
  247    HB1  ALA  14           3HB      ALA  14   2.843  -1.824  -4.963
  248    HB2  ALA  14           1HB      ALA  14   1.444  -0.834  -5.418
  249    HB3  ALA  14           2HB      ALA  14   1.680  -1.337  -3.727
  250    H    LEU  15           H        LEU  15   0.638  -3.388  -2.509
  251    HA   LEU  15           HA       LEU  15   2.689  -5.237  -2.033
  252    HB2  LEU  15           2HB      LEU  15   0.200  -4.435  -0.544
  253    HB3  LEU  15           3HB      LEU  15   1.128  -5.807   0.041
  254    HG   LEU  15           HG       LEU  15   2.521  -3.183  -0.581
  255   HD11  LEU  15          1HD1      LEU  15   1.479  -3.981   2.158
  256   HD12  LEU  15          2HD1      LEU  15   2.327  -2.492   1.707
  257   HD13  LEU  15          3HD1      LEU  15   0.690  -2.782   1.114
  258   HD21  LEU  15          3HD2      LEU  15   3.177  -5.477   1.320
  259   HD22  LEU  15          1HD2      LEU  15   3.896  -5.264  -0.281
  260   HD23  LEU  15          2HD2      LEU  15   4.184  -4.059   0.963
  261    H    TYR  16           H        TYR  16  -0.701  -5.879  -2.938
  262    HA   TYR  16           HA       TYR  16  -0.506  -8.734  -2.838
  263    HB2  TYR  16           2HB      TYR  16  -2.339  -6.735  -4.158
  264    HB3  TYR  16           3HB      TYR  16  -2.464  -8.430  -4.586
  265    HD1  TYR  16           HD2      TYR  16  -2.344 -10.111  -2.470
  266    HD2  TYR  16           HD1      TYR  16  -3.865  -6.073  -2.457
  267    HE1  TYR  16           HE2      TYR  16  -3.725 -10.639  -0.488
  268    HE2  TYR  16           HE1      TYR  16  -5.228  -6.599  -0.440
  269    HH   TYR  16           HH       TYR  16  -5.136  -9.833   1.106
  270    H    LEU  17           H        LEU  17   1.190  -6.716  -4.959
  271    HA   LEU  17           HA       LEU  17   1.657  -8.986  -6.859
  272    HB2  LEU  17           2HB      LEU  17   2.004  -5.997  -7.280
  273    HB3  LEU  17           3HB      LEU  17   2.462  -7.245  -8.434
  274    HG   LEU  17           HG       LEU  17  -0.382  -6.681  -7.490
  275   HD11  LEU  17          1HD1      LEU  17   0.499  -4.912  -8.921
  276   HD12  LEU  17          2HD1      LEU  17   1.042  -6.110 -10.122
  277   HD13  LEU  17          3HD1      LEU  17  -0.690  -5.869  -9.817
  278   HD21  LEU  17          3HD2      LEU  17   0.666  -8.620  -9.598
  279   HD22  LEU  17          1HD2      LEU  17  -0.182  -9.046  -8.093
  280   HD23  LEU  17          2HD2      LEU  17  -1.042  -8.188  -9.371
  281    H    VAL  18           H        VAL  18   3.191  -6.806  -4.556
  282    HA   VAL  18           HA       VAL  18   5.907  -7.775  -5.140
  283    HB   VAL  18           HB       VAL  18   4.777  -6.192  -2.802
  284   HG11  VAL  18          1HG1      VAL  18   6.874  -7.276  -2.083
  285   HG12  VAL  18          2HG1      VAL  18   7.689  -6.703  -3.555
  286   HG13  VAL  18          3HG1      VAL  18   7.123  -5.545  -2.337
  287   HG21  VAL  18          3HG2      VAL  18   6.001  -4.320  -3.943
  288   HG22  VAL  18          1HG2      VAL  18   6.371  -5.405  -5.293
  289   HG23  VAL  18          2HG2      VAL  18   4.691  -4.958  -4.934
  290    H    CYS  19           H        CYS  19   3.328  -8.564  -2.832
  291    HA   CYS  19           HA       CYS  19   4.338 -11.327  -2.726
  292    HB2  CYS  19           2HB      CYS  19   3.740 -11.414  -0.288
  293    HB3  CYS  19           3HB      CYS  19   5.246 -10.616  -0.713
  294    H    GLY  20           H        GLY  20   0.856 -11.584  -3.684
  295    HA2  GLY  20           HA2      GLY  20   3.217 -10.654  -5.059
  296    HA3  GLY  20           HA3      GLY  20   3.371 -12.363  -4.640
  297    H    GLU  21           H        GLU  21   0.392 -12.806  -5.007
  298    HA   GLU  21           HA       GLU  21  -0.016 -12.283  -7.894
  299    HB2  GLU  21           2HB      GLU  21   1.338 -14.440  -7.559
  300    HB3  GLU  21           3HB      GLU  21  -0.113 -15.139  -6.846
  301    HG2  GLU  21           2HG      GLU  21  -1.336 -14.670  -9.001
  302    HG3  GLU  21           3HG      GLU  21   0.125 -13.934  -9.649
  303    H    ARG  22           H        ARG  22  -1.334 -10.999  -6.030
  304    HA   ARG  22           HA       ARG  22  -3.286 -10.412  -5.063
  305    HB2  ARG  22           2HB      ARG  22  -4.663 -12.353  -6.945
  306    HB3  ARG  22           3HB      ARG  22  -5.428 -11.072  -6.018
  307    HG2  ARG  22           2HG      ARG  22  -3.451 -10.707  -8.308
  308    HG3  ARG  22           3HG      ARG  22  -5.186 -10.367  -8.313
  309    HD2  ARG  22           2HD      ARG  22  -4.793  -8.654  -6.497
  310    HD3  ARG  22           3HD      ARG  22  -3.048  -8.944  -6.694
  311    HE   ARG  22           HE       ARG  22  -4.295  -8.259  -9.210
  312   HH11  ARG  22          1HH1      ARG  22  -3.157  -6.808  -6.262
  313   HH12  ARG  22          2HH1      ARG  22  -2.565  -5.368  -7.034
  314   HH21  ARG  22          2HH2      ARG  22  -3.779  -6.284 -10.152
  315   HH22  ARG  22          1HH2      ARG  22  -3.129  -5.004  -9.170
  316    H    GLY  23           H        GLY  23  -2.490 -13.712  -4.808
  317    HA2  GLY  23           HA2      GLY  23  -3.471 -13.598  -1.975
  318    HA3  GLY  23           HA3      GLY  23  -2.789 -15.026  -2.753
  319    H    DHI  24           H        DHI  24  -1.807 -14.132  -0.377
  320    HA   DHI  24           HA       DHI  24   0.976 -13.315  -1.080
  321    HB2  DHI  24           2HB      DHI  24   0.801 -15.635  -0.622
  322    HB3  DHI  24           3HB      DHI  24   1.696 -14.869   0.672
  323    HD2  DHI  24           HD2      DHI  24  -1.437 -14.000   2.045
  324    HE1  DHI  24           HE1      DHI  24  -1.373 -18.173   2.900
  325    HE2  DHI  24           HE2      DHI  24  -2.478 -15.948   3.459
  326    H    PHE  25           H        PHE  25  -1.439 -11.741   0.265
  327    HA   PHE  25           HA       PHE  25   0.054 -10.569   2.560
  328    HB2  PHE  25           2HB      PHE  25   0.744  -9.346   0.564
  329    HB3  PHE  25           3HB      PHE  25  -0.923  -9.107   0.075
  330    HD1  PHE  25           HD2      PHE  25   1.528  -8.298   2.821
  331    HD2  PHE  25           HD1      PHE  25  -2.093  -7.164   0.758
  332    HE1  PHE  25           HE2      PHE  25   1.411  -6.219   4.161
  333    HE2  PHE  25           HE1      PHE  25  -2.184  -5.071   2.092
  334    HZ   PHE  25           HZ       PHE  25  -0.452  -4.609   3.806
  335    H    TYR  26           H        TYR  26  -1.240  -9.106   3.869
  336    HA   TYR  26           HA       TYR  26  -4.025  -8.693   3.308
  337    HB2  TYR  26           2HB      TYR  26  -4.207 -10.902   4.447
  338    HB3  TYR  26           3HB      TYR  26  -3.337 -10.258   5.834
  339    HD1  TYR  26           HD2      TYR  26  -6.411  -9.745   3.743
  340    HD2  TYR  26           HD1      TYR  26  -4.560  -9.149   7.604
  341    HE1  TYR  26           HE2      TYR  26  -8.575  -8.917   4.666
  342    HE2  TYR  26           HE1      TYR  26  -6.721  -8.361   8.518
  343    HH   TYR  26           HH       TYR  26  -8.940  -7.941   8.096
  344    H    THR  27           H        THR  27  -4.849  -6.917   4.410
  345    HA   THR  27           HA       THR  27  -3.586  -6.088   6.877
  346    HB   THR  27           HB       THR  27  -2.318  -4.692   5.366
  347    HG1  THR  27           HG1      THR  27  -3.077  -2.661   6.337
  348   HG21  THR  27          1HG2      THR  27  -3.285  -2.862   4.110
  349   HG22  THR  27          2HG2      THR  27  -3.966  -4.382   3.507
  350   HG23  THR  27          3HG2      THR  27  -4.931  -3.340   4.567
  351    HA   PRO  28           HA       PRO  28  -7.971  -5.302   7.558
  352    HB2  PRO  28           2HB      PRO  28  -7.975  -4.718  10.194
  353    HB3  PRO  28           3HB      PRO  28  -7.483  -6.331   9.595
  354    HG2  PRO  28           2HG      PRO  28  -5.668  -4.003  10.315
  355    HG3  PRO  28           3HG      PRO  28  -5.574  -5.702  10.896
  356    HD2  PRO  28           2HD      PRO  28  -4.111  -4.783   8.770
  357    HD3  PRO  28           3HD      PRO  28  -4.725  -6.460   8.855
  358    H    LYS  29           H        LYS  29  -5.824  -3.019   6.871
  359    HA   LYS  29           HA       LYS  29  -6.415  -0.557   7.937
  360    HB2  LYS  29           2HB      LYS  29  -4.698  -1.254   6.174
  361    HB3  LYS  29           3HB      LYS  29  -5.977  -1.096   4.977
  362    HG2  LYS  29           2HG      LYS  29  -6.205   1.349   5.755
  363    HG3  LYS  29           3HG      LYS  29  -4.783   1.074   6.757
  364    HD2  LYS  29           2HD      LYS  29  -4.020   2.110   4.741
  365    HD3  LYS  29           3HD      LYS  29  -3.522   0.422   4.663
  366    HE2  LYS  29           2HE      LYS  29  -4.331   1.003   2.500
  367    HE3  LYS  29           3HE      LYS  29  -5.562  -0.041   3.218
  368    HZ1  LYS  29           HZ1      LYS  29  -5.656   2.922   3.060
  369    HZ2  LYS  29           HZ2      LYS  29  -6.534   1.930   2.145
  370    HZ3  LYS  29           HZ3      LYS  29  -6.851   1.990   3.747
  371    H    THR  30           H        THR  30  -7.879   0.980   7.793
  372    HA   THR  30           HA       THR  30  -9.919   2.014   7.534
  373    HB   THR  30           HB       THR  30 -10.181   2.893   5.189
  374    HG1  THR  30           HG1      THR  30  -9.207   1.128   4.155
  375   HG21  THR  30          1HG2      THR  30  -8.122   4.230   5.294
  376   HG22  THR  30          2HG2      THR  30  -8.899   4.096   6.879
  377   HG23  THR  30          3HG2      THR  30  -7.451   3.134   6.522
  Start of MODEL   30
    1    H1   GLY   1           1H       GLY   1  -7.285  -1.958   6.783
    2    H2   GLY   1           2H       GLY   1  -6.621  -3.450   6.680
    3    H3   GLY   1           3H       GLY   1  -6.229  -2.457   7.933
    4    HA2  GLY   1           HA2      GLY   1  -5.566  -2.040   5.085
    5    HA3  GLY   1           HA3      GLY   1  -5.191  -0.892   6.385
    6    H    ILE   2           H        ILE   2  -3.102  -0.977   6.907
    7    HA   ILE   2           HA       ILE   2  -1.967  -3.465   7.875
    8    HB   ILE   2           HB       ILE   2  -1.277  -3.567   5.544
    9   HG12  ILE   2          2HG1      ILE   2   1.128  -3.779   5.735
   10   HG13  ILE   2          3HG1      ILE   2   1.150  -2.831   7.217
   11   HG21  ILE   2          1HG2      ILE   2   0.172  -1.960   4.470
   12   HG22  ILE   2          2HG2      ILE   2  -1.294  -1.129   4.997
   13   HG23  ILE   2          3HG2      ILE   2   0.217  -0.951   5.921
   14   HD11  ILE   2          3HD1      ILE   2  -0.103  -4.660   8.381
   15   HD12  ILE   2          1HD1      ILE   2  -0.120  -5.582   6.867
   16   HD13  ILE   2          2HD1      ILE   2   1.413  -5.223   7.669
   17    H    VAL   3           H        VAL   3  -0.310  -3.133   9.392
   18    HA   VAL   3           HA       VAL   3  -0.552  -0.654  10.892
   19    HB   VAL   3           HB       VAL   3   1.083  -3.173  11.390
   20   HG11  VAL   3          1HG1      VAL   3   0.457  -0.840  13.255
   21   HG12  VAL   3          2HG1      VAL   3   1.126  -2.403  13.768
   22   HG13  VAL   3          3HG1      VAL   3   2.064  -1.375  12.696
   23   HG21  VAL   3          3HG2      VAL   3  -1.351  -3.605  11.405
   24   HG22  VAL   3          1HG2      VAL   3  -0.696  -3.694  13.038
   25   HG23  VAL   3          2HG2      VAL   3  -1.596  -2.250  12.528
   26    H    GLU   4           H        GLU   4   0.993   0.893  11.307
   27    HA   GLU   4           HA       GLU   4   2.555   2.417  10.677
   28    HB2  GLU   4           2HB      GLU   4   4.305  -0.055  10.812
   29    HB3  GLU   4           3HB      GLU   4   4.923   1.597  10.676
   30    HG2  GLU   4           2HG      GLU   4   3.779   2.247  12.752
   31    HG3  GLU   4           3HG      GLU   4   3.157   0.613  12.948
   32    H    GLN   5           H        GLN   5   0.988   1.733   8.598
   33    HA   GLN   5           HA       GLN   5   2.133   1.079   6.148
   34    HB2  GLN   5           2HB      GLN   5   0.172   2.047   5.151
   35    HB3  GLN   5           3HB      GLN   5  -0.269   1.167   6.591
   36    HG2  GLN   5           2HG      GLN   5  -0.101   4.193   6.301
   37    HG3  GLN   5           3HG      GLN   5  -1.566   3.219   6.322
   38   HE21  GLN   5          2HE2      GLN   5  -1.373   1.563   8.547
   39   HE22  GLN   5          1HE2      GLN   5  -1.239   2.611   9.955
   40    H    CYS   6           H        CYS   6   2.550   2.280   4.241
   41    HA   CYS   6           HA       CYS   6   4.508   4.276   4.417
   42    HB2  CYS   6           2HB      CYS   6   2.722   3.429   2.110
   43    HB3  CYS   6           3HB      CYS   6   4.137   4.461   1.931
   44    H    CYS   7           H        CYS   7   1.434   4.899   2.723
   45    HA   CYS   7           HA       CYS   7   0.314   6.740   2.283
   46    HB2  CYS   7           2HB      CYS   7  -0.589   5.630   4.385
   47    HB3  CYS   7           3HB      CYS   7   0.033   7.012   5.270
   48    H    THR   8           H        THR   8   1.393   8.410   5.222
   49    HA   THR   8           HA       THR   8   1.839  10.897   3.929
   50    HB   THR   8           HB       THR   8   3.094   9.997   6.547
   51    HG1  THR   8           HG1      THR   8   1.139  10.576   7.505
   52   HG21  THR   8          1HG2      THR   8   1.985  12.684   5.605
   53   HG22  THR   8          2HG2      THR   8   2.579  12.337   7.245
   54   HG23  THR   8          3HG2      THR   8   3.697  12.290   5.880
   55    H    SER   9           H        SER   9   3.971   8.153   4.353
   56    HA   SER   9           HA       SER   9   6.330   9.661   3.306
   57    HB2  SER   9           2HB      SER   9   6.188   6.954   4.672
   58    HB3  SER   9           3HB      SER   9   7.657   7.736   4.065
   59    HG   SER   9           HG       SER   9   7.333   8.103   6.321
   60    H    ILE  10           H        ILE  10   7.573   8.749   1.635
   61    HA   ILE  10           HA       ILE  10   6.003   7.363  -0.431
   62    HB   ILE  10           HB       ILE  10   8.802   8.554  -0.499
   63   HG12  ILE  10          2HG1      ILE  10   6.087   9.554  -1.478
   64   HG13  ILE  10          3HG1      ILE  10   7.086  10.262  -0.214
   65   HG21  ILE  10          1HG2      ILE  10   7.096   7.392  -2.743
   66   HG22  ILE  10          2HG2      ILE  10   8.623   8.271  -2.976
   67   HG23  ILE  10          3HG2      ILE  10   8.642   6.737  -2.148
   68   HD11  ILE  10          3HD1      ILE  10   7.310  11.643  -2.128
   69   HD12  ILE  10          1HD1      ILE  10   8.838  10.754  -1.974
   70   HD13  ILE  10          2HD1      ILE  10   7.629  10.271  -3.198
   71    H    CYS  11           H        CYS  11   6.454   5.396  -1.333
   72    HA   CYS  11           HA       CYS  11   8.505   3.639  -0.101
   73    HB2  CYS  11           2HB      CYS  11   5.529   3.142  -0.326
   74    HB3  CYS  11           3HB      CYS  11   6.673   1.806  -0.251
   75    H    SER  12           H        SER  12   8.899   1.703  -1.316
   76    HA   SER  12           HA       SER  12   8.184   1.532  -4.159
   77    HB2  SER  12           2HB      SER  12  10.279   2.954  -4.026
   78    HB3  SER  12           3HB      SER  12  11.095   1.582  -3.256
   79    HG   SER  12           HG       SER  12  11.478   1.525  -5.474
   80    H    LEU  13           H        LEU  13   9.428  -0.623  -4.955
   81    HA   LEU  13           HA       LEU  13   8.268  -2.811  -3.660
   82    HB2  LEU  13           2HB      LEU  13   9.051  -2.718  -5.967
   83    HB3  LEU  13           3HB      LEU  13  10.733  -2.709  -5.453
   84    HG   LEU  13           HG       LEU  13   8.924  -5.017  -4.661
   85   HD11  LEU  13          1HD1      LEU  13   9.540  -6.188  -6.741
   86   HD12  LEU  13          2HD1      LEU  13   8.606  -4.731  -7.092
   87   HD13  LEU  13          3HD1      LEU  13  10.366  -4.727  -7.330
   88   HD21  LEU  13          3HD2      LEU  13  11.899  -4.858  -5.343
   89   HD22  LEU  13          1HD2      LEU  13  11.218  -5.055  -3.716
   90   HD23  LEU  13          2HD2      LEU  13  11.020  -6.336  -4.900
   91    H    TYR  14           H        TYR  14  11.604  -1.618  -3.201
   92    HA   TYR  14           HA       TYR  14  12.582  -3.587  -1.419
   93    HB2  TYR  14           2HB      TYR  14  13.999  -1.936  -2.485
   94    HB3  TYR  14           3HB      TYR  14  13.137  -0.610  -1.719
   95    HD1  TYR  14           HD1      TYR  14  15.534  -3.399  -1.131
   96    HD2  TYR  14           HD2      TYR  14  13.579   0.056   0.564
   97    HE1  TYR  14           HE1      TYR  14  17.083  -3.470   0.826
   98    HE2  TYR  14           HE2      TYR  14  15.090  -0.041   2.527
   99    HH   TYR  14           HH       TYR  14  16.858  -1.117   3.524
  100    H    GLN  15           H        GLN  15  10.468  -0.814  -0.741
  101    HA   GLN  15           HA       GLN  15  10.634  -1.164   2.192
  102    HB2  GLN  15           2HB      GLN  15   8.786   0.599   0.538
  103    HB3  GLN  15           3HB      GLN  15   8.986   0.657   2.280
  104    HG2  GLN  15           2HG      GLN  15  11.164   1.303   0.242
  105    HG3  GLN  15           3HG      GLN  15  10.164   2.482   1.073
  106   HE21  GLN  15          2HE2      GLN  15  12.802   2.909   1.348
  107   HE22  GLN  15          1HE2      GLN  15  13.327   2.430   2.956
  108    H    LEU  16           H        LEU  16   8.375  -1.845  -0.484
  109    HA   LEU  16           HA       LEU  16   6.226  -2.810   1.159
  110    HB2  LEU  16           2HB      LEU  16   6.880  -3.387  -1.735
  111    HB3  LEU  16           3HB      LEU  16   5.373  -3.819  -0.932
  112    HG   LEU  16           HG       LEU  16   6.448  -1.117  -1.681
  113   HD11  LEU  16          1HD1      LEU  16   3.782  -2.466  -2.176
  114   HD12  LEU  16          2HD1      LEU  16   4.298  -0.878  -2.792
  115   HD13  LEU  16          3HD1      LEU  16   5.128  -2.339  -3.334
  116   HD21  LEU  16          3HD2      LEU  16   4.115  -1.616   0.222
  117   HD22  LEU  16          1HD2      LEU  16   5.607  -0.714   0.587
  118   HD23  LEU  16          2HD2      LEU  16   4.455  -0.064  -0.574
  119    H    GLU  17           H        GLU  17   8.998  -4.537  -0.264
  120    HA   GLU  17           HA       GLU  17   8.437  -7.205   0.470
  121    HB2  GLU  17           2HB      GLU  17  10.949  -5.508   0.358
  122    HB3  GLU  17           3HB      GLU  17  11.050  -7.163   0.913
  123    HG2  GLU  17           2HG      GLU  17   9.796  -6.474  -1.767
  124    HG3  GLU  17           3HG      GLU  17  11.532  -6.673  -1.564
  125    H    ASN  18           H        ASN  18   9.428  -4.514   2.600
  126    HA   ASN  18           HA       ASN  18  10.231  -6.175   4.794
  127    HB2  ASN  18           2HB      ASN  18  10.985  -3.807   4.271
  128    HB3  ASN  18           3HB      ASN  18   9.409  -3.245   4.834
  129   HD21  ASN  18          2HD2      ASN  18   9.655  -2.367   6.860
  130   HD22  ASN  18          1HD2      ASN  18  10.666  -3.065   8.117
  131    H    TYR  19           H        TYR  19   7.017  -5.287   3.761
  132    HA   TYR  19           HA       TYR  19   5.802  -5.548   6.418
  133    HB2  TYR  19           2HB      TYR  19   4.644  -5.425   3.618
  134    HB3  TYR  19           3HB      TYR  19   3.680  -5.557   5.075
  135    HD1  TYR  19           HD1      TYR  19   5.898  -3.333   3.151
  136    HD2  TYR  19           HD2      TYR  19   3.431  -3.694   6.651
  137    HE1  TYR  19           HE1      TYR  19   5.891  -0.856   3.381
  138    HE2  TYR  19           HE2      TYR  19   3.411  -1.209   6.891
  139    HH   TYR  19           HH       TYR  19   5.185   0.920   4.623
  140    H    CYS  20           H        CYS  20   6.675  -7.778   3.848
  141    HA   CYS  20           HA       CYS  20   5.110  -9.963   5.167
  142    HB2  CYS  20           2HB      CYS  20   5.193 -11.053   2.974
  143    HB3  CYS  20           3HB      CYS  20   4.292  -9.543   3.014
  144    H    ASN  21           H        ASN  21   8.367  -9.168   3.961
  145    HA   ASN  21           HA       ASN  21   9.485 -11.788   4.421
  146    HB2  ASN  21           2HB      ASN  21  10.782  -9.036   4.252
  147    HB3  ASN  21           3HB      ASN  21  11.678 -10.546   4.359
  148   HD21  ASN  21          2HD2      ASN  21  12.339  -9.104   2.274
  149   HD22  ASN  21          1HD2      ASN  21  11.582  -9.677   0.787
  150    H1   PHE   1           H        PHE   1   6.868   1.332 -10.075
  151    HA   PHE   1           HA       PHE   1   4.083   0.903  -9.672
  152    HB2  PHE   1           2HB      PHE   1   5.733   1.065  -7.122
  153    HB3  PHE   1           3HB      PHE   1   3.984   1.176  -7.198
  154    HD1  PHE   1           HD1      PHE   1   2.667  -0.813  -8.190
  155    HD2  PHE   1           HD2      PHE   1   6.780  -1.050  -6.913
  156    HE1  PHE   1           HE1      PHE   1   2.490  -3.294  -8.072
  157    HE2  PHE   1           HE2      PHE   1   6.595  -3.518  -6.776
  158    HZ   PHE   1           HZ       PHE   1   4.458  -4.646  -7.364
  159    H    VAL   2           H        VAL   2   3.111   2.801  -8.360
  160    HA   VAL   2           HA       VAL   2   3.680   5.210  -9.750
  161    HB   VAL   2           HB       VAL   2   2.046   4.723  -7.226
  162   HG11  VAL   2          1HG1      VAL   2   2.400   7.134  -7.465
  163   HG12  VAL   2          2HG1      VAL   2   1.956   7.063  -9.186
  164   HG13  VAL   2          3HG1      VAL   2   0.749   6.741  -7.920
  165   HG21  VAL   2          3HG2      VAL   2   1.246   3.355  -9.116
  166   HG22  VAL   2          1HG2      VAL   2   0.115   4.667  -8.797
  167   HG23  VAL   2          2HG2      VAL   2   1.236   4.788 -10.168
  168    H    ASN   3           H        ASN   3   4.941   4.052  -6.702
  169    HA   ASN   3           HA       ASN   3   6.283   4.931  -5.086
  170    HB2  ASN   3           2HB      ASN   3   7.647   5.614  -7.701
  171    HB3  ASN   3           3HB      ASN   3   8.431   5.832  -6.137
  172   HD21  ASN   3          2HD2      ASN   3   9.983   4.265  -7.165
  173   HD22  ASN   3          1HD2      ASN   3   9.658   2.585  -6.746
  174    H    GLN   4           H        GLN   4   4.108   6.598  -5.310
  175    HA   GLN   4           HA       GLN   4   5.212   9.076  -4.087
  176    HB2  GLN   4           2HB      GLN   4   3.092   8.940  -6.267
  177    HB3  GLN   4           3HB      GLN   4   3.352  10.351  -5.249
  178    HG2  GLN   4           2HG      GLN   4   5.461  10.832  -6.201
  179    HG3  GLN   4           3HG      GLN   4   5.641   9.224  -6.894
  180   HE21  GLN   4          1HE2      GLN   4   4.405   8.592  -8.756
  181   HE22  GLN   4          2HE2      GLN   4   3.734   9.843  -9.810
  182    H    HIS   5           H        HIS   5   4.568   8.734  -2.059
  183    HA   HIS   5           HA       HIS   5   3.257   8.359  -0.195
  184    HB2  HIS   5           2HB      HIS   5   1.445  10.061  -1.935
  185    HB3  HIS   5           3HB      HIS   5   1.419   9.977  -0.175
  186    HD2  HIS   5           HD2      HIS   5   3.611  10.979   1.145
  187    HE1  HIS   5           HE1      HIS   5   5.164  13.201  -2.148
  188    HE2  HIS   5           HE2      HIS   5   5.317  12.833   0.370
  189    H    LEU   6           H        LEU   6   3.106   5.974  -1.265
  190    HA   LEU   6           HA       LEU   6   0.651   5.010  -2.256
  191    HB2  LEU   6           2HB      LEU   6   2.974   3.673  -0.823
  192    HB3  LEU   6           3HB      LEU   6   1.521   2.778  -1.231
  193    HG   LEU   6           HG       LEU   6   1.796   3.280  -3.620
  194   HD11  LEU   6          1HD1      LEU   6   4.452   4.519  -2.778
  195   HD12  LEU   6          2HD1      LEU   6   4.001   4.076  -4.437
  196   HD13  LEU   6          3HD1      LEU   6   3.093   5.338  -3.600
  197   HD21  LEU   6          3HD2      LEU   6   2.691   1.208  -2.615
  198   HD22  LEU   6          1HD2      LEU   6   3.692   1.752  -3.966
  199   HD23  LEU   6          2HD2      LEU   6   4.240   2.022  -2.296
  200    H    CYS   7           H        CYS   7  -1.275   5.194  -1.322
  201    HA   CYS   7           HA       CYS   7  -1.698   4.178   1.429
  202    HB2  CYS   7           2HB      CYS   7  -1.405   6.797   1.176
  203    HB3  CYS   7           3HB      CYS   7  -3.030   6.744   0.537
  204    H    GLY   8           H        GLY   8  -3.857   3.427   1.821
  205    HA2  GLY   8           HA2      GLY   8  -5.788   2.287   1.243
  206    HA3  GLY   8           HA3      GLY   8  -6.079   3.617   0.119
  207    H    SER   9           H        SER   9  -6.607   2.783  -1.816
  208    HA   SER   9           HA       SER   9  -6.185   0.259  -2.890
  209    HB2  SER   9           2HB      SER   9  -6.277   2.871  -4.440
  210    HB3  SER   9           3HB      SER   9  -6.652   1.251  -5.056
  211    HG   SER   9           HG       SER   9  -8.537   2.355  -4.517
  212    H    HIS  10           H        HIS  10  -4.035   3.124  -3.269
  213    HA   HIS  10           HA       HIS  10  -2.252   1.858  -5.145
  214    HB2  HIS  10           2HB      HIS  10  -1.879   4.309  -3.378
  215    HB3  HIS  10           3HB      HIS  10  -0.837   3.850  -4.723
  216    HD2  HIS  10           HD2      HIS  10  -1.860   4.041  -7.238
  217    HE1  HIS  10           HE1      HIS  10  -5.269   6.387  -6.198
  218    HE2  HIS  10           HE2      HIS  10  -3.848   5.526  -8.129
  219    H    LEU  11           H        LEU  11  -2.403   1.654  -1.673
  220    HA   LEU  11           HA       LEU  11   0.373   0.627  -1.496
  221    HB2  LEU  11           2HB      LEU  11  -0.477   2.107   0.279
  222    HB3  LEU  11           3HB      LEU  11  -1.773   0.967   0.632
  223    HG   LEU  11           HG       LEU  11  -0.140  -0.718   1.366
  224   HD11  LEU  11          1HD1      LEU  11   2.256  -0.101   1.671
  225   HD12  LEU  11          2HD1      LEU  11   1.814  -0.205  -0.031
  226   HD13  LEU  11          3HD1      LEU  11   1.979   1.389   0.746
  227   HD21  LEU  11          3HD2      LEU  11  -0.991   0.926   2.986
  228   HD22  LEU  11          1HD2      LEU  11   0.669   0.443   3.371
  229   HD23  LEU  11          2HD2      LEU  11   0.358   2.019   2.601
  230    H    VAL  12           H        VAL  12  -3.019  -0.606  -1.029
  231    HA   VAL  12           HA       VAL  12  -2.102  -3.254  -0.492
  232    HB   VAL  12           HB       VAL  12  -4.367  -3.952  -0.602
  233   HG11  VAL  12          1HG1      VAL  12  -4.214  -1.224   0.734
  234   HG12  VAL  12          2HG1      VAL  12  -5.309  -2.556   1.144
  235   HG13  VAL  12          3HG1      VAL  12  -3.567  -2.739   1.400
  236   HG21  VAL  12          3HG2      VAL  12  -5.276  -2.771  -2.531
  237   HG22  VAL  12          1HG2      VAL  12  -6.242  -2.420  -1.098
  238   HG23  VAL  12          2HG2      VAL  12  -5.082  -1.217  -1.690
  239    H    GLU  13           H        GLU  13  -3.223  -1.780  -3.592
  240    HA   GLU  13           HA       GLU  13  -3.035  -4.206  -5.123
  241    HB2  GLU  13           2HB      GLU  13  -2.707  -1.284  -5.906
  242    HB3  GLU  13           3HB      GLU  13  -2.702  -2.596  -7.072
  243    HG2  GLU  13           2HG      GLU  13  -5.042  -2.118  -5.185
  244    HG3  GLU  13           3HG      GLU  13  -4.895  -1.360  -6.769
  245    H    ALA  14           H        ALA  14  -0.524  -1.870  -4.129
  246    HA   ALA  14           HA       ALA  14   1.516  -3.085  -5.811
  247    HB1  ALA  14           3HB      ALA  14   1.801  -1.193  -3.449
  248    HB2  ALA  14           1HB      ALA  14   3.016  -1.564  -4.704
  249    HB3  ALA  14           2HB      ALA  14   1.538  -0.701  -5.138
  250    H    LEU  15           H        LEU  15   0.615  -3.377  -2.320
  251    HA   LEU  15           HA       LEU  15   2.644  -5.321  -1.701
  252    HB2  LEU  15           2HB      LEU  15  -0.021  -4.586  -0.446
  253    HB3  LEU  15           3HB      LEU  15   0.934  -5.914   0.181
  254    HG   LEU  15           HG       LEU  15   2.072  -3.104  -0.098
  255   HD11  LEU  15          1HD1      LEU  15   1.631  -2.848   2.312
  256   HD12  LEU  15          2HD1      LEU  15   0.118  -3.078   1.414
  257   HD13  LEU  15          3HD1      LEU  15   0.804  -4.424   2.340
  258   HD21  LEU  15          3HD2      LEU  15   2.924  -5.488   1.613
  259   HD22  LEU  15          1HD2      LEU  15   3.740  -4.965   0.137
  260   HD23  LEU  15          2HD2      LEU  15   3.714  -3.901   1.548
  261    H    TYR  16           H        TYR  16  -0.635  -5.744  -3.094
  262    HA   TYR  16           HA       TYR  16  -0.625  -8.601  -3.046
  263    HB2  TYR  16           2HB      TYR  16  -1.939  -6.641  -4.955
  264    HB3  TYR  16           3HB      TYR  16  -2.287  -8.364  -4.903
  265    HD1  TYR  16           HD2      TYR  16  -1.992  -8.192  -1.591
  266    HD2  TYR  16           HD1      TYR  16  -4.411  -6.319  -4.650
  267    HE1  TYR  16           HE2      TYR  16  -3.697  -7.760   0.044
  268    HE2  TYR  16           HE1      TYR  16  -6.184  -5.896  -2.950
  269    HH   TYR  16           HH       TYR  16  -5.795  -6.953   0.463
  270    H    LEU  17           H        LEU  17   1.175  -6.430  -5.095
  271    HA   LEU  17           HA       LEU  17   1.892  -8.609  -6.997
  272    HB2  LEU  17           2HB      LEU  17   1.867  -5.595  -7.028
  273    HB3  LEU  17           3HB      LEU  17   3.014  -6.425  -8.051
  274    HG   LEU  17           HG       LEU  17   0.848  -5.737  -9.123
  275   HD11  LEU  17          1HD1      LEU  17   0.718  -7.727 -10.525
  276   HD12  LEU  17          2HD1      LEU  17   2.403  -7.381 -10.117
  277   HD13  LEU  17          3HD1      LEU  17   1.547  -8.698  -9.285
  278   HD21  LEU  17          3HD2      LEU  17  -0.753  -6.516  -7.369
  279   HD22  LEU  17          1HD2      LEU  17  -1.109  -7.128  -8.985
  280   HD23  LEU  17          2HD2      LEU  17  -0.351  -8.195  -7.786
  281    H    VAL  18           H        VAL  18   3.307  -6.677  -4.406
  282    HA   VAL  18           HA       VAL  18   6.035  -7.693  -4.948
  283    HB   VAL  18           HB       VAL  18   4.928  -5.891  -2.762
  284   HG11  VAL  18          1HG1      VAL  18   7.788  -6.787  -3.303
  285   HG12  VAL  18          2HG1      VAL  18   7.351  -5.399  -2.292
  286   HG13  VAL  18          3HG1      VAL  18   6.853  -7.019  -1.808
  287   HG21  VAL  18          3HG2      VAL  18   6.331  -4.194  -3.981
  288   HG22  VAL  18          1HG2      VAL  18   6.647  -5.412  -5.235
  289   HG23  VAL  18          2HG2      VAL  18   5.001  -4.818  -4.948
  290    H    CYS  19           H        CYS  19   3.587  -8.063  -2.363
  291    HA   CYS  19           HA       CYS  19   5.048 -10.383  -1.225
  292    HB2  CYS  19           2HB      CYS  19   2.780  -8.675  -0.170
  293    HB3  CYS  19           3HB      CYS  19   3.518 -10.027   0.681
  294    H    GLY  20           H        GLY  20   3.640 -10.607  -3.781
  295    HA2  GLY  20           HA2      GLY  20   2.165 -13.013  -3.481
  296    HA3  GLY  20           HA3      GLY  20   1.026 -11.662  -3.569
  297    H    GLU  21           H        GLU  21   0.220 -12.474  -5.493
  298    HA   GLU  21           HA       GLU  21   1.721 -11.571  -7.901
  299    HB2  GLU  21           2HB      GLU  21   1.153 -13.502  -9.213
  300    HB3  GLU  21           3HB      GLU  21   2.048 -14.012  -7.783
  301    HG2  GLU  21           2HG      GLU  21  -0.231 -14.549  -6.708
  302    HG3  GLU  21           3HG      GLU  21  -0.940 -14.301  -8.302
  303    H    ARG  22           H        ARG  22  -1.335 -12.384  -6.411
  304    HA   ARG  22           HA       ARG  22  -2.603 -10.019  -7.294
  305    HB2  ARG  22           2HB      ARG  22  -2.886 -11.824  -9.319
  306    HB3  ARG  22           3HB      ARG  22  -4.165 -12.429  -8.301
  307    HG2  ARG  22           2HG      ARG  22  -4.997 -10.855  -9.982
  308    HG3  ARG  22           3HG      ARG  22  -5.307 -10.249  -8.357
  309    HD2  ARG  22           2HD      ARG  22  -4.516  -8.530 -10.061
  310    HD3  ARG  22           3HD      ARG  22  -3.636  -8.564  -8.543
  311    HE   ARG  22           HE       ARG  22  -1.809  -9.765  -9.605
  312   HH11  ARG  22          2HH2      ARG  22  -4.004  -8.392 -11.980
  313   HH12  ARG  22          1HH2      ARG  22  -2.830  -8.567 -13.257
  314   HH21  ARG  22          1HH1      ARG  22  -0.438  -9.969 -11.199
  315   HH22  ARG  22          2HH1      ARG  22  -0.826  -9.440 -12.819
  316    H    GLY  23           H        GLY  23  -3.284 -13.346  -6.293
  317    HA2  GLY  23           HA2      GLY  23  -4.344 -12.501  -3.646
  318    HA3  GLY  23           HA3      GLY  23  -3.998 -14.151  -4.184
  319    H    DHI  24           H        DHI  24  -3.076 -13.696  -1.821
  320    HA   DHI  24           HA       DHI  24  -0.179 -12.969  -1.965
  321    HB2  DHI  24           2HB      DHI  24   0.431 -14.970  -0.786
  322    HB3  DHI  24           3HB      DHI  24  -1.249 -15.424  -0.538
  323    HD2  DHI  24           HD2      DHI  24   0.479 -14.573  -3.956
  324    HE1  DHI  24           HE1      DHI  24  -1.038 -18.544  -4.199
  325    HE2  DHI  24           HE2      DHI  24   0.155 -16.700  -5.486
  326    H    PHE  25           H        PHE  25   0.577 -11.877  -0.203
  327    HA   PHE  25           HA       PHE  25  -0.368 -11.884   2.444
  328    HB2  PHE  25           2HB      PHE  25   1.769 -11.015   1.642
  329    HB3  PHE  25           3HB      PHE  25   0.945  -9.717   0.780
  330    HD1  PHE  25           HD1      PHE  25   0.824 -11.044   4.338
  331    HD2  PHE  25           HD2      PHE  25   1.483  -7.669   1.730
  332    HE1  PHE  25           HE1      PHE  25   1.246  -9.593   6.305
  333    HE2  PHE  25           HE2      PHE  25   1.908  -6.233   3.691
  334    HZ   PHE  25           HZ       PHE  25   1.807  -7.192   5.990
  335    H    TYR  26           H        TYR  26  -2.052 -10.977   3.499
  336    HA   TYR  26           HA       TYR  26  -4.262 -10.587   1.764
  337    HB2  TYR  26           2HB      TYR  26  -4.338 -12.088   3.628
  338    HB3  TYR  26           3HB      TYR  26  -3.994 -10.794   4.766
  339    HD1  TYR  26           HD1      TYR  26  -6.515 -10.965   1.942
  340    HD2  TYR  26           HD2      TYR  26  -5.831 -10.654   6.197
  341    HE1  TYR  26           HE1      TYR  26  -8.934 -10.566   2.301
  342    HE2  TYR  26           HE2      TYR  26  -8.269 -10.292   6.552
  343    HH   TYR  26           HH       TYR  26 -10.604 -10.199   3.832
  344    H    THR  27           H        THR  27  -3.096  -8.433   4.355
  345    HA   THR  27           HA       THR  27  -3.937  -6.318   4.996
  346    HB   THR  27           HB       THR  27  -2.765  -4.679   3.565
  347    HG1  THR  27           HG1      THR  27  -3.056  -5.720   1.564
  348   HG21  THR  27          1HG2      THR  27  -0.569  -5.512   4.043
  349   HG22  THR  27          2HG2      THR  27  -1.656  -6.053   5.336
  350   HG23  THR  27          3HG2      THR  27  -1.142  -7.195   4.079
  351    HA   PRO  28           HA       PRO  28  -7.673  -5.972   2.251
  352    HB2  PRO  28           2HB      PRO  28  -9.636  -5.913   4.159
  353    HB3  PRO  28           3HB      PRO  28  -8.897  -7.428   3.554
  354    HG2  PRO  28           2HG      PRO  28  -8.154  -5.869   6.055
  355    HG3  PRO  28           3HG      PRO  28  -8.499  -7.621   5.911
  356    HD2  PRO  28           2HD      PRO  28  -5.955  -6.685   5.886
  357    HD3  PRO  28           3HD      PRO  28  -6.436  -8.025   4.804
  358    H    LYS  29           H        LYS  29  -8.712  -4.072   1.653
  359    HA   LYS  29           HA       LYS  29  -7.884  -1.557   2.864
  360    HB2  LYS  29           2HB      LYS  29  -8.242  -1.855   0.429
  361    HB3  LYS  29           3HB      LYS  29  -9.971  -2.109   0.713
  362    HG2  LYS  29           2HG      LYS  29 -10.160   0.182   1.643
  363    HG3  LYS  29           3HG      LYS  29  -8.414   0.426   1.420
  364    HD2  LYS  29           2HD      LYS  29  -8.671   0.183  -1.021
  365    HD3  LYS  29           3HD      LYS  29 -10.404  -0.161  -0.820
  366    HE2  LYS  29           2HE      LYS  29 -10.718   2.081   0.224
  367    HE3  LYS  29           3HE      LYS  29  -9.001   2.429  -0.016
  368    HZ1  LYS  29           HZ1      LYS  29 -10.959   1.897  -2.189
  369    HZ2  LYS  29           HZ2      LYS  29 -10.338   3.359  -1.815
  370    HZ3  LYS  29           HZ3      LYS  29  -9.367   2.190  -2.424
  371    H    THR  30           H        THR  30  -8.923  -0.274   4.259
  372    HA   THR  30           HA       THR  30 -11.632  -0.952   5.307
  373    HB   THR  30           HB       THR  30 -10.684  -0.603   7.627
  374    HG1  THR  30           HG1      THR  30  -8.685   0.247   6.884
  375   HG21  THR  30          1HG2      THR  30  -9.656  -3.054   6.131
  376   HG22  THR  30          2HG2      THR  30  -9.912  -2.900   7.883
  377   HG23  THR  30          3HG2      THR  30 -11.297  -2.850   6.780