*HEADER    ANTIMICROBIAL PROTEIN                   30-JUL-13   2MBD              
*TITLE     LASIOCEPSIN                                                           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: LASIOCEPSIN;                                               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: LASIOGLOSSUM LATICEPS;                          
*SOURCE   4 ORGANISM_COMMON: BEES;                                               
*SOURCE   5 ORGANISM_TAXID: 88510                                                
*KEYWDS    ANTIMICROBIAL PEPTIDE, WILD BEE, VENOM, ANTIMICROBIAL PROTEIN         
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    48                                                                    
*AUTHOR    L.MONINCOVA, M.BUDESINSKY, S.CUJOVA, V.CEROVSKY, V.VEVERKA            
*REVDAT   1   15-JAN-14 2MBD    0                                                


#
#  11 ALA  H      11 ALA  QB      2.70             (#peak     1 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 1, nxpk= 0, iat= 167,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr2= 171, 172, 173,
 &end
#
#   9 ALA  H       9 ALA  QB      2.69             (#peak     2 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 2, nxpk= 0, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
 igr2= 142, 143, 144,
 &end
#
#   8 CYSS H       8 CYSS HB2     3.08             (#peak     3 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 3, nxpk= 0, iat= 128, 132, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
#  10 ILE  H      10 ILE  HB      3.09             (#peak     6 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 6, nxpk= 0, iat= 148, 152, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
#   3 PRO  HA      4 ARG  H       2.64             (#peak    15 #SUP  0.50  #QF  0.50)
 &rst
  ixpk= 15, nxpk= 0, iat=  40,  44, r1= 1.30, r2= 1.80, r3= 2.64, r4= 3.14,  &end
#
#  25 CYSS H      25 CYSS HB3     3.21             (#peak    17 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 17, nxpk= 0, iat= 401, 406, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#  26 LYS  H      26 LYS  HA      2.86             (#peak    18 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 18, nxpk= 0, iat= 411, 413, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,  &end
#
#   1 GLY  QA      2 LEU  H       2.88             (#peak    32 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 32, nxpk= 0, iat=  -1,  11, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
 igr1=   6,   7,
 &end
#
#  18 LYS  H      19 GLY  H       4.69             (#peak    33 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 33, nxpk= 0, iat= 282, 304, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#  19 GLY  H      22 LYS  H       5.02             (#peak    34 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 34, nxpk= 0, iat= 304, 344, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#   7 LEU  H       8 CYSS H       3.11             (#peak    35 #SUP  0.78  #QF  0.78)
 &rst
  ixpk= 35, nxpk= 0, iat= 109, 128, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
#   8 CYSS H       9 ALA  H       3.12             (#peak    36 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 36, nxpk= 0, iat= 128, 138, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#   4 ARG  H       6 ILE  H       4.87             (#peak    37 #SUP  0.95  #QF  0.50)
 &rst
  ixpk= 37, nxpk= 0, iat=  44,  90, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
#   6 ILE  H       8 CYSS H       5.10             (#peak    37 #SUP  0.95  #QF  0.50)
 &rst
  ixpk= 37, nxpk= 0, iat=  90, 128, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
#   8 CYSS H      11 ALA  H       4.99             (#peak    38 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 38, nxpk= 0, iat= 128, 167, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
#   5 LYS  H       6 ILE  H       3.40             (#peak    39 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 39, nxpk= 0, iat=  68,  90, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#   4 ARG  H       4 ARG  HE      5.50             (#peak    40 #SUP  1.00)
 &rst
  ixpk= 40, nxpk= 0, iat=  44,  57, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  17 CYSS H      18 LYS  H       4.39             (#peak    42 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 42, nxpk= 0, iat= 272, 282, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#   5 LYS  H       7 LEU  H       4.92             (#peak    44 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 44, nxpk= 0, iat=  68, 109, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
#  15 GLY  H      16 LYS  H       3.33             (#peak    45 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 45, nxpk= 0, iat= 243, 250, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
#  14 LYS  H      16 LYS  H       4.55             (#peak    46 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 46, nxpk= 0, iat= 221, 250, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#  25 CYSS H      26 LYS  H       3.19             (#peak    47 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 47, nxpk= 0, iat= 401, 411, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,  &end
#
#  24 VAL  H      25 CYSS H       2.88             (#peak    48 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 48, nxpk= 0, iat= 385, 401, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,  &end
#
#  25 CYSS H      27 CYSS H       5.42             (#peak    49 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 49, nxpk= 0, iat= 401, 433, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
#  22 LYS  H      25 CYSS H       5.22             (#peak    50 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 50, nxpk= 0, iat= 344, 401, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
#  10 ILE  H      11 ALA  H       3.18             (#peak    51 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 51, nxpk= 0, iat= 148, 167, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
#   9 ALA  H      10 ILE  H       3.16             (#peak    52 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 52, nxpk= 0, iat= 138, 148, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66,  &end
#
#   6 ILE  H       7 LEU  H       2.97             (#peak    53 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 53, nxpk= 0, iat=  90, 109, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47,  &end
#
#  12 LYS  H      13 LYS  H       3.25             (#peak    54 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 54, nxpk= 0, iat= 177, 199, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
#  14 LYS  H      15 GLY  H       3.38             (#peak    55 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 55, nxpk= 0, iat= 221, 243, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#  13 LYS  H      14 LYS  H       3.24             (#peak    56 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 56, nxpk= 0, iat= 199, 221, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
#   9 ALA  H      11 ALA  H       4.64             (#peak    57 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 57, nxpk= 0, iat= 138, 167, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#  24 VAL  H      26 LYS  H       5.14             (#peak    58 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 58, nxpk= 0, iat= 385, 411, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#  26 LYS  H      27 CYSS H       3.67             (#peak    59 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 59, nxpk= 0, iat= 411, 433, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  22 LYS  H      23 LEU  H       3.08             (#peak    60 #SUP  0.77  #QF  0.77)
 &rst
  ixpk= 60, nxpk= 0, iat= 344, 366, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
#   4 ARG  HA      4 ARG  HE      5.37             (#peak    62 #SUP  1.00)
 &rst
  ixpk= 62, nxpk= 0, iat=  46,  57, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,  &end
#
#  17 CYSS H      17 CYSS HB3     3.36             (#peak    66 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 66, nxpk= 0, iat= 272, 277, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  17 CYSS H      17 CYSS HB2     3.74             (#peak    67 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 67, nxpk= 0, iat= 272, 276, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  27 CYSS H      27 CYSS HB2     3.97             (#peak    68 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 68, nxpk= 0, iat= 433, 437, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#  27 CYSS H      27 CYSS HB3     3.97             (#peak    69 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 69, nxpk= 0, iat= 433, 438, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#   4 ARG  HB2     4 ARG  QD      3.99             (#peak    71 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 71, nxpk= 0, iat=  48,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2=  54,  55,
 &end
#
#   4 ARG  HB3     4 ARG  QD      3.99             (#peak    72 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 72, nxpk= 0, iat=  49,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2=  54,  55,
 &end
#
#  12 LYS  H      12 LYS  HB2     3.61             (#peak    74 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 74, nxpk= 0, iat= 177, 181, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
#  12 LYS  H      12 LYS  HB3     3.61             (#peak    75 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 75, nxpk= 0, iat= 177, 182, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
#  12 LYS  H      12 LYS  QG      4.42             (#peak    76 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 76, nxpk= 0, iat= 177,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 184, 185,
 &end
#
#  13 LYS  H      13 LYS  QB      2.72             (#peak    77 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 77, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,
 igr2= 203, 204,
 &end
#
#  12 LYS  QG     13 LYS  H       5.13             (#peak    78 #SUP  1.00  #QF  0.37)
 &rst
  ixpk= 78, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 184, 185,
 &end
#
#  13 LYS  H      13 LYS  HG3     5.39             (#peak    78 #SUP  1.00  #QF  0.37)
 &rst
  ixpk= 78, nxpk= 0, iat= 199, 207, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
#   9 ALA  QB     13 LYS  H       4.98             (#peak    79 #SUP  0.99  #QF  0.39)
 &rst
  ixpk= 79, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1= 142, 143, 144,
 &end
#
#  13 LYS  H      13 LYS  HG2     5.39             (#peak    79 #SUP  0.99  #QF  0.39)
 &rst
  ixpk= 79, nxpk= 0, iat= 199, 206, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
#  12 LYS  H      12 LYS  QE      5.50             (#peak    80 #SUP  1.00)
 &rst
  ixpk= 80, nxpk= 0, iat= 177,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 190, 191,
 &end
#
#  14 LYS  H      14 LYS  HD2     3.96             (#peak    81 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 81, nxpk= 0, iat= 221, 231, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  14 LYS  H      14 LYS  HD3     3.96             (#peak    82 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 82, nxpk= 0, iat= 221, 232, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  22 LYS  H      22 LYS  QD      4.51             (#peak    83 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 83, nxpk= 0, iat= 344,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2= 354, 355,
 &end
#
#  26 LYS  H      26 LYS  HB3     4.17             (#peak    84 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 84, nxpk= 0, iat= 411, 416, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  26 LYS  H      26 LYS  HB2     4.17             (#peak    85 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 85, nxpk= 0, iat= 411, 415, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  19 GLY  H      21 LEU  H       5.43             (#peak    86 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 86, nxpk= 0, iat= 304, 325, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
#   6 ILE  QG2     8 CYSS H       4.86             (#peak    87 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 87, nxpk= 0, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1=  96,  97,  98,
 &end
#
#   7 LEU  QD1     8 CYSS H       5.50             (#peak    88 #SUP  0.93  #QF  0.23)
 &rst
  ixpk= 88, nxpk= 0, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 118, 119, 120,
 &end
#
#   4 ARG  H      24 VAL  QG1     5.50             (#peak    88 #SUP  0.93  #QF  0.23)
 &rst
  ixpk= 88, nxpk= 0, iat=  44,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 391, 392, 393,
 &end
#
#   7 LEU  QD2     8 CYSS H       5.50             (#peak    89 #SUP  0.92  #QF  0.86)
 &rst
  ixpk= 89, nxpk= 0, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 122, 123, 124,
 &end
#
#   5 LYS  H       6 ILE  QD1     5.50             (#peak    90 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 90, nxpk= 0, iat=  68,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 103, 104, 105,
 &end
#
#   2 LEU  H       2 LEU  QD1     5.10             (#peak    91 #SUP  0.95  #QF  0.62)
 &rst
  ixpk= 91, nxpk= 0, iat=  11,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr2=  20,  21,  22,
 &end
#
#   2 LEU  H       2 LEU  QD2     5.10             (#peak    91 #SUP  0.95  #QF  0.62)
 &rst
  ixpk= 91, nxpk= 0, iat=  11,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr2=  24,  25,  26,
 &end
#
#  18 LYS  QG     19 GLY  H       4.91             (#peak    94 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 94, nxpk= 0, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 289, 290,
 &end
#
#  18 LYS  HB3    19 GLY  H       4.00             (#peak    95 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 95, nxpk= 0, iat= 287, 304, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  19 GLY  H      22 LYS  HB2     5.22             (#peak    96 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 96, nxpk= 0, iat= 304, 348, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
#  19 GLY  H      22 LYS  QD      5.32             (#peak    97 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 97, nxpk= 0, iat= 304,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2= 354, 355,
 &end
#
#  18 LYS  HB2    19 GLY  H       4.00             (#peak    98 #SUP  0.95  #QF  0.78)
 &rst
  ixpk= 98, nxpk= 0, iat= 286, 304, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  19 GLY  H      22 LYS  HB3     4.45             (#peak    98 #SUP  0.95  #QF  0.78)
 &rst
  ixpk= 98, nxpk= 0, iat= 304, 349, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#   8 CYSS H       9 ALA  QB      4.49             (#peak    99 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 99, nxpk= 0, iat= 128,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 142, 143, 144,
 &end
#
#   8 CYSS H      11 ALA  QB      4.97             (#peak   100 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 100, nxpk= 0, iat= 128,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2= 171, 172, 173,
 &end
#
#   4 ARG  H       4 ARG  QG      3.26             (#peak   101 #SUP  0.89  #QF  0.50)
 &rst
  ixpk= 101, nxpk= 0, iat=  44,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2=  51,  52,
 &end
#
#   7 LEU  QB      8 CYSS H       3.60             (#peak   101 #SUP  0.89  #QF  0.50)
 &rst
  ixpk= 101, nxpk= 0, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 113, 114,
 &end
#
#   3 PRO  QG      4 ARG  H       4.98             (#peak   102 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 102, nxpk= 0, iat=  -1,  44, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
 igr1=  34,  35,
 &end
#
#   3 PRO  QG      5 LYS  H       5.50             (#peak   103 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 103, nxpk= 0, iat=  -1,  68, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  34,  35,
 &end
#
#  16 LYS  HB2    17 CYSS H       4.75             (#peak   104 #SUP  0.58  #QF  0.58)
 &rst
  ixpk= 104, nxpk= 0, iat= 254, 272, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
#   4 ARG  H       4 ARG  HB2     3.66             (#peak   105 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 105, nxpk= 0, iat=  44,  48, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#   5 LYS  H       5 LYS  HB2     3.76             (#peak   107 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 107, nxpk= 0, iat=  68,  72, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#   4 ARG  H       4 ARG  HB3     3.66             (#peak   108 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 108, nxpk= 0, iat=  44,  49, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#   5 LYS  H       5 LYS  HB3     3.76             (#peak   109 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 109, nxpk= 0, iat=  68,  73, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#   4 ARG  QG      5 LYS  H       5.02             (#peak   110 #SUP  1.00  #QF  0.91)
 &rst
  ixpk= 110, nxpk= 0, iat=  -1,  68, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1=  51,  52,
 &end
#
#   5 LYS  H       5 LYS  QD      5.49             (#peak   110 #SUP  1.00  #QF  0.91)
 &rst
  ixpk= 110, nxpk= 0, iat=  68,  -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr2=  78,  79,
 &end
#
#  16 LYS  HB3    17 CYSS H       4.44             (#peak   111 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 111, nxpk= 0, iat= 255, 272, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#   5 LYS  H       5 LYS  QG      4.35             (#peak   112 #SUP  1.00)
 &rst
  ixpk= 112, nxpk= 0, iat=  68,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2=  75,  76,
 &end
#
#  11 ALA  QB     17 CYSS H       5.25             (#peak   113 #SUP  0.96  #QF  0.91)
 &rst
  ixpk= 113, nxpk= 0, iat=  -1, 272, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 171, 172, 173,
 &end
#
#  17 CYSS H      18 LYS  QG      4.66             (#peak   114 #SUP  0.41  #QF  0.41)
 &rst
  ixpk= 114, nxpk= 0, iat= 272,  -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr2= 289, 290,
 &end
#
#   2 LEU  H       2 LEU  HG      3.96             (#peak   115 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 115, nxpk= 0, iat=  11,  18, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#   2 LEU  H       2 LEU  HB2     4.16             (#peak   116 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 116, nxpk= 0, iat=  11,  15, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#   2 LEU  H       2 LEU  HB3     4.16             (#peak   117 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 117, nxpk= 0, iat=  11,  16, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  14 LYS  HB3    16 LYS  H       5.02             (#peak   118 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 118, nxpk= 0, iat= 226, 250, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#  16 LYS  H      16 LYS  HB3     3.50             (#peak   119 #SUP  0.79  #QF  0.79)
 &rst
  ixpk= 119, nxpk= 0, iat= 250, 255, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  16 LYS  H      16 LYS  HB2     4.07             (#peak   120 #SUP  0.69  #QF  0.69)
 &rst
  ixpk= 120, nxpk= 0, iat= 250, 254, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  14 LYS  HB2    16 LYS  H       5.02             (#peak   121 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 121, nxpk= 0, iat= 225, 250, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#  24 VAL  HB     25 CYSS H       3.47             (#peak   122 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 122, nxpk= 0, iat= 389, 401, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
#  21 LEU  HB3    25 CYSS H       5.50             (#peak   123 #SUP  0.40  #QF  0.40)
 &rst
  ixpk= 123, nxpk= 0, iat= 330, 401, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  23 LEU  HB3    25 CYSS H       5.50             (#peak   124 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 124, nxpk= 0, iat= 371, 401, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  25 CYSS H      26 LYS  QG      5.50             (#peak   125 #SUP  0.53  #QF  0.53)
 &rst
  ixpk= 125, nxpk= 0, iat= 401,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 418, 419,
 &end
#
#  11 ALA  QB     16 LYS  H       4.67             (#peak   126 #SUP  0.94  #QF  0.91)
 &rst
  ixpk= 126, nxpk= 0, iat=  -1, 250, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 171, 172, 173,
 &end
#
#  16 LYS  H      16 LYS  HG2     5.06             (#peak   126 #SUP  0.94  #QF  0.91)
 &rst
  ixpk= 126, nxpk= 0, iat= 250, 257, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
#  16 LYS  H      16 LYS  HG3     5.06             (#peak   127 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 127, nxpk= 0, iat= 250, 258, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
#  24 VAL  QG2    25 CYSS H       4.00             (#peak   128 #SUP  1.00)
 &rst
  ixpk= 128, nxpk= 0, iat=  -1, 401, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 395, 396, 397,
 &end
#
#  21 LEU  QD1    25 CYSS H       5.50             (#peak   129 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 129, nxpk= 0, iat=  -1, 401, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 334, 335, 336,
 &end
#
#  24 VAL  QG1    25 CYSS H       3.74             (#peak   130 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 130, nxpk= 0, iat=  -1, 401, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 391, 392, 393,
 &end
#
#  21 LEU  QD2    25 CYSS H       5.50             (#peak   131 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 131, nxpk= 0, iat=  -1, 401, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 338, 339, 340,
 &end
#
#   9 ALA  QB     10 ILE  H       3.13             (#peak   133 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 133, nxpk= 0, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr1= 142, 143, 144,
 &end
#
#  10 ILE  H      11 ALA  QB      4.70             (#peak   135 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 135, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2= 171, 172, 173,
 &end
#
#  11 ALA  QB     12 LYS  H       3.26             (#peak   136 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 136, nxpk= 0, iat=  -1, 177, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr1= 171, 172, 173,
 &end
#
#   6 ILE  QG2     7 LEU  H       3.75             (#peak   138 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 138, nxpk= 0, iat=  -1, 109, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1=  96,  97,  98,
 &end
#
#   7 LEU  H       7 LEU  QD1     4.50             (#peak   139 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 139, nxpk= 0, iat= 109,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 118, 119, 120,
 &end
#
#  10 ILE  H      10 ILE  QG2     3.87             (#peak   140 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 140, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2= 154, 155, 156,
 &end
#
#   7 LEU  H       7 LEU  QD2     4.50             (#peak   141 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 141, nxpk= 0, iat= 109,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 122, 123, 124,
 &end
#
#  10 ILE  H      10 ILE  QD1     3.92             (#peak   142 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 142, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2= 161, 162, 163,
 &end
#
#  24 VAL  QG1    26 LYS  H       5.50             (#peak   146 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 146, nxpk= 0, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 391, 392, 393,
 &end
#
#  10 ILE  QG2    11 ALA  H       3.54             (#peak   147 #SUP  1.00)
 &rst
  ixpk= 147, nxpk= 0, iat=  -1, 167, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr1= 154, 155, 156,
 &end
#
#  10 ILE  QD1    11 ALA  H       4.78             (#peak   148 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 148, nxpk= 0, iat=  -1, 167, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 161, 162, 163,
 &end
#
#  10 ILE  HB     11 ALA  H       3.25             (#peak   149 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 149, nxpk= 0, iat= 152, 167, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
#  13 LYS  QB     14 LYS  H       3.29             (#peak   150 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 150, nxpk= 0, iat=  -1, 221, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
 igr1= 203, 204,
 &end
#
#  14 LYS  H      14 LYS  QG      4.01             (#peak   152 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 152, nxpk= 0, iat= 221,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2= 228, 229,
 &end
#
#  24 VAL  HB     26 LYS  H       5.50             (#peak   154 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 154, nxpk= 0, iat= 389, 411, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  11 ALA  QB     15 GLY  H       5.14             (#peak   155 #SUP  0.53  #QF  0.53)
 &rst
  ixpk= 155, nxpk= 0, iat=  -1, 243, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 171, 172, 173,
 &end
#
#  11 ALA  QB     13 LYS  H       4.62             (#peak   156 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 156, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 171, 172, 173,
 &end
#
#  14 LYS  HB2    15 GLY  H       4.78             (#peak   157 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 157, nxpk= 0, iat= 225, 243, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
#  14 LYS  HB3    15 GLY  H       4.78             (#peak   158 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 158, nxpk= 0, iat= 226, 243, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
#  14 LYS  HD2    15 GLY  H       5.50             (#peak   159 #SUP  0.72  #QF  0.72)
 &rst
  ixpk= 159, nxpk= 0, iat= 231, 243, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  14 LYS  HD3    15 GLY  H       5.50             (#peak   160 #SUP  0.95  #QF  0.65)
 &rst
  ixpk= 160, nxpk= 0, iat= 232, 243, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  15 GLY  H      16 LYS  HB3     5.50             (#peak   160 #SUP  0.95  #QF  0.65)
 &rst
  ixpk= 160, nxpk= 0, iat= 243, 255, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  14 LYS  QG     15 GLY  H       5.50             (#peak   161 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 161, nxpk= 0, iat=  -1, 243, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 228, 229,
 &end
#
#  13 LYS  H      13 LYS  QD      4.84             (#peak   162 #SUP  0.41  #QF  0.41)
 &rst
  ixpk= 162, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 209, 210,
 &end
#
#  10 ILE  QG2    13 LYS  H       5.12             (#peak   164 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 164, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1= 154, 155, 156,
 &end
#
#   9 ALA  H      10 ILE  QD1     5.36             (#peak   165 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 165, nxpk= 0, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr2= 161, 162, 163,
 &end
#
#   6 ILE  QG2     9 ALA  H       4.64             (#peak   166 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 166, nxpk= 0, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1=  96,  97,  98,
 &end
#
#   9 ALA  H      10 ILE  HG13    5.50             (#peak   167 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 167, nxpk= 0, iat= 138, 159, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   9 ALA  H      11 ALA  QB      5.14             (#peak   168 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 168, nxpk= 0, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 171, 172, 173,
 &end
#
#   7 LEU  QB      9 ALA  H       5.15             (#peak   169 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 169, nxpk= 0, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 113, 114,
 &end
#
#   9 ALA  H      10 ILE  HG12    5.50             (#peak   170 #SUP  1.00)
 &rst
  ixpk= 170, nxpk= 0, iat= 138, 158, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   9 ALA  H      10 ILE  HB      5.22             (#peak   171 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 171, nxpk= 0, iat= 138, 152, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
#  18 LYS  H      21 LEU  HB3     3.88             (#peak   173 #SUP  0.81  #QF  0.81)
 &rst
  ixpk= 173, nxpk= 0, iat= 282, 330, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
#  18 LYS  H      21 LEU  HG      5.50             (#peak   174 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 174, nxpk= 0, iat= 282, 332, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  26 LYS  QD     27 CYSS H       4.44             (#peak   175 #SUP  0.98  #QF  0.97)
 &rst
  ixpk= 175, nxpk= 0, iat=  -1, 433, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 421, 422,
 &end
#
#  18 LYS  H      21 LEU  HB2     4.16             (#peak   176 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 176, nxpk= 0, iat= 282, 329, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  22 LYS  QD     27 CYSS H       4.76             (#peak   177 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 177, nxpk= 0, iat=  -1, 433, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 354, 355,
 &end
#
#  26 LYS  QG     27 CYSS H       4.31             (#peak   178 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 178, nxpk= 0, iat=  -1, 433, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 418, 419,
 &end
#
#  22 LYS  QG     27 CYSS H       5.09             (#peak   179 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 179, nxpk= 0, iat=  -1, 433, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 351, 352,
 &end
#
#  18 LYS  H      18 LYS  QG      4.21             (#peak   180 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 180, nxpk= 0, iat= 282,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 289, 290,
 &end
#
#  18 LYS  H      21 LEU  QD1     5.12             (#peak   181 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 181, nxpk= 0, iat= 282,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr2= 334, 335, 336,
 &end
#
#  18 LYS  H      21 LEU  QD2     5.12             (#peak   182 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 182, nxpk= 0, iat= 282,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr2= 338, 339, 340,
 &end
#
#  21 LEU  H      24 VAL  QG2     4.93             (#peak   183 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 183, nxpk= 0, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr2= 395, 396, 397,
 &end
#
#  22 LYS  H      24 VAL  QG2     5.09             (#peak   184 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 184, nxpk= 0, iat= 344,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2= 395, 396, 397,
 &end
#
#  21 LEU  H      21 LEU  QD1     4.36             (#peak   185 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 185, nxpk= 0, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 334, 335, 336,
 &end
#
#  21 LEU  QD1    22 LYS  H       5.09             (#peak   186 #SUP  0.69  #QF  0.69)
 &rst
  ixpk= 186, nxpk= 0, iat=  -1, 344, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 334, 335, 336,
 &end
#
#  21 LEU  H      21 LEU  QD2     4.36             (#peak   187 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 187, nxpk= 0, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 338, 339, 340,
 &end
#
#  21 LEU  QD2    22 LYS  H       5.09             (#peak   188 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 188, nxpk= 0, iat=  -1, 344, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 338, 339, 340,
 &end
#
#  22 LYS  H      22 LYS  QG      4.36             (#peak   189 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 189, nxpk= 0, iat= 344,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr2= 351, 352,
 &end
#
#  21 LEU  H      21 LEU  HB2     3.60             (#peak   190 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 190, nxpk= 0, iat= 325, 329, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  22 LYS  H      22 LYS  HB2     3.29             (#peak   191 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 191, nxpk= 0, iat= 344, 348, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#  21 LEU  H      21 LEU  HB3     3.19             (#peak   192 #SUP  0.74  #QF  0.74)
 &rst
  ixpk= 192, nxpk= 0, iat= 325, 330, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,  &end
#
#  22 LYS  H      22 LYS  HB3     3.35             (#peak   194 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 194, nxpk= 0, iat= 344, 349, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#  21 LEU  HB3    22 LYS  H       4.31             (#peak   195 #SUP  0.49  #QF  0.49)
 &rst
  ixpk= 195, nxpk= 0, iat= 330, 344, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  20 PRO  HG2    21 LEU  H       4.80             (#peak   196 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 196, nxpk= 0, iat= 315, 325, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   3 PRO  QG      6 ILE  H       4.74             (#peak   198 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 198, nxpk= 0, iat=  -1,  90, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1=  34,  35,
 &end
#
#   6 ILE  H       6 ILE  HB      3.21             (#peak   199 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 199, nxpk= 0, iat=  90,  94, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#   5 LYS  HB2     6 ILE  H       4.73             (#peak   200 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 200, nxpk= 0, iat=  72,  90, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
#  22 LYS  HB3    23 LEU  H       3.82             (#peak   201 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 201, nxpk= 0, iat= 349, 366, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#  23 LEU  H      23 LEU  HB2     3.02             (#peak   202 #SUP  0.70  #QF  0.70)
 &rst
  ixpk= 202, nxpk= 0, iat= 366, 370, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,  &end
#
#  24 VAL  H      24 VAL  HB      3.26             (#peak   203 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 203, nxpk= 0, iat= 385, 389, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
#   4 ARG  QG      4 ARG  HE      4.17             (#peak   204 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 204, nxpk= 0, iat=  -1,  57, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr1=  51,  52,
 &end
#
#  23 LEU  H      23 LEU  HB3     3.12             (#peak   205 #SUP  0.80  #QF  0.72)
 &rst
  ixpk= 205, nxpk= 0, iat= 366, 371, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  23 LEU  HB3    24 VAL  H       3.50             (#peak   205 #SUP  0.80  #QF  0.72)
 &rst
  ixpk= 205, nxpk= 0, iat= 371, 385, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  22 LYS  HB2    23 LEU  H       4.13             (#peak   206 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 206, nxpk= 0, iat= 348, 366, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#   5 LYS  HB3     6 ILE  H       4.73             (#peak   207 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 207, nxpk= 0, iat=  73,  90, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
#   5 LYS  QD      6 ILE  H       4.89             (#peak   208 #SUP  0.86  #QF  0.30)
 &rst
  ixpk= 208, nxpk= 0, iat=  -1,  90, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1=  78,  79,
 &end
#
#   6 ILE  H       7 LEU  QB      5.16             (#peak   208 #SUP  0.86  #QF  0.30)
 &rst
  ixpk= 208, nxpk= 0, iat=  90,  -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr2= 113, 114,
 &end
#
#   6 ILE  H       6 ILE  HG12    4.00             (#peak   209 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 209, nxpk= 0, iat=  90, 100, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  20 PRO  HG3    21 LEU  H       4.80             (#peak   210 #SUP  0.74  #QF  0.74)
 &rst
  ixpk= 210, nxpk= 0, iat= 316, 325, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   5 LYS  QG      6 ILE  H       5.31             (#peak   211 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 211, nxpk= 0, iat=  -1,  90, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr1=  75,  76,
 &end
#
#   6 ILE  H       6 ILE  HG13    4.00             (#peak   213 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 213, nxpk= 0, iat=  90, 101, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  22 LYS  QG     23 LEU  H       5.17             (#peak   214 #SUP  0.82  #QF  0.82)
 &rst
  ixpk= 214, nxpk= 0, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 351, 352,
 &end
#
#  22 LYS  QD     23 LEU  H       5.23             (#peak   215 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 215, nxpk= 0, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 354, 355,
 &end
#
#  24 VAL  H      24 VAL  QG2     2.84             (#peak   216 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 216, nxpk= 0, iat= 385,  -1, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,
 igr2= 395, 396, 397,
 &end
#
#  24 VAL  H      24 VAL  QG1     3.93             (#peak   217 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 217, nxpk= 0, iat= 385,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 391, 392, 393,
 &end
#
#   6 ILE  H       6 ILE  QD1     4.37             (#peak   219 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 219, nxpk= 0, iat=  90,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 103, 104, 105,
 &end
#
#   6 ILE  H       6 ILE  QG2     3.87             (#peak   220 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 220, nxpk= 0, iat=  90,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2=  96,  97,  98,
 &end
#
#   4 ARG  HE     24 VAL  QG1     4.90             (#peak   221 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 221, nxpk= 0, iat=  57,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 391, 392, 393,
 &end
#
#  10 ILE  QG2    16 LYS  H       5.50             (#peak   222 #SUP  0.48  #QF  0.48)
 &rst
  ixpk= 222, nxpk= 0, iat=  -1, 250, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 154, 155, 156,
 &end
#
#   2 LEU  H       3 PRO  HD2     5.36             (#peak   225 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 225, nxpk= 0, iat=  11,  31, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#   3 PRO  HD2     4 ARG  H       5.50             (#peak   226 #SUP  0.82  #QF  0.82)
 &rst
  ixpk= 226, nxpk= 0, iat=  31,  44, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  17 CYSS H      27 CYSS HB2     5.50             (#peak   227 #SUP  0.76  #QF  0.76)
 &rst
  ixpk= 227, nxpk= 0, iat= 272, 437, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  17 CYSS H      27 CYSS HB3     5.50             (#peak   228 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 228, nxpk= 0, iat= 272, 438, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   5 LYS  H       5 LYS  QE      5.50             (#peak   229 #SUP  0.67  #QF  0.53)
 &rst
  ixpk= 229, nxpk= 0, iat=  68,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  81,  82,
 &end
#
#  16 LYS  QE     17 CYSS H       5.50             (#peak   229 #SUP  0.67  #QF  0.53)
 &rst
  ixpk= 229, nxpk= 0, iat=  -1, 272, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 263, 264,
 &end
#
#   8 CYSS H       8 CYSS HB3     3.59             (#peak   230 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 230, nxpk= 0, iat= 128, 133, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#   4 ARG  H       4 ARG  QD      4.70             (#peak   231 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 231, nxpk= 0, iat=  44,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2=  54,  55,
 &end
#
#  16 LYS  H      17 CYSS HB3     5.50             (#peak   232 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 232, nxpk= 0, iat= 250, 277, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  16 LYS  H      17 CYSS HB2     5.19             (#peak   233 #SUP  0.82  #QF  0.82)
 &rst
  ixpk= 233, nxpk= 0, iat= 250, 276, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
#  12 LYS  H      17 CYSS HB2     5.04             (#peak   234 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 234, nxpk= 0, iat= 177, 276, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
#  17 CYSS HB2    18 LYS  H       4.43             (#peak   235 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 235, nxpk= 0, iat= 276, 282, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#   7 LEU  H       8 CYSS HB2     5.31             (#peak   236 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 236, nxpk= 0, iat= 109, 132, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
#   3 PRO  HD2     7 LEU  H       5.25             (#peak   237 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 237, nxpk= 0, iat=  31, 109, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
#  12 LYS  H      17 CYSS HB3     5.50             (#peak   238 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 238, nxpk= 0, iat= 177, 277, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  25 CYSS HB3    26 LYS  H       4.15             (#peak   239 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 239, nxpk= 0, iat= 406, 411, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  25 CYSS H      25 CYSS HB2     3.80             (#peak   240 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 240, nxpk= 0, iat= 401, 405, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  25 CYSS HB2    26 LYS  H       4.13             (#peak   241 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 241, nxpk= 0, iat= 405, 411, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  12 LYS  QE     13 LYS  H       5.50             (#peak   242 #SUP  0.76  #QF  0.43)
 &rst
  ixpk= 242, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 190, 191,
 &end
#
#  13 LYS  H      13 LYS  QE      5.50             (#peak   242 #SUP  0.76  #QF  0.43)
 &rst
  ixpk= 242, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 212, 213,
 &end
#
#   8 CYSS HB3     9 ALA  H       4.14             (#peak   243 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 243, nxpk= 0, iat= 133, 138, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#   8 CYSS HB2     9 ALA  H       4.11             (#peak   244 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 244, nxpk= 0, iat= 132, 138, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  25 CYSS HB3    27 CYSS H       5.36             (#peak   245 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 245, nxpk= 0, iat= 406, 433, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#  17 CYSS HB3    18 LYS  H       4.35             (#peak   246 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 246, nxpk= 0, iat= 277, 282, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#  24 VAL  H      25 CYSS HB3     5.15             (#peak   249 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 249, nxpk= 0, iat= 385, 406, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
#  24 VAL  H      25 CYSS HB2     5.50             (#peak   250 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 250, nxpk= 0, iat= 385, 405, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  26 LYS  QE     27 CYSS H       5.21             (#peak   251 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 251, nxpk= 0, iat=  -1, 433, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 424, 425,
 &end
#
#   3 PRO  HD2     6 ILE  H       5.12             (#peak   252 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 252, nxpk= 0, iat=  31,  90, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
#  17 CYSS HB3    22 LYS  H       5.50             (#peak   253 #SUP  0.49  #QF  0.49)
 &rst
  ixpk= 253, nxpk= 0, iat= 277, 344, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  18 LYS  HA     19 GLY  H       2.99             (#peak   255 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 255, nxpk= 0, iat= 284, 304, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
#  16 LYS  HA     17 CYSS H       3.35             (#peak   256 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 256, nxpk= 0, iat= 252, 272, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#   8 CYSS H       9 ALA  HA      5.50             (#peak   257 #SUP  0.47  #QF  0.47)
 &rst
  ixpk= 257, nxpk= 0, iat= 128, 140, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  15 GLY  HA2    17 CYSS H       5.32             (#peak   258 #SUP  0.36  #QF  0.36)
 &rst
  ixpk= 258, nxpk= 0, iat= 245, 272, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
#   2 LEU  H       3 PRO  HD3     5.09             (#peak   260 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 260, nxpk= 0, iat=  11,  32, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
#  11 ALA  HA     16 LYS  H       4.21             (#peak   262 #SUP  0.97  #QF  0.22)
 &rst
  ixpk= 262, nxpk= 0, iat= 169, 250, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  13 LYS  HA     15 GLY  H       5.12             (#peak   265 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 265, nxpk= 0, iat= 201, 243, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
#  14 LYS  HA     16 LYS  H       4.81             (#peak   266 #SUP  0.73  #QF  0.73)
 &rst
  ixpk= 266, nxpk= 0, iat= 223, 250, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#  21 LEU  HA     25 CYSS H       4.29             (#peak   267 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 267, nxpk= 0, iat= 327, 401, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  23 LEU  HA     25 CYSS H       4.70             (#peak   269 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 269, nxpk= 0, iat= 368, 401, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#   8 CYSS HA     10 ILE  H       5.02             (#peak   270 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 270, nxpk= 0, iat= 130, 148, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#  10 ILE  H      11 ALA  HA      5.50             (#peak   272 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 272, nxpk= 0, iat= 148, 169, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   8 CYSS HA     12 LYS  H       5.03             (#peak   275 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 275, nxpk= 0, iat= 130, 177, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
#   8 CYSS HA     11 ALA  H       3.87             (#peak   276 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 276, nxpk= 0, iat= 130, 167, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
#   3 PRO  HA      7 LEU  H       5.50             (#peak   277 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 277, nxpk= 0, iat=  40, 109, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  26 LYS  H      27 CYSS HA      5.50             (#peak   278 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 278, nxpk= 0, iat= 411, 435, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  23 LEU  HA     26 LYS  H       5.50             (#peak   279 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 279, nxpk= 0, iat= 368, 411, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  11 ALA  HA     14 LYS  H       4.86             (#peak   281 #SUP  0.94  #QF  0.93)
 &rst
  ixpk= 281, nxpk= 0, iat= 169, 221, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
#  14 LYS  H      15 GLY  HA2     4.90             (#peak   282 #SUP  0.62  #QF  0.62)
 &rst
  ixpk= 282, nxpk= 0, iat= 221, 245, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
#   7 LEU  HA     11 ALA  H       4.53             (#peak   283 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 283, nxpk= 0, iat= 111, 167, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  10 ILE  HA     14 LYS  H       5.30             (#peak   285 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 285, nxpk= 0, iat= 150, 221, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#  22 LYS  HA     26 LYS  H       5.01             (#peak   287 #SUP  0.99  #QF  0.81)
 &rst
  ixpk= 287, nxpk= 0, iat= 346, 411, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
#  11 ALA  HA     13 LYS  H       4.82             (#peak   289 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 289, nxpk= 0, iat= 169, 199, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#  10 ILE  HA     13 LYS  H       3.83             (#peak   290 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 290, nxpk= 0, iat= 150, 199, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  13 LYS  H      14 LYS  HA      5.50             (#peak   291 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 291, nxpk= 0, iat= 199, 223, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  15 GLY  H      16 LYS  HA      5.50             (#peak   292 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 292, nxpk= 0, iat= 243, 252, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  14 LYS  HA     15 GLY  H       3.57             (#peak   293 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 293, nxpk= 0, iat= 223, 243, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#   6 ILE  HA      9 ALA  H       3.84             (#peak   294 #SUP  0.77  #QF  0.77)
 &rst
  ixpk= 294, nxpk= 0, iat=  92, 138, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#   4 ARG  HA      7 LEU  H       3.59             (#peak   295 #SUP  0.81  #QF  0.35)
 &rst
  ixpk= 295, nxpk= 0, iat=  46, 109, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#   7 LEU  HA      9 ALA  H       4.55             (#peak   296 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 296, nxpk= 0, iat= 111, 138, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#   9 ALA  H      10 ILE  HA      5.32             (#peak   297 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 297, nxpk= 0, iat= 138, 150, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
#  17 CYSS HA     18 LYS  H       2.80             (#peak   299 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 299, nxpk= 0, iat= 274, 282, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  26 LYS  HA     27 CYSS H       2.97             (#peak   300 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 300, nxpk= 0, iat= 413, 433, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47,  &end
#
#  22 LYS  HA     27 CYSS H       3.54             (#peak   301 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 301, nxpk= 0, iat= 346, 433, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#  20 PRO  HD2    21 LEU  H       4.15             (#peak   302 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 302, nxpk= 0, iat= 312, 325, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  20 PRO  HD3    21 LEU  H       4.15             (#peak   303 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 303, nxpk= 0, iat= 313, 325, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  19 GLY  HA3    22 LYS  H       5.27             (#peak   304 #SUP  0.57  #QF  0.57)
 &rst
  ixpk= 304, nxpk= 0, iat= 307, 344, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
#  19 GLY  HA2    22 LYS  H       5.27             (#peak   307 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 307, nxpk= 0, iat= 306, 344, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
#  20 PRO  HA     22 LYS  H       4.66             (#peak   309 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 309, nxpk= 0, iat= 321, 344, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#  18 LYS  HA     22 LYS  H       4.66             (#peak   310 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 310, nxpk= 0, iat= 284, 344, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#   3 PRO  HA      6 ILE  H       5.40             (#peak   311 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 311, nxpk= 0, iat=  40,  90, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
#  21 LEU  HA     24 VAL  H       3.57             (#peak   313 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 313, nxpk= 0, iat= 327, 385, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#  20 PRO  HA     23 LEU  H       4.13             (#peak   315 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 315, nxpk= 0, iat= 321, 366, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  18 LYS  HA     23 LEU  H       5.50             (#peak   316 #SUP  0.77  #QF  0.77)
 &rst
  ixpk= 316, nxpk= 0, iat= 284, 366, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   6 ILE  H       9 ALA  H       5.47             (#peak   317 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 317, nxpk= 0, iat=  90, 138, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
#  23 LEU  H      27 CYSS H       5.50             (#peak   318 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 318, nxpk= 0, iat= 366, 433, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  21 LEU  H      23 LEU  H       5.48             (#peak   319 #SUP  1.00  #QF  0.89)
 &rst
  ixpk= 319, nxpk= 0, iat= 325, 366, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
#  21 LEU  H      24 VAL  H       5.50             (#peak   319 #SUP  1.00  #QF  0.89)
 &rst
  ixpk= 319, nxpk= 0, iat= 325, 385, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   2 LEU  HA      3 PRO  HD3     3.09             (#peak   320 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 320, nxpk= 0, iat=  13,  32, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
#   1 GLY  QA      2 LEU  HA      4.84             (#peak   321 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 321, nxpk= 0, iat=  -1,  13, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1=   6,   7,
 &end
#
#   2 LEU  HA      3 PRO  HD2     3.35             (#peak   322 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 322, nxpk= 0, iat=  13,  31, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#   2 LEU  HA      3 PRO  QG      4.51             (#peak   323 #SUP  1.00)
 &rst
  ixpk= 323, nxpk= 0, iat=  13,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2=  34,  35,
 &end
#
#   2 LEU  HA      6 ILE  HB      5.35             (#peak   324 #SUP  0.47  #QF  0.47)
 &rst
  ixpk= 324, nxpk= 0, iat=  13,  94, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#   7 LEU  HA      8 CYSS HA      5.50             (#peak   329 #SUP  0.64  #QF  0.32)
 &rst
  ixpk= 329, nxpk= 0, iat= 111, 130, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  18 LYS  HA     22 LYS  HA      5.50             (#peak   329 #SUP  0.64  #QF  0.32)
 &rst
  ixpk= 329, nxpk= 0, iat= 284, 346, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   3 PRO  HA      4 ARG  HA      5.29             (#peak   330 #SUP  0.90  #QF  0.52)
 &rst
  ixpk= 330, nxpk= 0, iat=  40,  46, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
#  15 GLY  HA3    16 LYS  HA      5.46             (#peak   333 #SUP  0.69  #QF  0.69)
 &rst
  ixpk= 333, nxpk= 0, iat= 246, 252, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
#  12 LYS  HA     17 CYSS HB3     5.14             (#peak   338 #SUP  0.93  #QF  0.61)
 &rst
  ixpk= 338, nxpk= 0, iat= 179, 277, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#  17 CYSS HB3    22 LYS  HA      5.44             (#peak   338 #SUP  0.93  #QF  0.61)
 &rst
  ixpk= 338, nxpk= 0, iat= 277, 346, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,  &end
#
#  22 LYS  HA     27 CYSS HB2     3.98             (#peak   340 #SUP  0.81  #QF  0.81)
 &rst
  ixpk= 340, nxpk= 0, iat= 346, 437, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  22 LYS  HA     27 CYSS HB3     3.98             (#peak   341 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 341, nxpk= 0, iat= 346, 438, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  17 CYSS HB3    27 CYSS HB2     4.46             (#peak   344 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 344, nxpk= 0, iat= 277, 437, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
#  17 CYSS HB3    27 CYSS HB3     4.46             (#peak   345 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 345, nxpk= 0, iat= 277, 438, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
#   4 ARG  HA      4 ARG  QD      4.10             (#peak   347 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 347, nxpk= 0, iat=  46,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr2=  54,  55,
 &end
#
#   5 LYS  HA      8 CYSS HB3     4.27             (#peak   349 #SUP  0.63  #QF  0.63)
 &rst
  ixpk= 349, nxpk= 0, iat=  70, 133, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#   8 CYSS HB3     9 ALA  HA      5.07             (#peak   350 #SUP  0.52  #QF  0.52)
 &rst
  ixpk= 350, nxpk= 0, iat= 133, 140, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
#   9 ALA  HA     12 LYS  QE      5.50             (#peak   351 #SUP  0.41  #QF  0.41)
 &rst
  ixpk= 351, nxpk= 0, iat= 140,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 190, 191,
 &end
#
#   8 CYSS HA     12 LYS  QE      4.46             (#peak   354 #SUP  0.47  #QF  0.47)
 &rst
  ixpk= 354, nxpk= 0, iat= 130,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 190, 191,
 &end
#
#  12 LYS  HA     17 CYSS HB2     4.97             (#peak   360 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 360, nxpk= 0, iat= 179, 276, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
#  17 CYSS HB2    27 CYSS HB2     5.50             (#peak   363 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 363, nxpk= 0, iat= 276, 437, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  17 CYSS HB2    27 CYSS HB3     5.50             (#peak   364 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 364, nxpk= 0, iat= 276, 438, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   5 LYS  HA      8 CYSS HB2     4.29             (#peak   365 #SUP  0.74  #QF  0.74)
 &rst
  ixpk= 365, nxpk= 0, iat=  70, 132, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  21 LEU  HA     24 VAL  HB      3.70             (#peak   370 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 370, nxpk= 0, iat= 327, 389, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#   3 PRO  HD2     6 ILE  HB      3.86             (#peak   376 #SUP  0.57  #QF  0.57)
 &rst
  ixpk= 376, nxpk= 0, iat=  31,  94, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  10 ILE  HA     13 LYS  QB      3.72             (#peak   377 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 377, nxpk= 0, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2= 203, 204,
 &end
#
#  10 ILE  HA     10 ILE  HG12    4.01             (#peak   380 #SUP  1.00)
 &rst
  ixpk= 380, nxpk= 0, iat= 150, 158, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  10 ILE  HA     13 LYS  QD      4.55             (#peak   381 #SUP  0.43  #QF  0.43)
 &rst
  ixpk= 381, nxpk= 0, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
 igr2= 209, 210,
 &end
#
#   9 ALA  QB     10 ILE  HA      4.35             (#peak   382 #SUP  0.94  #QF  0.92)
 &rst
  ixpk= 382, nxpk= 0, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 142, 143, 144,
 &end
#
#  10 ILE  HA     10 ILE  HG13    4.01             (#peak   383 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 383, nxpk= 0, iat= 150, 159, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  10 ILE  HA     10 ILE  QG2     3.11             (#peak   384 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 384, nxpk= 0, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr2= 154, 155, 156,
 &end
#
#  10 ILE  HA     10 ILE  QD1     4.01             (#peak   385 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 385, nxpk= 0, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 161, 162, 163,
 &end
#
#  22 LYS  HA     22 LYS  QG      4.22             (#peak   386 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 386, nxpk= 0, iat= 346,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr2= 351, 352,
 &end
#
#   6 ILE  HA      6 ILE  HG13    4.11             (#peak   387 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 387, nxpk= 0, iat=  92, 101, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  11 ALA  HA     16 LYS  HB2     5.50             (#peak   388 #SUP  0.97  #QF  0.95)
 &rst
  ixpk= 388, nxpk= 0, iat= 169, 254, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  15 GLY  HA2    16 LYS  HB2     5.50             (#peak   388 #SUP  0.97  #QF  0.95)
 &rst
  ixpk= 388, nxpk= 0, iat= 245, 254, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  11 ALA  HA     16 LYS  HB3     4.29             (#peak   391 #SUP  0.58  #QF  0.58)
 &rst
  ixpk= 391, nxpk= 0, iat= 169, 255, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#   6 ILE  HA      6 ILE  HG12    4.11             (#peak   395 #SUP  0.93  #QF  0.74)
 &rst
  ixpk= 395, nxpk= 0, iat=  92, 100, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#   6 ILE  HA      9 ALA  QB      4.13             (#peak   395 #SUP  0.93  #QF  0.74)
 &rst
  ixpk= 395, nxpk= 0, iat=  92,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 142, 143, 144,
 &end
#
#   4 ARG  HA      4 ARG  QG      3.43             (#peak   399 #SUP  0.83  #QF  0.78)
 &rst
  ixpk= 399, nxpk= 0, iat=  46,  -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr2=  51,  52,
 &end
#
#   4 ARG  HA      7 LEU  QB      3.53             (#peak   399 #SUP  0.83  #QF  0.78)
 &rst
  ixpk= 399, nxpk= 0, iat=  46,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 113, 114,
 &end
#
#   4 ARG  HA      7 LEU  HG      5.02             (#peak   400 #SUP  0.71  #QF  0.33)
 &rst
  ixpk= 400, nxpk= 0, iat=  46, 116, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#   5 LYS  HA      5 LYS  QG      4.19             (#peak   401 #SUP  0.83  #QF  0.54)
 &rst
  ixpk= 401, nxpk= 0, iat=  70,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr2=  75,  76,
 &end
#
#  11 ALA  QB     12 LYS  HA      4.11             (#peak   402 #SUP  0.69  #QF  0.69)
 &rst
  ixpk= 402, nxpk= 0, iat=  -1, 179, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 171, 172, 173,
 &end
#
#  21 LEU  HA     21 LEU  HG      4.06             (#peak   409 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 409, nxpk= 0, iat= 327, 332, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#  13 LYS  HA     13 LYS  QD      4.44             (#peak   410 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 410, nxpk= 0, iat= 201,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2= 209, 210,
 &end
#
#  26 LYS  HA     26 LYS  QG      3.88             (#peak   412 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 412, nxpk= 0, iat= 413,  -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr2= 418, 419,
 &end
#
#  14 LYS  HA     14 LYS  QG      4.00             (#peak   413 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 413, nxpk= 0, iat= 223,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 228, 229,
 &end
#
#  11 ALA  QB     17 CYSS HA      3.63             (#peak   414 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 414, nxpk= 0, iat=  -1, 274, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1= 171, 172, 173,
 &end
#
#  18 LYS  HA     22 LYS  QG      5.32             (#peak   418 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 418, nxpk= 0, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2= 351, 352,
 &end
#
#   8 CYSS HA     11 ALA  QB      3.37             (#peak   419 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 419, nxpk= 0, iat= 130,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2= 171, 172, 173,
 &end
#
#  18 LYS  HA     22 LYS  QD      4.75             (#peak   420 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 420, nxpk= 0, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2= 354, 355,
 &end
#
#  18 LYS  HA     22 LYS  HB3     4.25             (#peak   422 #SUP  0.95  #QF  0.64)
 &rst
  ixpk= 422, nxpk= 0, iat= 284, 349, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  20 PRO  HA     23 LEU  HB2     4.65             (#peak   430 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 430, nxpk= 0, iat= 321, 370, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#  17 CYSS HA     21 LEU  HB3     4.43             (#peak   431 #SUP  0.73  #QF  0.73)
 &rst
  ixpk= 431, nxpk= 0, iat= 274, 330, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#  14 LYS  HA     14 LYS  HD2     4.27             (#peak   433 #SUP  0.58  #QF  0.58)
 &rst
  ixpk= 433, nxpk= 0, iat= 223, 231, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#  14 LYS  HA     14 LYS  HD3     4.27             (#peak   434 #SUP  0.63  #QF  0.63)
 &rst
  ixpk= 434, nxpk= 0, iat= 223, 232, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#  23 LEU  HA     23 LEU  HG      3.87             (#peak   435 #SUP  0.98  #QF  0.94)
 &rst
  ixpk= 435, nxpk= 0, iat= 368, 373, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
#  16 LYS  HB3    17 CYSS HA      5.35             (#peak   436 #SUP  0.87  #QF  0.57)
 &rst
  ixpk= 436, nxpk= 0, iat= 255, 274, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#  17 CYSS HA     21 LEU  HB2     5.50             (#peak   436 #SUP  0.87  #QF  0.57)
 &rst
  ixpk= 436, nxpk= 0, iat= 274, 329, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  20 PRO  HA     23 LEU  HB3     4.44             (#peak   437 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 437, nxpk= 0, iat= 321, 371, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#   2 LEU  HB3     3 PRO  HD2     4.43             (#peak   438 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 438, nxpk= 0, iat=  16,  31, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#   2 LEU  HB2     3 PRO  HD2     4.43             (#peak   439 #SUP  0.88  #QF  0.64)
 &rst
  ixpk= 439, nxpk= 0, iat=  15,  31, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#   4 ARG  QD     24 VAL  HB      4.88             (#peak   440 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 440, nxpk= 0, iat=  -1, 389, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr1=  54,  55,
 &end
#
#  11 ALA  QB     17 CYSS HB2     4.03             (#peak   444 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 444, nxpk= 0, iat=  -1, 276, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 171, 172, 173,
 &end
#
#  12 LYS  QG     17 CYSS HB2     5.50             (#peak   445 #SUP  0.78  #QF  0.78)
 &rst
  ixpk= 445, nxpk= 0, iat=  -1, 276, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 184, 185,
 &end
#
#  17 CYSS HB2    22 LYS  HB2     5.45             (#peak   446 #SUP  0.27  #QF  0.27)
 &rst
  ixpk= 446, nxpk= 0, iat= 276, 348, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
#  10 ILE  QG2    10 ILE  HG13    3.67             (#peak   451 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 451, nxpk= 0, iat=  -1, 159, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 154, 155, 156,
 &end
#
#   6 ILE  QG2     6 ILE  HG13    3.75             (#peak   453 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 453, nxpk= 0, iat=  -1, 101, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1=  96,  97,  98,
 &end
#
#   6 ILE  QG2     6 ILE  QD1     3.31             (#peak   454 #SUP  0.76  #QF  0.58)
 &rst
  ixpk= 454, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr1=  96,  97,  98,
 igr2= 103, 104, 105,
 &end
#
#   6 ILE  QG2    10 ILE  QD1     3.81             (#peak   454 #SUP  0.76  #QF  0.58)
 &rst
  ixpk= 454, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1=  96,  97,  98,
 igr2= 161, 162, 163,
 &end
#
#   5 LYS  QG      6 ILE  QD1     4.31             (#peak   456 #SUP  0.65  #QF  0.65)
 &rst
  ixpk= 456, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1=  75,  76,
 igr2= 103, 104, 105,
 &end
#
#  11 ALA  QB     21 LEU  QD1     3.60             (#peak   457 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 457, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 171, 172, 173,
 igr2= 334, 335, 336,
 &end
#
#  11 ALA  QB     21 LEU  QD2     3.60             (#peak   459 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 459, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 171, 172, 173,
 igr2= 338, 339, 340,
 &end
#
#  10 ILE  QG2    14 LYS  QG      4.51             (#peak   460 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 460, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr1= 154, 155, 156,
 igr2= 228, 229,
 &end
#
#   4 ARG  QG     24 VAL  QG2     4.57             (#peak   461 #SUP  0.81  #QF  0.41)
 &rst
  ixpk= 461, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr1=  51,  52,
 igr2= 395, 396, 397,
 &end
#
#  23 LEU  HB3    24 VAL  QG2     4.81             (#peak   461 #SUP  0.81  #QF  0.41)
 &rst
  ixpk= 461, nxpk= 0, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr2= 395, 396, 397,
 &end
#
#  23 LEU  HB2    24 VAL  QG2     5.50             (#peak   462 #SUP  0.94  #QF  0.69)
 &rst
  ixpk= 462, nxpk= 0, iat= 370,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 395, 396, 397,
 &end
#
#   3 PRO  QG      6 ILE  QD1     4.16             (#peak   465 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 465, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=  34,  35,
 igr2= 103, 104, 105,
 &end
#
#  22 LYS  HB2    22 LYS  QD      3.15             (#peak   476 #SUP  0.84  #QF  0.70)
 &rst
  ixpk= 476, nxpk= 0, iat= 348,  -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
 igr2= 354, 355,
 &end
#
#  10 ILE  HB     10 ILE  QD1     3.39             (#peak   494 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 494, nxpk= 0, iat= 152,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2= 161, 162, 163,
 &end
#
#  21 LEU  HB3    21 LEU  QD1     4.19             (#peak   495 #SUP  0.72  #QF  0.59)
 &rst
  ixpk= 495, nxpk= 0, iat= 330,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 334, 335, 336,
 &end
#
#   6 ILE  QG2     6 ILE  HG12    3.75             (#peak   497 #SUP  0.93  #QF  0.79)
 &rst
  ixpk= 497, nxpk= 0, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1=  96,  97,  98,
 &end
#
#   6 ILE  QG2     9 ALA  QB      3.99             (#peak   497 #SUP  0.93  #QF  0.79)
 &rst
  ixpk= 497, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1=  96,  97,  98,
 igr2= 142, 143, 144,
 &end
#
#   7 LEU  QB      7 LEU  QD2     3.48             (#peak   499 #SUP  0.99  #QF  0.94)
 &rst
  ixpk= 499, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1= 113, 114,
 igr2= 122, 123, 124,
 &end
#
#  10 ILE  QG2    10 ILE  HG12    3.67             (#peak   502 #SUP  0.93  #QF  0.89)
 &rst
  ixpk= 502, nxpk= 0, iat=  -1, 158, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 154, 155, 156,
 &end
#
#   3 PRO  HD2     6 ILE  QG2     4.78             (#peak   503 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 503, nxpk= 0, iat=  31,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2=  96,  97,  98,
 &end
#
#   3 PRO  HD2     6 ILE  QD1     4.14             (#peak   505 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 505, nxpk= 0, iat=  31,  -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr2= 103, 104, 105,
 &end
#
#   4 ARG  QD     24 VAL  QG1     3.77             (#peak   506 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 506, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1=  54,  55,
 igr2= 391, 392, 393,
 &end
#
#   4 ARG  QD     24 VAL  QG2     4.45             (#peak   507 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 507, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=  54,  55,
 igr2= 395, 396, 397,
 &end
#
#  24 VAL  QG1    25 CYSS HB2     4.15             (#peak   508 #SUP  0.28  #QF  0.28)
 &rst
  ixpk= 508, nxpk= 0, iat=  -1, 405, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 391, 392, 393,
 &end
#
#  10 ILE  QG2    14 LYS  QE      3.94             (#peak   509 #SUP  0.56  #QF  0.56)
 &rst
  ixpk= 509, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1= 154, 155, 156,
 igr2= 234, 235,
 &end
#
#  11 ALA  QB     17 CYSS HB3     4.45             (#peak   510 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 510, nxpk= 0, iat=  -1, 277, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 171, 172, 173,
 &end
#
#  10 ILE  QG2    11 ALA  HA      4.07             (#peak   512 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 512, nxpk= 0, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1= 154, 155, 156,
 &end
#
#  24 VAL  HA     24 VAL  QG2     3.17             (#peak   514 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 514, nxpk= 0, iat= 387,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2= 395, 396, 397,
 &end
#
#  24 VAL  HA     24 VAL  QG1     3.05             (#peak   515 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 515, nxpk= 0, iat= 387,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2= 391, 392, 393,
 &end
#
#   6 ILE  HA      6 ILE  QG2     3.15             (#peak   516 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 516, nxpk= 0, iat=  92,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr2=  96,  97,  98,
 &end
#
#   7 LEU  HA      7 LEU  QD1     3.94             (#peak   517 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 517, nxpk= 0, iat= 111,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 118, 119, 120,
 &end
#
#   7 LEU  HA      7 LEU  QD2     3.94             (#peak   518 #SUP  0.70  #QF  0.70)
 &rst
  ixpk= 518, nxpk= 0, iat= 111,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 122, 123, 124,
 &end
#
#   3 PRO  HD3     6 ILE  QD1     4.38             (#peak   519 #SUP  1.00  #QF  0.48)
 &rst
  ixpk= 519, nxpk= 0, iat=  32,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2= 103, 104, 105,
 &end
#
#   6 ILE  HA      6 ILE  QD1     4.58             (#peak   519 #SUP  1.00  #QF  0.48)
 &rst
  ixpk= 519, nxpk= 0, iat=  92,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2= 103, 104, 105,
 &end
#
#   7 LEU  HA     10 ILE  QD1     4.40             (#peak   520 #SUP  0.66  #QF  0.66)
 &rst
  ixpk= 520, nxpk= 0, iat= 111,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 161, 162, 163,
 &end
#
#  21 LEU  HA     24 VAL  QG1     3.98             (#peak   522 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 522, nxpk= 0, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr2= 391, 392, 393,
 &end
#
#  21 LEU  HA     24 VAL  QG2     3.24             (#peak   523 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 523, nxpk= 0, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 395, 396, 397,
 &end
#
#  21 LEU  HA     21 LEU  QD1     4.06             (#peak   524 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 524, nxpk= 0, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 334, 335, 336,
 &end
#
#  21 LEU  HA     21 LEU  QD2     4.06             (#peak   525 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 525, nxpk= 0, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 338, 339, 340,
 &end
#
#  23 LEU  HA     23 LEU  QD1     4.36             (#peak   526 #SUP  0.75  #QF  0.75)
 &rst
  ixpk= 526, nxpk= 0, iat= 368,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 375, 376, 377,
 &end
#
#  23 LEU  HA     23 LEU  QD2     4.36             (#peak   527 #SUP  0.76  #QF  0.76)
 &rst
  ixpk= 527, nxpk= 0, iat= 368,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 379, 380, 381,
 &end
#
#  17 CYSS HA     21 LEU  QD2     5.12             (#peak   528 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 528, nxpk= 0, iat= 274,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr2= 338, 339, 340,
 &end
#
#  17 CYSS HA     21 LEU  QD1     5.12             (#peak   529 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 529, nxpk= 0, iat= 274,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr2= 334, 335, 336,
 &end
#
#  10 ILE  QG2    11 ALA  QB      4.57             (#peak   532 #SUP  0.75  #QF  0.75)
 &rst
  ixpk= 532, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr1= 154, 155, 156,
 igr2= 171, 172, 173,
 &end
#
#   9 ALA  QB     10 ILE  QD1     3.62             (#peak   534 #SUP  0.55  #QF  0.55)
 &rst
  ixpk= 534, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 142, 143, 144,
 igr2= 161, 162, 163,
 &end
#
#  21 LEU  HB3    21 LEU  QD2     4.19             (#peak   535 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 535, nxpk= 0, iat= 330,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 338, 339, 340,
 &end
#
#   4 ARG  QG     24 VAL  QG1     3.33             (#peak   537 #SUP  0.98  #QF  0.26)
 &rst
  ixpk= 537, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1=  51,  52,
 igr2= 391, 392, 393,
 &end
#
#   7 LEU  QB      7 LEU  QD1     3.48             (#peak   537 #SUP  0.98  #QF  0.26)
 &rst
  ixpk= 537, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1= 113, 114,
 igr2= 118, 119, 120,
 &end
#
#  11 ALA  QB     21 LEU  HG      4.25             (#peak   541 #SUP  0.59  #QF  0.59)
 &rst
  ixpk= 541, nxpk= 0, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 171, 172, 173,
 &end
#
#  11 ALA  QB     12 LYS  QD      4.46             (#peak   542 #SUP  0.76  #QF  0.76)
 &rst
  ixpk= 542, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr1= 171, 172, 173,
 igr2= 187, 188,
 &end
#
#  12 LYS  QG     12 LYS  QD      2.93             (#peak   543 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 543, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
 igr1= 184, 185,
 igr2= 187, 188,
 &end
#
#   7 LEU  QB      7 LEU  HG      2.74             (#peak   544 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 544, nxpk= 0, iat=  -1, 116, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,
 igr1= 113, 114,
 &end
#
#   5 LYS  QE      6 ILE  QD1     4.50             (#peak   551 #SUP  0.41  #QF  0.41)
 &rst
  ixpk= 551, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  81,  82,
 igr2= 103, 104, 105,
 &end
#
#   2 LEU  H       2 LEU  QB      3.34             (#peak   116)
 &rst
  ixpk= 116, nxpk= 0, iat=  11,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr2=  15,  16,
 &end
#
#   2 LEU  H       2 LEU  QQD     4.30             (#peak    91)
 &rst
  ixpk= 91, nxpk= 0, iat=  11,  17, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   2 LEU  HA      2 LEU  QQD     3.13             (#peak   328)
 &rst
  ixpk= 328, nxpk= 0, iat=  13,  17, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
#   2 LEU  QB      3 PRO  HD2     3.75             (#peak   438)
 &rst
  ixpk= 438, nxpk= 0, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1=  15,  16,
 &end
#
#   2 LEU  QB      3 PRO  HD3     4.27             (#peak   394)
 &rst
  ixpk= 394, nxpk= 0, iat=  -1,  32, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1=  15,  16,
 &end
#
#   2 LEU  QB      6 ILE  H       4.99             (#peak   212)
 &rst
  ixpk= 212, nxpk= 0, iat=  -1,  90, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1=  15,  16,
 &end
#
#   2 LEU  QB      7 LEU  H       4.46             (#peak   134)
 &rst
  ixpk= 134, nxpk= 0, iat=  -1, 109, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1=  15,  16,
 &end
#
#   2 LEU  QQD     3 PRO  HD2     3.82             (#peak   504)
 &rst
  ixpk= 504, nxpk= 0, iat=  17,  31, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,  &end
#
#   2 LEU  QQD     3 PRO  HD3     3.64             (#peak   521)
 &rst
  ixpk= 521, nxpk= 0, iat=  17,  32, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,  &end
#
#   3 PRO  QB      4 ARG  H       3.78             (#peak   223)
 &rst
  ixpk= 223, nxpk= 0, iat=  -1,  44, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=  37,  38,
 &end
#
#   3 PRO  QB      5 LYS  H       4.66             (#peak   224)
 &rst
  ixpk= 224, nxpk= 0, iat=  -1,  68, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr1=  37,  38,
 &end
#
#   3 PRO  QB      6 ILE  H       5.10             (#peak   248)
 &rst
  ixpk= 248, nxpk= 0, iat=  -1,  90, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1=  37,  38,
 &end
#
#   3 PRO  HD2     6 ILE  QG1     4.63             (#peak   439)
 &rst
  ixpk= 439, nxpk= 0, iat=  31,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr2= 100, 101,
 &end
#
#   4 ARG  H       4 ARG  QB      2.96             (#peak   105)
 &rst
  ixpk= 105, nxpk= 0, iat=  44,  -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
 igr2=  48,  49,
 &end
#
#   4 ARG  H       7 LEU  QQD     5.44             (#peak    88)
 &rst
  ixpk= 88, nxpk= 0, iat=  44, 115, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,  &end
#
#   4 ARG  QB      4 ARG  HE      4.44             (#peak    63)
 &rst
  ixpk= 63, nxpk= 0, iat=  -1,  57, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1=  48,  49,
 &end
#
#   4 ARG  QB      5 LYS  H       3.89             (#peak   106)
 &rst
  ixpk= 106, nxpk= 0, iat=  -1,  68, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1=  48,  49,
 &end
#
#   4 ARG  QB     24 VAL  QG2     4.95             (#peak   462)
 &rst
  ixpk= 462, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=  48,  49,
 igr2= 395, 396, 397,
 &end
#
#   5 LYS  H       5 LYS  QB      3.12             (#peak   107)
 &rst
  ixpk= 107, nxpk= 0, iat=  68,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr2=  72,  73,
 &end
#
#   5 LYS  QB      6 ILE  H       4.00             (#peak   207)
 &rst
  ixpk= 207, nxpk= 0, iat=  -1,  90, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1=  72,  73,
 &end
#
#   6 ILE  HA      6 ILE  QG1     3.52             (#peak   395)
 &rst
  ixpk= 395, nxpk= 0, iat=  92,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 100, 101,
 &end
#
#   6 ILE  QG2     6 ILE  QG1     3.23             (#peak   497)
 &rst
  ixpk= 497, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr1=  96,  97,  98,
 igr2= 100, 101,
 &end
#
#   6 ILE  QG2    10 ILE  QG1     3.82             (#peak   540)
 &rst
  ixpk= 540, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1=  96,  97,  98,
 igr2= 158, 159,
 &end
#
#   6 ILE  QG1     7 LEU  H       5.02             (#peak   137)
 &rst
  ixpk= 137, nxpk= 0, iat=  -1, 109, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1= 100, 101,
 &end
#
#   7 LEU  H       7 LEU  QQD     3.86             (#peak   139)
 &rst
  ixpk= 139, nxpk= 0, iat= 109, 115, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,  &end
#
#   7 LEU  HA      7 LEU  QQD     3.20             (#peak   518)
 &rst
  ixpk= 518, nxpk= 0, iat= 111, 115, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
#   7 LEU  HA     10 ILE  QG1     4.34             (#peak    73)
 &rst
  ixpk= 73, nxpk= 0, iat= 111,  -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr2= 158, 159,
 &end
#
#   7 LEU  QQD     8 CYSS H       4.76             (#peak    89)
 &rst
  ixpk= 89, nxpk= 0, iat= 115, 128, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,  &end
#
#   8 CYSS H      21 LEU  QQD     5.44             (#peak    89)
 &rst
  ixpk= 89, nxpk= 0, iat= 128, 331, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,  &end
#
#   8 CYSS HA     21 LEU  QQD     4.79             (#peak   531)
 &rst
  ixpk= 531, nxpk= 0, iat= 130, 331, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,  &end
#
#   9 ALA  H      10 ILE  QG1     4.65             (#peak   170)
 &rst
  ixpk= 170, nxpk= 0, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2= 158, 159,
 &end
#
#  10 ILE  H      10 ILE  QG1     3.21             (#peak   132)
 &rst
  ixpk= 132, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 158, 159,
 &end
#
#  10 ILE  HA     10 ILE  QG1     3.52             (#peak   383)
 &rst
  ixpk= 383, nxpk= 0, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 158, 159,
 &end
#
#  10 ILE  QG2    14 LYS  QB      3.90             (#peak   502)
 &rst
  ixpk= 502, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1= 154, 155, 156,
 igr2= 225, 226,
 &end
#
#  10 ILE  QG2    14 LYS  QD      3.51             (#peak   538)
 &rst
  ixpk= 538, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1= 154, 155, 156,
 igr2= 231, 232,
 &end
#
#  10 ILE  QG1    11 ALA  H       4.89             (#peak   143)
 &rst
  ixpk= 143, nxpk= 0, iat=  -1, 167, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 158, 159,
 &end
#
#  11 ALA  H      21 LEU  QQD     4.90             (#peak   145)
 &rst
  ixpk= 145, nxpk= 0, iat= 167, 331, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,  &end
#
#  11 ALA  HA     14 LYS  QB      4.15             (#peak   390)
 &rst
  ixpk= 390, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr2= 225, 226,
 &end
#
#  11 ALA  HA     16 LYS  QG      5.34             (#peak   393)
 &rst
  ixpk= 393, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 257, 258,
 &end
#
#  11 ALA  HA     21 LEU  QQD     5.44             (#peak   513)
 &rst
  ixpk= 513, nxpk= 0, iat= 169, 331, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,  &end
#
#  11 ALA  QB     21 LEU  QQD     3.03             (#peak   457)
 &rst
  ixpk= 457, nxpk= 0, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1= 171, 172, 173,
 &end
#
#  12 LYS  H      12 LYS  QB      3.07             (#peak    75)
 &rst
  ixpk= 75, nxpk= 0, iat= 177,  -1, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,
 igr2= 181, 182,
 &end
#
#  12 LYS  QB     12 LYS  QD      3.48             (#peak   548)
 &rst
  ixpk= 548, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 181, 182,
 igr2= 187, 188,
 &end
#
#  12 LYS  QB     13 LYS  H       3.73             (#peak   163)
 &rst
  ixpk= 163, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 181, 182,
 &end
#
#  13 LYS  H      13 LYS  QG      4.74             (#peak    79)
 &rst
  ixpk= 79, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr2= 206, 207,
 &end
#
#  13 LYS  QG     14 LYS  H       5.14             (#peak   153)
 &rst
  ixpk= 153, nxpk= 0, iat=  -1, 221, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1= 206, 207,
 &end
#
#  14 LYS  H      14 LYS  QB      3.18             (#peak   151)
 &rst
  ixpk= 151, nxpk= 0, iat= 221,  -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
 igr2= 225, 226,
 &end
#
#  14 LYS  HA     14 LYS  QD      3.69             (#peak   433)
 &rst
  ixpk= 433, nxpk= 0, iat= 223,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 231, 232,
 &end
#
#  14 LYS  QB     14 LYS  QD      3.17             (#peak   545)
 &rst
  ixpk= 545, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
 igr1= 225, 226,
 igr2= 231, 232,
 &end
#
#  14 LYS  QB     15 GLY  H       4.19             (#peak   158)
 &rst
  ixpk= 158, nxpk= 0, iat=  -1, 243, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 225, 226,
 &end
#
#  14 LYS  QB     16 LYS  H       4.18             (#peak   118)
 &rst
  ixpk= 118, nxpk= 0, iat=  -1, 250, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1= 225, 226,
 &end
#
#  14 LYS  QD     15 GLY  H       4.76             (#peak   159)
 &rst
  ixpk= 159, nxpk= 0, iat=  -1, 243, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 231, 232,
 &end
#
#  16 LYS  H      16 LYS  QG      4.33             (#peak   127)
 &rst
  ixpk= 127, nxpk= 0, iat= 250,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 257, 258,
 &end
#
#  16 LYS  QG     17 CYSS H       5.34             (#peak   113)
 &rst
  ixpk= 113, nxpk= 0, iat=  -1, 272, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 257, 258,
 &end
#
#  17 CYSS H      21 LEU  QQD     5.43             (#peak    93)
 &rst
  ixpk= 93, nxpk= 0, iat= 272, 331, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,  &end
#
#  17 CYSS HA     21 LEU  QQD     3.90             (#peak   529)
 &rst
  ixpk= 529, nxpk= 0, iat= 274, 331, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,  &end
#
#  17 CYSS HB2    27 CYSS QB      4.82             (#peak   363)
 &rst
  ixpk= 363, nxpk= 0, iat= 276,  -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr2= 437, 438,
 &end
#
#  17 CYSS HB3    27 CYSS QB      3.92             (#peak   345)
 &rst
  ixpk= 345, nxpk= 0, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 437, 438,
 &end
#
#  18 LYS  H      21 LEU  QQD     3.90             (#peak   181)
 &rst
  ixpk= 181, nxpk= 0, iat= 282, 331, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,  &end
#
#  18 LYS  HA     19 GLY  QA      4.63             (#peak   335)
 &rst
  ixpk= 335, nxpk= 0, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr2= 306, 307,
 &end
#
#  18 LYS  QB     19 GLY  H       3.46             (#peak    95)
 &rst
  ixpk= 95, nxpk= 0, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr1= 286, 287,
 &end
#
#  19 GLY  H      20 PRO  QD      4.80             (#peak   254)
 &rst
  ixpk= 254, nxpk= 0, iat= 304,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 312, 313,
 &end
#
#  19 GLY  QA     20 PRO  QD      3.13             (#peak   332)
 &rst
  ixpk= 332, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr1= 306, 307,
 igr2= 312, 313,
 &end
#
#  19 GLY  QA     21 LEU  H       4.37             (#peak   306)
 &rst
  ixpk= 306, nxpk= 0, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1= 306, 307,
 &end
#
#  19 GLY  QA     22 LYS  H       4.45             (#peak   307)
 &rst
  ixpk= 307, nxpk= 0, iat=  -1, 344, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 306, 307,
 &end
#
#  20 PRO  HA     23 LEU  QQD     4.24             (#peak   530)
 &rst
  ixpk= 530, nxpk= 0, iat= 321, 372, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,  &end
#
#  20 PRO  QB     21 LEU  H       3.79             (#peak   197)
 &rst
  ixpk= 197, nxpk= 0, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr1= 318, 319,
 &end
#
#  20 PRO  QG     21 LEU  H       4.07             (#peak   196)
 &rst
  ixpk= 196, nxpk= 0, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1= 315, 316,
 &end
#
#  20 PRO  QD     21 LEU  H       3.49             (#peak   302)
 &rst
  ixpk= 302, nxpk= 0, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr1= 312, 313,
 &end
#
#  20 PRO  QD     21 LEU  HB2     5.35             (#peak   400)
 &rst
  ixpk= 400, nxpk= 0, iat=  -1, 329, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr1= 312, 313,
 &end
#
#  21 LEU  HA     21 LEU  QQD     3.11             (#peak   525)
 &rst
  ixpk= 525, nxpk= 0, iat= 327, 331, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
#  21 LEU  QQD    22 LYS  H       4.40             (#peak   188)
 &rst
  ixpk= 188, nxpk= 0, iat= 331, 344, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,  &end
#
#  21 LEU  QQD    24 VAL  H       4.87             (#peak   218)
 &rst
  ixpk= 218, nxpk= 0, iat= 331, 385, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,  &end
#
#  21 LEU  QQD    24 VAL  HB      4.16             (#peak   466)
 &rst
  ixpk= 466, nxpk= 0, iat= 331, 389, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,  &end
#
#  23 LEU  H      23 LEU  QQD     5.28             (#peak   218)
 &rst
  ixpk= 218, nxpk= 0, iat= 366, 372, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,  &end
#
#  23 LEU  HA     23 LEU  QQD     3.10             (#peak   527)
 &rst
  ixpk= 527, nxpk= 0, iat= 368, 372, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#  26 LYS  H      26 LYS  QB      3.60             (#peak    84)
 &rst
  ixpk= 84, nxpk= 0, iat= 411,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 415, 416,
 &end
#
#  27 CYSS H      27 CYSS QB      3.34             (#peak    68)
 &rst
  ixpk= 68, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr2= 437, 438,
 &end
#
#   8 CYSS SG     25 CYSS SG      2.00  2.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 407, r1= 1.50, r2= 2.00, r3= 2.10, r4= 2.60, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
#   8 CYSS SG     25 CYSS CB      3.00  3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 404, r1= 2.50, r2= 3.00, r3= 3.10, r4= 3.60,  &end
#
#   8 CYSS CB     25 CYSS SG      3.00  3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 131, 407, r1= 2.50, r2= 3.00, r3= 3.10, r4= 3.60,  &end
#
#  17 CYSS SG     27 CYSS SG      2.00  2.10
 &rst
  ixpk= 0, nxpk= 0, iat= 278, 439, r1= 1.50, r2= 2.00, r3= 2.10, r4= 2.60,  &end
#
#  17 CYSS SG     27 CYSS CB      3.00  3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 278, 436, r1= 2.50, r2= 3.00, r3= 3.10, r4= 3.60,  &end
#
#  17 CYSS CB     27 CYSS SG      3.00  3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 439, r1= 2.50, r2= 3.00, r3= 3.10, r4= 3.60,  &end
# 442 atoms read from pdb file vv12_1_amb.pdb.
# 4 ARG PHI:  (3 PRO C)-(4 ARG N)-(4 ARG CA)-(4 ARG C) -71.0 -31.0
 &rst     iat =    41,    43,    45,    65,
   r1 = -72.0, r2 = -71.0, r3 = -31.0, r4 = -30.0,
   rk2 =   2.0, rk3 =   2.0,    &end

# 4 ARG PSI:  (4 ARG N)-(4 ARG CA)-(4 ARG C)-(5 LYS N) -62.0 -26.0
 &rst     iat =    43,    45,    65,    67,
   r1 = -63.0, r2 = -62.0, r3 = -26.0, r4 = -25.0,
 &end

# 5 LYS PHI:  (4 ARG C)-(5 LYS N)-(5 LYS CA)-(5 LYS C) -70.0 -50.0
 &rst     iat =    65,    67,    69,    87,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 5 LYS PSI:  (5 LYS N)-(5 LYS CA)-(5 LYS C)-(6 ILE N) -55.0 -23.0
 &rst     iat =    67,    69,    87,    89,
   r1 = -56.0, r2 = -55.0, r3 = -23.0, r4 = -22.0,
 &end

# 6 ILE PHI:  (5 LYS C)-(6 ILE N)-(6 ILE CA)-(6 ILE C) -85.0 -57.0
 &rst     iat =    87,    89,    91,   106,
   r1 = -86.0, r2 = -85.0, r3 = -57.0, r4 = -56.0,
 &end

# 6 ILE PSI:  (6 ILE N)-(6 ILE CA)-(6 ILE C)-(7 LEU N) -49.0 -25.0
 &rst     iat =    89,    91,   106,   108,
   r1 = -50.0, r2 = -49.0, r3 = -25.0, r4 = -24.0,
 &end

# 7 LEU PHI:  (6 ILE C)-(7 LEU N)-(7 LEU CA)-(7 LEU C) -73.0 -53.0
 &rst     iat =   106,   108,   110,   125,
   r1 = -74.0, r2 = -73.0, r3 = -53.0, r4 = -52.0,
 &end

# 7 LEU PSI:  (7 LEU N)-(7 LEU CA)-(7 LEU C)-(8 CYX N) -58.0 -22.0
 &rst     iat =   108,   110,   125,   127,
   r1 = -59.0, r2 = -58.0, r3 = -22.0, r4 = -21.0,
 &end

# 8 CYS PHI:  (7 LEU C)-(8 CYX N)-(8 CYX CA)-(8 CYX C) -80.0 -56.0
 &rst     iat =   125,   127,   129,   135,
   r1 = -81.0, r2 = -80.0, r3 = -56.0, r4 = -55.0,
 &end

# 8 CYS PSI:  (8 CYX N)-(8 CYX CA)-(8 CYX C)-(9 ALA N) -52.0 -28.0
 &rst     iat =   127,   129,   135,   137,
   r1 = -53.0, r2 = -52.0, r3 = -28.0, r4 = -27.0,
 &end

# 9 ALA PHI:  (8 CYX C)-(9 ALA N)-(9 ALA CA)-(9 ALA C) -73.0 -53.0
 &rst     iat =   135,   137,   139,   145,
   r1 = -74.0, r2 = -73.0, r3 = -53.0, r4 = -52.0,
 &end

# 9 ALA PSI:  (9 ALA N)-(9 ALA CA)-(9 ALA C)-(10 ILE N) -50.0 -30.0
 &rst     iat =   137,   139,   145,   147,
   r1 = -51.0, r2 = -50.0, r3 = -30.0, r4 = -29.0,
 &end

# 10 ILE PHI:  (9 ALA C)-(10 ILE N)-(10 ILE CA)-(10 ILE C) -74.0 -54.0
 &rst     iat =   145,   147,   149,   164,
   r1 = -75.0, r2 = -74.0, r3 = -54.0, r4 = -53.0,
 &end

# 10 ILE PSI:  (10 ILE N)-(10 ILE CA)-(10 ILE C)-(11 ALA N) -55.0 -35.0
 &rst     iat =   147,   149,   164,   166,
   r1 = -56.0, r2 = -55.0, r3 = -35.0, r4 = -34.0,
 &end

# 11 ALA PHI:  (10 ILE C)-(11 ALA N)-(11 ALA CA)-(11 ALA C) -73.0 -53.0
 &rst     iat =   164,   166,   168,   174,
   r1 = -74.0, r2 = -73.0, r3 = -53.0, r4 = -52.0,
 &end

# 11 ALA PSI:  (11 ALA N)-(11 ALA CA)-(11 ALA C)-(12 LYS N) -50.0 -30.0
 &rst     iat =   166,   168,   174,   176,
   r1 = -51.0, r2 = -50.0, r3 = -30.0, r4 = -29.0,
 &end

# 12 LYS PHI:  (11 ALA C)-(12 LYS N)-(12 LYS CA)-(12 LYS C) -74.0 -54.0
 &rst     iat =   174,   176,   178,   196,
   r1 = -75.0, r2 = -74.0, r3 = -54.0, r4 = -53.0,
 &end

# 12 LYS PSI:  (12 LYS N)-(12 LYS CA)-(12 LYS C)-(13 LYS N) -52.0 -28.0
 &rst     iat =   176,   178,   196,   198,
   r1 = -53.0, r2 = -52.0, r3 = -28.0, r4 = -27.0,
 &end

# 13 LYS PHI:  (12 LYS C)-(13 LYS N)-(13 LYS CA)-(13 LYS C) -74.0 -54.0
 &rst     iat =   196,   198,   200,   218,
   r1 = -75.0, r2 = -74.0, r3 = -54.0, r4 = -53.0,
 &end

# 13 LYS PSI:  (13 LYS N)-(13 LYS CA)-(13 LYS C)-(14 LYS N) -56.0 -12.0
 &rst     iat =   198,   200,   218,   220,
   r1 = -57.0, r2 = -56.0, r3 = -12.0, r4 = -11.0,
 &end

# 14 LYS PHI:  (13 LYS C)-(14 LYS N)-(14 LYS CA)-(14 LYS C) -112.0 -68.0
 &rst     iat =   218,   220,   222,   240,
   r1 = -113.0, r2 = -112.0, r3 = -68.0, r4 = -67.0,
 &end

# 14 LYS PSI:  (14 LYS N)-(14 LYS CA)-(14 LYS C)-(15 GLY N) -22.0  14.0
 &rst     iat =   220,   222,   240,   242,
   r1 = -23.0, r2 = -22.0, r3 =  14.0, r4 =  15.0,
 &end

# 15 GLY PHI:  (14 LYS C)-(15 GLY N)-(15 GLY CA)-(15 GLY C)  64.0 104.0
 &rst     iat =   240,   242,   244,   247,
   r1 =  63.0, r2 =  64.0, r3 = 104.0, r4 = 105.0,
 &end

# 15 GLY PSI:  (15 GLY N)-(15 GLY CA)-(15 GLY C)-(16 LYS N)  -8.0  44.0
 &rst     iat =   242,   244,   247,   249,
   r1 =  -9.0, r2 =  -8.0, r3 =  44.0, r4 =  45.0,
 &end

# 16 LYS PHI:  (15 GLY C)-(16 LYS N)-(16 LYS CA)-(16 LYS C) -121.0 -81.0
# &rst     iat =   247,   249,   251,   269,
#   r1 = -122.0, r2 = -121.0, r3 = -81.0, r4 = -80.0,
# &end

# 16 LYS PSI:  (16 LYS N)-(16 LYS CA)-(16 LYS C)-(17 CYX N) 110.0 174.0
# &rst     iat =   249,   251,   269,   271,
#   r1 = 109.0, r2 = 110.0, r3 = 174.0, r4 = 175.0,
# &end

# 17 CYS PHI:  (16 LYS C)-(17 CYX N)-(17 CYX CA)-(17 CYX C) -164.0 -100.0
 &rst     iat =   269,   271,   273,   279,
   r1 = -165.0, r2 = -164.0, r3 = -100.0, r4 = -99.0,
 &end

# 17 CYS PSI:  (17 CYX N)-(17 CYX CA)-(17 CYX C)-(18 LYS N) 138.0 174.0
 &rst     iat =   271,   273,   279,   281,
   r1 = 137.0, r2 = 138.0, r3 = 174.0, r4 = 175.0,
 &end

# 18 LYS PHI:  (17 CYX C)-(18 LYS N)-(18 LYS CA)-(18 LYS C) -171.0 -83.0
 &rst     iat =   279,   281,   283,   301,
   r1 = -172.0, r2 = -171.0, r3 = -83.0, r4 = -82.0,
 &end

# 18 LYS PSI:  (18 LYS N)-(18 LYS CA)-(18 LYS C)-(19 GLY N) 114.0 174.0
 &rst     iat =   281,   283,   301,   303,
   r1 = 113.0, r2 = 114.0, r3 = 174.0, r4 = 175.0,
 &end

# 21 LEU PHI:  (20 PRO C)-(21 LEU N)-(21 LEU CA)-(21 LEU C) -93.0 -41.0
 &rst     iat =   322,   324,   326,   341,
   r1 = -94.0, r2 = -93.0, r3 = -41.0, r4 = -40.0,
 &end

# 21 LEU PSI:  (21 LEU N)-(21 LEU CA)-(21 LEU C)-(22 LYS N) -53.0  -9.0
 &rst     iat =   324,   326,   341,   343,
   r1 = -54.0, r2 = -53.0, r3 =  -9.0, r4 =  -8.0,
 &end

# 22 LYS PHI:  (21 LEU C)-(22 LYS N)-(22 LYS CA)-(22 LYS C) -77.0 -49.0
 &rst     iat =   341,   343,   345,   363,
   r1 = -78.0, r2 = -77.0, r3 = -49.0, r4 = -48.0,
 &end

# 22 LYS PSI:  (22 LYS N)-(22 LYS CA)-(22 LYS C)-(23 LEU N) -48.0 -28.0
 &rst     iat =   343,   345,   363,   365,
   r1 = -49.0, r2 = -48.0, r3 = -28.0, r4 = -27.0,
 &end

# 23 LEU PHI:  (22 LYS C)-(23 LEU N)-(23 LEU CA)-(23 LEU C) -89.0 -45.0
 &rst     iat =   363,   365,   367,   382,
   r1 = -90.0, r2 = -89.0, r3 = -45.0, r4 = -44.0,
 &end

# 23 LEU PSI:  (23 LEU N)-(23 LEU CA)-(23 LEU C)-(24 VAL N) -52.0 -20.0
 &rst     iat =   365,   367,   382,   384,
   r1 = -53.0, r2 = -52.0, r3 = -20.0, r4 = -19.0,
 &end

# 24 VAL PHI:  (23 LEU C)-(24 VAL N)-(24 VAL CA)-(24 VAL C) -122.0 -62.0
 &rst     iat =   382,   384,   386,   398,
   r1 = -123.0, r2 = -122.0, r3 = -62.0, r4 = -61.0,
 &end

# 24 VAL PSI:  (24 VAL N)-(24 VAL CA)-(24 VAL C)-(25 CYX N) -63.0   9.0
 &rst     iat =   384,   386,   398,   400,
   r1 = -64.0, r2 = -63.0, r3 =   9.0, r4 =  10.0,
 &end

# 26 LYS PHI:  (25 CYX C)-(26 LYS N)-(26 LYS CA)-(26 LYS C) -186.0 -74.0
# &rst     iat =   408,   410,   412,   430,
#   r1 = -187.0, r2 = -186.0, r3 = -74.0, r4 = -73.0,
# &end
#
# 26 LYS PSI:  (26 LYS N)-(26 LYS CA)-(26 LYS C)-(27 CYX N)  98.0 186.0
# &rst     iat =   410,   412,   430,   432,
#   r1 =  97.0, r2 =  98.0, r3 = 186.0, r4 = 187.0,
# &end

# 442 atoms read from pdb file vv12_1_amb.pdb.
# 4 ARG PHI:  (3 PRO C)-(4 ARG N)-(4 ARG CA)-(4 ARG C) -71.0 -31.0
 &rst     iat =    41,    43,    45,    65,
   r1 = -72.0, r2 = -71.0, r3 = -31.0, r4 = -30.0,
   rk2 =   2.0, rk3 =   2.0,    &end

# 4 ARG PSI:  (4 ARG N)-(4 ARG CA)-(4 ARG C)-(5 LYS N) -62.0 -26.0
 &rst     iat =    43,    45,    65,    67,
   r1 = -63.0, r2 = -62.0, r3 = -26.0, r4 = -25.0,
 &end

# 5 LYS PHI:  (4 ARG C)-(5 LYS N)-(5 LYS CA)-(5 LYS C) -70.0 -50.0
 &rst     iat =    65,    67,    69,    87,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 5 LYS PSI:  (5 LYS N)-(5 LYS CA)-(5 LYS C)-(6 ILE N) -55.0 -23.0
 &rst     iat =    67,    69,    87,    89,
   r1 = -56.0, r2 = -55.0, r3 = -23.0, r4 = -22.0,
 &end

# 6 ILE PHI:  (5 LYS C)-(6 ILE N)-(6 ILE CA)-(6 ILE C) -85.0 -57.0
 &rst     iat =    87,    89,    91,   106,
   r1 = -86.0, r2 = -85.0, r3 = -57.0, r4 = -56.0,
 &end

# 6 ILE PSI:  (6 ILE N)-(6 ILE CA)-(6 ILE C)-(7 LEU N) -49.0 -25.0
 &rst     iat =    89,    91,   106,   108,
   r1 = -50.0, r2 = -49.0, r3 = -25.0, r4 = -24.0,
 &end

# 7 LEU PHI:  (6 ILE C)-(7 LEU N)-(7 LEU CA)-(7 LEU C) -73.0 -53.0
 &rst     iat =   106,   108,   110,   125,
   r1 = -74.0, r2 = -73.0, r3 = -53.0, r4 = -52.0,
 &end

# 7 LEU PSI:  (7 LEU N)-(7 LEU CA)-(7 LEU C)-(8 CYX N) -58.0 -22.0
 &rst     iat =   108,   110,   125,   127,
   r1 = -59.0, r2 = -58.0, r3 = -22.0, r4 = -21.0,
 &end

# 8 CYS PHI:  (7 LEU C)-(8 CYX N)-(8 CYX CA)-(8 CYX C) -80.0 -56.0
 &rst     iat =   125,   127,   129,   135,
   r1 = -81.0, r2 = -80.0, r3 = -56.0, r4 = -55.0,
 &end

# 8 CYS PSI:  (8 CYX N)-(8 CYX CA)-(8 CYX C)-(9 ALA N) -52.0 -28.0
 &rst     iat =   127,   129,   135,   137,
   r1 = -53.0, r2 = -52.0, r3 = -28.0, r4 = -27.0,
 &end

# 9 ALA PHI:  (8 CYX C)-(9 ALA N)-(9 ALA CA)-(9 ALA C) -73.0 -53.0
 &rst     iat =   135,   137,   139,   145,
   r1 = -74.0, r2 = -73.0, r3 = -53.0, r4 = -52.0,
 &end

# 9 ALA PSI:  (9 ALA N)-(9 ALA CA)-(9 ALA C)-(10 ILE N) -50.0 -30.0
 &rst     iat =   137,   139,   145,   147,
   r1 = -51.0, r2 = -50.0, r3 = -30.0, r4 = -29.0,
 &end

# 10 ILE PHI:  (9 ALA C)-(10 ILE N)-(10 ILE CA)-(10 ILE C) -74.0 -54.0
 &rst     iat =   145,   147,   149,   164,
   r1 = -75.0, r2 = -74.0, r3 = -54.0, r4 = -53.0,
 &end

# 10 ILE PSI:  (10 ILE N)-(10 ILE CA)-(10 ILE C)-(11 ALA N) -55.0 -35.0
 &rst     iat =   147,   149,   164,   166,
   r1 = -56.0, r2 = -55.0, r3 = -35.0, r4 = -34.0,
 &end

# 11 ALA PHI:  (10 ILE C)-(11 ALA N)-(11 ALA CA)-(11 ALA C) -73.0 -53.0
 &rst     iat =   164,   166,   168,   174,
   r1 = -74.0, r2 = -73.0, r3 = -53.0, r4 = -52.0,
 &end

# 11 ALA PSI:  (11 ALA N)-(11 ALA CA)-(11 ALA C)-(12 LYS N) -50.0 -30.0
 &rst     iat =   166,   168,   174,   176,
   r1 = -51.0, r2 = -50.0, r3 = -30.0, r4 = -29.0,
 &end

# 12 LYS PHI:  (11 ALA C)-(12 LYS N)-(12 LYS CA)-(12 LYS C) -74.0 -54.0
 &rst     iat =   174,   176,   178,   196,
   r1 = -75.0, r2 = -74.0, r3 = -54.0, r4 = -53.0,
 &end

# 12 LYS PSI:  (12 LYS N)-(12 LYS CA)-(12 LYS C)-(13 LYS N) -52.0 -28.0
 &rst     iat =   176,   178,   196,   198,
   r1 = -53.0, r2 = -52.0, r3 = -28.0, r4 = -27.0,
 &end

# 13 LYS PHI:  (12 LYS C)-(13 LYS N)-(13 LYS CA)-(13 LYS C) -74.0 -54.0
 &rst     iat =   196,   198,   200,   218,
   r1 = -75.0, r2 = -74.0, r3 = -54.0, r4 = -53.0,
 &end

# 13 LYS PSI:  (13 LYS N)-(13 LYS CA)-(13 LYS C)-(14 LYS N) -56.0 -12.0
 &rst     iat =   198,   200,   218,   220,
   r1 = -57.0, r2 = -56.0, r3 = -12.0, r4 = -11.0,
 &end

# 14 LYS PHI:  (13 LYS C)-(14 LYS N)-(14 LYS CA)-(14 LYS C) -112.0 -68.0
 &rst     iat =   218,   220,   222,   240,
   r1 = -113.0, r2 = -112.0, r3 = -68.0, r4 = -67.0,
 &end

# 14 LYS PSI:  (14 LYS N)-(14 LYS CA)-(14 LYS C)-(15 GLY N) -22.0  14.0
 &rst     iat =   220,   222,   240,   242,
   r1 = -23.0, r2 = -22.0, r3 =  14.0, r4 =  15.0,
 &end

# 15 GLY PHI:  (14 LYS C)-(15 GLY N)-(15 GLY CA)-(15 GLY C)  64.0 104.0
 &rst     iat =   240,   242,   244,   247,
   r1 =  63.0, r2 =  64.0, r3 = 104.0, r4 = 105.0,
 &end

# 15 GLY PSI:  (15 GLY N)-(15 GLY CA)-(15 GLY C)-(16 LYS N)  -8.0  44.0
 &rst     iat =   242,   244,   247,   249,
   r1 =  -9.0, r2 =  -8.0, r3 =  44.0, r4 =  45.0,
 &end

# 16 LYS PHI:  (15 GLY C)-(16 LYS N)-(16 LYS CA)-(16 LYS C) -121.0 -81.0
 &rst     iat =   247,   249,   251,   269,
   r1 = -122.0, r2 = -121.0, r3 = -81.0, r4 = -80.0,
 &end

# 16 LYS PSI:  (16 LYS N)-(16 LYS CA)-(16 LYS C)-(17 CYX N) 110.0 174.0
 &rst     iat =   249,   251,   269,   271,
   r1 = 109.0, r2 = 110.0, r3 = 174.0, r4 = 175.0,
 &end

# 17 CYS PHI:  (16 LYS C)-(17 CYX N)-(17 CYX CA)-(17 CYX C) -164.0 -100.0
 &rst     iat =   269,   271,   273,   279,
   r1 = -165.0, r2 = -164.0, r3 = -100.0, r4 = -99.0,
 &end

# 17 CYS PSI:  (17 CYX N)-(17 CYX CA)-(17 CYX C)-(18 LYS N) 138.0 174.0
 &rst     iat =   271,   273,   279,   281,
   r1 = 137.0, r2 = 138.0, r3 = 174.0, r4 = 175.0,
 &end

# 18 LYS PHI:  (17 CYX C)-(18 LYS N)-(18 LYS CA)-(18 LYS C) -171.0 -83.0
 &rst     iat =   279,   281,   283,   301,
   r1 = -172.0, r2 = -171.0, r3 = -83.0, r4 = -82.0,
 &end

# 18 LYS PSI:  (18 LYS N)-(18 LYS CA)-(18 LYS C)-(19 GLY N) 114.0 174.0
 &rst     iat =   281,   283,   301,   303,
   r1 = 113.0, r2 = 114.0, r3 = 174.0, r4 = 175.0,
 &end

# 21 LEU PHI:  (20 PRO C)-(21 LEU N)-(21 LEU CA)-(21 LEU C) -93.0 -41.0
 &rst     iat =   322,   324,   326,   341,
   r1 = -94.0, r2 = -93.0, r3 = -41.0, r4 = -40.0,
 &end

# 21 LEU PSI:  (21 LEU N)-(21 LEU CA)-(21 LEU C)-(22 LYS N) -53.0  -9.0
 &rst     iat =   324,   326,   341,   343,
   r1 = -54.0, r2 = -53.0, r3 =  -9.0, r4 =  -8.0,
 &end

# 22 LYS PHI:  (21 LEU C)-(22 LYS N)-(22 LYS CA)-(22 LYS C) -77.0 -49.0
 &rst     iat =   341,   343,   345,   363,
   r1 = -78.0, r2 = -77.0, r3 = -49.0, r4 = -48.0,
 &end

# 22 LYS PSI:  (22 LYS N)-(22 LYS CA)-(22 LYS C)-(23 LEU N) -48.0 -28.0
 &rst     iat =   343,   345,   363,   365,
   r1 = -49.0, r2 = -48.0, r3 = -28.0, r4 = -27.0,
 &end

# 23 LEU PHI:  (22 LYS C)-(23 LEU N)-(23 LEU CA)-(23 LEU C) -89.0 -45.0
 &rst     iat =   363,   365,   367,   382,
   r1 = -90.0, r2 = -89.0, r3 = -45.0, r4 = -44.0,
 &end

# 23 LEU PSI:  (23 LEU N)-(23 LEU CA)-(23 LEU C)-(24 VAL N) -52.0 -20.0
 &rst     iat =   365,   367,   382,   384,
   r1 = -53.0, r2 = -52.0, r3 = -20.0, r4 = -19.0,
 &end

# 24 VAL PHI:  (23 LEU C)-(24 VAL N)-(24 VAL CA)-(24 VAL C) -122.0 -62.0
 &rst     iat =   382,   384,   386,   398,
   r1 = -123.0, r2 = -122.0, r3 = -62.0, r4 = -61.0,
 &end

# 24 VAL PSI:  (24 VAL N)-(24 VAL CA)-(24 VAL C)-(25 CYX N) -63.0   9.0
 &rst     iat =   384,   386,   398,   400,
   r1 = -64.0, r2 = -63.0, r3 =   9.0, r4 =  10.0,
 &end

# 26 LYS PHI:  (25 CYX C)-(26 LYS N)-(26 LYS CA)-(26 LYS C) -186.0 -74.0
 &rst     iat =   408,   410,   412,   430,
   r1 = -187.0, r2 = -186.0, r3 = -74.0, r4 = -73.0,
 &end

# 26 LYS PSI:  (26 LYS N)-(26 LYS CA)-(26 LYS C)-(27 CYX N)  98.0 186.0
 &rst     iat =   410,   412,   430,   432,
   r1 =  97.0, r2 =  98.0, r3 = 186.0, r4 = 187.0,
 &end

#
#  11 ALA  H      11 ALA  QB      2.70             (#peak     1 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 1, nxpk= 0, iat= 167,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr2= 171, 172, 173,
 &end
#
#   9 ALA  H       9 ALA  QB      2.69             (#peak     2 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 2, nxpk= 0, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
 igr2= 142, 143, 144,
 &end
#
#   8 CYSS H       8 CYSS HB2     3.08             (#peak     3 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 3, nxpk= 0, iat= 128, 132, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
#  10 ILE  H      10 ILE  HB      3.09             (#peak     6 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 6, nxpk= 0, iat= 148, 152, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
#   3 PRO  HA      4 ARG  H       2.64             (#peak    15 #SUP  0.50  #QF  0.50)
 &rst
  ixpk= 15, nxpk= 0, iat=  40,  44, r1= 1.30, r2= 1.80, r3= 2.64, r4= 3.14,  &end
#
#  25 CYSS H      25 CYSS HB3     3.21             (#peak    17 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 17, nxpk= 0, iat= 401, 406, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#  26 LYS  H      26 LYS  HA      2.86             (#peak    18 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 18, nxpk= 0, iat= 411, 413, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,  &end
#
#   1 GLY  QA      2 LEU  H       2.88             (#peak    32 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 32, nxpk= 0, iat=  -1,  11, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
 igr1=   6,   7,
 &end
#
#  18 LYS  H      19 GLY  H       4.69             (#peak    33 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 33, nxpk= 0, iat= 282, 304, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#  19 GLY  H      22 LYS  H       5.02             (#peak    34 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 34, nxpk= 0, iat= 304, 344, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#   7 LEU  H       8 CYSS H       3.11             (#peak    35 #SUP  0.78  #QF  0.78)
 &rst
  ixpk= 35, nxpk= 0, iat= 109, 128, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
#   8 CYSS H       9 ALA  H       3.12             (#peak    36 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 36, nxpk= 0, iat= 128, 138, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#   4 ARG  H       6 ILE  H       4.87             (#peak    37 #SUP  0.95  #QF  0.50)
 &rst
  ixpk= 37, nxpk= 0, iat=  44,  90, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
#   6 ILE  H       8 CYSS H       5.10             (#peak    37 #SUP  0.95  #QF  0.50)
 &rst
  ixpk= 37, nxpk= 0, iat=  90, 128, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
#   8 CYSS H      11 ALA  H       4.99             (#peak    38 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 38, nxpk= 0, iat= 128, 167, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
#   5 LYS  H       6 ILE  H       3.40             (#peak    39 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 39, nxpk= 0, iat=  68,  90, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#   4 ARG  H       4 ARG  HE      5.50             (#peak    40 #SUP  1.00)
 &rst
  ixpk= 40, nxpk= 0, iat=  44,  57, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  17 CYSS H      18 LYS  H       4.39             (#peak    42 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 42, nxpk= 0, iat= 272, 282, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#   5 LYS  H       7 LEU  H       4.92             (#peak    44 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 44, nxpk= 0, iat=  68, 109, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
#  15 GLY  H      16 LYS  H       3.33             (#peak    45 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 45, nxpk= 0, iat= 243, 250, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
#  14 LYS  H      16 LYS  H       4.55             (#peak    46 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 46, nxpk= 0, iat= 221, 250, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#  25 CYSS H      26 LYS  H       3.19             (#peak    47 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 47, nxpk= 0, iat= 401, 411, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,  &end
#
#  24 VAL  H      25 CYSS H       2.88             (#peak    48 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 48, nxpk= 0, iat= 385, 401, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,  &end
#
#  25 CYSS H      27 CYSS H       5.42             (#peak    49 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 49, nxpk= 0, iat= 401, 433, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
#  22 LYS  H      25 CYSS H       5.22             (#peak    50 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 50, nxpk= 0, iat= 344, 401, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
#  10 ILE  H      11 ALA  H       3.18             (#peak    51 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 51, nxpk= 0, iat= 148, 167, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
#   9 ALA  H      10 ILE  H       3.16             (#peak    52 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 52, nxpk= 0, iat= 138, 148, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66,  &end
#
#   6 ILE  H       7 LEU  H       2.97             (#peak    53 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 53, nxpk= 0, iat=  90, 109, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47,  &end
#
#  12 LYS  H      13 LYS  H       3.25             (#peak    54 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 54, nxpk= 0, iat= 177, 199, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
#  14 LYS  H      15 GLY  H       3.38             (#peak    55 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 55, nxpk= 0, iat= 221, 243, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#  13 LYS  H      14 LYS  H       3.24             (#peak    56 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 56, nxpk= 0, iat= 199, 221, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
#   9 ALA  H      11 ALA  H       4.64             (#peak    57 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 57, nxpk= 0, iat= 138, 167, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#  24 VAL  H      26 LYS  H       5.14             (#peak    58 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 58, nxpk= 0, iat= 385, 411, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#  26 LYS  H      27 CYSS H       3.67             (#peak    59 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 59, nxpk= 0, iat= 411, 433, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  22 LYS  H      23 LEU  H       3.08             (#peak    60 #SUP  0.77  #QF  0.77)
 &rst
  ixpk= 60, nxpk= 0, iat= 344, 366, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
#   4 ARG  HA      4 ARG  HE      5.37             (#peak    62 #SUP  1.00)
 &rst
  ixpk= 62, nxpk= 0, iat=  46,  57, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,  &end
#
#  17 CYSS H      17 CYSS HB3     3.36             (#peak    66 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 66, nxpk= 0, iat= 272, 277, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  17 CYSS H      17 CYSS HB2     3.74             (#peak    67 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 67, nxpk= 0, iat= 272, 276, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  27 CYSS H      27 CYSS HB2     3.97             (#peak    68 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 68, nxpk= 0, iat= 433, 437, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#  27 CYSS H      27 CYSS HB3     3.97             (#peak    69 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 69, nxpk= 0, iat= 433, 438, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#   4 ARG  HB2     4 ARG  QD      3.99             (#peak    71 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 71, nxpk= 0, iat=  48,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2=  54,  55,
 &end
#
#   4 ARG  HB3     4 ARG  QD      3.99             (#peak    72 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 72, nxpk= 0, iat=  49,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2=  54,  55,
 &end
#
#  12 LYS  H      12 LYS  HB2     3.61             (#peak    74 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 74, nxpk= 0, iat= 177, 181, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
#  12 LYS  H      12 LYS  HB3     3.61             (#peak    75 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 75, nxpk= 0, iat= 177, 182, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
#  12 LYS  H      12 LYS  QG      4.42             (#peak    76 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 76, nxpk= 0, iat= 177,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 184, 185,
 &end
#
#  13 LYS  H      13 LYS  QB      2.72             (#peak    77 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 77, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,
 igr2= 203, 204,
 &end
#
#  12 LYS  QG     13 LYS  H       5.13             (#peak    78 #SUP  1.00  #QF  0.37)
 &rst
  ixpk= 78, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 184, 185,
 &end
#
#  13 LYS  H      13 LYS  HG3     5.39             (#peak    78 #SUP  1.00  #QF  0.37)
 &rst
  ixpk= 78, nxpk= 0, iat= 199, 207, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
#   9 ALA  QB     13 LYS  H       4.98             (#peak    79 #SUP  0.99  #QF  0.39)
 &rst
  ixpk= 79, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1= 142, 143, 144,
 &end
#
#  13 LYS  H      13 LYS  HG2     5.39             (#peak    79 #SUP  0.99  #QF  0.39)
 &rst
  ixpk= 79, nxpk= 0, iat= 199, 206, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
#  12 LYS  H      12 LYS  QE      5.50             (#peak    80 #SUP  1.00)
 &rst
  ixpk= 80, nxpk= 0, iat= 177,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 190, 191,
 &end
#
#  14 LYS  H      14 LYS  HD2     3.96             (#peak    81 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 81, nxpk= 0, iat= 221, 231, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  14 LYS  H      14 LYS  HD3     3.96             (#peak    82 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 82, nxpk= 0, iat= 221, 232, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  22 LYS  H      22 LYS  QD      4.51             (#peak    83 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 83, nxpk= 0, iat= 344,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2= 354, 355,
 &end
#
#  26 LYS  H      26 LYS  HB3     4.17             (#peak    84 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 84, nxpk= 0, iat= 411, 416, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  26 LYS  H      26 LYS  HB2     4.17             (#peak    85 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 85, nxpk= 0, iat= 411, 415, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  19 GLY  H      21 LEU  H       5.43             (#peak    86 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 86, nxpk= 0, iat= 304, 325, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
#   6 ILE  QG2     8 CYSS H       4.86             (#peak    87 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 87, nxpk= 0, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1=  96,  97,  98,
 &end
#
#   7 LEU  QD1     8 CYSS H       5.50             (#peak    88 #SUP  0.93  #QF  0.23)
 &rst
  ixpk= 88, nxpk= 0, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 118, 119, 120,
 &end
#
#   4 ARG  H      24 VAL  QG1     5.50             (#peak    88 #SUP  0.93  #QF  0.23)
 &rst
  ixpk= 88, nxpk= 0, iat=  44,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 391, 392, 393,
 &end
#
#   7 LEU  QD2     8 CYSS H       5.50             (#peak    89 #SUP  0.92  #QF  0.86)
 &rst
  ixpk= 89, nxpk= 0, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 122, 123, 124,
 &end
#
#   5 LYS  H       6 ILE  QD1     5.50             (#peak    90 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 90, nxpk= 0, iat=  68,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 103, 104, 105,
 &end
#
#   2 LEU  H       2 LEU  QD1     5.10             (#peak    91 #SUP  0.95  #QF  0.62)
 &rst
  ixpk= 91, nxpk= 0, iat=  11,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr2=  20,  21,  22,
 &end
#
#   2 LEU  H       2 LEU  QD2     5.10             (#peak    91 #SUP  0.95  #QF  0.62)
 &rst
  ixpk= 91, nxpk= 0, iat=  11,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr2=  24,  25,  26,
 &end
#
#  18 LYS  QG     19 GLY  H       4.91             (#peak    94 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 94, nxpk= 0, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 289, 290,
 &end
#
#  18 LYS  HB3    19 GLY  H       4.00             (#peak    95 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 95, nxpk= 0, iat= 287, 304, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  19 GLY  H      22 LYS  HB2     5.22             (#peak    96 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 96, nxpk= 0, iat= 304, 348, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
#  19 GLY  H      22 LYS  QD      5.32             (#peak    97 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 97, nxpk= 0, iat= 304,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2= 354, 355,
 &end
#
#  18 LYS  HB2    19 GLY  H       4.00             (#peak    98 #SUP  0.95  #QF  0.78)
 &rst
  ixpk= 98, nxpk= 0, iat= 286, 304, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  19 GLY  H      22 LYS  HB3     4.45             (#peak    98 #SUP  0.95  #QF  0.78)
 &rst
  ixpk= 98, nxpk= 0, iat= 304, 349, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#   8 CYSS H       9 ALA  QB      4.49             (#peak    99 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 99, nxpk= 0, iat= 128,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 142, 143, 144,
 &end
#
#   8 CYSS H      11 ALA  QB      4.97             (#peak   100 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 100, nxpk= 0, iat= 128,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2= 171, 172, 173,
 &end
#
#   4 ARG  H       4 ARG  QG      3.26             (#peak   101 #SUP  0.89  #QF  0.50)
 &rst
  ixpk= 101, nxpk= 0, iat=  44,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2=  51,  52,
 &end
#
#   7 LEU  QB      8 CYSS H       3.60             (#peak   101 #SUP  0.89  #QF  0.50)
 &rst
  ixpk= 101, nxpk= 0, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 113, 114,
 &end
#
#   3 PRO  QG      4 ARG  H       4.98             (#peak   102 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 102, nxpk= 0, iat=  -1,  44, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
 igr1=  34,  35,
 &end
#
#   3 PRO  QG      5 LYS  H       5.50             (#peak   103 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 103, nxpk= 0, iat=  -1,  68, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  34,  35,
 &end
#
#  16 LYS  HB2    17 CYSS H       4.75             (#peak   104 #SUP  0.58  #QF  0.58)
 &rst
  ixpk= 104, nxpk= 0, iat= 254, 272, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
#   4 ARG  H       4 ARG  HB2     3.66             (#peak   105 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 105, nxpk= 0, iat=  44,  48, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#   5 LYS  H       5 LYS  HB2     3.76             (#peak   107 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 107, nxpk= 0, iat=  68,  72, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#   4 ARG  H       4 ARG  HB3     3.66             (#peak   108 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 108, nxpk= 0, iat=  44,  49, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#   5 LYS  H       5 LYS  HB3     3.76             (#peak   109 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 109, nxpk= 0, iat=  68,  73, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#   4 ARG  QG      5 LYS  H       5.02             (#peak   110 #SUP  1.00  #QF  0.91)
 &rst
  ixpk= 110, nxpk= 0, iat=  -1,  68, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1=  51,  52,
 &end
#
#   5 LYS  H       5 LYS  QD      5.49             (#peak   110 #SUP  1.00  #QF  0.91)
 &rst
  ixpk= 110, nxpk= 0, iat=  68,  -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr2=  78,  79,
 &end
#
#  16 LYS  HB3    17 CYSS H       4.44             (#peak   111 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 111, nxpk= 0, iat= 255, 272, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#   5 LYS  H       5 LYS  QG      4.35             (#peak   112 #SUP  1.00)
 &rst
  ixpk= 112, nxpk= 0, iat=  68,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2=  75,  76,
 &end
#
#  11 ALA  QB     17 CYSS H       5.25             (#peak   113 #SUP  0.96  #QF  0.91)
 &rst
  ixpk= 113, nxpk= 0, iat=  -1, 272, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 171, 172, 173,
 &end
#
#  17 CYSS H      18 LYS  QG      4.66             (#peak   114 #SUP  0.41  #QF  0.41)
 &rst
  ixpk= 114, nxpk= 0, iat= 272,  -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr2= 289, 290,
 &end
#
#   2 LEU  H       2 LEU  HG      3.96             (#peak   115 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 115, nxpk= 0, iat=  11,  18, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#   2 LEU  H       2 LEU  HB2     4.16             (#peak   116 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 116, nxpk= 0, iat=  11,  15, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#   2 LEU  H       2 LEU  HB3     4.16             (#peak   117 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 117, nxpk= 0, iat=  11,  16, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  14 LYS  HB3    16 LYS  H       5.02             (#peak   118 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 118, nxpk= 0, iat= 226, 250, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#  16 LYS  H      16 LYS  HB3     3.50             (#peak   119 #SUP  0.79  #QF  0.79)
 &rst
  ixpk= 119, nxpk= 0, iat= 250, 255, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  16 LYS  H      16 LYS  HB2     4.07             (#peak   120 #SUP  0.69  #QF  0.69)
 &rst
  ixpk= 120, nxpk= 0, iat= 250, 254, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  14 LYS  HB2    16 LYS  H       5.02             (#peak   121 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 121, nxpk= 0, iat= 225, 250, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#  24 VAL  HB     25 CYSS H       3.47             (#peak   122 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 122, nxpk= 0, iat= 389, 401, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
#  21 LEU  HB3    25 CYSS H       5.50             (#peak   123 #SUP  0.40  #QF  0.40)
 &rst
  ixpk= 123, nxpk= 0, iat= 330, 401, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  23 LEU  HB3    25 CYSS H       5.50             (#peak   124 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 124, nxpk= 0, iat= 371, 401, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  25 CYSS H      26 LYS  QG      5.50             (#peak   125 #SUP  0.53  #QF  0.53)
 &rst
  ixpk= 125, nxpk= 0, iat= 401,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 418, 419,
 &end
#
#  11 ALA  QB     16 LYS  H       4.67             (#peak   126 #SUP  0.94  #QF  0.91)
 &rst
  ixpk= 126, nxpk= 0, iat=  -1, 250, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 171, 172, 173,
 &end
#
#  16 LYS  H      16 LYS  HG2     5.06             (#peak   126 #SUP  0.94  #QF  0.91)
 &rst
  ixpk= 126, nxpk= 0, iat= 250, 257, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
#  16 LYS  H      16 LYS  HG3     5.06             (#peak   127 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 127, nxpk= 0, iat= 250, 258, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
#  24 VAL  QG2    25 CYSS H       4.00             (#peak   128 #SUP  1.00)
 &rst
  ixpk= 128, nxpk= 0, iat=  -1, 401, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 395, 396, 397,
 &end
#
#  21 LEU  QD1    25 CYSS H       5.50             (#peak   129 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 129, nxpk= 0, iat=  -1, 401, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 334, 335, 336,
 &end
#
#  24 VAL  QG1    25 CYSS H       3.74             (#peak   130 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 130, nxpk= 0, iat=  -1, 401, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1= 391, 392, 393,
 &end
#
#  21 LEU  QD2    25 CYSS H       5.50             (#peak   131 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 131, nxpk= 0, iat=  -1, 401, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 338, 339, 340,
 &end
#
#   9 ALA  QB     10 ILE  H       3.13             (#peak   133 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 133, nxpk= 0, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr1= 142, 143, 144,
 &end
#
#  10 ILE  H      11 ALA  QB      4.70             (#peak   135 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 135, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2= 171, 172, 173,
 &end
#
#  11 ALA  QB     12 LYS  H       3.26             (#peak   136 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 136, nxpk= 0, iat=  -1, 177, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr1= 171, 172, 173,
 &end
#
#   6 ILE  QG2     7 LEU  H       3.75             (#peak   138 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 138, nxpk= 0, iat=  -1, 109, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1=  96,  97,  98,
 &end
#
#   7 LEU  H       7 LEU  QD1     4.50             (#peak   139 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 139, nxpk= 0, iat= 109,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 118, 119, 120,
 &end
#
#  10 ILE  H      10 ILE  QG2     3.87             (#peak   140 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 140, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2= 154, 155, 156,
 &end
#
#   7 LEU  H       7 LEU  QD2     4.50             (#peak   141 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 141, nxpk= 0, iat= 109,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 122, 123, 124,
 &end
#
#  10 ILE  H      10 ILE  QD1     3.92             (#peak   142 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 142, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2= 161, 162, 163,
 &end
#
#  24 VAL  QG1    26 LYS  H       5.50             (#peak   146 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 146, nxpk= 0, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 391, 392, 393,
 &end
#
#  10 ILE  QG2    11 ALA  H       3.54             (#peak   147 #SUP  1.00)
 &rst
  ixpk= 147, nxpk= 0, iat=  -1, 167, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr1= 154, 155, 156,
 &end
#
#  10 ILE  QD1    11 ALA  H       4.78             (#peak   148 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 148, nxpk= 0, iat=  -1, 167, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 161, 162, 163,
 &end
#
#  10 ILE  HB     11 ALA  H       3.25             (#peak   149 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 149, nxpk= 0, iat= 152, 167, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
#  13 LYS  QB     14 LYS  H       3.29             (#peak   150 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 150, nxpk= 0, iat=  -1, 221, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
 igr1= 203, 204,
 &end
#
#  14 LYS  H      14 LYS  QG      4.01             (#peak   152 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 152, nxpk= 0, iat= 221,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2= 228, 229,
 &end
#
#  24 VAL  HB     26 LYS  H       5.50             (#peak   154 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 154, nxpk= 0, iat= 389, 411, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  11 ALA  QB     15 GLY  H       5.14             (#peak   155 #SUP  0.53  #QF  0.53)
 &rst
  ixpk= 155, nxpk= 0, iat=  -1, 243, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 171, 172, 173,
 &end
#
#  11 ALA  QB     13 LYS  H       4.62             (#peak   156 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 156, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 171, 172, 173,
 &end
#
#  14 LYS  HB2    15 GLY  H       4.78             (#peak   157 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 157, nxpk= 0, iat= 225, 243, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
#  14 LYS  HB3    15 GLY  H       4.78             (#peak   158 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 158, nxpk= 0, iat= 226, 243, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
#  14 LYS  HD2    15 GLY  H       5.50             (#peak   159 #SUP  0.72  #QF  0.72)
 &rst
  ixpk= 159, nxpk= 0, iat= 231, 243, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  14 LYS  HD3    15 GLY  H       5.50             (#peak   160 #SUP  0.95  #QF  0.65)
 &rst
  ixpk= 160, nxpk= 0, iat= 232, 243, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  15 GLY  H      16 LYS  HB3     5.50             (#peak   160 #SUP  0.95  #QF  0.65)
 &rst
  ixpk= 160, nxpk= 0, iat= 243, 255, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  14 LYS  QG     15 GLY  H       5.50             (#peak   161 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 161, nxpk= 0, iat=  -1, 243, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 228, 229,
 &end
#
#  13 LYS  H      13 LYS  QD      4.84             (#peak   162 #SUP  0.41  #QF  0.41)
 &rst
  ixpk= 162, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 209, 210,
 &end
#
#  10 ILE  QG2    13 LYS  H       5.12             (#peak   164 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 164, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1= 154, 155, 156,
 &end
#
#   9 ALA  H      10 ILE  QD1     5.36             (#peak   165 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 165, nxpk= 0, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr2= 161, 162, 163,
 &end
#
#   6 ILE  QG2     9 ALA  H       4.64             (#peak   166 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 166, nxpk= 0, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1=  96,  97,  98,
 &end
#
#   9 ALA  H      10 ILE  HG13    5.50             (#peak   167 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 167, nxpk= 0, iat= 138, 159, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   9 ALA  H      11 ALA  QB      5.14             (#peak   168 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 168, nxpk= 0, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 171, 172, 173,
 &end
#
#   7 LEU  QB      9 ALA  H       5.15             (#peak   169 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 169, nxpk= 0, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 113, 114,
 &end
#
#   9 ALA  H      10 ILE  HG12    5.50             (#peak   170 #SUP  1.00)
 &rst
  ixpk= 170, nxpk= 0, iat= 138, 158, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   9 ALA  H      10 ILE  HB      5.22             (#peak   171 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 171, nxpk= 0, iat= 138, 152, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
#  18 LYS  H      21 LEU  HB3     3.88             (#peak   173 #SUP  0.81  #QF  0.81)
 &rst
  ixpk= 173, nxpk= 0, iat= 282, 330, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
#  18 LYS  H      21 LEU  HG      5.50             (#peak   174 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 174, nxpk= 0, iat= 282, 332, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  26 LYS  QD     27 CYSS H       4.44             (#peak   175 #SUP  0.98  #QF  0.97)
 &rst
  ixpk= 175, nxpk= 0, iat=  -1, 433, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 421, 422,
 &end
#
#  18 LYS  H      21 LEU  HB2     4.16             (#peak   176 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 176, nxpk= 0, iat= 282, 329, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  22 LYS  QD     27 CYSS H       4.76             (#peak   177 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 177, nxpk= 0, iat=  -1, 433, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 354, 355,
 &end
#
#  26 LYS  QG     27 CYSS H       4.31             (#peak   178 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 178, nxpk= 0, iat=  -1, 433, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 418, 419,
 &end
#
#  22 LYS  QG     27 CYSS H       5.09             (#peak   179 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 179, nxpk= 0, iat=  -1, 433, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 351, 352,
 &end
#
#  18 LYS  H      18 LYS  QG      4.21             (#peak   180 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 180, nxpk= 0, iat= 282,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 289, 290,
 &end
#
#  18 LYS  H      21 LEU  QD1     5.12             (#peak   181 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 181, nxpk= 0, iat= 282,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr2= 334, 335, 336,
 &end
#
#  18 LYS  H      21 LEU  QD2     5.12             (#peak   182 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 182, nxpk= 0, iat= 282,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr2= 338, 339, 340,
 &end
#
#  21 LEU  H      24 VAL  QG2     4.93             (#peak   183 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 183, nxpk= 0, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr2= 395, 396, 397,
 &end
#
#  22 LYS  H      24 VAL  QG2     5.09             (#peak   184 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 184, nxpk= 0, iat= 344,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2= 395, 396, 397,
 &end
#
#  21 LEU  H      21 LEU  QD1     4.36             (#peak   185 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 185, nxpk= 0, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 334, 335, 336,
 &end
#
#  21 LEU  QD1    22 LYS  H       5.09             (#peak   186 #SUP  0.69  #QF  0.69)
 &rst
  ixpk= 186, nxpk= 0, iat=  -1, 344, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 334, 335, 336,
 &end
#
#  21 LEU  H      21 LEU  QD2     4.36             (#peak   187 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 187, nxpk= 0, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 338, 339, 340,
 &end
#
#  21 LEU  QD2    22 LYS  H       5.09             (#peak   188 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 188, nxpk= 0, iat=  -1, 344, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 338, 339, 340,
 &end
#
#  22 LYS  H      22 LYS  QG      4.36             (#peak   189 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 189, nxpk= 0, iat= 344,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr2= 351, 352,
 &end
#
#  21 LEU  H      21 LEU  HB2     3.60             (#peak   190 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 190, nxpk= 0, iat= 325, 329, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  22 LYS  H      22 LYS  HB2     3.29             (#peak   191 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 191, nxpk= 0, iat= 344, 348, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#  21 LEU  H      21 LEU  HB3     3.19             (#peak   192 #SUP  0.74  #QF  0.74)
 &rst
  ixpk= 192, nxpk= 0, iat= 325, 330, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,  &end
#
#  22 LYS  H      22 LYS  HB3     3.35             (#peak   194 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 194, nxpk= 0, iat= 344, 349, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#  21 LEU  HB3    22 LYS  H       4.31             (#peak   195 #SUP  0.49  #QF  0.49)
 &rst
  ixpk= 195, nxpk= 0, iat= 330, 344, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  20 PRO  HG2    21 LEU  H       4.80             (#peak   196 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 196, nxpk= 0, iat= 315, 325, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   3 PRO  QG      6 ILE  H       4.74             (#peak   198 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 198, nxpk= 0, iat=  -1,  90, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1=  34,  35,
 &end
#
#   6 ILE  H       6 ILE  HB      3.21             (#peak   199 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 199, nxpk= 0, iat=  90,  94, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#   5 LYS  HB2     6 ILE  H       4.73             (#peak   200 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 200, nxpk= 0, iat=  72,  90, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
#  22 LYS  HB3    23 LEU  H       3.82             (#peak   201 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 201, nxpk= 0, iat= 349, 366, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#  23 LEU  H      23 LEU  HB2     3.02             (#peak   202 #SUP  0.70  #QF  0.70)
 &rst
  ixpk= 202, nxpk= 0, iat= 366, 370, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,  &end
#
#  24 VAL  H      24 VAL  HB      3.26             (#peak   203 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 203, nxpk= 0, iat= 385, 389, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
#   4 ARG  QG      4 ARG  HE      4.17             (#peak   204 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 204, nxpk= 0, iat=  -1,  57, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr1=  51,  52,
 &end
#
#  23 LEU  H      23 LEU  HB3     3.12             (#peak   205 #SUP  0.80  #QF  0.72)
 &rst
  ixpk= 205, nxpk= 0, iat= 366, 371, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  23 LEU  HB3    24 VAL  H       3.50             (#peak   205 #SUP  0.80  #QF  0.72)
 &rst
  ixpk= 205, nxpk= 0, iat= 371, 385, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  22 LYS  HB2    23 LEU  H       4.13             (#peak   206 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 206, nxpk= 0, iat= 348, 366, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#   5 LYS  HB3     6 ILE  H       4.73             (#peak   207 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 207, nxpk= 0, iat=  73,  90, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
#   5 LYS  QD      6 ILE  H       4.89             (#peak   208 #SUP  0.86  #QF  0.30)
 &rst
  ixpk= 208, nxpk= 0, iat=  -1,  90, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1=  78,  79,
 &end
#
#   6 ILE  H       7 LEU  QB      5.16             (#peak   208 #SUP  0.86  #QF  0.30)
 &rst
  ixpk= 208, nxpk= 0, iat=  90,  -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr2= 113, 114,
 &end
#
#   6 ILE  H       6 ILE  HG12    4.00             (#peak   209 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 209, nxpk= 0, iat=  90, 100, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  20 PRO  HG3    21 LEU  H       4.80             (#peak   210 #SUP  0.74  #QF  0.74)
 &rst
  ixpk= 210, nxpk= 0, iat= 316, 325, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   5 LYS  QG      6 ILE  H       5.31             (#peak   211 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 211, nxpk= 0, iat=  -1,  90, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr1=  75,  76,
 &end
#
#   6 ILE  H       6 ILE  HG13    4.00             (#peak   213 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 213, nxpk= 0, iat=  90, 101, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  22 LYS  QG     23 LEU  H       5.17             (#peak   214 #SUP  0.82  #QF  0.82)
 &rst
  ixpk= 214, nxpk= 0, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 351, 352,
 &end
#
#  22 LYS  QD     23 LEU  H       5.23             (#peak   215 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 215, nxpk= 0, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 354, 355,
 &end
#
#  24 VAL  H      24 VAL  QG2     2.84             (#peak   216 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 216, nxpk= 0, iat= 385,  -1, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,
 igr2= 395, 396, 397,
 &end
#
#  24 VAL  H      24 VAL  QG1     3.93             (#peak   217 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 217, nxpk= 0, iat= 385,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 391, 392, 393,
 &end
#
#   6 ILE  H       6 ILE  QD1     4.37             (#peak   219 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 219, nxpk= 0, iat=  90,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 103, 104, 105,
 &end
#
#   6 ILE  H       6 ILE  QG2     3.87             (#peak   220 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 220, nxpk= 0, iat=  90,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2=  96,  97,  98,
 &end
#
#   4 ARG  HE     24 VAL  QG1     4.90             (#peak   221 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 221, nxpk= 0, iat=  57,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 391, 392, 393,
 &end
#
#  10 ILE  QG2    16 LYS  H       5.50             (#peak   222 #SUP  0.48  #QF  0.48)
 &rst
  ixpk= 222, nxpk= 0, iat=  -1, 250, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 154, 155, 156,
 &end
#
#   2 LEU  H       3 PRO  HD2     5.36             (#peak   225 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 225, nxpk= 0, iat=  11,  31, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#   3 PRO  HD2     4 ARG  H       5.50             (#peak   226 #SUP  0.82  #QF  0.82)
 &rst
  ixpk= 226, nxpk= 0, iat=  31,  44, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  17 CYSS H      27 CYSS HB2     5.50             (#peak   227 #SUP  0.76  #QF  0.76)
 &rst
  ixpk= 227, nxpk= 0, iat= 272, 437, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  17 CYSS H      27 CYSS HB3     5.50             (#peak   228 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 228, nxpk= 0, iat= 272, 438, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   5 LYS  H       5 LYS  QE      5.50             (#peak   229 #SUP  0.67  #QF  0.53)
 &rst
  ixpk= 229, nxpk= 0, iat=  68,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  81,  82,
 &end
#
#  16 LYS  QE     17 CYSS H       5.50             (#peak   229 #SUP  0.67  #QF  0.53)
 &rst
  ixpk= 229, nxpk= 0, iat=  -1, 272, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 263, 264,
 &end
#
#   8 CYSS H       8 CYSS HB3     3.59             (#peak   230 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 230, nxpk= 0, iat= 128, 133, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#   4 ARG  H       4 ARG  QD      4.70             (#peak   231 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 231, nxpk= 0, iat=  44,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2=  54,  55,
 &end
#
#  16 LYS  H      17 CYSS HB3     5.50             (#peak   232 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 232, nxpk= 0, iat= 250, 277, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  16 LYS  H      17 CYSS HB2     5.19             (#peak   233 #SUP  0.82  #QF  0.82)
 &rst
  ixpk= 233, nxpk= 0, iat= 250, 276, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
#  12 LYS  H      17 CYSS HB2     5.04             (#peak   234 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 234, nxpk= 0, iat= 177, 276, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
#  17 CYSS HB2    18 LYS  H       4.43             (#peak   235 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 235, nxpk= 0, iat= 276, 282, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#   7 LEU  H       8 CYSS HB2     5.31             (#peak   236 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 236, nxpk= 0, iat= 109, 132, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
#   3 PRO  HD2     7 LEU  H       5.25             (#peak   237 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 237, nxpk= 0, iat=  31, 109, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
#  12 LYS  H      17 CYSS HB3     5.50             (#peak   238 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 238, nxpk= 0, iat= 177, 277, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  25 CYSS HB3    26 LYS  H       4.15             (#peak   239 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 239, nxpk= 0, iat= 406, 411, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  25 CYSS H      25 CYSS HB2     3.80             (#peak   240 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 240, nxpk= 0, iat= 401, 405, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  25 CYSS HB2    26 LYS  H       4.13             (#peak   241 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 241, nxpk= 0, iat= 405, 411, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  12 LYS  QE     13 LYS  H       5.50             (#peak   242 #SUP  0.76  #QF  0.43)
 &rst
  ixpk= 242, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 190, 191,
 &end
#
#  13 LYS  H      13 LYS  QE      5.50             (#peak   242 #SUP  0.76  #QF  0.43)
 &rst
  ixpk= 242, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 212, 213,
 &end
#
#   8 CYSS HB3     9 ALA  H       4.14             (#peak   243 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 243, nxpk= 0, iat= 133, 138, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#   8 CYSS HB2     9 ALA  H       4.11             (#peak   244 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 244, nxpk= 0, iat= 132, 138, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  25 CYSS HB3    27 CYSS H       5.36             (#peak   245 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 245, nxpk= 0, iat= 406, 433, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#  17 CYSS HB3    18 LYS  H       4.35             (#peak   246 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 246, nxpk= 0, iat= 277, 282, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#  24 VAL  H      25 CYSS HB3     5.15             (#peak   249 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 249, nxpk= 0, iat= 385, 406, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
#  24 VAL  H      25 CYSS HB2     5.50             (#peak   250 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 250, nxpk= 0, iat= 385, 405, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  26 LYS  QE     27 CYSS H       5.21             (#peak   251 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 251, nxpk= 0, iat=  -1, 433, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 424, 425,
 &end
#
#   3 PRO  HD2     6 ILE  H       5.12             (#peak   252 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 252, nxpk= 0, iat=  31,  90, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
#  17 CYSS HB3    22 LYS  H       5.50             (#peak   253 #SUP  0.49  #QF  0.49)
 &rst
  ixpk= 253, nxpk= 0, iat= 277, 344, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  18 LYS  HA     19 GLY  H       2.99             (#peak   255 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 255, nxpk= 0, iat= 284, 304, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
#  16 LYS  HA     17 CYSS H       3.35             (#peak   256 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 256, nxpk= 0, iat= 252, 272, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#   8 CYSS H       9 ALA  HA      5.50             (#peak   257 #SUP  0.47  #QF  0.47)
 &rst
  ixpk= 257, nxpk= 0, iat= 128, 140, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  15 GLY  HA2    17 CYSS H       5.32             (#peak   258 #SUP  0.36  #QF  0.36)
 &rst
  ixpk= 258, nxpk= 0, iat= 245, 272, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
#   2 LEU  H       3 PRO  HD3     5.09             (#peak   260 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 260, nxpk= 0, iat=  11,  32, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
#  11 ALA  HA     16 LYS  H       4.21             (#peak   262 #SUP  0.97  #QF  0.22)
 &rst
  ixpk= 262, nxpk= 0, iat= 169, 250, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  13 LYS  HA     15 GLY  H       5.12             (#peak   265 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 265, nxpk= 0, iat= 201, 243, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
#  14 LYS  HA     16 LYS  H       4.81             (#peak   266 #SUP  0.73  #QF  0.73)
 &rst
  ixpk= 266, nxpk= 0, iat= 223, 250, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#  21 LEU  HA     25 CYSS H       4.29             (#peak   267 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 267, nxpk= 0, iat= 327, 401, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  23 LEU  HA     25 CYSS H       4.70             (#peak   269 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 269, nxpk= 0, iat= 368, 401, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#   8 CYSS HA     10 ILE  H       5.02             (#peak   270 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 270, nxpk= 0, iat= 130, 148, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#  10 ILE  H      11 ALA  HA      5.50             (#peak   272 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 272, nxpk= 0, iat= 148, 169, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   8 CYSS HA     12 LYS  H       5.03             (#peak   275 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 275, nxpk= 0, iat= 130, 177, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
#   8 CYSS HA     11 ALA  H       3.87             (#peak   276 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 276, nxpk= 0, iat= 130, 167, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
#   3 PRO  HA      7 LEU  H       5.50             (#peak   277 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 277, nxpk= 0, iat=  40, 109, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  26 LYS  H      27 CYSS HA      5.50             (#peak   278 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 278, nxpk= 0, iat= 411, 435, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  23 LEU  HA     26 LYS  H       5.50             (#peak   279 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 279, nxpk= 0, iat= 368, 411, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  11 ALA  HA     14 LYS  H       4.86             (#peak   281 #SUP  0.94  #QF  0.93)
 &rst
  ixpk= 281, nxpk= 0, iat= 169, 221, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
#  14 LYS  H      15 GLY  HA2     4.90             (#peak   282 #SUP  0.62  #QF  0.62)
 &rst
  ixpk= 282, nxpk= 0, iat= 221, 245, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
#   7 LEU  HA     11 ALA  H       4.53             (#peak   283 #SUP  0.85  #QF  0.85)
 &rst
  ixpk= 283, nxpk= 0, iat= 111, 167, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  10 ILE  HA     14 LYS  H       5.30             (#peak   285 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 285, nxpk= 0, iat= 150, 221, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#  22 LYS  HA     26 LYS  H       5.01             (#peak   287 #SUP  0.99  #QF  0.81)
 &rst
  ixpk= 287, nxpk= 0, iat= 346, 411, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
#  11 ALA  HA     13 LYS  H       4.82             (#peak   289 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 289, nxpk= 0, iat= 169, 199, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#  10 ILE  HA     13 LYS  H       3.83             (#peak   290 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 290, nxpk= 0, iat= 150, 199, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  13 LYS  H      14 LYS  HA      5.50             (#peak   291 #SUP  0.80  #QF  0.80)
 &rst
  ixpk= 291, nxpk= 0, iat= 199, 223, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  15 GLY  H      16 LYS  HA      5.50             (#peak   292 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 292, nxpk= 0, iat= 243, 252, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  14 LYS  HA     15 GLY  H       3.57             (#peak   293 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 293, nxpk= 0, iat= 223, 243, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#   6 ILE  HA      9 ALA  H       3.84             (#peak   294 #SUP  0.77  #QF  0.77)
 &rst
  ixpk= 294, nxpk= 0, iat=  92, 138, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#   4 ARG  HA      7 LEU  H       3.59             (#peak   295 #SUP  0.81  #QF  0.35)
 &rst
  ixpk= 295, nxpk= 0, iat=  46, 109, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#   7 LEU  HA      9 ALA  H       4.55             (#peak   296 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 296, nxpk= 0, iat= 111, 138, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#   9 ALA  H      10 ILE  HA      5.32             (#peak   297 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 297, nxpk= 0, iat= 138, 150, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
#  17 CYSS HA     18 LYS  H       2.80             (#peak   299 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 299, nxpk= 0, iat= 274, 282, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  26 LYS  HA     27 CYSS H       2.97             (#peak   300 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 300, nxpk= 0, iat= 413, 433, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47,  &end
#
#  22 LYS  HA     27 CYSS H       3.54             (#peak   301 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 301, nxpk= 0, iat= 346, 433, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#  20 PRO  HD2    21 LEU  H       4.15             (#peak   302 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 302, nxpk= 0, iat= 312, 325, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  20 PRO  HD3    21 LEU  H       4.15             (#peak   303 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 303, nxpk= 0, iat= 313, 325, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  19 GLY  HA3    22 LYS  H       5.27             (#peak   304 #SUP  0.57  #QF  0.57)
 &rst
  ixpk= 304, nxpk= 0, iat= 307, 344, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
#  19 GLY  HA2    22 LYS  H       5.27             (#peak   307 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 307, nxpk= 0, iat= 306, 344, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
#  20 PRO  HA     22 LYS  H       4.66             (#peak   309 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 309, nxpk= 0, iat= 321, 344, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#  18 LYS  HA     22 LYS  H       4.66             (#peak   310 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 310, nxpk= 0, iat= 284, 344, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#   3 PRO  HA      6 ILE  H       5.40             (#peak   311 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 311, nxpk= 0, iat=  40,  90, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
#  21 LEU  HA     24 VAL  H       3.57             (#peak   313 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 313, nxpk= 0, iat= 327, 385, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#  20 PRO  HA     23 LEU  H       4.13             (#peak   315 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 315, nxpk= 0, iat= 321, 366, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  18 LYS  HA     23 LEU  H       5.50             (#peak   316 #SUP  0.77  #QF  0.77)
 &rst
  ixpk= 316, nxpk= 0, iat= 284, 366, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   6 ILE  H       9 ALA  H       5.47             (#peak   317 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 317, nxpk= 0, iat=  90, 138, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
#  23 LEU  H      27 CYSS H       5.50             (#peak   318 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 318, nxpk= 0, iat= 366, 433, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  21 LEU  H      23 LEU  H       5.48             (#peak   319 #SUP  1.00  #QF  0.89)
 &rst
  ixpk= 319, nxpk= 0, iat= 325, 366, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
#  21 LEU  H      24 VAL  H       5.50             (#peak   319 #SUP  1.00  #QF  0.89)
 &rst
  ixpk= 319, nxpk= 0, iat= 325, 385, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   2 LEU  HA      3 PRO  HD3     3.09             (#peak   320 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 320, nxpk= 0, iat=  13,  32, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
#   1 GLY  QA      2 LEU  HA      4.84             (#peak   321 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 321, nxpk= 0, iat=  -1,  13, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1=   6,   7,
 &end
#
#   2 LEU  HA      3 PRO  HD2     3.35             (#peak   322 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 322, nxpk= 0, iat=  13,  31, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#   2 LEU  HA      3 PRO  QG      4.51             (#peak   323 #SUP  1.00)
 &rst
  ixpk= 323, nxpk= 0, iat=  13,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2=  34,  35,
 &end
#
#   2 LEU  HA      6 ILE  HB      5.35             (#peak   324 #SUP  0.47  #QF  0.47)
 &rst
  ixpk= 324, nxpk= 0, iat=  13,  94, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#   7 LEU  HA      8 CYSS HA      5.50             (#peak   329 #SUP  0.64  #QF  0.32)
 &rst
  ixpk= 329, nxpk= 0, iat= 111, 130, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  18 LYS  HA     22 LYS  HA      5.50             (#peak   329 #SUP  0.64  #QF  0.32)
 &rst
  ixpk= 329, nxpk= 0, iat= 284, 346, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   3 PRO  HA      4 ARG  HA      5.29             (#peak   330 #SUP  0.90  #QF  0.52)
 &rst
  ixpk= 330, nxpk= 0, iat=  40,  46, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
#  15 GLY  HA3    16 LYS  HA      5.46             (#peak   333 #SUP  0.69  #QF  0.69)
 &rst
  ixpk= 333, nxpk= 0, iat= 246, 252, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
#  12 LYS  HA     17 CYSS HB3     5.14             (#peak   338 #SUP  0.93  #QF  0.61)
 &rst
  ixpk= 338, nxpk= 0, iat= 179, 277, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#  17 CYSS HB3    22 LYS  HA      5.44             (#peak   338 #SUP  0.93  #QF  0.61)
 &rst
  ixpk= 338, nxpk= 0, iat= 277, 346, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,  &end
#
#  22 LYS  HA     27 CYSS HB2     3.98             (#peak   340 #SUP  0.81  #QF  0.81)
 &rst
  ixpk= 340, nxpk= 0, iat= 346, 437, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  22 LYS  HA     27 CYSS HB3     3.98             (#peak   341 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 341, nxpk= 0, iat= 346, 438, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  17 CYSS HB3    27 CYSS HB2     4.46             (#peak   344 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 344, nxpk= 0, iat= 277, 437, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
#  17 CYSS HB3    27 CYSS HB3     4.46             (#peak   345 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 345, nxpk= 0, iat= 277, 438, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
#   4 ARG  HA      4 ARG  QD      4.10             (#peak   347 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 347, nxpk= 0, iat=  46,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr2=  54,  55,
 &end
#
#   5 LYS  HA      8 CYSS HB3     4.27             (#peak   349 #SUP  0.63  #QF  0.63)
 &rst
  ixpk= 349, nxpk= 0, iat=  70, 133, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#   8 CYSS HB3     9 ALA  HA      5.07             (#peak   350 #SUP  0.52  #QF  0.52)
 &rst
  ixpk= 350, nxpk= 0, iat= 133, 140, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
#   9 ALA  HA     12 LYS  QE      5.50             (#peak   351 #SUP  0.41  #QF  0.41)
 &rst
  ixpk= 351, nxpk= 0, iat= 140,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 190, 191,
 &end
#
#   8 CYSS HA     12 LYS  QE      4.46             (#peak   354 #SUP  0.47  #QF  0.47)
 &rst
  ixpk= 354, nxpk= 0, iat= 130,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 190, 191,
 &end
#
#  12 LYS  HA     17 CYSS HB2     4.97             (#peak   360 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 360, nxpk= 0, iat= 179, 276, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
#  17 CYSS HB2    27 CYSS HB2     5.50             (#peak   363 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 363, nxpk= 0, iat= 276, 437, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  17 CYSS HB2    27 CYSS HB3     5.50             (#peak   364 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 364, nxpk= 0, iat= 276, 438, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   5 LYS  HA      8 CYSS HB2     4.29             (#peak   365 #SUP  0.74  #QF  0.74)
 &rst
  ixpk= 365, nxpk= 0, iat=  70, 132, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  21 LEU  HA     24 VAL  HB      3.70             (#peak   370 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 370, nxpk= 0, iat= 327, 389, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#   3 PRO  HD2     6 ILE  HB      3.86             (#peak   376 #SUP  0.57  #QF  0.57)
 &rst
  ixpk= 376, nxpk= 0, iat=  31,  94, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  10 ILE  HA     13 LYS  QB      3.72             (#peak   377 #SUP  0.88  #QF  0.88)
 &rst
  ixpk= 377, nxpk= 0, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2= 203, 204,
 &end
#
#  10 ILE  HA     10 ILE  HG12    4.01             (#peak   380 #SUP  1.00)
 &rst
  ixpk= 380, nxpk= 0, iat= 150, 158, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  10 ILE  HA     13 LYS  QD      4.55             (#peak   381 #SUP  0.43  #QF  0.43)
 &rst
  ixpk= 381, nxpk= 0, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
 igr2= 209, 210,
 &end
#
#   9 ALA  QB     10 ILE  HA      4.35             (#peak   382 #SUP  0.94  #QF  0.92)
 &rst
  ixpk= 382, nxpk= 0, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 142, 143, 144,
 &end
#
#  10 ILE  HA     10 ILE  HG13    4.01             (#peak   383 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 383, nxpk= 0, iat= 150, 159, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  10 ILE  HA     10 ILE  QG2     3.11             (#peak   384 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 384, nxpk= 0, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr2= 154, 155, 156,
 &end
#
#  10 ILE  HA     10 ILE  QD1     4.01             (#peak   385 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 385, nxpk= 0, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 161, 162, 163,
 &end
#
#  22 LYS  HA     22 LYS  QG      4.22             (#peak   386 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 386, nxpk= 0, iat= 346,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr2= 351, 352,
 &end
#
#   6 ILE  HA      6 ILE  HG13    4.11             (#peak   387 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 387, nxpk= 0, iat=  92, 101, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  11 ALA  HA     16 LYS  HB2     5.50             (#peak   388 #SUP  0.97  #QF  0.95)
 &rst
  ixpk= 388, nxpk= 0, iat= 169, 254, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  15 GLY  HA2    16 LYS  HB2     5.50             (#peak   388 #SUP  0.97  #QF  0.95)
 &rst
  ixpk= 388, nxpk= 0, iat= 245, 254, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  11 ALA  HA     16 LYS  HB3     4.29             (#peak   391 #SUP  0.58  #QF  0.58)
 &rst
  ixpk= 391, nxpk= 0, iat= 169, 255, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#   6 ILE  HA      6 ILE  HG12    4.11             (#peak   395 #SUP  0.93  #QF  0.74)
 &rst
  ixpk= 395, nxpk= 0, iat=  92, 100, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#   6 ILE  HA      9 ALA  QB      4.13             (#peak   395 #SUP  0.93  #QF  0.74)
 &rst
  ixpk= 395, nxpk= 0, iat=  92,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 142, 143, 144,
 &end
#
#   4 ARG  HA      4 ARG  QG      3.43             (#peak   399 #SUP  0.83  #QF  0.78)
 &rst
  ixpk= 399, nxpk= 0, iat=  46,  -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr2=  51,  52,
 &end
#
#   4 ARG  HA      7 LEU  QB      3.53             (#peak   399 #SUP  0.83  #QF  0.78)
 &rst
  ixpk= 399, nxpk= 0, iat=  46,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 113, 114,
 &end
#
#   4 ARG  HA      7 LEU  HG      5.02             (#peak   400 #SUP  0.71  #QF  0.33)
 &rst
  ixpk= 400, nxpk= 0, iat=  46, 116, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#   5 LYS  HA      5 LYS  QG      4.19             (#peak   401 #SUP  0.83  #QF  0.54)
 &rst
  ixpk= 401, nxpk= 0, iat=  70,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr2=  75,  76,
 &end
#
#  11 ALA  QB     12 LYS  HA      4.11             (#peak   402 #SUP  0.69  #QF  0.69)
 &rst
  ixpk= 402, nxpk= 0, iat=  -1, 179, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 171, 172, 173,
 &end
#
#  21 LEU  HA     21 LEU  HG      4.06             (#peak   409 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 409, nxpk= 0, iat= 327, 332, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#  13 LYS  HA     13 LYS  QD      4.44             (#peak   410 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 410, nxpk= 0, iat= 201,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2= 209, 210,
 &end
#
#  26 LYS  HA     26 LYS  QG      3.88             (#peak   412 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 412, nxpk= 0, iat= 413,  -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr2= 418, 419,
 &end
#
#  14 LYS  HA     14 LYS  QG      4.00             (#peak   413 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 413, nxpk= 0, iat= 223,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 228, 229,
 &end
#
#  11 ALA  QB     17 CYSS HA      3.63             (#peak   414 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 414, nxpk= 0, iat=  -1, 274, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1= 171, 172, 173,
 &end
#
#  18 LYS  HA     22 LYS  QG      5.32             (#peak   418 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 418, nxpk= 0, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2= 351, 352,
 &end
#
#   8 CYSS HA     11 ALA  QB      3.37             (#peak   419 #SUP  0.83  #QF  0.83)
 &rst
  ixpk= 419, nxpk= 0, iat= 130,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2= 171, 172, 173,
 &end
#
#  18 LYS  HA     22 LYS  QD      4.75             (#peak   420 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 420, nxpk= 0, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2= 354, 355,
 &end
#
#  18 LYS  HA     22 LYS  HB3     4.25             (#peak   422 #SUP  0.95  #QF  0.64)
 &rst
  ixpk= 422, nxpk= 0, iat= 284, 349, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  20 PRO  HA     23 LEU  HB2     4.65             (#peak   430 #SUP  0.91  #QF  0.91)
 &rst
  ixpk= 430, nxpk= 0, iat= 321, 370, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#  17 CYSS HA     21 LEU  HB3     4.43             (#peak   431 #SUP  0.73  #QF  0.73)
 &rst
  ixpk= 431, nxpk= 0, iat= 274, 330, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#  14 LYS  HA     14 LYS  HD2     4.27             (#peak   433 #SUP  0.58  #QF  0.58)
 &rst
  ixpk= 433, nxpk= 0, iat= 223, 231, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#  14 LYS  HA     14 LYS  HD3     4.27             (#peak   434 #SUP  0.63  #QF  0.63)
 &rst
  ixpk= 434, nxpk= 0, iat= 223, 232, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#  23 LEU  HA     23 LEU  HG      3.87             (#peak   435 #SUP  0.98  #QF  0.94)
 &rst
  ixpk= 435, nxpk= 0, iat= 368, 373, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
#  16 LYS  HB3    17 CYSS HA      5.35             (#peak   436 #SUP  0.87  #QF  0.57)
 &rst
  ixpk= 436, nxpk= 0, iat= 255, 274, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#  17 CYSS HA     21 LEU  HB2     5.50             (#peak   436 #SUP  0.87  #QF  0.57)
 &rst
  ixpk= 436, nxpk= 0, iat= 274, 329, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  20 PRO  HA     23 LEU  HB3     4.44             (#peak   437 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 437, nxpk= 0, iat= 321, 371, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#   2 LEU  HB3     3 PRO  HD2     4.43             (#peak   438 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 438, nxpk= 0, iat=  16,  31, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#   2 LEU  HB2     3 PRO  HD2     4.43             (#peak   439 #SUP  0.88  #QF  0.64)
 &rst
  ixpk= 439, nxpk= 0, iat=  15,  31, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#   4 ARG  QD     24 VAL  HB      4.88             (#peak   440 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 440, nxpk= 0, iat=  -1, 389, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr1=  54,  55,
 &end
#
#  11 ALA  QB     17 CYSS HB2     4.03             (#peak   444 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 444, nxpk= 0, iat=  -1, 276, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 171, 172, 173,
 &end
#
#  12 LYS  QG     17 CYSS HB2     5.50             (#peak   445 #SUP  0.78  #QF  0.78)
 &rst
  ixpk= 445, nxpk= 0, iat=  -1, 276, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 184, 185,
 &end
#
#  17 CYSS HB2    22 LYS  HB2     5.45             (#peak   446 #SUP  0.27  #QF  0.27)
 &rst
  ixpk= 446, nxpk= 0, iat= 276, 348, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
#  10 ILE  QG2    10 ILE  HG13    3.67             (#peak   451 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 451, nxpk= 0, iat=  -1, 159, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 154, 155, 156,
 &end
#
#   6 ILE  QG2     6 ILE  HG13    3.75             (#peak   453 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 453, nxpk= 0, iat=  -1, 101, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1=  96,  97,  98,
 &end
#
#   6 ILE  QG2     6 ILE  QD1     3.31             (#peak   454 #SUP  0.76  #QF  0.58)
 &rst
  ixpk= 454, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr1=  96,  97,  98,
 igr2= 103, 104, 105,
 &end
#
#   6 ILE  QG2    10 ILE  QD1     3.81             (#peak   454 #SUP  0.76  #QF  0.58)
 &rst
  ixpk= 454, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1=  96,  97,  98,
 igr2= 161, 162, 163,
 &end
#
#   5 LYS  QG      6 ILE  QD1     4.31             (#peak   456 #SUP  0.65  #QF  0.65)
 &rst
  ixpk= 456, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1=  75,  76,
 igr2= 103, 104, 105,
 &end
#
#  11 ALA  QB     21 LEU  QD1     3.60             (#peak   457 #SUP  0.89  #QF  0.89)
 &rst
  ixpk= 457, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 171, 172, 173,
 igr2= 334, 335, 336,
 &end
#
#  11 ALA  QB     21 LEU  QD2     3.60             (#peak   459 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 459, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 171, 172, 173,
 igr2= 338, 339, 340,
 &end
#
#  10 ILE  QG2    14 LYS  QG      4.51             (#peak   460 #SUP  0.87  #QF  0.87)
 &rst
  ixpk= 460, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr1= 154, 155, 156,
 igr2= 228, 229,
 &end
#
#   4 ARG  QG     24 VAL  QG2     4.57             (#peak   461 #SUP  0.81  #QF  0.41)
 &rst
  ixpk= 461, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr1=  51,  52,
 igr2= 395, 396, 397,
 &end
#
#  23 LEU  HB3    24 VAL  QG2     4.81             (#peak   461 #SUP  0.81  #QF  0.41)
 &rst
  ixpk= 461, nxpk= 0, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr2= 395, 396, 397,
 &end
#
#  23 LEU  HB2    24 VAL  QG2     5.50             (#peak   462 #SUP  0.94  #QF  0.69)
 &rst
  ixpk= 462, nxpk= 0, iat= 370,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 395, 396, 397,
 &end
#
#   3 PRO  QG      6 ILE  QD1     4.16             (#peak   465 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 465, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=  34,  35,
 igr2= 103, 104, 105,
 &end
#
#  22 LYS  HB2    22 LYS  QD      3.15             (#peak   476 #SUP  0.84  #QF  0.70)
 &rst
  ixpk= 476, nxpk= 0, iat= 348,  -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
 igr2= 354, 355,
 &end
#
#  10 ILE  HB     10 ILE  QD1     3.39             (#peak   494 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 494, nxpk= 0, iat= 152,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2= 161, 162, 163,
 &end
#
#  21 LEU  HB3    21 LEU  QD1     4.19             (#peak   495 #SUP  0.72  #QF  0.59)
 &rst
  ixpk= 495, nxpk= 0, iat= 330,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 334, 335, 336,
 &end
#
#   6 ILE  QG2     6 ILE  HG12    3.75             (#peak   497 #SUP  0.93  #QF  0.79)
 &rst
  ixpk= 497, nxpk= 0, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1=  96,  97,  98,
 &end
#
#   6 ILE  QG2     9 ALA  QB      3.99             (#peak   497 #SUP  0.93  #QF  0.79)
 &rst
  ixpk= 497, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1=  96,  97,  98,
 igr2= 142, 143, 144,
 &end
#
#   7 LEU  QB      7 LEU  QD2     3.48             (#peak   499 #SUP  0.99  #QF  0.94)
 &rst
  ixpk= 499, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1= 113, 114,
 igr2= 122, 123, 124,
 &end
#
#  10 ILE  QG2    10 ILE  HG12    3.67             (#peak   502 #SUP  0.93  #QF  0.89)
 &rst
  ixpk= 502, nxpk= 0, iat=  -1, 158, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 154, 155, 156,
 &end
#
#   3 PRO  HD2     6 ILE  QG2     4.78             (#peak   503 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 503, nxpk= 0, iat=  31,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2=  96,  97,  98,
 &end
#
#   3 PRO  HD2     6 ILE  QD1     4.14             (#peak   505 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 505, nxpk= 0, iat=  31,  -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr2= 103, 104, 105,
 &end
#
#   4 ARG  QD     24 VAL  QG1     3.77             (#peak   506 #SUP  0.90  #QF  0.90)
 &rst
  ixpk= 506, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1=  54,  55,
 igr2= 391, 392, 393,
 &end
#
#   4 ARG  QD     24 VAL  QG2     4.45             (#peak   507 #SUP  0.95  #QF  0.95)
 &rst
  ixpk= 507, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=  54,  55,
 igr2= 395, 396, 397,
 &end
#
#  24 VAL  QG1    25 CYSS HB2     4.15             (#peak   508 #SUP  0.28  #QF  0.28)
 &rst
  ixpk= 508, nxpk= 0, iat=  -1, 405, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 391, 392, 393,
 &end
#
#  10 ILE  QG2    14 LYS  QE      3.94             (#peak   509 #SUP  0.56  #QF  0.56)
 &rst
  ixpk= 509, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1= 154, 155, 156,
 igr2= 234, 235,
 &end
#
#  11 ALA  QB     17 CYSS HB3     4.45             (#peak   510 #SUP  0.98  #QF  0.98)
 &rst
  ixpk= 510, nxpk= 0, iat=  -1, 277, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 171, 172, 173,
 &end
#
#  10 ILE  QG2    11 ALA  HA      4.07             (#peak   512 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 512, nxpk= 0, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1= 154, 155, 156,
 &end
#
#  24 VAL  HA     24 VAL  QG2     3.17             (#peak   514 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 514, nxpk= 0, iat= 387,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2= 395, 396, 397,
 &end
#
#  24 VAL  HA     24 VAL  QG1     3.05             (#peak   515 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 515, nxpk= 0, iat= 387,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2= 391, 392, 393,
 &end
#
#   6 ILE  HA      6 ILE  QG2     3.15             (#peak   516 #SUP  0.99  #QF  0.99)
 &rst
  ixpk= 516, nxpk= 0, iat=  92,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr2=  96,  97,  98,
 &end
#
#   7 LEU  HA      7 LEU  QD1     3.94             (#peak   517 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 517, nxpk= 0, iat= 111,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 118, 119, 120,
 &end
#
#   7 LEU  HA      7 LEU  QD2     3.94             (#peak   518 #SUP  0.70  #QF  0.70)
 &rst
  ixpk= 518, nxpk= 0, iat= 111,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 122, 123, 124,
 &end
#
#   3 PRO  HD3     6 ILE  QD1     4.38             (#peak   519 #SUP  1.00  #QF  0.48)
 &rst
  ixpk= 519, nxpk= 0, iat=  32,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2= 103, 104, 105,
 &end
#
#   6 ILE  HA      6 ILE  QD1     4.58             (#peak   519 #SUP  1.00  #QF  0.48)
 &rst
  ixpk= 519, nxpk= 0, iat=  92,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2= 103, 104, 105,
 &end
#
#   7 LEU  HA     10 ILE  QD1     4.40             (#peak   520 #SUP  0.66  #QF  0.66)
 &rst
  ixpk= 520, nxpk= 0, iat= 111,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 161, 162, 163,
 &end
#
#  21 LEU  HA     24 VAL  QG1     3.98             (#peak   522 #SUP  0.86  #QF  0.86)
 &rst
  ixpk= 522, nxpk= 0, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr2= 391, 392, 393,
 &end
#
#  21 LEU  HA     24 VAL  QG2     3.24             (#peak   523 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 523, nxpk= 0, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 395, 396, 397,
 &end
#
#  21 LEU  HA     21 LEU  QD1     4.06             (#peak   524 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 524, nxpk= 0, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 334, 335, 336,
 &end
#
#  21 LEU  HA     21 LEU  QD2     4.06             (#peak   525 #SUP  0.92  #QF  0.92)
 &rst
  ixpk= 525, nxpk= 0, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 338, 339, 340,
 &end
#
#  23 LEU  HA     23 LEU  QD1     4.36             (#peak   526 #SUP  0.75  #QF  0.75)
 &rst
  ixpk= 526, nxpk= 0, iat= 368,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 375, 376, 377,
 &end
#
#  23 LEU  HA     23 LEU  QD2     4.36             (#peak   527 #SUP  0.76  #QF  0.76)
 &rst
  ixpk= 527, nxpk= 0, iat= 368,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 379, 380, 381,
 &end
#
#  17 CYSS HA     21 LEU  QD2     5.12             (#peak   528 #SUP  0.93  #QF  0.93)
 &rst
  ixpk= 528, nxpk= 0, iat= 274,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr2= 338, 339, 340,
 &end
#
#  17 CYSS HA     21 LEU  QD1     5.12             (#peak   529 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 529, nxpk= 0, iat= 274,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr2= 334, 335, 336,
 &end
#
#  10 ILE  QG2    11 ALA  QB      4.57             (#peak   532 #SUP  0.75  #QF  0.75)
 &rst
  ixpk= 532, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr1= 154, 155, 156,
 igr2= 171, 172, 173,
 &end
#
#   9 ALA  QB     10 ILE  QD1     3.62             (#peak   534 #SUP  0.55  #QF  0.55)
 &rst
  ixpk= 534, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 142, 143, 144,
 igr2= 161, 162, 163,
 &end
#
#  21 LEU  HB3    21 LEU  QD2     4.19             (#peak   535 #SUP  0.97  #QF  0.97)
 &rst
  ixpk= 535, nxpk= 0, iat= 330,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 338, 339, 340,
 &end
#
#   4 ARG  QG     24 VAL  QG1     3.33             (#peak   537 #SUP  0.98  #QF  0.26)
 &rst
  ixpk= 537, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1=  51,  52,
 igr2= 391, 392, 393,
 &end
#
#   7 LEU  QB      7 LEU  QD1     3.48             (#peak   537 #SUP  0.98  #QF  0.26)
 &rst
  ixpk= 537, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1= 113, 114,
 igr2= 118, 119, 120,
 &end
#
#  11 ALA  QB     21 LEU  HG      4.25             (#peak   541 #SUP  0.59  #QF  0.59)
 &rst
  ixpk= 541, nxpk= 0, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 171, 172, 173,
 &end
#
#  11 ALA  QB     12 LYS  QD      4.46             (#peak   542 #SUP  0.76  #QF  0.76)
 &rst
  ixpk= 542, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr1= 171, 172, 173,
 igr2= 187, 188,
 &end
#
#  12 LYS  QG     12 LYS  QD      2.93             (#peak   543 #SUP  0.94  #QF  0.94)
 &rst
  ixpk= 543, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
 igr1= 184, 185,
 igr2= 187, 188,
 &end
#
#   7 LEU  QB      7 LEU  HG      2.74             (#peak   544 #SUP  0.96  #QF  0.96)
 &rst
  ixpk= 544, nxpk= 0, iat=  -1, 116, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,
 igr1= 113, 114,
 &end
#
#   5 LYS  QE      6 ILE  QD1     4.50             (#peak   551 #SUP  0.41  #QF  0.41)
 &rst
  ixpk= 551, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  81,  82,
 igr2= 103, 104, 105,
 &end
#
#   2 LEU  H       2 LEU  QB      3.34             (#peak   116)
 &rst
  ixpk= 116, nxpk= 0, iat=  11,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr2=  15,  16,
 &end
#
#   2 LEU  H       2 LEU  QQD     4.30             (#peak    91)
 &rst
  ixpk= 91, nxpk= 0, iat=  11,  17, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,  &end
#
#   2 LEU  HA      2 LEU  QQD     3.13             (#peak   328)
 &rst
  ixpk= 328, nxpk= 0, iat=  13,  17, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
#   2 LEU  QB      3 PRO  HD2     3.75             (#peak   438)
 &rst
  ixpk= 438, nxpk= 0, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1=  15,  16,
 &end
#
#   2 LEU  QB      3 PRO  HD3     4.27             (#peak   394)
 &rst
  ixpk= 394, nxpk= 0, iat=  -1,  32, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1=  15,  16,
 &end
#
#   2 LEU  QB      6 ILE  H       4.99             (#peak   212)
 &rst
  ixpk= 212, nxpk= 0, iat=  -1,  90, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1=  15,  16,
 &end
#
#   2 LEU  QB      7 LEU  H       4.46             (#peak   134)
 &rst
  ixpk= 134, nxpk= 0, iat=  -1, 109, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1=  15,  16,
 &end
#
#   2 LEU  QQD     3 PRO  HD2     3.82             (#peak   504)
 &rst
  ixpk= 504, nxpk= 0, iat=  17,  31, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,  &end
#
#   2 LEU  QQD     3 PRO  HD3     3.64             (#peak   521)
 &rst
  ixpk= 521, nxpk= 0, iat=  17,  32, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,  &end
#
#   3 PRO  QB      4 ARG  H       3.78             (#peak   223)
 &rst
  ixpk= 223, nxpk= 0, iat=  -1,  44, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=  37,  38,
 &end
#
#   3 PRO  QB      5 LYS  H       4.66             (#peak   224)
 &rst
  ixpk= 224, nxpk= 0, iat=  -1,  68, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr1=  37,  38,
 &end
#
#   3 PRO  QB      6 ILE  H       5.10             (#peak   248)
 &rst
  ixpk= 248, nxpk= 0, iat=  -1,  90, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1=  37,  38,
 &end
#
#   3 PRO  HD2     6 ILE  QG1     4.63             (#peak   439)
 &rst
  ixpk= 439, nxpk= 0, iat=  31,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr2= 100, 101,
 &end
#
#   4 ARG  H       4 ARG  QB      2.96             (#peak   105)
 &rst
  ixpk= 105, nxpk= 0, iat=  44,  -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
 igr2=  48,  49,
 &end
#
#   4 ARG  H       7 LEU  QQD     5.44             (#peak    88)
 &rst
  ixpk= 88, nxpk= 0, iat=  44, 115, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,  &end
#
#   4 ARG  QB      4 ARG  HE      4.44             (#peak    63)
 &rst
  ixpk= 63, nxpk= 0, iat=  -1,  57, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1=  48,  49,
 &end
#
#   4 ARG  QB      5 LYS  H       3.89             (#peak   106)
 &rst
  ixpk= 106, nxpk= 0, iat=  -1,  68, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1=  48,  49,
 &end
#
#   4 ARG  QB     24 VAL  QG2     4.95             (#peak   462)
 &rst
  ixpk= 462, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=  48,  49,
 igr2= 395, 396, 397,
 &end
#
#   5 LYS  H       5 LYS  QB      3.12             (#peak   107)
 &rst
  ixpk= 107, nxpk= 0, iat=  68,  -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
 igr2=  72,  73,
 &end
#
#   5 LYS  QB      6 ILE  H       4.00             (#peak   207)
 &rst
  ixpk= 207, nxpk= 0, iat=  -1,  90, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1=  72,  73,
 &end
#
#   6 ILE  HA      6 ILE  QG1     3.52             (#peak   395)
 &rst
  ixpk= 395, nxpk= 0, iat=  92,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 100, 101,
 &end
#
#   6 ILE  QG2     6 ILE  QG1     3.23             (#peak   497)
 &rst
  ixpk= 497, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr1=  96,  97,  98,
 igr2= 100, 101,
 &end
#
#   6 ILE  QG2    10 ILE  QG1     3.82             (#peak   540)
 &rst
  ixpk= 540, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1=  96,  97,  98,
 igr2= 158, 159,
 &end
#
#   6 ILE  QG1     7 LEU  H       5.02             (#peak   137)
 &rst
  ixpk= 137, nxpk= 0, iat=  -1, 109, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1= 100, 101,
 &end
#
#   7 LEU  H       7 LEU  QQD     3.86             (#peak   139)
 &rst
  ixpk= 139, nxpk= 0, iat= 109, 115, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,  &end
#
#   7 LEU  HA      7 LEU  QQD     3.20             (#peak   518)
 &rst
  ixpk= 518, nxpk= 0, iat= 111, 115, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
#   7 LEU  HA     10 ILE  QG1     4.34             (#peak    73)
 &rst
  ixpk= 73, nxpk= 0, iat= 111,  -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr2= 158, 159,
 &end
#
#   7 LEU  QQD     8 CYSS H       4.76             (#peak    89)
 &rst
  ixpk= 89, nxpk= 0, iat= 115, 128, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,  &end
#
#   8 CYSS H      21 LEU  QQD     5.44             (#peak    89)
 &rst
  ixpk= 89, nxpk= 0, iat= 128, 331, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,  &end
#
#   8 CYSS HA     21 LEU  QQD     4.79             (#peak   531)
 &rst
  ixpk= 531, nxpk= 0, iat= 130, 331, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,  &end
#
#   9 ALA  H      10 ILE  QG1     4.65             (#peak   170)
 &rst
  ixpk= 170, nxpk= 0, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2= 158, 159,
 &end
#
#  10 ILE  H      10 ILE  QG1     3.21             (#peak   132)
 &rst
  ixpk= 132, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 158, 159,
 &end
#
#  10 ILE  HA     10 ILE  QG1     3.52             (#peak   383)
 &rst
  ixpk= 383, nxpk= 0, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 158, 159,
 &end
#
#  10 ILE  QG2    14 LYS  QB      3.90             (#peak   502)
 &rst
  ixpk= 502, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1= 154, 155, 156,
 igr2= 225, 226,
 &end
#
#  10 ILE  QG2    14 LYS  QD      3.51             (#peak   538)
 &rst
  ixpk= 538, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1= 154, 155, 156,
 igr2= 231, 232,
 &end
#
#  10 ILE  QG1    11 ALA  H       4.89             (#peak   143)
 &rst
  ixpk= 143, nxpk= 0, iat=  -1, 167, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 158, 159,
 &end
#
#  11 ALA  H      21 LEU  QQD     4.90             (#peak   145)
 &rst
  ixpk= 145, nxpk= 0, iat= 167, 331, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,  &end
#
#  11 ALA  HA     14 LYS  QB      4.15             (#peak   390)
 &rst
  ixpk= 390, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr2= 225, 226,
 &end
#
#  11 ALA  HA     16 LYS  QG      5.34             (#peak   393)
 &rst
  ixpk= 393, nxpk= 0, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 257, 258,
 &end
#
#  11 ALA  HA     21 LEU  QQD     5.44             (#peak   513)
 &rst
  ixpk= 513, nxpk= 0, iat= 169, 331, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,  &end
#
#  11 ALA  QB     21 LEU  QQD     3.03             (#peak   457)
 &rst
  ixpk= 457, nxpk= 0, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1= 171, 172, 173,
 &end
#
#  12 LYS  H      12 LYS  QB      3.07             (#peak    75)
 &rst
  ixpk= 75, nxpk= 0, iat= 177,  -1, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,
 igr2= 181, 182,
 &end
#
#  12 LYS  QB     12 LYS  QD      3.48             (#peak   548)
 &rst
  ixpk= 548, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 181, 182,
 igr2= 187, 188,
 &end
#
#  12 LYS  QB     13 LYS  H       3.73             (#peak   163)
 &rst
  ixpk= 163, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 181, 182,
 &end
#
#  13 LYS  H      13 LYS  QG      4.74             (#peak    79)
 &rst
  ixpk= 79, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr2= 206, 207,
 &end
#
#  13 LYS  QG     14 LYS  H       5.14             (#peak   153)
 &rst
  ixpk= 153, nxpk= 0, iat=  -1, 221, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1= 206, 207,
 &end
#
#  14 LYS  H      14 LYS  QB      3.18             (#peak   151)
 &rst
  ixpk= 151, nxpk= 0, iat= 221,  -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
 igr2= 225, 226,
 &end
#
#  14 LYS  HA     14 LYS  QD      3.69             (#peak   433)
 &rst
  ixpk= 433, nxpk= 0, iat= 223,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 231, 232,
 &end
#
#  14 LYS  QB     14 LYS  QD      3.17             (#peak   545)
 &rst
  ixpk= 545, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
 igr1= 225, 226,
 igr2= 231, 232,
 &end
#
#  14 LYS  QB     15 GLY  H       4.19             (#peak   158)
 &rst
  ixpk= 158, nxpk= 0, iat=  -1, 243, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 225, 226,
 &end
#
#  14 LYS  QB     16 LYS  H       4.18             (#peak   118)
 &rst
  ixpk= 118, nxpk= 0, iat=  -1, 250, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1= 225, 226,
 &end
#
#  14 LYS  QD     15 GLY  H       4.76             (#peak   159)
 &rst
  ixpk= 159, nxpk= 0, iat=  -1, 243, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 231, 232,
 &end
#
#  16 LYS  H      16 LYS  QG      4.33             (#peak   127)
 &rst
  ixpk= 127, nxpk= 0, iat= 250,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 257, 258,
 &end
#
#  16 LYS  QG     17 CYSS H       5.34             (#peak   113)
 &rst
  ixpk= 113, nxpk= 0, iat=  -1, 272, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 257, 258,
 &end
#
#  17 CYSS H      21 LEU  QQD     5.43             (#peak    93)
 &rst
  ixpk= 93, nxpk= 0, iat= 272, 331, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,  &end
#
#  17 CYSS HA     21 LEU  QQD     3.90             (#peak   529)
 &rst
  ixpk= 529, nxpk= 0, iat= 274, 331, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,  &end
#
#  17 CYSS HB2    27 CYSS QB      4.82             (#peak   363)
 &rst
  ixpk= 363, nxpk= 0, iat= 276,  -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr2= 437, 438,
 &end
#
#  17 CYSS HB3    27 CYSS QB      3.92             (#peak   345)
 &rst
  ixpk= 345, nxpk= 0, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 437, 438,
 &end
#
#  18 LYS  H      21 LEU  QQD     3.90             (#peak   181)
 &rst
  ixpk= 181, nxpk= 0, iat= 282, 331, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,  &end
#
#  18 LYS  HA     19 GLY  QA      4.63             (#peak   335)
 &rst
  ixpk= 335, nxpk= 0, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr2= 306, 307,
 &end
#
#  18 LYS  QB     19 GLY  H       3.46             (#peak    95)
 &rst
  ixpk= 95, nxpk= 0, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr1= 286, 287,
 &end
#
#  19 GLY  H      20 PRO  QD      4.80             (#peak   254)
 &rst
  ixpk= 254, nxpk= 0, iat= 304,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 312, 313,
 &end
#
#  19 GLY  QA     20 PRO  QD      3.13             (#peak   332)
 &rst
  ixpk= 332, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr1= 306, 307,
 igr2= 312, 313,
 &end
#
#  19 GLY  QA     21 LEU  H       4.37             (#peak   306)
 &rst
  ixpk= 306, nxpk= 0, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1= 306, 307,
 &end
#
#  19 GLY  QA     22 LYS  H       4.45             (#peak   307)
 &rst
  ixpk= 307, nxpk= 0, iat=  -1, 344, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 306, 307,
 &end
#
#  20 PRO  HA     23 LEU  QQD     4.24             (#peak   530)
 &rst
  ixpk= 530, nxpk= 0, iat= 321, 372, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,  &end
#
#  20 PRO  QB     21 LEU  H       3.79             (#peak   197)
 &rst
  ixpk= 197, nxpk= 0, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr1= 318, 319,
 &end
#
#  20 PRO  QG     21 LEU  H       4.07             (#peak   196)
 &rst
  ixpk= 196, nxpk= 0, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1= 315, 316,
 &end
#
#  20 PRO  QD     21 LEU  H       3.49             (#peak   302)
 &rst
  ixpk= 302, nxpk= 0, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr1= 312, 313,
 &end
#
#  20 PRO  QD     21 LEU  HB2     5.35             (#peak   400)
 &rst
  ixpk= 400, nxpk= 0, iat=  -1, 329, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr1= 312, 313,
 &end
#
#  21 LEU  HA     21 LEU  QQD     3.11             (#peak   525)
 &rst
  ixpk= 525, nxpk= 0, iat= 327, 331, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
#  21 LEU  QQD    22 LYS  H       4.40             (#peak   188)
 &rst
  ixpk= 188, nxpk= 0, iat= 331, 344, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,  &end
#
#  21 LEU  QQD    24 VAL  H       4.87             (#peak   218)
 &rst
  ixpk= 218, nxpk= 0, iat= 331, 385, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,  &end
#
#  21 LEU  QQD    24 VAL  HB      4.16             (#peak   466)
 &rst
  ixpk= 466, nxpk= 0, iat= 331, 389, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,  &end
#
#  23 LEU  H      23 LEU  QQD     5.28             (#peak   218)
 &rst
  ixpk= 218, nxpk= 0, iat= 366, 372, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,  &end
#
#  23 LEU  HA     23 LEU  QQD     3.10             (#peak   527)
 &rst
  ixpk= 527, nxpk= 0, iat= 368, 372, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#  26 LYS  H      26 LYS  QB      3.60             (#peak    84)
 &rst
  ixpk= 84, nxpk= 0, iat= 411,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 415, 416,
 &end
#
#  27 CYSS H      27 CYSS QB      3.34             (#peak    68)
 &rst
  ixpk= 68, nxpk= 0, iat= 433,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr2= 437, 438,
 &end
#
#   8 CYSS SG     25 CYSS SG      2.00  2.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 407, r1= 1.50, r2= 2.00, r3= 2.10, r4= 2.60, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
#   8 CYSS SG     25 CYSS CB      3.00  3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 404, r1= 2.50, r2= 3.00, r3= 3.10, r4= 3.60,  &end
#
#   8 CYSS CB     25 CYSS SG      3.00  3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 131, 407, r1= 2.50, r2= 3.00, r3= 3.10, r4= 3.60,  &end
#
#  17 CYSS SG     27 CYSS SG      2.00  2.10
 &rst
  ixpk= 0, nxpk= 0, iat= 278, 439, r1= 1.50, r2= 2.00, r3= 2.10, r4= 2.60,  &end
#
#  17 CYSS SG     27 CYSS CB      3.00  3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 278, 436, r1= 2.50, r2= 3.00, r3= 3.10, r4= 3.60,  &end
#
#  17 CYSS CB     27 CYSS SG      3.00  3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 439, r1= 2.50, r2= 3.00, r3= 3.10, r4= 3.60,  &end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           1H       GLY   1  11.399  -7.539   1.691
    2    H2   GLY   1           2H       GLY   1  11.780  -6.951   3.173
    3    H3   GLY   1           3H       GLY   1  11.155  -8.458   3.024
    4    HA2  GLY   1           HA2      GLY   1   9.470  -6.952   3.842
    5    HA3  GLY   1           HA3      GLY   1   9.740  -5.944   2.409
    6    H    LEU   2           H        LEU   2   7.216  -6.812   2.935
    7    HA   LEU   2           HA       LEU   2   6.565  -9.262   1.502
    8    HB2  LEU   2           2HB      LEU   2   4.830  -6.997   2.547
    9    HB3  LEU   2           3HB      LEU   2   4.205  -8.490   1.863
   10    HG   LEU   2           HG       LEU   2   5.937  -8.337   4.372
   11   HD11  LEU   2          1HD1      LEU   2   3.712  -7.291   4.676
   12   HD12  LEU   2          2HD1      LEU   2   2.939  -8.788   4.109
   13   HD13  LEU   2          3HD1      LEU   2   3.887  -8.786   5.608
   14   HD21  LEU   2          3HD2      LEU   2   4.368 -10.648   3.140
   15   HD22  LEU   2          1HD2      LEU   2   6.138 -10.529   3.278
   16   HD23  LEU   2          2HD2      LEU   2   5.153 -10.670   4.735
   17    HA   PRO   3           HA       PRO   3   6.155  -7.597  -2.608
   18    HB2  PRO   3           2HB      PRO   3   3.637  -9.206  -2.901
   19    HB3  PRO   3           3HB      PRO   3   5.081  -9.171  -3.953
   20    HG2  PRO   3           2HG      PRO   3   4.656 -11.252  -2.258
   21    HG3  PRO   3           3HG      PRO   3   6.303 -10.570  -2.466
   22    HD2  PRO   3           2HD      PRO   3   4.318 -10.029  -0.239
   23    HD3  PRO   3           3HD      PRO   3   6.065 -10.391  -0.148
   24    H    ARG   4           H        ARG   4   4.949  -6.079  -3.866
   25    HA   ARG   4           HA       ARG   4   3.420  -4.188  -2.384
   26    HB2  ARG   4           2HB      ARG   4   3.728  -4.504  -5.398
   27    HB3  ARG   4           3HB      ARG   4   3.021  -3.095  -4.590
   28    HG2  ARG   4           2HG      ARG   4   5.096  -2.691  -3.361
   29    HG3  ARG   4           3HG      ARG   4   5.867  -4.091  -4.120
   30    HD2  ARG   4           2HD      ARG   4   5.014  -1.510  -5.453
   31    HD3  ARG   4           3HD      ARG   4   6.657  -2.049  -5.108
   32    HE   ARG   4           HE       ARG   4   5.414  -4.031  -6.731
   33   HH11  ARG   4          1HH2      ARG   4   6.691  -0.788  -7.080
   34   HH12  ARG   4          2HH2      ARG   4   6.983  -0.991  -8.784
   35   HH21  ARG   4          1HH1      ARG   4   5.804  -4.217  -8.911
   36   HH22  ARG   4          2HH1      ARG   4   6.497  -2.883  -9.784
   37    H    LYS   5           H        LYS   5   2.253  -6.847  -4.386
   38    HA   LYS   5           HA       LYS   5  -0.554  -6.149  -4.342
   39    HB2  LYS   5           2HB      LYS   5   0.836  -8.858  -4.561
   40    HB3  LYS   5           3HB      LYS   5  -0.895  -8.584  -4.800
   41    HG2  LYS   5           2HG      LYS   5  -0.427  -7.070  -6.699
   42    HG3  LYS   5           3HG      LYS   5   1.310  -7.264  -6.447
   43    HD2  LYS   5           2HD      LYS   5   0.673  -8.667  -8.275
   44    HD3  LYS   5           3HD      LYS   5   1.105  -9.703  -6.907
   45    HE2  LYS   5           2HE      LYS   5  -1.304 -10.023  -6.385
   46    HE3  LYS   5           3HE      LYS   5  -1.743  -8.936  -7.709
   47    HZ1  LYS   5           HZ1      LYS   5  -1.886 -11.264  -8.385
   48    HZ2  LYS   5           HZ2      LYS   5  -0.726 -10.522  -9.257
   49    HZ3  LYS   5           HZ3      LYS   5  -0.316 -11.525  -8.034
   50    H    ILE   6           H        ILE   6   1.448  -8.021  -2.078
   51    HA   ILE   6           HA       ILE   6  -0.760  -8.714  -0.298
   52    HB   ILE   6           HB       ILE   6   2.252  -8.959  -0.162
   53   HG12  ILE   6          2HG1      ILE   6   1.756 -11.352   0.126
   54   HG13  ILE   6          3HG1      ILE   6   0.024 -11.031   0.110
   55   HG21  ILE   6          1HG2      ILE   6   2.004 -10.068   2.058
   56   HG22  ILE   6          2HG2      ILE   6   1.659  -8.341   2.116
   57   HG23  ILE   6          3HG2      ILE   6   0.319  -9.510   2.126
   58   HD11  ILE   6          3HD1      ILE   6   0.905 -11.999  -2.007
   59   HD12  ILE   6          1HD1      ILE   6   0.113 -10.440  -2.258
   60   HD13  ILE   6          2HD1      ILE   6   1.895 -10.549  -2.246
   61    H    LEU   7           H        LEU   7   1.833  -6.208  -0.230
   62    HA   LEU   7           HA       LEU   7   0.970  -4.889   2.151
   63    HB2  LEU   7           2HB      LEU   7   2.265  -3.808  -0.387
   64    HB3  LEU   7           3HB      LEU   7   2.044  -2.855   1.073
   65    HG   LEU   7           HG       LEU   7   3.710  -5.408   0.939
   66   HD11  LEU   7          1HD1      LEU   7   4.693  -3.579  -0.391
   67   HD12  LEU   7          2HD1      LEU   7   4.555  -2.480   1.002
   68   HD13  LEU   7          3HD1      LEU   7   5.640  -3.889   1.069
   69   HD21  LEU   7          3HD2      LEU   7   3.378  -3.307   3.125
   70   HD22  LEU   7          1HD2      LEU   7   2.896  -5.017   3.214
   71   HD23  LEU   7          2HD2      LEU   7   4.606  -4.588   3.124
   72    H    CYS   8           H        CYS   8  -0.208  -4.537  -1.207
   73    HA   CYS   8           HA       CYS   8  -2.008  -2.402  -0.643
   74    HB2  CYS   8           2HB      CYS   8  -1.162  -3.033  -2.875
   75    HB3  CYS   8           3HB      CYS   8  -2.179  -4.478  -2.839
   76    H    ALA   9           H        ALA   9  -2.437  -5.916  -0.201
   77    HA   ALA   9           HA       ALA   9  -5.307  -5.974  -0.025
   78    HB1  ALA   9           3HB      ALA   9  -4.917  -8.100   1.126
   79    HB2  ALA   9           1HB      ALA   9  -3.780  -7.978  -0.236
   80    HB3  ALA   9           2HB      ALA   9  -3.223  -7.686   1.436
   81    H    ILE  10           H        ILE  10  -2.711  -5.383   2.244
   82    HA   ILE  10           HA       ILE  10  -4.320  -5.084   4.637
   83    HB   ILE  10           HB       ILE  10  -1.420  -4.384   4.003
   84   HG12  ILE  10          2HG1      ILE  10  -2.523  -6.898   5.334
   85   HG13  ILE  10          3HG1      ILE  10  -2.127  -6.832   3.644
   86   HG21  ILE  10          1HG2      ILE  10  -1.086  -4.432   6.450
   87   HG22  ILE  10          2HG2      ILE  10  -2.263  -3.193   6.007
   88   HG23  ILE  10          3HG2      ILE  10  -2.821  -4.741   6.686
   89   HD11  ILE  10          3HD1      ILE  10   0.201  -6.279   4.106
   90   HD12  ILE  10          1HD1      ILE  10  -0.110  -6.491   5.855
   91   HD13  ILE  10          2HD1      ILE  10  -0.321  -7.852   4.722
   92    H    ALA  11           H        ALA  11  -2.571  -2.851   2.452
   93    HA   ALA  11           HA       ALA  11  -3.115  -0.419   3.676
   94    HB1  ALA  11           3HB      ALA  11  -2.993  -0.996   0.676
   95    HB2  ALA  11           1HB      ALA  11  -2.603   0.521   1.486
   96    HB3  ALA  11           2HB      ALA  11  -1.577  -0.876   1.765
   97    H    LYS  12           H        LYS  12  -5.110  -1.968   1.093
   98    HA   LYS  12           HA       LYS  12  -7.216   0.010   1.296
   99    HB2  LYS  12           2HB      LYS  12  -7.180  -2.733  -0.014
  100    HB3  LYS  12           3HB      LYS  12  -8.438  -1.502  -0.234
  101    HG2  LYS  12           2HG      LYS  12  -6.671   0.099  -1.055
  102    HG3  LYS  12           3HG      LYS  12  -5.494  -1.210  -0.997
  103    HD2  LYS  12           2HD      LYS  12  -7.949  -1.017  -2.767
  104    HD3  LYS  12           3HD      LYS  12  -6.244  -0.924  -3.243
  105    HE2  LYS  12           2HE      LYS  12  -5.942  -3.299  -2.467
  106    HE3  LYS  12           3HE      LYS  12  -7.673  -3.379  -2.121
  107    HZ1  LYS  12           HZ1      LYS  12  -7.175  -4.277  -4.322
  108    HZ2  LYS  12           HZ2      LYS  12  -8.108  -2.950  -4.477
  109    HZ3  LYS  12           HZ3      LYS  12  -6.510  -2.866  -4.809
  110    H    LYS  13           H        LYS  13  -6.733  -3.055   2.988
  111    HA   LYS  13           HA       LYS  13  -9.409  -3.154   4.128
  112    HB2  LYS  13           2HB      LYS  13  -7.993  -5.125   3.879
  113    HB3  LYS  13           3HB      LYS  13  -6.808  -4.460   5.017
  114    HG2  LYS  13           2HG      LYS  13  -8.398  -4.626   6.854
  115    HG3  LYS  13           3HG      LYS  13  -9.720  -4.996   5.737
  116    HD2  LYS  13           2HD      LYS  13  -9.006  -7.013   6.883
  117    HD3  LYS  13           3HD      LYS  13  -8.677  -7.143   5.151
  118    HE2  LYS  13           2HE      LYS  13  -6.293  -6.596   5.550
  119    HE3  LYS  13           3HE      LYS  13  -6.617  -6.404   7.281
  120    HZ1  LYS  13           HZ1      LYS  13  -5.732  -8.616   6.784
  121    HZ2  LYS  13           HZ2      LYS  13  -7.253  -8.759   7.352
  122    HZ3  LYS  13           HZ3      LYS  13  -6.958  -8.936   5.755
  123    H    LYS  14           H        LYS  14  -6.321  -1.814   5.335
  124    HA   LYS  14           HA       LYS  14  -7.567  -0.693   7.767
  125    HB2  LYS  14           2HB      LYS  14  -4.790  -0.671   6.551
  126    HB3  LYS  14           3HB      LYS  14  -5.219   0.534   7.749
  127    HG2  LYS  14           2HG      LYS  14  -4.156  -1.227   8.892
  128    HG3  LYS  14           3HG      LYS  14  -5.853  -1.207   9.368
  129    HD2  LYS  14           2HD      LYS  14  -6.292  -3.131   7.841
  130    HD3  LYS  14           3HD      LYS  14  -4.582  -3.163   7.393
  131    HE2  LYS  14           2HE      LYS  14  -5.727  -3.571  10.199
  132    HE3  LYS  14           3HE      LYS  14  -5.227  -4.865   9.112
  133    HZ1  LYS  14           HZ1      LYS  14  -2.948  -3.969   9.206
  134    HZ2  LYS  14           HZ2      LYS  14  -3.418  -2.803  10.253
  135    HZ3  LYS  14           HZ3      LYS  14  -3.481  -4.368  10.694
  136    H    GLY  15           H        GLY  15  -7.195   0.396   4.514
  137    HA2  GLY  15           HA2      GLY  15  -8.125   2.279   3.510
  138    HA3  GLY  15           HA3      GLY  15  -8.516   2.966   5.088
  139    H    LYS  16           H        LYS  16  -5.230   1.818   4.449
  140    HA   LYS  16           HA       LYS  16  -4.252   4.637   4.112
  141    HB2  LYS  16           2HB      LYS  16  -4.076   3.867   6.477
  142    HB3  LYS  16           3HB      LYS  16  -3.029   2.543   5.940
  143    HG2  LYS  16           2HG      LYS  16  -1.405   4.211   5.039
  144    HG3  LYS  16           3HG      LYS  16  -2.483   5.525   5.546
  145    HD2  LYS  16           2HD      LYS  16  -2.237   4.818   7.911
  146    HD3  LYS  16           3HD      LYS  16  -1.169   3.487   7.403
  147    HE2  LYS  16           2HE      LYS  16   0.396   5.130   6.400
  148    HE3  LYS  16           3HE      LYS  16  -0.665   6.453   6.899
  149    HZ1  LYS  16           HZ1      LYS  16   0.703   4.576   8.762
  150    HZ2  LYS  16           HZ2      LYS  16   1.148   6.122   8.496
  151    HZ3  LYS  16           HZ3      LYS  16  -0.276   5.800   9.222
  152    H    CYS  17           H        CYS  17  -3.935   4.431   1.986
  153    HA   CYS  17           HA       CYS  17  -1.648   2.757   1.024
  154    HB2  CYS  17           2HB      CYS  17  -3.867   1.783   0.317
  155    HB3  CYS  17           3HB      CYS  17  -4.237   3.293  -0.480
  156    H    LYS  18           H        LYS  18  -0.106   4.033   0.092
  157    HA   LYS  18           HA       LYS  18  -0.717   6.760  -0.955
  158    HB2  LYS  18           2HB      LYS  18   1.288   6.206   1.291
  159    HB3  LYS  18           3HB      LYS  18   1.100   7.742   0.438
  160    HG2  LYS  18           2HG      LYS  18  -1.332   7.759   1.241
  161    HG3  LYS  18           3HG      LYS  18  -0.881   6.445   2.337
  162    HD2  LYS  18           2HD      LYS  18   0.331   9.242   2.240
  163    HD3  LYS  18           3HD      LYS  18  -0.801   8.633   3.453
  164    HE2  LYS  18           2HE      LYS  18   0.869   6.957   4.194
  165    HE3  LYS  18           3HE      LYS  18   2.004   7.529   2.965
  166    HZ1  LYS  18           HZ1      LYS  18   2.019   9.699   4.064
  167    HZ2  LYS  18           HZ2      LYS  18   0.969   9.187   5.204
  168    HZ3  LYS  18           HZ3      LYS  18   2.468   8.542   5.120
  169    H    GLY  19           H        GLY  19   1.608   7.769  -1.678
  170    HA2  GLY  19           HA2      GLY  19   2.389   6.103  -3.884
  171    HA3  GLY  19           HA3      GLY  19   3.196   7.593  -3.385
  172    HA   PRO  20           HA       PRO  20   3.925   5.355  -5.195
  173    HB2  PRO  20           2HB      PRO  20   5.383   3.127  -5.840
  174    HB3  PRO  20           3HB      PRO  20   6.075   4.765  -5.665
  175    HG2  PRO  20           2HG      PRO  20   6.009   2.547  -3.594
  176    HG3  PRO  20           3HG      PRO  20   7.410   3.552  -4.101
  177    HD2  PRO  20           2HD      PRO  20   5.945   4.201  -1.874
  178    HD3  PRO  20           3HD      PRO  20   6.486   5.505  -2.987
  179    H    LEU  21           H        LEU  21   3.219   3.067  -2.658
  180    HA   LEU  21           HA       LEU  21   2.119   0.877  -3.971
  181    HB2  LEU  21           2HB      LEU  21   2.515   1.204  -1.495
  182    HB3  LEU  21           3HB      LEU  21   1.081   2.224  -1.444
  183    HG   LEU  21           HG       LEU  21  -0.292   0.243  -2.243
  184   HD11  LEU  21          1HD1      LEU  21   0.706  -1.980  -1.859
  185   HD12  LEU  21          2HD1      LEU  21   1.485  -1.142  -3.210
  186   HD13  LEU  21          3HD1      LEU  21   2.296  -1.224  -1.620
  187   HD21  LEU  21          3HD2      LEU  21  -0.248  -0.870  -0.055
  188   HD22  LEU  21          1HD2      LEU  21   1.274  -0.046   0.349
  189   HD23  LEU  21          2HD2      LEU  21  -0.219   0.894   0.110
  190    H    LYS  22           H        LYS  22   0.482   3.949  -3.260
  191    HA   LYS  22           HA       LYS  22  -2.151   3.268  -4.141
  192    HB2  LYS  22           2HB      LYS  22  -1.366   5.316  -2.795
  193    HB3  LYS  22           3HB      LYS  22  -0.858   6.020  -4.331
  194    HG2  LYS  22           2HG      LYS  22  -3.434   5.424  -4.968
  195    HG3  LYS  22           3HG      LYS  22  -3.599   5.515  -3.201
  196    HD2  LYS  22           2HD      LYS  22  -2.465   7.779  -3.317
  197    HD3  LYS  22           3HD      LYS  22  -2.608   7.680  -5.080
  198    HE2  LYS  22           2HE      LYS  22  -4.914   7.607  -3.074
  199    HE3  LYS  22           3HE      LYS  22  -4.414   9.020  -4.005
  200    HZ1  LYS  22           HZ1      LYS  22  -5.563   6.506  -5.113
  201    HZ2  LYS  22           HZ2      LYS  22  -6.252   7.976  -5.102
  202    HZ3  LYS  22           HZ3      LYS  22  -4.946   7.717  -6.046
  203    H    LEU  23           H        LEU  23   0.578   4.589  -5.934
  204    HA   LEU  23           HA       LEU  23  -0.807   4.756  -8.490
  205    HB2  LEU  23           2HB      LEU  23   1.059   6.204  -7.835
  206    HB3  LEU  23           3HB      LEU  23   2.147   4.840  -7.720
  207    HG   LEU  23           HG       LEU  23   2.407   6.340  -9.695
  208   HD11  LEU  23          1HD1      LEU  23   3.312   4.016  -9.667
  209   HD12  LEU  23          2HD1      LEU  23   1.866   3.479 -10.551
  210   HD13  LEU  23          3HD1      LEU  23   2.960   4.658 -11.280
  211   HD21  LEU  23          3HD2      LEU  23  -0.082   4.991 -10.790
  212   HD22  LEU  23          1HD2      LEU  23  -0.002   6.673 -10.203
  213   HD23  LEU  23          2HD2      LEU  23   0.957   6.172 -11.609
  214    H    VAL  24           H        VAL  24   1.413   2.405  -6.988
  215    HA   VAL  24           HA       VAL  24   1.667   0.596  -9.181
  216    HB   VAL  24           HB       VAL  24   1.950   0.272  -6.177
  217   HG11  VAL  24          1HG1      VAL  24   2.749  -1.776  -8.282
  218   HG12  VAL  24          2HG1      VAL  24   3.187  -1.815  -6.559
  219   HG13  VAL  24          3HG1      VAL  24   1.507  -1.991  -7.025
  220   HG21  VAL  24          3HG2      VAL  24   4.052   0.347  -8.383
  221   HG22  VAL  24          1HG2      VAL  24   3.581   1.753  -7.418
  222   HG23  VAL  24          2HG2      VAL  24   4.327   0.369  -6.623
  223    H    CYS  25           H        CYS  25  -0.618   0.526  -6.410
  224    HA   CYS  25           HA       CYS  25  -1.979  -1.829  -7.557
  225    HB2  CYS  25           2HB      CYS  25  -1.152  -1.555  -5.178
  226    HB3  CYS  25           3HB      CYS  25  -2.440  -0.379  -4.945
  227    H    LYS  26           H        LYS  26  -2.467   1.527  -7.669
  228    HA   LYS  26           HA       LYS  26  -4.171   2.962  -8.068
  229    HB2  LYS  26           2HB      LYS  26  -5.258   0.592  -9.602
  230    HB3  LYS  26           3HB      LYS  26  -6.041   2.177  -9.610
  231    HG2  LYS  26           2HG      LYS  26  -3.083   1.921 -10.197
  232    HG3  LYS  26           3HG      LYS  26  -4.277   1.624 -11.466
  233    HD2  LYS  26           2HD      LYS  26  -5.087   3.853 -11.413
  234    HD3  LYS  26           3HD      LYS  26  -4.318   4.209  -9.854
  235    HE2  LYS  26           2HE      LYS  26  -2.104   4.012 -10.809
  236    HE3  LYS  26           3HE      LYS  26  -2.767   3.526 -12.379
  237    HZ1  LYS  26           HZ1      LYS  26  -2.212   5.892 -12.371
  238    HZ2  LYS  26           HZ2      LYS  26  -3.822   5.719 -12.544
  239    HZ3  LYS  26           HZ3      LYS  26  -3.204   6.182 -11.104
  240    H    CYS  27           H        CYS  27  -4.164   2.830  -5.835
  241    HA   CYS  27           HA       CYS  27  -6.539   1.735  -4.425
  242    HB2  CYS  27           2HB      CYS  27  -4.302   3.544  -3.478
  243    HB3  CYS  27           3HB      CYS  27  -5.626   3.004  -2.478
  Start of MODEL    2
    1    H1   GLY   1           1H       GLY   1  11.036  -7.517   5.106
    2    H2   GLY   1           2H       GLY   1  10.436  -8.945   4.569
    3    H3   GLY   1           3H       GLY   1  10.971  -7.829   3.498
    4    HA2  GLY   1           HA2      GLY   1   8.638  -7.511   5.273
    5    HA3  GLY   1           HA3      GLY   1   9.220  -6.294   4.123
    6    H    LEU   2           H        LEU   2   6.637  -7.072   3.933
    7    HA   LEU   2           HA       LEU   2   6.233  -9.243   2.039
    8    HB2  LEU   2           2HB      LEU   2   4.436  -7.005   3.036
    9    HB3  LEU   2           3HB      LEU   2   3.886  -8.269   1.949
   10    HG   LEU   2           HG       LEU   2   4.965  -8.765   4.760
   11   HD11  LEU   2          1HD1      LEU   2   2.621  -9.192   5.355
   12   HD12  LEU   2          2HD1      LEU   2   2.828  -7.533   4.773
   13   HD13  LEU   2          3HD1      LEU   2   2.107  -8.761   3.710
   14   HD21  LEU   2          3HD2      LEU   2   3.930 -11.015   4.457
   15   HD22  LEU   2          1HD2      LEU   2   3.590 -10.618   2.759
   16   HD23  LEU   2          2HD2      LEU   2   5.267 -10.744   3.338
   17    HA   PRO   3           HA       PRO   3   6.810  -6.863  -1.711
   18    HB2  PRO   3           2HB      PRO   3   5.544  -8.391  -3.560
   19    HB3  PRO   3           3HB      PRO   3   7.009  -8.966  -2.705
   20    HG2  PRO   3           2HG      PRO   3   4.109  -9.557  -2.019
   21    HG3  PRO   3           3HG      PRO   3   5.454 -10.727  -2.212
   22    HD2  PRO   3           2HD      PRO   3   4.686  -9.746   0.231
   23    HD3  PRO   3           3HD      PRO   3   6.396 -10.126  -0.138
   24    H    ARG   4           H        ARG   4   5.687  -5.532  -3.208
   25    HA   ARG   4           HA       ARG   4   3.551  -4.033  -2.193
   26    HB2  ARG   4           2HB      ARG   4   3.510  -2.832  -4.193
   27    HB3  ARG   4           3HB      ARG   4   5.163  -3.168  -3.692
   28    HG2  ARG   4           2HG      ARG   4   5.285  -4.997  -5.441
   29    HG3  ARG   4           3HG      ARG   4   3.629  -4.573  -5.927
   30    HD2  ARG   4           2HD      ARG   4   4.951  -3.342  -7.412
   31    HD3  ARG   4           3HD      ARG   4   4.461  -2.179  -6.152
   32    HE   ARG   4           HE       ARG   4   6.963  -3.274  -5.390
   33   HH11  ARG   4          1HH1      ARG   4   5.798  -1.214  -7.974
   34   HH12  ARG   4          2HH1      ARG   4   7.324  -0.385  -8.120
   35   HH21  ARG   4          2HH2      ARG   4   8.879  -2.175  -5.632
   36   HH22  ARG   4          1HH2      ARG   4   9.017  -0.924  -6.831
   37    H    LYS   5           H        LYS   5   3.268  -6.834  -4.300
   38    HA   LYS   5           HA       LYS   5   0.462  -6.467  -4.918
   39    HB2  LYS   5           2HB      LYS   5   0.552  -8.666  -5.879
   40    HB3  LYS   5           3HB      LYS   5   1.987  -7.755  -6.341
   41    HG2  LYS   5           2HG      LYS   5   3.292  -8.985  -4.568
   42    HG3  LYS   5           3HG      LYS   5   1.835  -9.932  -4.207
   43    HD2  LYS   5           2HD      LYS   5   1.800 -10.777  -6.535
   44    HD3  LYS   5           3HD      LYS   5   3.266  -9.838  -6.897
   45    HE2  LYS   5           2HE      LYS   5   4.501 -11.092  -5.142
   46    HE3  LYS   5           3HE      LYS   5   3.041 -12.021  -4.771
   47    HZ1  LYS   5           HZ1      LYS   5   4.454 -12.046  -7.388
   48    HZ2  LYS   5           HZ2      LYS   5   4.506 -13.239  -6.278
   49    HZ3  LYS   5           HZ3      LYS   5   3.106 -12.904  -7.043
   50    H    ILE   6           H        ILE   6   2.041  -7.791  -2.112
   51    HA   ILE   6           HA       ILE   6  -0.535  -8.872  -1.051
   52    HB   ILE   6           HB       ILE   6   2.293  -9.046   0.048
   53   HG12  ILE   6          2HG1      ILE   6   0.429 -11.128  -1.201
   54   HG13  ILE   6          3HG1      ILE   6   1.866 -10.450  -1.957
   55   HG21  ILE   6          1HG2      ILE   6   1.312 -10.535   1.775
   56   HG22  ILE   6          2HG2      ILE   6   0.604  -8.934   1.879
   57   HG23  ILE   6          3HG2      ILE   6  -0.311 -10.246   1.112
   58   HD11  ILE   6          3HD1      ILE   6   2.438 -12.617  -1.179
   59   HD12  ILE   6          1HD1      ILE   6   3.264 -11.455  -0.126
   60   HD13  ILE   6          2HD1      ILE   6   1.804 -12.302   0.442
   61    H    LEU   7           H        LEU   7   1.934  -6.343  -0.370
   62    HA   LEU   7           HA       LEU   7   0.619  -5.112   1.832
   63    HB2  LEU   7           2HB      LEU   7   2.283  -3.916  -0.417
   64    HB3  LEU   7           3HB      LEU   7   1.773  -3.010   0.996
   65    HG   LEU   7           HG       LEU   7   3.558  -5.479   1.115
   66   HD11  LEU   7          1HD1      LEU   7   4.211  -2.509   1.363
   67   HD12  LEU   7          2HD1      LEU   7   5.347  -3.853   1.617
   68   HD13  LEU   7          3HD1      LEU   7   4.664  -3.573   0.011
   69   HD21  LEU   7          3HD2      LEU   7   4.009  -4.652   3.440
   70   HD22  LEU   7          1HD2      LEU   7   2.720  -3.449   3.236
   71   HD23  LEU   7          2HD2      LEU   7   2.341  -5.188   3.218
   72    H    CYS   8           H        CYS   8  -0.164  -4.910  -1.617
   73    HA   CYS   8           HA       CYS   8  -1.919  -2.712  -1.595
   74    HB2  CYS   8           2HB      CYS   8  -1.124  -3.760  -3.613
   75    HB3  CYS   8           3HB      CYS   8  -1.874  -5.298  -3.196
   76    H    ALA   9           H        ALA   9  -2.591  -6.087  -0.555
   77    HA   ALA   9           HA       ALA   9  -5.453  -5.803  -0.322
   78    HB1  ALA   9           3HB      ALA   9  -3.479  -7.616   1.166
   79    HB2  ALA   9           1HB      ALA   9  -5.236  -7.844   1.049
   80    HB3  ALA   9           2HB      ALA   9  -4.227  -7.983  -0.410
   81    H    ILE  10           H        ILE  10  -2.728  -5.389   1.864
   82    HA   ILE  10           HA       ILE  10  -4.249  -4.912   4.264
   83    HB   ILE  10           HB       ILE  10  -1.311  -4.458   3.585
   84   HG12  ILE  10          2HG1      ILE  10  -2.614  -6.863   4.948
   85   HG13  ILE  10          3HG1      ILE  10  -2.224  -6.837   3.245
   86   HG21  ILE  10          1HG2      ILE  10  -2.668  -4.731   6.306
   87   HG22  ILE  10          2HG2      ILE  10  -0.924  -4.561   6.022
   88   HG23  ILE  10          3HG2      ILE  10  -2.004  -3.225   5.633
   89   HD11  ILE  10          3HD1      ILE  10  -0.182  -6.680   5.458
   90   HD12  ILE  10          1HD1      ILE  10  -0.516  -8.018   4.333
   91   HD13  ILE  10          2HD1      ILE  10   0.150  -6.503   3.710
   92    H    ALA  11           H        ALA  11  -2.501  -2.807   1.980
   93    HA   ALA  11           HA       ALA  11  -2.682  -0.362   3.278
   94    HB1  ALA  11           3HB      ALA  11  -2.829  -0.938   0.272
   95    HB2  ALA  11           1HB      ALA  11  -2.245   0.548   1.046
   96    HB3  ALA  11           2HB      ALA  11  -1.346  -0.939   1.266
   97    H    LYS  12           H        LYS  12  -5.018  -1.633   0.860
   98    HA   LYS  12           HA       LYS  12  -6.926   0.498   1.314
   99    HB2  LYS  12           2HB      LYS  12  -7.218  -2.137  -0.188
  100    HB3  LYS  12           3HB      LYS  12  -8.371  -0.787  -0.217
  101    HG2  LYS  12           2HG      LYS  12  -6.448   0.710  -0.963
  102    HG3  LYS  12           3HG      LYS  12  -5.485  -0.749  -1.196
  103    HD2  LYS  12           2HD      LYS  12  -8.043   0.009  -2.660
  104    HD3  LYS  12           3HD      LYS  12  -6.390   0.057  -3.283
  105    HE2  LYS  12           2HE      LYS  12  -6.271  -2.460  -2.868
  106    HE3  LYS  12           3HE      LYS  12  -8.012  -2.414  -2.568
  107    HZ1  LYS  12           HZ1      LYS  12  -6.682  -1.520  -5.087
  108    HZ2  LYS  12           HZ2      LYS  12  -7.511  -2.922  -4.905
  109    HZ3  LYS  12           HZ3      LYS  12  -8.295  -1.491  -4.817
  110    H    LYS  13           H        LYS  13  -6.597  -2.680   2.836
  111    HA   LYS  13           HA       LYS  13  -9.194  -2.551   4.181
  112    HB2  LYS  13           2HB      LYS  13  -6.678  -4.194   4.618
  113    HB3  LYS  13           3HB      LYS  13  -8.068  -4.293   5.706
  114    HG2  LYS  13           2HG      LYS  13  -9.550  -4.968   3.910
  115    HG3  LYS  13           3HG      LYS  13  -8.276  -4.762   2.702
  116    HD2  LYS  13           2HD      LYS  13  -6.920  -6.517   3.876
  117    HD3  LYS  13           3HD      LYS  13  -8.260  -6.788   4.994
  118    HE2  LYS  13           2HE      LYS  13  -8.398  -7.111   1.957
  119    HE3  LYS  13           3HE      LYS  13  -8.101  -8.432   3.089
  120    HZ1  LYS  13           HZ1      LYS  13 -10.579  -6.794   3.010
  121    HZ2  LYS  13           HZ2      LYS  13 -10.436  -8.335   2.499
  122    HZ3  LYS  13           HZ3      LYS  13 -10.285  -7.993   4.085
  123    H    LYS  14           H        LYS  14  -5.912  -1.549   5.150
  124    HA   LYS  14           HA       LYS  14  -6.867  -0.485   7.744
  125    HB2  LYS  14           2HB      LYS  14  -4.165  -0.752   6.394
  126    HB3  LYS  14           3HB      LYS  14  -4.370   0.328   7.755
  127    HG2  LYS  14           2HG      LYS  14  -3.520  -1.795   8.508
  128    HG3  LYS  14           3HG      LYS  14  -5.098  -1.446   9.213
  129    HD2  LYS  14           2HD      LYS  14  -6.176  -3.082   7.729
  130    HD3  LYS  14           3HD      LYS  14  -4.664  -3.305   6.841
  131    HE2  LYS  14           2HE      LYS  14  -4.925  -5.179   8.301
  132    HE3  LYS  14           3HE      LYS  14  -3.587  -4.198   8.900
  133    HZ1  LYS  14           HZ1      LYS  14  -6.353  -4.166  10.003
  134    HZ2  LYS  14           HZ2      LYS  14  -5.076  -4.908  10.692
  135    HZ3  LYS  14           HZ3      LYS  14  -5.102  -3.284  10.582
  136    H    GLY  15           H        GLY  15  -6.602   0.791   4.571
  137    HA2  GLY  15           HA2      GLY  15  -7.336   2.849   3.799
  138    HA3  GLY  15           HA3      GLY  15  -7.554   3.419   5.455
  139    H    LYS  16           H        LYS  16  -4.465   2.061   4.429
  140    HA   LYS  16           HA       LYS  16  -3.236   4.787   4.195
  141    HB2  LYS  16           2HB      LYS  16  -2.916   3.899   6.481
  142    HB3  LYS  16           3HB      LYS  16  -2.092   2.482   5.816
  143    HG2  LYS  16           2HG      LYS  16  -0.354   3.952   4.818
  144    HG3  LYS  16           3HG      LYS  16  -1.188   5.382   5.436
  145    HD2  LYS  16           2HD      LYS  16  -0.012   3.152   7.158
  146    HD3  LYS  16           3HD      LYS  16   0.786   4.690   6.794
  147    HE2  LYS  16           2HE      LYS  16  -1.112   5.919   7.849
  148    HE3  LYS  16           3HE      LYS  16  -1.867   4.377   8.269
  149    HZ1  LYS  16           HZ1      LYS  16  -0.584   5.260  10.129
  150    HZ2  LYS  16           HZ2      LYS  16   0.090   3.861   9.630
  151    HZ3  LYS  16           HZ3      LYS  16   0.788   5.289   9.248
  152    H    CYS  17           H        CYS  17  -2.903   4.806   2.099
  153    HA   CYS  17           HA       CYS  17  -1.062   2.837   0.823
  154    HB2  CYS  17           2HB      CYS  17  -3.471   2.147   0.458
  155    HB3  CYS  17           3HB      CYS  17  -3.754   3.692  -0.298
  156    H    LYS  18           H        LYS  18   0.528   3.993  -0.185
  157    HA   LYS  18           HA       LYS  18   0.064   6.714  -1.288
  158    HB2  LYS  18           2HB      LYS  18   1.878   6.149   1.129
  159    HB3  LYS  18           3HB      LYS  18   1.862   7.662   0.228
  160    HG2  LYS  18           2HG      LYS  18  -0.546   7.982   0.863
  161    HG3  LYS  18           3HG      LYS  18  -0.403   6.562   1.924
  162    HD2  LYS  18           2HD      LYS  18   1.427   7.664   3.172
  163    HD3  LYS  18           3HD      LYS  18   1.289   9.089   2.117
  164    HE2  LYS  18           2HE      LYS  18  -1.082   9.374   2.837
  165    HE3  LYS  18           3HE      LYS  18  -0.918   7.980   3.913
  166    HZ1  LYS  18           HZ1      LYS  18   0.813   9.211   5.124
  167    HZ2  LYS  18           HZ2      LYS  18   0.651  10.498   4.130
  168    HZ3  LYS  18           HZ3      LYS  18  -0.577  10.065   5.111
  169    H    GLY  19           H        GLY  19   2.150   7.749  -1.978
  170    HA2  GLY  19           HA2      GLY  19   3.947   7.751  -3.426
  171    HA3  GLY  19           HA3      GLY  19   4.524   6.380  -2.491
  172    HA   PRO  20           HA       PRO  20   3.864   4.545  -6.658
  173    HB2  PRO  20           2HB      PRO  20   5.242   2.209  -6.289
  174    HB3  PRO  20           3HB      PRO  20   6.039   3.777  -6.620
  175    HG2  PRO  20           2HG      PRO  20   5.600   2.446  -3.929
  176    HG3  PRO  20           3HG      PRO  20   7.109   3.164  -4.577
  177    HD2  PRO  20           2HD      PRO  20   5.465   4.529  -2.898
  178    HD3  PRO  20           3HD      PRO  20   6.323   5.364  -4.229
  179    H    LEU  21           H        LEU  21   3.229   3.011  -3.460
  180    HA   LEU  21           HA       LEU  21   1.787   0.792  -4.472
  181    HB2  LEU  21           2HB      LEU  21   2.733   1.040  -2.159
  182    HB3  LEU  21           3HB      LEU  21   1.436   2.171  -1.781
  183    HG   LEU  21           HG       LEU  21  -0.253   0.390  -2.135
  184   HD11  LEU  21          1HD1      LEU  21   0.502  -1.973  -2.310
  185   HD12  LEU  21          2HD1      LEU  21   0.856  -1.050  -3.768
  186   HD13  LEU  21          3HD1      LEU  21   2.160  -1.402  -2.603
  187   HD21  LEU  21          3HD2      LEU  21   2.025  -0.372  -0.266
  188   HD22  LEU  21          1HD2      LEU  21   0.668   0.720   0.103
  189   HD23  LEU  21          2HD2      LEU  21   0.369  -1.004  -0.189
  190    H    LYS  22           H        LYS  22   0.666   4.061  -3.675
  191    HA   LYS  22           HA       LYS  22  -2.149   3.698  -3.975
  192    HB2  LYS  22           2HB      LYS  22  -1.111   5.663  -2.991
  193    HB3  LYS  22           3HB      LYS  22  -0.350   6.092  -4.532
  194    HG2  LYS  22           2HG      LYS  22  -2.541   6.548  -5.539
  195    HG3  LYS  22           3HG      LYS  22  -3.363   5.910  -4.111
  196    HD2  LYS  22           2HD      LYS  22  -3.463   8.259  -3.937
  197    HD3  LYS  22           3HD      LYS  22  -2.277   7.705  -2.737
  198    HE2  LYS  22           2HE      LYS  22  -0.425   8.333  -4.262
  199    HE3  LYS  22           3HE      LYS  22  -1.588   8.798  -5.509
  200    HZ1  LYS  22           HZ1      LYS  22  -0.799  10.732  -4.268
  201    HZ2  LYS  22           HZ2      LYS  22  -2.399  10.545  -4.023
  202    HZ3  LYS  22           HZ3      LYS  22  -1.339  10.119  -2.855
  203    H    LEU  23           H        LEU  23   0.326   4.340  -6.395
  204    HA   LEU  23           HA       LEU  23  -1.549   4.357  -8.632
  205    HB2  LEU  23           2HB      LEU  23   0.573   5.604  -8.657
  206    HB3  LEU  23           3HB      LEU  23   1.482   4.100  -8.531
  207    HG   LEU  23           HG       LEU  23   0.645   3.387 -10.756
  208   HD11  LEU  23          1HD1      LEU  23  -0.657   6.148 -10.829
  209   HD12  LEU  23          2HD1      LEU  23  -0.465   5.065 -12.225
  210   HD13  LEU  23          3HD1      LEU  23  -1.500   4.581 -10.881
  211   HD21  LEU  23          3HD2      LEU  23   1.891   6.166 -10.730
  212   HD22  LEU  23          1HD2      LEU  23   2.764   4.628 -10.544
  213   HD23  LEU  23          2HD2      LEU  23   1.948   4.998 -12.071
  214    H    VAL  24           H        VAL  24   0.725   1.915  -7.333
  215    HA   VAL  24           HA       VAL  24   0.288  -0.110  -9.303
  216    HB   VAL  24           HB       VAL  24   1.242  -0.241  -6.420
  217   HG11  VAL  24          1HG1      VAL  24   0.536  -2.508  -6.989
  218   HG12  VAL  24          2HG1      VAL  24   1.405  -2.422  -8.540
  219   HG13  VAL  24          3HG1      VAL  24   2.291  -2.420  -7.000
  220   HG21  VAL  24          3HG2      VAL  24   3.460  -0.279  -7.324
  221   HG22  VAL  24          1HG2      VAL  24   2.855  -0.442  -8.997
  222   HG23  VAL  24          2HG2      VAL  24   2.639   1.067  -8.103
  223    H    CYS  25           H        CYS  25  -1.352   0.509  -6.224
  224    HA   CYS  25           HA       CYS  25  -2.998  -1.946  -6.430
  225    HB2  CYS  25           2HB      CYS  25  -1.646  -1.283  -4.417
  226    HB3  CYS  25           3HB      CYS  25  -2.666   0.138  -4.247
  227    H    LYS  26           H        LYS  26  -3.215   1.250  -7.318
  228    HA   LYS  26           HA       LYS  26  -4.695   2.860  -7.604
  229    HB2  LYS  26           2HB      LYS  26  -5.430   0.784  -9.190
  230    HB3  LYS  26           3HB      LYS  26  -6.961   1.088  -8.389
  231    HG2  LYS  26           2HG      LYS  26  -5.182   3.054  -9.880
  232    HG3  LYS  26           3HG      LYS  26  -6.724   2.413 -10.456
  233    HD2  LYS  26           2HD      LYS  26  -6.305   4.361  -8.140
  234    HD3  LYS  26           3HD      LYS  26  -6.969   4.740  -9.723
  235    HE2  LYS  26           2HE      LYS  26  -8.968   3.468  -9.319
  236    HE3  LYS  26           3HE      LYS  26  -8.287   2.718  -7.873
  237    HZ1  LYS  26           HZ1      LYS  26  -8.274   4.872  -6.777
  238    HZ2  LYS  26           HZ2      LYS  26  -8.877   5.614  -8.112
  239    HZ3  LYS  26           HZ3      LYS  26  -9.787   4.532  -7.294
  240    H    CYS  27           H        CYS  27  -4.542   3.374  -5.445
  241    HA   CYS  27           HA       CYS  27  -6.858   2.799  -3.677
  242    HB2  CYS  27           2HB      CYS  27  -4.221   4.198  -3.165
  243    HB3  CYS  27           3HB      CYS  27  -5.436   3.829  -1.955
  Start of MODEL    3
    1    H1   GLY   1           1H       GLY   1   8.951  -8.226   5.962
    2    H2   GLY   1           2H       GLY   1   9.963  -8.091   4.684
    3    H3   GLY   1           3H       GLY   1   9.953  -6.933   5.843
    4    HA2  GLY   1           HA2      GLY   1   7.718  -6.271   5.272
    5    HA3  GLY   1           HA3      GLY   1   8.808  -6.143   3.879
    6    H    LEU   2           H        LEU   2   6.793  -6.236   2.640
    7    HA   LEU   2           HA       LEU   2   6.001  -9.019   1.961
    8    HB2  LEU   2           2HB      LEU   2   4.167  -6.651   2.495
    9    HB3  LEU   2           3HB      LEU   2   3.640  -8.056   1.583
   10    HG   LEU   2           HG       LEU   2   4.598  -8.161   4.477
   11   HD11  LEU   2          1HD1      LEU   2   2.215  -8.450   5.018
   12   HD12  LEU   2          2HD1      LEU   2   2.507  -6.888   4.238
   13   HD13  LEU   2          3HD1      LEU   2   1.789  -8.221   3.307
   14   HD21  LEU   2          3HD2      LEU   2   3.227 -10.238   2.703
   15   HD22  LEU   2          1HD2      LEU   2   4.885 -10.329   3.343
   16   HD23  LEU   2          2HD2      LEU   2   3.512 -10.406   4.449
   17    HA   PRO   3           HA       PRO   3   6.574  -7.439  -2.205
   18    HB2  PRO   3           2HB      PRO   3   5.257  -9.282  -3.701
   19    HB3  PRO   3           3HB      PRO   3   6.750  -9.692  -2.800
   20    HG2  PRO   3           2HG      PRO   3   3.874 -10.147  -1.933
   21    HG3  PRO   3           3HG      PRO   3   5.222 -11.327  -1.937
   22    HD2  PRO   3           2HD      PRO   3   4.504  -9.909   0.294
   23    HD3  PRO   3           3HD      PRO   3   6.208 -10.349  -0.035
   24    H    ARG   4           H        ARG   4   5.407  -6.325  -3.828
   25    HA   ARG   4           HA       ARG   4   3.306  -4.684  -2.947
   26    HB2  ARG   4           2HB      ARG   4   4.212  -5.345  -5.780
   27    HB3  ARG   4           3HB      ARG   4   3.055  -4.069  -5.391
   28    HG2  ARG   4           2HG      ARG   4   4.707  -2.943  -3.954
   29    HG3  ARG   4           3HG      ARG   4   5.916  -4.179  -4.327
   30    HD2  ARG   4           2HD      ARG   4   4.589  -2.340  -6.361
   31    HD3  ARG   4           3HD      ARG   4   6.185  -2.080  -5.640
   32    HE   ARG   4           HE       ARG   4   6.265  -4.652  -6.761
   33   HH11  ARG   4          1HH2      ARG   4   5.924  -1.391  -7.996
   34   HH12  ARG   4          2HH2      ARG   4   6.602  -1.811  -9.545
   35   HH21  ARG   4          2HH1      ARG   4   7.116  -5.119  -8.761
   36   HH22  ARG   4          1HH1      ARG   4   7.263  -3.864  -9.956
   37    H    LYS   5           H        LYS   5   2.962  -7.701  -4.755
   38    HA   LYS   5           HA       LYS   5   0.162  -7.440  -5.333
   39    HB2  LYS   5           2HB      LYS   5   0.239  -9.744  -5.983
   40    HB3  LYS   5           3HB      LYS   5   1.693  -8.928  -6.554
   41    HG2  LYS   5           2HG      LYS   5   2.933  -9.886  -4.552
   42    HG3  LYS   5           3HG      LYS   5   1.480 -10.814  -4.163
   43    HD2  LYS   5           2HD      LYS   5   3.058 -11.018  -6.761
   44    HD3  LYS   5           3HD      LYS   5   3.188 -12.126  -5.388
   45    HE2  LYS   5           2HE      LYS   5   0.776 -12.708  -5.631
   46    HE3  LYS   5           3HE      LYS   5   0.663 -11.637  -7.035
   47    HZ1  LYS   5           HZ1      LYS   5   2.415 -14.032  -6.860
   48    HZ2  LYS   5           HZ2      LYS   5   1.029 -13.937  -7.711
   49    HZ3  LYS   5           HZ3      LYS   5   2.316 -13.039  -8.154
   50    H    ILE   6           H        ILE   6   1.717  -8.264  -2.364
   51    HA   ILE   6           HA       ILE   6  -0.891  -9.097  -1.136
   52    HB   ILE   6           HB       ILE   6   1.928  -9.284  -0.008
   53   HG12  ILE   6          2HG1      ILE   6   0.063 -11.474  -1.044
   54   HG13  ILE   6          3HG1      ILE   6   1.508 -10.892  -1.865
   55   HG21  ILE   6          1HG2      ILE   6   0.167  -8.919   1.730
   56   HG22  ILE   6          2HG2      ILE   6  -0.736 -10.303   1.091
   57   HG23  ILE   6          3HG2      ILE   6   0.858 -10.528   1.845
   58   HD11  ILE   6          3HD1      ILE   6   2.087 -12.938  -0.818
   59   HD12  ILE   6          1HD1      ILE   6   2.897 -11.642   0.079
   60   HD13  ILE   6          2HD1      ILE   6   1.442 -12.423   0.748
   61    H    LEU   7           H        LEU   7   1.862  -6.822  -0.728
   62    HA   LEU   7           HA       LEU   7   0.825  -5.434   1.477
   63    HB2  LEU   7           2HB      LEU   7   3.174  -5.456   0.618
   64    HB3  LEU   7           3HB      LEU   7   2.675  -4.430  -0.720
   65    HG   LEU   7           HG       LEU   7   2.135  -2.600   0.848
   66   HD11  LEU   7          1HD1      LEU   7   1.487  -3.813   2.871
   67   HD12  LEU   7          2HD1      LEU   7   3.120  -4.505   3.018
   68   HD13  LEU   7          3HD1      LEU   7   2.853  -2.762   3.229
   69   HD21  LEU   7          3HD2      LEU   7   4.430  -2.844  -0.077
   70   HD22  LEU   7          1HD2      LEU   7   4.434  -2.094   1.526
   71   HD23  LEU   7          2HD2      LEU   7   4.893  -3.802   1.342
   72    H    CYS   8           H        CYS   8   0.012  -5.014  -1.926
   73    HA   CYS   8           HA       CYS   8  -1.422  -2.531  -1.797
   74    HB2  CYS   8           2HB      CYS   8  -0.820  -3.525  -3.876
   75    HB3  CYS   8           3HB      CYS   8  -1.633  -5.034  -3.494
   76    H    ALA   9           H        ALA   9  -2.487  -5.884  -0.962
   77    HA   ALA   9           HA       ALA   9  -5.247  -5.072  -0.512
   78    HB1  ALA   9           3HB      ALA   9  -3.721  -7.559   0.383
   79    HB2  ALA   9           1HB      ALA   9  -5.482  -7.338   0.402
   80    HB3  ALA   9           2HB      ALA   9  -4.613  -7.380  -1.144
   81    H    ILE  10           H        ILE  10  -2.394  -5.632   1.564
   82    HA   ILE  10           HA       ILE  10  -3.586  -5.065   4.090
   83    HB   ILE  10           HB       ILE  10  -0.744  -4.537   3.145
   84   HG12  ILE  10          2HG1      ILE  10  -1.331  -6.882   2.766
   85   HG13  ILE  10          3HG1      ILE  10  -0.124  -6.696   4.004
   86   HG21  ILE  10          1HG2      ILE  10  -0.128  -4.772   5.547
   87   HG22  ILE  10          2HG2      ILE  10  -1.130  -3.353   5.227
   88   HG23  ILE  10          3HG2      ILE  10  -1.857  -4.795   5.961
   89   HD11  ILE  10          3HD1      ILE  10  -1.759  -8.440   4.574
   90   HD12  ILE  10          1HD1      ILE  10  -1.834  -7.130   5.761
   91   HD13  ILE  10          2HD1      ILE  10  -3.083  -7.268   4.498
   92    H    ALA  11           H        ALA  11  -1.869  -2.833   1.844
   93    HA   ALA  11           HA       ALA  11  -2.167  -0.456   3.310
   94    HB1  ALA  11           3HB      ALA  11  -0.713  -0.826   1.304
   95    HB2  ALA  11           1HB      ALA  11  -2.172  -0.829   0.276
   96    HB3  ALA  11           2HB      ALA  11  -1.701   0.628   1.166
   97    H    LYS  12           H        LYS  12  -4.364  -1.824   0.817
   98    HA   LYS  12           HA       LYS  12  -6.326   0.239   0.996
   99    HB2  LYS  12           2HB      LYS  12  -5.887  -1.739  -0.771
  100    HB3  LYS  12           3HB      LYS  12  -7.060  -2.591   0.217
  101    HG2  LYS  12           2HG      LYS  12  -8.364  -1.572  -1.457
  102    HG3  LYS  12           3HG      LYS  12  -8.565  -0.503  -0.071
  103    HD2  LYS  12           2HD      LYS  12  -8.238   0.879  -2.017
  104    HD3  LYS  12           3HD      LYS  12  -6.797   1.008  -1.012
  105    HE2  LYS  12           2HE      LYS  12  -6.101   0.877  -3.289
  106    HE3  LYS  12           3HE      LYS  12  -5.606  -0.600  -2.473
  107    HZ1  LYS  12           HZ1      LYS  12  -6.568  -0.906  -4.710
  108    HZ2  LYS  12           HZ2      LYS  12  -7.412  -1.756  -3.583
  109    HZ3  LYS  12           HZ3      LYS  12  -8.023  -0.360  -4.190
  110    H    LYS  13           H        LYS  13  -6.175  -2.906   2.705
  111    HA   LYS  13           HA       LYS  13  -8.734  -2.552   4.042
  112    HB2  LYS  13           2HB      LYS  13  -6.468  -4.528   4.208
  113    HB3  LYS  13           3HB      LYS  13  -7.515  -4.387   5.605
  114    HG2  LYS  13           2HG      LYS  13  -8.318  -6.151   4.178
  115    HG3  LYS  13           3HG      LYS  13  -9.501  -4.851   4.309
  116    HD2  LYS  13           2HD      LYS  13  -8.862  -4.040   2.033
  117    HD3  LYS  13           3HD      LYS  13  -7.631  -5.305   1.946
  118    HE2  LYS  13           2HE      LYS  13  -9.500  -6.062   0.683
  119    HE3  LYS  13           3HE      LYS  13  -9.395  -7.045   2.144
  120    HZ1  LYS  13           HZ1      LYS  13 -11.269  -4.764   1.755
  121    HZ2  LYS  13           HZ2      LYS  13 -11.679  -6.338   1.675
  122    HZ3  LYS  13           HZ3      LYS  13 -11.198  -5.702   3.095
  123    H    LYS  14           H        LYS  14  -5.425  -1.736   5.061
  124    HA   LYS  14           HA       LYS  14  -6.368  -0.723   7.677
  125    HB2  LYS  14           2HB      LYS  14  -3.680  -0.880   6.281
  126    HB3  LYS  14           3HB      LYS  14  -3.904   0.215   7.629
  127    HG2  LYS  14           2HG      LYS  14  -2.996  -1.763   8.512
  128    HG3  LYS  14           3HG      LYS  14  -4.658  -1.626   9.083
  129    HD2  LYS  14           2HD      LYS  14  -5.359  -3.309   7.365
  130    HD3  LYS  14           3HD      LYS  14  -3.676  -3.472   6.854
  131    HE2  LYS  14           2HE      LYS  14  -4.804  -4.070   9.633
  132    HE3  LYS  14           3HE      LYS  14  -4.460  -5.276   8.392
  133    HZ1  LYS  14           HZ1      LYS  14  -2.424  -3.556   9.707
  134    HZ2  LYS  14           HZ2      LYS  14  -2.647  -5.145   9.973
  135    HZ3  LYS  14           HZ3      LYS  14  -2.099  -4.640   8.524
  136    H    GLY  15           H        GLY  15  -6.426   0.585   4.543
  137    HA2  GLY  15           HA2      GLY  15  -6.911   2.694   3.749
  138    HA3  GLY  15           HA3      GLY  15  -7.207   3.246   5.403
  139    H    LYS  16           H        LYS  16  -4.165   1.749   4.493
  140    HA   LYS  16           HA       LYS  16  -2.704   4.317   4.968
  141    HB2  LYS  16           2HB      LYS  16  -2.676   2.588   6.833
  142    HB3  LYS  16           3HB      LYS  16  -1.848   1.499   5.726
  143    HG2  LYS  16           2HG      LYS  16  -0.180   2.480   7.104
  144    HG3  LYS  16           3HG      LYS  16   0.001   3.248   5.527
  145    HD2  LYS  16           2HD      LYS  16  -1.294   5.235   6.395
  146    HD3  LYS  16           3HD      LYS  16  -1.393   4.428   7.976
  147    HE2  LYS  16           2HE      LYS  16   1.124   4.329   8.010
  148    HE3  LYS  16           3HE      LYS  16   1.147   5.230   6.486
  149    HZ1  LYS  16           HZ1      LYS  16   1.431   6.707   8.396
  150    HZ2  LYS  16           HZ2      LYS  16   0.027   7.069   7.648
  151    HZ3  LYS  16           HZ3      LYS  16   0.016   6.230   9.051
  152    H    CYS  17           H        CYS  17  -3.131   4.445   2.611
  153    HA   CYS  17           HA       CYS  17  -0.947   3.157   1.028
  154    HB2  CYS  17           2HB      CYS  17  -3.261   2.096   0.706
  155    HB3  CYS  17           3HB      CYS  17  -3.773   3.648   0.070
  156    H    LYS  18           H        LYS  18   0.350   4.668   0.243
  157    HA   LYS  18           HA       LYS  18  -0.640   7.193  -0.952
  158    HB2  LYS  18           2HB      LYS  18   1.353   7.092   1.372
  159    HB3  LYS  18           3HB      LYS  18   1.111   8.497   0.333
  160    HG2  LYS  18           2HG      LYS  18  -1.313   8.538   1.021
  161    HG3  LYS  18           3HG      LYS  18  -0.938   7.278   2.218
  162    HD2  LYS  18           2HD      LYS  18   0.728   8.769   3.280
  163    HD3  LYS  18           3HD      LYS  18   0.376  10.026   2.072
  164    HE2  LYS  18           2HE      LYS  18  -2.006  10.052   2.822
  165    HE3  LYS  18           3HE      LYS  18  -1.622   8.846   4.057
  166    HZ1  LYS  18           HZ1      LYS  18  -0.072  10.464   5.044
  167    HZ2  LYS  18           HZ2      LYS  18  -0.443  11.573   3.903
  168    HZ3  LYS  18           HZ3      LYS  18  -1.575  11.095   4.973
  169    H    GLY  19           H        GLY  19   1.136   8.395  -2.022
  170    HA2  GLY  19           HA2      GLY  19   2.884   8.532  -3.532
  171    HA3  GLY  19           HA3      GLY  19   3.734   7.581  -2.321
  172    HA   PRO  20           HA       PRO  20   4.149   4.924  -6.017
  173    HB2  PRO  20           2HB      PRO  20   5.681   3.322  -3.961
  174    HB3  PRO  20           3HB      PRO  20   6.091   3.647  -5.674
  175    HG2  PRO  20           2HG      PRO  20   7.303   5.060  -3.717
  176    HG3  PRO  20           3HG      PRO  20   6.689   5.918  -5.171
  177    HD2  PRO  20           2HD      PRO  20   5.373   5.654  -2.449
  178    HD3  PRO  20           3HD      PRO  20   5.576   7.110  -3.471
  179    H    LEU  21           H        LEU  21   3.222   3.747  -2.727
  180    HA   LEU  21           HA       LEU  21   2.167   1.242  -3.646
  181    HB2  LEU  21           2HB      LEU  21   2.700   2.338  -1.185
  182    HB3  LEU  21           3HB      LEU  21   0.964   2.538  -1.220
  183    HG   LEU  21           HG       LEU  21   1.487   0.516  -0.074
  184   HD11  LEU  21          1HD1      LEU  21   0.597  -0.416  -2.830
  185   HD12  LEU  21          2HD1      LEU  21   0.340  -1.216  -1.268
  186   HD13  LEU  21          3HD1      LEU  21  -0.470   0.319  -1.611
  187   HD21  LEU  21          3HD2      LEU  21   3.082  -0.387  -2.507
  188   HD22  LEU  21          1HD2      LEU  21   3.745   0.146  -0.946
  189   HD23  LEU  21          2HD2      LEU  21   2.769  -1.328  -1.044
  190    H    LYS  22           H        LYS  22   0.690   4.404  -3.220
  191    HA   LYS  22           HA       LYS  22  -2.030   3.672  -3.984
  192    HB2  LYS  22           2HB      LYS  22  -1.685   5.590  -2.623
  193    HB3  LYS  22           3HB      LYS  22  -0.540   6.306  -3.764
  194    HG2  LYS  22           2HG      LYS  22  -2.262   6.791  -5.360
  195    HG3  LYS  22           3HG      LYS  22  -3.466   5.847  -4.461
  196    HD2  LYS  22           2HD      LYS  22  -3.427   7.406  -2.616
  197    HD3  LYS  22           3HD      LYS  22  -2.003   8.231  -3.275
  198    HE2  LYS  22           2HE      LYS  22  -3.620   9.727  -3.896
  199    HE3  LYS  22           3HE      LYS  22  -3.508   8.735  -5.350
  200    HZ1  LYS  22           HZ1      LYS  22  -5.812   9.038  -4.759
  201    HZ2  LYS  22           HZ2      LYS  22  -5.468   7.464  -4.455
  202    HZ3  LYS  22           HZ3      LYS  22  -5.576   8.528  -3.227
  203    H    LEU  23           H        LEU  23   0.760   4.920  -5.807
  204    HA   LEU  23           HA       LEU  23  -0.550   5.066  -8.352
  205    HB2  LEU  23           2HB      LEU  23   1.561   6.136  -7.759
  206    HB3  LEU  23           3HB      LEU  23   2.380   4.589  -7.650
  207    HG   LEU  23           HG       LEU  23   1.044   5.414 -10.247
  208   HD11  LEU  23          1HD1      LEU  23   3.173   6.455 -10.946
  209   HD12  LEU  23          2HD1      LEU  23   2.458   7.315  -9.576
  210   HD13  LEU  23          3HD1      LEU  23   3.832   6.219  -9.309
  211   HD21  LEU  23          3HD2      LEU  23   2.921   4.108 -11.240
  212   HD22  LEU  23          1HD2      LEU  23   3.529   3.741  -9.613
  213   HD23  LEU  23          2HD2      LEU  23   1.966   3.103 -10.159
  214    H    VAL  24           H        VAL  24   1.171   2.358  -6.782
  215    HA   VAL  24           HA       VAL  24   0.834   0.442  -8.912
  216    HB   VAL  24           HB       VAL  24   1.407   0.174  -5.938
  217   HG11  VAL  24          1HG1      VAL  24   0.522  -1.994  -6.643
  218   HG12  VAL  24          2HG1      VAL  24   1.597  -1.999  -8.061
  219   HG13  VAL  24          3HG1      VAL  24   2.264  -2.093  -6.416
  220   HG21  VAL  24          3HG2      VAL  24   3.688  -0.066  -6.545
  221   HG22  VAL  24          1HG2      VAL  24   3.300  -0.214  -8.287
  222   HG23  VAL  24          2HG2      VAL  24   3.116   1.331  -7.447
  223    H    CYS  25           H        CYS  25  -1.012   1.055  -5.944
  224    HA   CYS  25           HA       CYS  25  -2.832  -1.200  -6.486
  225    HB2  CYS  25           2HB      CYS  25  -1.405  -0.851  -4.453
  226    HB3  CYS  25           3HB      CYS  25  -2.397   0.526  -4.041
  227    H    LYS  26           H        LYS  26  -2.959   1.979  -7.191
  228    HA   LYS  26           HA       LYS  26  -4.462   3.599  -7.569
  229    HB2  LYS  26           2HB      LYS  26  -6.451   2.977  -8.910
  230    HB3  LYS  26           3HB      LYS  26  -4.898   2.383  -9.453
  231    HG2  LYS  26           2HG      LYS  26  -6.401   0.643  -9.837
  232    HG3  LYS  26           3HG      LYS  26  -5.413   0.150  -8.469
  233    HD2  LYS  26           2HD      LYS  26  -7.331   0.895  -6.953
  234    HD3  LYS  26           3HD      LYS  26  -8.309   1.120  -8.406
  235    HE2  LYS  26           2HE      LYS  26  -6.906  -1.449  -7.541
  236    HE3  LYS  26           3HE      LYS  26  -8.601  -1.078  -7.204
  237    HZ1  LYS  26           HZ1      LYS  26  -8.421  -2.467  -9.175
  238    HZ2  LYS  26           HZ2      LYS  26  -9.006  -1.009  -9.612
  239    HZ3  LYS  26           HZ3      LYS  26  -7.448  -1.398  -9.926
  240    H    CYS  27           H        CYS  27  -4.347   2.969  -4.996
  241    HA   CYS  27           HA       CYS  27  -6.703   2.858  -3.466
  242    HB2  CYS  27           2HB      CYS  27  -4.130   4.379  -2.860
  243    HB3  CYS  27           3HB      CYS  27  -5.328   3.886  -1.696
  Start of MODEL    4
    1    H1   GLY   1           1H       GLY   1  11.297  -8.987   1.394
    2    H2   GLY   1           2H       GLY   1  11.866  -8.428   2.826
    3    H3   GLY   1           3H       GLY   1  10.985  -9.809   2.773
    4    HA2  GLY   1           HA2      GLY   1   9.637  -8.009   3.625
    5    HA3  GLY   1           HA3      GLY   1   9.983  -7.109   2.138
    6    H    LEU   2           H        LEU   2   7.384  -7.499   2.830
    7    HA   LEU   2           HA       LEU   2   6.188  -9.853   1.667
    8    HB2  LEU   2           2HB      LEU   2   5.148  -7.193   2.656
    9    HB3  LEU   2           3HB      LEU   2   4.097  -8.304   1.793
   10    HG   LEU   2           HG       LEU   2   4.399 -10.040   3.461
   11   HD11  LEU   2          1HD1      LEU   2   6.637  -9.637   4.340
   12   HD12  LEU   2          2HD1      LEU   2   6.140  -8.041   4.967
   13   HD13  LEU   2          3HD1      LEU   2   5.470  -9.536   5.654
   14   HD21  LEU   2          3HD2      LEU   2   3.188  -8.942   5.296
   15   HD22  LEU   2          1HD2      LEU   2   3.710  -7.346   4.714
   16   HD23  LEU   2          2HD2      LEU   2   2.612  -8.340   3.738
   17    HA   PRO   3           HA       PRO   3   6.123  -8.613  -2.633
   18    HB2  PRO   3           2HB      PRO   3   3.425  -9.923  -2.793
   19    HB3  PRO   3           3HB      PRO   3   4.866 -10.180  -3.820
   20    HG2  PRO   3           2HG      PRO   3   4.179 -11.993  -1.914
   21    HG3  PRO   3           3HG      PRO   3   5.897 -11.547  -2.168
   22    HD2  PRO   3           2HD      PRO   3   3.996 -10.527  -0.038
   23    HD3  PRO   3           3HD      PRO   3   5.690 -11.082   0.104
   24    H    ARG   4           H        ARG   4   5.203  -7.042  -4.023
   25    HA   ARG   4           HA       ARG   4   3.717  -4.902  -2.855
   26    HB2  ARG   4           2HB      ARG   4   4.217  -5.596  -5.782
   27    HB3  ARG   4           3HB      ARG   4   3.478  -4.092  -5.224
   28    HG2  ARG   4           2HG      ARG   4   5.514  -3.625  -3.838
   29    HG3  ARG   4           3HG      ARG   4   6.300  -5.040  -4.551
   30    HD2  ARG   4           2HD      ARG   4   5.263  -2.612  -6.074
   31    HD3  ARG   4           3HD      ARG   4   6.953  -2.904  -5.634
   32    HE   ARG   4           HE       ARG   4   6.171  -5.174  -7.066
   33   HH11  ARG   4          1HH2      ARG   4   6.494  -1.766  -7.805
   34   HH12  ARG   4          2HH2      ARG   4   6.776  -2.067  -9.499
   35   HH21  ARG   4          1HH1      ARG   4   6.533  -5.486  -9.238
   36   HH22  ARG   4          2HH1      ARG   4   6.805  -4.120 -10.278
   37    H    LYS   5           H        LYS   5   2.523  -7.642  -4.760
   38    HA   LYS   5           HA       LYS   5  -0.199  -6.678  -4.917
   39    HB2  LYS   5           2HB      LYS   5  -0.768  -8.895  -5.716
   40    HB3  LYS   5           3HB      LYS   5   0.652  -8.248  -6.533
   41    HG2  LYS   5           2HG      LYS   5   2.123  -9.680  -5.105
   42    HG3  LYS   5           3HG      LYS   5   0.676 -10.335  -4.315
   43    HD2  LYS   5           2HD      LYS   5  -0.127 -11.205  -6.491
   44    HD3  LYS   5           3HD      LYS   5   1.327 -10.557  -7.282
   45    HE2  LYS   5           2HE      LYS   5   2.751 -11.981  -5.823
   46    HE3  LYS   5           3HE      LYS   5   1.305 -12.623  -5.031
   47    HZ1  LYS   5           HZ1      LYS   5   1.953 -12.951  -7.915
   48    HZ2  LYS   5           HZ2      LYS   5   2.092 -14.113  -6.780
   49    HZ3  LYS   5           HZ3      LYS   5   0.618 -13.544  -7.183
   50    H    ILE   6           H        ILE   6   1.451  -8.557  -2.406
   51    HA   ILE   6           HA       ILE   6  -0.958  -8.972  -0.803
   52    HB   ILE   6           HB       ILE   6   2.015  -9.296  -0.373
   53   HG12  ILE   6          2HG1      ILE   6   1.385 -11.567   0.275
   54   HG13  ILE   6          3HG1      ILE   6  -0.330 -11.167   0.140
   55   HG21  ILE   6          1HG2      ILE   6   1.595  -9.989   1.981
   56   HG22  ILE   6          2HG2      ILE   6   1.345  -8.265   1.734
   57   HG23  ILE   6          3HG2      ILE   6  -0.058  -9.352   1.859
   58   HD11  ILE   6          3HD1      ILE   6   0.544 -12.542  -1.732
   59   HD12  ILE   6          1HD1      ILE   6  -0.165 -11.014  -2.269
   60   HD13  ILE   6          2HD1      ILE   6   1.612 -11.207  -2.196
   61    H    LEU   7           H        LEU   7   1.775  -6.606  -0.692
   62    HA   LEU   7           HA       LEU   7   0.707  -5.085   1.459
   63    HB2  LEU   7           2HB      LEU   7   2.566  -4.328  -0.831
   64    HB3  LEU   7           3HB      LEU   7   2.223  -3.259   0.525
   65    HG   LEU   7           HG       LEU   7   3.472  -6.024   0.833
   66   HD11  LEU   7          1HD1      LEU   7   4.751  -3.259   0.887
   67   HD12  LEU   7          2HD1      LEU   7   5.566  -4.802   1.237
   68   HD13  LEU   7          3HD1      LEU   7   4.953  -4.483  -0.389
   69   HD21  LEU   7          3HD2      LEU   7   3.065  -3.717   2.787
   70   HD22  LEU   7          1HD2      LEU   7   2.348  -5.343   2.889
   71   HD23  LEU   7          2HD2      LEU   7   4.085  -5.132   3.102
   72    H    CYS   8           H        CYS   8  -0.005  -4.811  -2.011
   73    HA   CYS   8           HA       CYS   8  -1.618  -2.472  -1.950
   74    HB2  CYS   8           2HB      CYS   8  -0.861  -3.479  -3.990
   75    HB3  CYS   8           3HB      CYS   8  -1.656  -5.003  -3.621
   76    H    ALA   9           H        ALA   9  -2.467  -5.857  -1.050
   77    HA   ALA   9           HA       ALA   9  -5.304  -5.277  -0.742
   78    HB1  ALA   9           3HB      ALA   9  -3.623  -7.586   0.322
   79    HB2  ALA   9           1HB      ALA   9  -5.391  -7.519   0.211
   80    HB3  ALA   9           2HB      ALA   9  -4.410  -7.532  -1.270
   81    H    ILE  10           H        ILE  10  -2.505  -5.513   1.465
   82    HA   ILE  10           HA       ILE  10  -3.863  -4.952   3.915
   83    HB   ILE  10           HB       ILE  10  -1.012  -4.287   3.078
   84   HG12  ILE  10          2HG1      ILE  10  -1.479  -6.690   2.821
   85   HG13  ILE  10          3HG1      ILE  10  -0.304  -6.359   4.055
   86   HG21  ILE  10          1HG2      ILE  10  -2.241  -4.463   5.853
   87   HG22  ILE  10          2HG2      ILE  10  -0.498  -4.369   5.516
   88   HG23  ILE  10          3HG2      ILE  10  -1.552  -3.023   5.075
   89   HD11  ILE  10          3HD1      ILE  10  -2.024  -6.790   5.807
   90   HD12  ILE  10          1HD1      ILE  10  -3.239  -7.066   4.530
   91   HD13  ILE  10          2HD1      ILE  10  -1.853  -8.157   4.696
   92    H    ALA  11           H        ALA  11  -2.247  -2.701   1.627
   93    HA   ALA  11           HA       ALA  11  -2.553  -0.360   3.107
   94    HB1  ALA  11           3HB      ALA  11  -1.085  -0.677   1.144
   95    HB2  ALA  11           1HB      ALA  11  -2.507  -0.708   0.072
   96    HB3  ALA  11           2HB      ALA  11  -2.083   0.764   0.974
   97    H    LYS  12           H        LYS  12  -4.822  -1.583   0.567
   98    HA   LYS  12           HA       LYS  12  -6.699   0.588   1.103
   99    HB2  LYS  12           2HB      LYS  12  -8.016  -0.327  -0.661
  100    HB3  LYS  12           3HB      LYS  12  -6.318  -0.264  -1.121
  101    HG2  LYS  12           2HG      LYS  12  -6.240  -2.780  -0.454
  102    HG3  LYS  12           3HG      LYS  12  -8.000  -2.711  -0.443
  103    HD2  LYS  12           2HD      LYS  12  -8.070  -2.056  -2.775
  104    HD3  LYS  12           3HD      LYS  12  -6.316  -1.789  -2.816
  105    HE2  LYS  12           2HE      LYS  12  -5.861  -4.141  -2.492
  106    HE3  LYS  12           3HE      LYS  12  -7.588  -4.501  -2.290
  107    HZ1  LYS  12           HZ1      LYS  12  -6.355  -3.436  -4.783
  108    HZ2  LYS  12           HZ2      LYS  12  -6.825  -4.985  -4.556
  109    HZ3  LYS  12           HZ3      LYS  12  -7.939  -3.796  -4.592
  110    H    LYS  13           H        LYS  13  -6.404  -2.665   2.414
  111    HA   LYS  13           HA       LYS  13  -9.045  -2.767   3.604
  112    HB2  LYS  13           2HB      LYS  13  -7.711  -4.734   3.135
  113    HB3  LYS  13           3HB      LYS  13  -6.383  -4.133   4.142
  114    HG2  LYS  13           2HG      LYS  13  -7.753  -4.360   6.150
  115    HG3  LYS  13           3HG      LYS  13  -9.138  -4.916   5.177
  116    HD2  LYS  13           2HD      LYS  13  -8.016  -6.950   4.563
  117    HD3  LYS  13           3HD      LYS  13  -6.431  -6.296   4.998
  118    HE2  LYS  13           2HE      LYS  13  -6.951  -7.792   6.718
  119    HE3  LYS  13           3HE      LYS  13  -7.132  -6.151   7.359
  120    HZ1  LYS  13           HZ1      LYS  13  -9.380  -7.897   6.473
  121    HZ2  LYS  13           HZ2      LYS  13  -8.990  -7.604   8.027
  122    HZ3  LYS  13           HZ3      LYS  13  -9.554  -6.394   7.092
  123    H    LYS  14           H        LYS  14  -5.858  -1.596   4.751
  124    HA   LYS  14           HA       LYS  14  -6.958  -0.618   7.311
  125    HB2  LYS  14           2HB      LYS  14  -4.237  -0.605   5.974
  126    HB3  LYS  14           3HB      LYS  14  -4.567   0.536   7.264
  127    HG2  LYS  14           2HG      LYS  14  -3.528  -1.323   8.255
  128    HG3  LYS  14           3HG      LYS  14  -5.207  -1.290   8.795
  129    HD2  LYS  14           2HD      LYS  14  -5.748  -3.092   7.148
  130    HD3  LYS  14           3HD      LYS  14  -4.053  -3.143   6.658
  131    HE2  LYS  14           2HE      LYS  14  -5.157  -3.720   9.450
  132    HE3  LYS  14           3HE      LYS  14  -4.693  -4.942   8.264
  133    HZ1  LYS  14           HZ1      LYS  14  -2.920  -4.590   9.855
  134    HZ2  LYS  14           HZ2      LYS  14  -2.397  -4.093   8.393
  135    HZ3  LYS  14           HZ3      LYS  14  -2.834  -2.998   9.530
  136    H    GLY  15           H        GLY  15  -6.755   0.712   4.131
  137    HA2  GLY  15           HA2      GLY  15  -7.417   2.784   3.311
  138    HA3  GLY  15           HA3      GLY  15  -7.848   3.311   4.943
  139    H    LYS  16           H        LYS  16  -4.687   1.979   4.187
  140    HA   LYS  16           HA       LYS  16  -3.357   4.617   4.679
  141    HB2  LYS  16           2HB      LYS  16  -3.337   2.965   6.603
  142    HB3  LYS  16           3HB      LYS  16  -2.459   1.850   5.565
  143    HG2  LYS  16           2HG      LYS  16  -0.862   2.906   6.972
  144    HG3  LYS  16           3HG      LYS  16  -0.619   3.597   5.368
  145    HD2  LYS  16           2HD      LYS  16  -1.913   5.626   6.063
  146    HD3  LYS  16           3HD      LYS  16  -2.157   4.894   7.666
  147    HE2  LYS  16           2HE      LYS  16   0.341   4.767   7.925
  148    HE3  LYS  16           3HE      LYS  16   0.516   5.594   6.372
  149    HZ1  LYS  16           HZ1      LYS  16  -0.822   6.729   8.776
  150    HZ2  LYS  16           HZ2      LYS  16   0.653   7.156   8.230
  151    HZ3  LYS  16           HZ3      LYS  16  -0.672   7.501   7.342
  152    H    CYS  17           H        CYS  17  -3.594   4.744   2.336
  153    HA   CYS  17           HA       CYS  17  -1.355   3.417   0.865
  154    HB2  CYS  17           2HB      CYS  17  -3.624   2.314   0.528
  155    HB3  CYS  17           3HB      CYS  17  -4.155   3.826  -0.200
  156    H    LYS  18           H        LYS  18  -0.042   4.987   0.254
  157    HA   LYS  18           HA       LYS  18  -1.013   7.444  -1.110
  158    HB2  LYS  18           2HB      LYS  18   0.788   7.447   1.364
  159    HB3  LYS  18           3HB      LYS  18   0.571   8.829   0.288
  160    HG2  LYS  18           2HG      LYS  18  -1.899   8.774   0.779
  161    HG3  LYS  18           3HG      LYS  18  -1.575   7.535   2.011
  162    HD2  LYS  18           2HD      LYS  18  -0.064   9.098   3.197
  163    HD3  LYS  18           3HD      LYS  18  -0.367  10.335   1.957
  164    HE2  LYS  18           2HE      LYS  18  -2.804  10.261   2.510
  165    HE3  LYS  18           3HE      LYS  18  -2.469   9.082   3.784
  166    HZ1  LYS  18           HZ1      LYS  18  -1.072  10.775   4.873
  167    HZ2  LYS  18           HZ2      LYS  18  -1.401  11.858   3.695
  168    HZ3  LYS  18           HZ3      LYS  18  -2.592  11.336   4.678
  169    H    GLY  19           H        GLY  19   0.749   8.668  -2.093
  170    HA2  GLY  19           HA2      GLY  19   2.483   8.805  -3.606
  171    HA3  GLY  19           HA3      GLY  19   3.399   8.132  -2.277
  172    HA   PRO  20           HA       PRO  20   4.292   5.073  -5.476
  173    HB2  PRO  20           2HB      PRO  20   5.783   3.275  -4.033
  174    HB3  PRO  20           3HB      PRO  20   6.398   4.863  -4.582
  175    HG2  PRO  20           2HG      PRO  20   5.262   4.149  -1.860
  176    HG3  PRO  20           3HG      PRO  20   6.773   5.038  -2.232
  177    HD2  PRO  20           2HD      PRO  20   4.473   6.334  -1.602
  178    HD3  PRO  20           3HD      PRO  20   5.585   6.989  -2.844
  179    H    LEU  21           H        LEU  21   2.966   3.976  -2.274
  180    HA   LEU  21           HA       LEU  21   2.126   1.419  -3.275
  181    HB2  LEU  21           2HB      LEU  21   2.307   2.564  -0.783
  182    HB3  LEU  21           3HB      LEU  21   0.582   2.688  -1.041
  183    HG   LEU  21           HG       LEU  21   1.014   0.698   0.182
  184   HD11  LEU  21          1HD1      LEU  21   0.127  -1.095  -1.150
  185   HD12  LEU  21          2HD1      LEU  21  -0.682   0.405  -1.632
  186   HD13  LEU  21          3HD1      LEU  21   0.585  -0.297  -2.663
  187   HD21  LEU  21          3HD2      LEU  21   2.523  -1.079  -0.515
  188   HD22  LEU  21          1HD2      LEU  21   2.973  -0.183  -1.978
  189   HD23  LEU  21          2HD2      LEU  21   3.404   0.449  -0.374
  190    H    LYS  22           H        LYS  22   0.531   4.556  -3.118
  191    HA   LYS  22           HA       LYS  22  -2.071   3.773  -4.126
  192    HB2  LYS  22           2HB      LYS  22  -1.787   5.807  -2.901
  193    HB3  LYS  22           3HB      LYS  22  -0.560   6.413  -4.020
  194    HG2  LYS  22           2HG      LYS  22  -2.159   6.697  -5.789
  195    HG3  LYS  22           3HG      LYS  22  -3.430   5.879  -4.876
  196    HD2  LYS  22           2HD      LYS  22  -2.063   8.445  -3.957
  197    HD3  LYS  22           3HD      LYS  22  -3.539   8.415  -4.941
  198    HE2  LYS  22           2HE      LYS  22  -4.662   7.049  -3.158
  199    HE3  LYS  22           3HE      LYS  22  -3.229   7.232  -2.143
  200    HZ1  LYS  22           HZ1      LYS  22  -4.936   9.450  -3.136
  201    HZ2  LYS  22           HZ2      LYS  22  -4.893   8.899  -1.602
  202    HZ3  LYS  22           HZ3      LYS  22  -3.592   9.661  -2.230
  203    H    LEU  23           H        LEU  23   0.799   5.091  -5.779
  204    HA   LEU  23           HA       LEU  23  -0.175   4.885  -8.438
  205    HB2  LEU  23           2HB      LEU  23   1.770   6.149  -7.724
  206    HB3  LEU  23           3HB      LEU  23   2.666   4.690  -7.344
  207    HG   LEU  23           HG       LEU  23   1.643   5.122 -10.168
  208   HD11  LEU  23          1HD1      LEU  23   3.746   6.300 -10.708
  209   HD12  LEU  23          2HD1      LEU  23   2.772   7.220  -9.553
  210   HD13  LEU  23          3HD1      LEU  23   4.190   6.310  -8.985
  211   HD21  LEU  23          3HD2      LEU  23   4.162   3.800  -9.034
  212   HD22  LEU  23          1HD2      LEU  23   2.751   2.941  -9.679
  213   HD23  LEU  23          2HD2      LEU  23   3.741   3.917 -10.756
  214    H    VAL  24           H        VAL  24   1.477   2.403  -6.475
  215    HA   VAL  24           HA       VAL  24   1.651   0.395  -8.531
  216    HB   VAL  24           HB       VAL  24   1.867   0.358  -5.504
  217   HG11  VAL  24          1HG1      VAL  24   2.501  -1.955  -7.378
  218   HG12  VAL  24          2HG1      VAL  24   2.994  -1.830  -5.672
  219   HG13  VAL  24          3HG1      VAL  24   1.285  -1.942  -6.078
  220   HG21  VAL  24          3HG2      VAL  24   4.217   0.297  -5.868
  221   HG22  VAL  24          1HG2      VAL  24   4.022  -0.023  -7.617
  222   HG23  VAL  24          2HG2      VAL  24   3.603   1.553  -6.941
  223    H    CYS  25           H        CYS  25  -0.829   1.073  -6.106
  224    HA   CYS  25           HA       CYS  25  -2.152  -1.558  -6.597
  225    HB2  CYS  25           2HB      CYS  25  -1.309  -0.893  -4.350
  226    HB3  CYS  25           3HB      CYS  25  -2.378   0.503  -4.375
  227    H    LYS  26           H        LYS  26  -2.546   1.776  -7.109
  228    HA   LYS  26           HA       LYS  26  -4.037   3.286  -7.391
  229    HB2  LYS  26           2HB      LYS  26  -4.699   1.924  -9.406
  230    HB3  LYS  26           3HB      LYS  26  -6.111   1.381  -8.451
  231    HG2  LYS  26           2HG      LYS  26  -6.718   3.743  -8.023
  232    HG3  LYS  26           3HG      LYS  26  -5.238   4.278  -8.817
  233    HD2  LYS  26           2HD      LYS  26  -7.101   4.706 -10.204
  234    HD3  LYS  26           3HD      LYS  26  -6.066   3.518 -10.989
  235    HE2  LYS  26           2HE      LYS  26  -8.524   2.701  -9.374
  236    HE3  LYS  26           3HE      LYS  26  -8.680   3.256 -11.040
  237    HZ1  LYS  26           HZ1      LYS  26  -7.070   0.905 -10.211
  238    HZ2  LYS  26           HZ2      LYS  26  -8.508   0.862 -10.975
  239    HZ3  LYS  26           HZ3      LYS  26  -7.205   1.464 -11.744
  240    H    CYS  27           H        CYS  27  -4.773   4.364  -5.872
  241    HA   CYS  27           HA       CYS  27  -6.802   3.302  -3.962
  242    HB2  CYS  27           2HB      CYS  27  -4.164   4.596  -3.178
  243    HB3  CYS  27           3HB      CYS  27  -5.486   4.256  -2.087
  Start of MODEL    5
    1    H1   GLY   1           1H       GLY   1   9.385  -5.424   5.968
    2    H2   GLY   1           2H       GLY   1   9.210  -7.038   5.742
    3    H3   GLY   1           3H       GLY   1   9.738  -6.093   4.513
    4    HA2  GLY   1           HA2      GLY   1   7.054  -5.969   5.730
    5    HA3  GLY   1           HA3      GLY   1   7.627  -4.936   4.408
    6    H    LEU   2           H        LEU   2   5.351  -6.343   4.007
    7    HA   LEU   2           HA       LEU   2   5.770  -8.924   2.770
    8    HB2  LEU   2           2HB      LEU   2   3.459  -6.948   2.845
    9    HB3  LEU   2           3HB      LEU   2   3.395  -8.380   1.851
   10    HG   LEU   2           HG       LEU   2   2.179  -8.733   3.869
   11   HD11  LEU   2          1HD1      LEU   2   4.714 -10.409   4.030
   12   HD12  LEU   2          2HD1      LEU   2   3.087 -10.842   4.581
   13   HD13  LEU   2          3HD1      LEU   2   3.408 -10.659   2.849
   14   HD21  LEU   2          3HD2      LEU   2   3.417  -7.214   5.390
   15   HD22  LEU   2          1HD2      LEU   2   3.108  -8.815   6.079
   16   HD23  LEU   2          2HD2      LEU   2   4.729  -8.419   5.485
   17    HA   PRO   3           HA       PRO   3   6.800  -7.683  -1.440
   18    HB2  PRO   3           2HB      PRO   3   4.869  -9.796  -2.353
   19    HB3  PRO   3           3HB      PRO   3   6.581  -9.559  -2.811
   20    HG2  PRO   3           2HG      PRO   3   5.866 -11.544  -1.099
   21    HG3  PRO   3           3HG      PRO   3   7.345 -10.574  -0.798
   22    HD2  PRO   3           2HD      PRO   3   4.597 -10.231   0.442
   23    HD3  PRO   3           3HD      PRO   3   6.202 -10.273   1.233
   24    H    ARG   4           H        ARG   4   5.853  -6.441  -3.149
   25    HA   ARG   4           HA       ARG   4   3.799  -4.748  -2.364
   26    HB2  ARG   4           2HB      ARG   4   3.932  -3.653  -4.371
   27    HB3  ARG   4           3HB      ARG   4   5.544  -4.197  -3.925
   28    HG2  ARG   4           2HG      ARG   4   5.333  -6.077  -5.604
   29    HG3  ARG   4           3HG      ARG   4   3.729  -5.443  -6.041
   30    HD2  ARG   4           2HD      ARG   4   5.138  -4.449  -7.635
   31    HD3  ARG   4           3HD      ARG   4   4.840  -3.204  -6.416
   32    HE   ARG   4           HE       ARG   4   7.079  -3.219  -5.806
   33   HH11  ARG   4          1HH2      ARG   4   6.597  -5.978  -7.920
   34   HH12  ARG   4          2HH2      ARG   4   8.307  -6.280  -8.056
   35   HH21  ARG   4          1HH1      ARG   4   9.236  -3.669  -6.022
   36   HH22  ARG   4          2HH1      ARG   4   9.755  -5.005  -7.009
   37    H    LYS   5           H        LYS   5   3.331  -7.633  -4.376
   38    HA   LYS   5           HA       LYS   5   0.637  -7.233  -5.106
   39    HB2  LYS   5           2HB      LYS   5   2.327  -8.851  -6.038
   40    HB3  LYS   5           3HB      LYS   5   2.211  -9.800  -4.560
   41    HG2  LYS   5           2HG      LYS   5   0.927 -10.807  -6.336
   42    HG3  LYS   5           3HG      LYS   5  -0.171 -10.286  -5.055
   43    HD2  LYS   5           2HD      LYS   5  -0.893  -8.356  -6.358
   44    HD3  LYS   5           3HD      LYS   5   0.395  -8.630  -7.566
   45    HE2  LYS   5           2HE      LYS   5  -0.555 -10.818  -8.097
   46    HE3  LYS   5           3HE      LYS   5  -1.828 -10.583  -6.886
   47    HZ1  LYS   5           HZ1      LYS   5  -2.637  -8.690  -8.207
   48    HZ2  LYS   5           HZ2      LYS   5  -1.462  -8.907  -9.323
   49    HZ3  LYS   5           HZ3      LYS   5  -2.624 -10.034  -9.129
   50    H    ILE   6           H        ILE   6   1.996  -8.617  -2.121
   51    HA   ILE   6           HA       ILE   6  -0.669  -9.293  -1.021
   52    HB   ILE   6           HB       ILE   6   2.152  -9.511   0.106
   53   HG12  ILE   6          2HG1      ILE   6   1.683 -11.938   0.151
   54   HG13  ILE   6          3HG1      ILE   6   0.138 -11.680  -0.654
   55   HG21  ILE   6          1HG2      ILE   6   0.634  -9.044   1.980
   56   HG22  ILE   6          2HG2      ILE   6  -0.511 -10.270   1.394
   57   HG23  ILE   6          3HG2      ILE   6   1.082 -10.744   2.010
   58   HD11  ILE   6          3HD1      ILE   6   2.837 -10.984  -1.888
   59   HD12  ILE   6          1HD1      ILE   6   2.032 -12.552  -2.082
   60   HD13  ILE   6          2HD1      ILE   6   1.257 -11.102  -2.717
   61    H    LEU   7           H        LEU   7   1.974  -6.950  -0.435
   62    HA   LEU   7           HA       LEU   7   0.838  -5.558   1.725
   63    HB2  LEU   7           2HB      LEU   7   3.194  -5.468   0.901
   64    HB3  LEU   7           3HB      LEU   7   2.652  -4.552  -0.501
   65    HG   LEU   7           HG       LEU   7   1.991  -2.667   0.945
   66   HD11  LEU   7          1HD1      LEU   7   2.705  -2.647   3.335
   67   HD12  LEU   7          2HD1      LEU   7   1.415  -3.809   3.039
   68   HD13  LEU   7          3HD1      LEU   7   3.091  -4.379   3.222
   69   HD21  LEU   7          3HD2      LEU   7   4.296  -2.826   0.036
   70   HD22  LEU   7          1HD2      LEU   7   4.252  -1.983   1.594
   71   HD23  LEU   7          2HD2      LEU   7   4.813  -3.669   1.508
   72    H    CYS   8           H        CYS   8   0.124  -5.232  -1.723
   73    HA   CYS   8           HA       CYS   8  -1.366  -2.827  -1.752
   74    HB2  CYS   8           2HB      CYS   8  -0.637  -3.970  -3.728
   75    HB3  CYS   8           3HB      CYS   8  -1.515  -5.435  -3.307
   76    H    ALA   9           H        ALA   9  -2.418  -6.113  -0.709
   77    HA   ALA   9           HA       ALA   9  -5.210  -5.334  -0.387
   78    HB1  ALA   9           3HB      ALA   9  -3.619  -7.681   0.742
   79    HB2  ALA   9           1HB      ALA   9  -5.390  -7.525   0.715
   80    HB3  ALA   9           2HB      ALA   9  -4.484  -7.663  -0.808
   81    H    ILE  10           H        ILE  10  -2.401  -5.685   1.782
   82    HA   ILE  10           HA       ILE  10  -3.660  -4.971   4.236
   83    HB   ILE  10           HB       ILE  10  -0.778  -4.485   3.403
   84   HG12  ILE  10          2HG1      ILE  10  -1.249  -6.814   2.953
   85   HG13  ILE  10          3HG1      ILE  10  -0.203  -6.663   4.336
   86   HG21  ILE  10          1HG2      ILE  10  -2.019  -4.816   6.162
   87   HG22  ILE  10          2HG2      ILE  10  -0.277  -4.750   5.823
   88   HG23  ILE  10          3HG2      ILE  10  -1.291  -3.345   5.488
   89   HD11  ILE  10          3HD1      ILE  10  -3.198  -7.260   4.440
   90   HD12  ILE  10          1HD1      ILE  10  -1.882  -8.421   4.667
   91   HD13  ILE  10          2HD1      ILE  10  -2.123  -7.132   5.857
   92    H    ALA  11           H        ALA  11  -2.035  -2.918   1.794
   93    HA   ALA  11           HA       ALA  11  -2.027  -0.498   3.163
   94    HB1  ALA  11           3HB      ALA  11  -1.680   0.477   0.957
   95    HB2  ALA  11           1HB      ALA  11  -0.848  -1.072   1.023
   96    HB3  ALA  11           2HB      ALA  11  -2.407  -0.944   0.163
   97    H    LYS  12           H        LYS  12  -4.684  -1.847   1.203
   98    HA   LYS  12           HA       LYS  12  -6.461   0.477   1.517
   99    HB2  LYS  12           2HB      LYS  12  -6.882  -2.398   0.577
  100    HB3  LYS  12           3HB      LYS  12  -8.164  -1.170   0.587
  101    HG2  LYS  12           2HG      LYS  12  -6.981   0.235  -0.951
  102    HG3  LYS  12           3HG      LYS  12  -5.505  -0.739  -0.827
  103    HD2  LYS  12           2HD      LYS  12  -6.631  -2.666  -1.846
  104    HD3  LYS  12           3HD      LYS  12  -8.140  -1.696  -2.037
  105    HE2  LYS  12           2HE      LYS  12  -6.818   0.017  -3.259
  106    HE3  LYS  12           3HE      LYS  12  -5.376  -0.968  -3.004
  107    HZ1  LYS  12           HZ1      LYS  12  -7.715  -1.707  -4.699
  108    HZ2  LYS  12           HZ2      LYS  12  -6.218  -1.321  -5.242
  109    HZ3  LYS  12           HZ3      LYS  12  -6.449  -2.707  -4.406
  110    H    LYS  13           H        LYS  13  -6.291  -2.749   2.869
  111    HA   LYS  13           HA       LYS  13  -8.489  -2.615   4.696
  112    HB2  LYS  13           2HB      LYS  13  -5.909  -4.226   4.768
  113    HB3  LYS  13           3HB      LYS  13  -7.193  -4.430   5.964
  114    HG2  LYS  13           2HG      LYS  13  -8.807  -5.054   4.273
  115    HG3  LYS  13           3HG      LYS  13  -7.665  -4.719   2.967
  116    HD2  LYS  13           2HD      LYS  13  -6.144  -6.490   3.862
  117    HD3  LYS  13           3HD      LYS  13  -7.340  -6.885   5.101
  118    HE2  LYS  13           2HE      LYS  13  -7.817  -7.020   2.083
  119    HE3  LYS  13           3HE      LYS  13  -7.341  -8.396   3.082
  120    HZ1  LYS  13           HZ1      LYS  13  -9.732  -8.364   2.770
  121    HZ2  LYS  13           HZ2      LYS  13  -9.408  -8.117   4.348
  122    HZ3  LYS  13           HZ3      LYS  13  -9.869  -6.867   3.399
  123    H    LYS  14           H        LYS  14  -5.151  -1.533   5.223
  124    HA   LYS  14           HA       LYS  14  -5.802  -0.529   7.937
  125    HB2  LYS  14           2HB      LYS  14  -3.261  -0.877   6.329
  126    HB3  LYS  14           3HB      LYS  14  -3.282   0.234   7.678
  127    HG2  LYS  14           2HG      LYS  14  -2.423  -1.939   8.334
  128    HG3  LYS  14           3HG      LYS  14  -3.843  -1.461   9.261
  129    HD2  LYS  14           2HD      LYS  14  -5.251  -3.032   8.034
  130    HD3  LYS  14           3HD      LYS  14  -3.903  -3.448   6.949
  131    HE2  LYS  14           2HE      LYS  14  -2.616  -4.324   8.861
  132    HE3  LYS  14           3HE      LYS  14  -3.881  -3.810   9.982
  133    HZ1  LYS  14           HZ1      LYS  14  -5.393  -5.393   8.926
  134    HZ2  LYS  14           HZ2      LYS  14  -4.233  -5.876   7.872
  135    HZ3  LYS  14           HZ3      LYS  14  -4.068  -6.169   9.468
  136    H    GLY  15           H        GLY  15  -6.083   0.799   4.824
  137    HA2  GLY  15           HA2      GLY  15  -6.555   2.940   4.114
  138    HA3  GLY  15           HA3      GLY  15  -6.637   3.468   5.799
  139    H    LYS  16           H        LYS  16  -3.791   1.926   4.465
  140    HA   LYS  16           HA       LYS  16  -2.130   4.288   5.131
  141    HB2  LYS  16           2HB      LYS  16  -1.784   2.070   6.221
  142    HB3  LYS  16           3HB      LYS  16  -1.491   1.351   4.651
  143    HG2  LYS  16           2HG      LYS  16   0.557   1.538   5.756
  144    HG3  LYS  16           3HG      LYS  16   0.620   2.679   4.442
  145    HD2  LYS  16           2HD      LYS  16   0.006   3.392   7.354
  146    HD3  LYS  16           3HD      LYS  16   1.623   3.380   6.677
  147    HE2  LYS  16           2HE      LYS  16  -0.631   5.263   5.881
  148    HE3  LYS  16           3HE      LYS  16   0.785   5.642   6.851
  149    HZ1  LYS  16           HZ1      LYS  16   2.160   5.059   4.871
  150    HZ2  LYS  16           HZ2      LYS  16   0.783   4.904   3.980
  151    HZ3  LYS  16           HZ3      LYS  16   1.195   6.350   4.620
  152    H    CYS  17           H        CYS  17  -3.427   2.927   2.323
  153    HA   CYS  17           HA       CYS  17  -1.173   2.928   0.601
  154    HB2  CYS  17           2HB      CYS  17  -3.422   1.719   0.402
  155    HB3  CYS  17           3HB      CYS  17  -4.062   3.235  -0.224
  156    H    LYS  18           H        LYS  18  -0.020   4.641   0.120
  157    HA   LYS  18           HA       LYS  18  -1.204   7.038  -1.173
  158    HB2  LYS  18           2HB      LYS  18   0.674   7.158   1.244
  159    HB3  LYS  18           3HB      LYS  18   0.281   8.533   0.209
  160    HG2  LYS  18           2HG      LYS  18  -2.148   8.238   0.805
  161    HG3  LYS  18           3HG      LYS  18  -1.656   7.007   1.990
  162    HD2  LYS  18           2HD      LYS  18  -0.244   8.682   3.150
  163    HD3  LYS  18           3HD      LYS  18  -0.736   9.914   1.965
  164    HE2  LYS  18           2HE      LYS  18  -3.116   9.585   2.627
  165    HE3  LYS  18           3HE      LYS  18  -2.615   8.389   3.828
  166    HZ1  LYS  18           HZ1      LYS  18  -1.346  10.152   4.949
  167    HZ2  LYS  18           HZ2      LYS  18  -1.815  11.254   3.836
  168    HZ3  LYS  18           HZ3      LYS  18  -2.915  10.581   4.831
  169    H    GLY  19           H        GLY  19   0.454   8.420  -2.159
  170    HA2  GLY  19           HA2      GLY  19   2.149   8.718  -3.691
  171    HA3  GLY  19           HA3      GLY  19   3.135   8.006  -2.432
  172    HA   PRO  20           HA       PRO  20   3.986   5.151  -5.843
  173    HB2  PRO  20           2HB      PRO  20   5.647   3.371  -4.574
  174    HB3  PRO  20           3HB      PRO  20   6.153   5.009  -5.086
  175    HG2  PRO  20           2HG      PRO  20   5.222   4.125  -2.337
  176    HG3  PRO  20           3HG      PRO  20   6.665   5.101  -2.758
  177    HD2  PRO  20           2HD      PRO  20   4.351   6.255  -1.932
  178    HD3  PRO  20           3HD      PRO  20   5.355   7.018  -3.205
  179    H    LEU  21           H        LEU  21   2.895   3.903  -2.618
  180    HA   LEU  21           HA       LEU  21   2.098   1.341  -3.648
  181    HB2  LEU  21           2HB      LEU  21   2.394   2.426  -1.134
  182    HB3  LEU  21           3HB      LEU  21   0.652   2.458  -1.275
  183    HG   LEU  21           HG       LEU  21   1.302   0.463  -0.143
  184   HD11  LEU  21          1HD1      LEU  21   0.663  -0.454  -2.972
  185   HD12  LEU  21          2HD1      LEU  21   0.401  -1.340  -1.460
  186   HD13  LEU  21          3HD1      LEU  21  -0.536   0.124  -1.792
  187   HD21  LEU  21          3HD2      LEU  21   3.105  -0.245  -2.495
  188   HD22  LEU  21          1HD2      LEU  21   3.639   0.337  -0.902
  189   HD23  LEU  21          2HD2      LEU  21   2.813  -1.222  -1.047
  190    H    LYS  22           H        LYS  22   0.409   4.398  -3.297
  191    HA   LYS  22           HA       LYS  22  -2.257   3.583  -4.106
  192    HB2  LYS  22           2HB      LYS  22  -1.800   5.664  -2.926
  193    HB3  LYS  22           3HB      LYS  22  -0.819   6.262  -4.270
  194    HG2  LYS  22           2HG      LYS  22  -2.838   6.285  -5.724
  195    HG3  LYS  22           3HG      LYS  22  -3.809   5.697  -4.360
  196    HD2  LYS  22           2HD      LYS  22  -3.216   7.742  -3.064
  197    HD3  LYS  22           3HD      LYS  22  -2.183   8.276  -4.394
  198    HE2  LYS  22           2HE      LYS  22  -4.142   9.532  -4.648
  199    HE3  LYS  22           3HE      LYS  22  -4.233   8.283  -5.892
  200    HZ1  LYS  22           HZ1      LYS  22  -5.774   7.045  -4.439
  201    HZ2  LYS  22           HZ2      LYS  22  -5.643   8.189  -3.271
  202    HZ3  LYS  22           HZ3      LYS  22  -6.341   8.549  -4.700
  203    H    LEU  23           H        LEU  23   0.534   4.779  -5.964
  204    HA   LEU  23           HA       LEU  23  -0.731   4.577  -8.540
  205    HB2  LEU  23           2HB      LEU  23   1.238   5.977  -8.038
  206    HB3  LEU  23           3HB      LEU  23   2.204   4.536  -7.739
  207    HG   LEU  23           HG       LEU  23   1.963   3.860 -10.115
  208   HD11  LEU  23          1HD1      LEU  23  -0.178   4.918 -10.708
  209   HD12  LEU  23          2HD1      LEU  23   0.516   6.532 -10.421
  210   HD13  LEU  23          3HD1      LEU  23   1.103   5.520 -11.761
  211   HD21  LEU  23          3HD2      LEU  23   3.875   5.227  -9.379
  212   HD22  LEU  23          1HD2      LEU  23   3.412   5.609 -11.044
  213   HD23  LEU  23          2HD2      LEU  23   2.959   6.711  -9.723
  214    H    VAL  24           H        VAL  24   1.255   2.234  -6.709
  215    HA   VAL  24           HA       VAL  24   1.387   0.186  -8.730
  216    HB   VAL  24           HB       VAL  24   1.706   0.181  -5.707
  217   HG11  VAL  24          1HG1      VAL  24   1.136  -2.128  -6.250
  218   HG12  VAL  24          2HG1      VAL  24   2.307  -2.132  -7.592
  219   HG13  VAL  24          3HG1      VAL  24   2.856  -1.998  -5.905
  220   HG21  VAL  24          3HG2      VAL  24   3.401   1.394  -7.165
  221   HG22  VAL  24          1HG2      VAL  24   4.054   0.115  -6.141
  222   HG23  VAL  24          2HG2      VAL  24   3.803  -0.171  -7.885
  223    H    CYS  25           H        CYS  25  -0.936   0.811  -6.153
  224    HA   CYS  25           HA       CYS  25  -2.250  -1.830  -6.564
  225    HB2  CYS  25           2HB      CYS  25  -1.079  -1.257  -4.461
  226    HB3  CYS  25           3HB      CYS  25  -2.149   0.123  -4.246
  227    H    LYS  26           H        LYS  26  -2.840   1.466  -7.082
  228    HA   LYS  26           HA       LYS  26  -4.559   2.794  -7.530
  229    HB2  LYS  26           2HB      LYS  26  -4.822   0.661  -9.183
  230    HB3  LYS  26           3HB      LYS  26  -6.422   0.649  -8.456
  231    HG2  LYS  26           2HG      LYS  26  -5.020   3.011  -9.772
  232    HG3  LYS  26           3HG      LYS  26  -6.270   2.007 -10.526
  233    HD2  LYS  26           2HD      LYS  26  -7.866   2.723  -8.698
  234    HD3  LYS  26           3HD      LYS  26  -6.654   3.877  -8.131
  235    HE2  LYS  26           2HE      LYS  26  -7.907   3.827 -10.910
  236    HE3  LYS  26           3HE      LYS  26  -8.394   4.886  -9.585
  237    HZ1  LYS  26           HZ1      LYS  26  -6.164   5.873  -9.632
  238    HZ2  LYS  26           HZ2      LYS  26  -5.723   4.915 -10.885
  239    HZ3  LYS  26           HZ3      LYS  26  -6.890   6.031 -11.082
  240    H    CYS  27           H        CYS  27  -4.787   3.466  -5.513
  241    HA   CYS  27           HA       CYS  27  -6.941   2.338  -3.779
  242    HB2  CYS  27           2HB      CYS  27  -4.461   3.946  -3.059
  243    HB3  CYS  27           3HB      CYS  27  -5.660   3.365  -1.937
  Start of MODEL    6
    1    H1   GLY   1           1H       GLY   1  10.461  -5.333   3.429
    2    H2   GLY   1           2H       GLY   1  10.358  -4.569   4.876
    3    H3   GLY   1           3H       GLY   1  10.080  -6.181   4.775
    4    HA2  GLY   1           HA2      GLY   1   7.996  -5.004   5.013
    5    HA3  GLY   1           HA3      GLY   1   8.412  -4.070   3.563
    6    H    LEU   2           H        LEU   2   6.037  -5.482   3.703
    7    HA   LEU   2           HA       LEU   2   6.219  -8.091   2.461
    8    HB2  LEU   2           2HB      LEU   2   3.965  -6.157   3.060
    9    HB3  LEU   2           3HB      LEU   2   3.698  -7.572   2.057
   10    HG   LEU   2           HG       LEU   2   4.377  -9.078   3.861
   11   HD11  LEU   2          1HD1      LEU   2   5.919  -7.744   5.198
   12   HD12  LEU   2          2HD1      LEU   2   4.634  -6.564   5.570
   13   HD13  LEU   2          3HD1      LEU   2   4.553  -8.224   6.200
   14   HD21  LEU   2          3HD2      LEU   2   2.410  -8.710   5.293
   15   HD22  LEU   2          1HD2      LEU   2   2.277  -7.035   4.707
   16   HD23  LEU   2          2HD2      LEU   2   2.020  -8.399   3.598
   17    HA   PRO   3           HA       PRO   3   6.537  -6.822  -1.809
   18    HB2  PRO   3           2HB      PRO   3   4.645  -9.020  -2.546
   19    HB3  PRO   3           3HB      PRO   3   6.305  -8.718  -3.130
   20    HG2  PRO   3           2HG      PRO   3   5.776 -10.725  -1.358
   21    HG3  PRO   3           3HG      PRO   3   7.261  -9.728  -1.212
   22    HD2  PRO   3           2HD      PRO   3   4.654  -9.435   0.316
   23    HD3  PRO   3           3HD      PRO   3   6.338  -9.435   0.916
   24    H    ARG   4           H        ARG   4   5.394  -5.630  -3.377
   25    HA   ARG   4           HA       ARG   4   3.144  -4.128  -2.602
   26    HB2  ARG   4           2HB      ARG   4   4.315  -4.722  -5.350
   27    HB3  ARG   4           3HB      ARG   4   3.006  -3.560  -5.101
   28    HG2  ARG   4           2HG      ARG   4   4.333  -2.167  -3.689
   29    HG3  ARG   4           3HG      ARG   4   5.650  -3.343  -3.607
   30    HD2  ARG   4           2HD      ARG   4   4.759  -1.833  -6.095
   31    HD3  ARG   4           3HD      ARG   4   6.144  -1.420  -5.104
   32    HE   ARG   4           HE       ARG   4   5.939  -3.581  -7.074
   33   HH11  ARG   4          1HH2      ARG   4   7.867  -2.434  -4.374
   34   HH12  ARG   4          2HH2      ARG   4   9.257  -3.364  -4.865
   35   HH21  ARG   4          1HH1      ARG   4   7.746  -4.733  -7.630
   36   HH22  ARG   4          2HH1      ARG   4   9.182  -4.626  -6.656
   37    H    LYS   5           H        LYS   5   3.131  -7.111  -4.499
   38    HA   LYS   5           HA       LYS   5   0.407  -7.218  -5.300
   39    HB2  LYS   5           2HB      LYS   5   2.236  -9.495  -4.428
   40    HB3  LYS   5           3HB      LYS   5   0.738  -9.679  -5.348
   41    HG2  LYS   5           2HG      LYS   5   1.768  -8.402  -7.228
   42    HG3  LYS   5           3HG      LYS   5   3.274  -8.271  -6.288
   43    HD2  LYS   5           2HD      LYS   5   3.237 -10.824  -6.088
   44    HD3  LYS   5           3HD      LYS   5   1.948 -10.834  -7.294
   45    HE2  LYS   5           2HE      LYS   5   4.733  -9.637  -7.649
   46    HE3  LYS   5           3HE      LYS   5   4.260 -11.256  -8.171
   47    HZ1  LYS   5           HZ1      LYS   5   4.117  -9.692 -10.014
   48    HZ2  LYS   5           HZ2      LYS   5   2.621 -10.237  -9.666
   49    HZ3  LYS   5           HZ3      LYS   5   3.074  -8.732  -9.209
   50    H    ILE   6           H        ILE   6   1.872  -8.244  -2.226
   51    HA   ILE   6           HA       ILE   6  -0.692  -9.224  -1.129
   52    HB   ILE   6           HB       ILE   6   2.142  -9.110  -0.017
   53   HG12  ILE   6          2HG1      ILE   6   1.990 -11.572   0.020
   54   HG13  ILE   6          3HG1      ILE   6   0.399 -11.518  -0.732
   55   HG21  ILE   6          1HG2      ILE   6  -0.381 -10.225   1.292
   56   HG22  ILE   6          2HG2      ILE   6   1.275 -10.436   1.900
   57   HG23  ILE   6          3HG2      ILE   6   0.560  -8.830   1.855
   58   HD11  ILE   6          3HD1      ILE   6   1.343 -10.841  -2.836
   59   HD12  ILE   6          1HD1      ILE   6   2.929 -10.490  -2.087
   60   HD13  ILE   6          2HD1      ILE   6   2.342 -12.156  -2.226
   61    H    LEU   7           H        LEU   7   1.664  -6.593  -0.505
   62    HA   LEU   7           HA       LEU   7   0.300  -5.457   1.691
   63    HB2  LEU   7           2HB      LEU   7   2.699  -5.156   1.023
   64    HB3  LEU   7           3HB      LEU   7   2.172  -4.133  -0.312
   65    HG   LEU   7           HG       LEU   7   1.257  -2.487   1.310
   66   HD11  LEU   7          1HD1      LEU   7   2.406  -4.348   3.433
   67   HD12  LEU   7          2HD1      LEU   7   1.867  -2.679   3.715
   68   HD13  LEU   7          3HD1      LEU   7   0.697  -3.899   3.224
   69   HD21  LEU   7          3HD2      LEU   7   3.589  -2.316   0.502
   70   HD22  LEU   7          1HD2      LEU   7   3.421  -1.693   2.152
   71   HD23  LEU   7          2HD2      LEU   7   4.138  -3.299   1.876
   72    H    CYS   8           H        CYS   8  -0.268  -5.004  -1.762
   73    HA   CYS   8           HA       CYS   8  -1.886  -2.696  -1.782
   74    HB2  CYS   8           2HB      CYS   8  -1.111  -3.749  -3.783
   75    HB3  CYS   8           3HB      CYS   8  -1.873  -5.279  -3.379
   76    H    ALA   9           H        ALA   9  -2.785  -6.042  -0.792
   77    HA   ALA   9           HA       ALA   9  -5.627  -5.549  -0.619
   78    HB1  ALA   9           3HB      ALA   9  -5.602  -7.629   0.708
   79    HB2  ALA   9           1HB      ALA   9  -4.577  -7.811  -0.733
   80    HB3  ALA   9           2HB      ALA   9  -3.836  -7.547   0.863
   81    H    ILE  10           H        ILE  10  -2.985  -5.544   1.712
   82    HA   ILE  10           HA       ILE  10  -4.529  -4.984   4.042
   83    HB   ILE  10           HB       ILE  10  -1.539  -4.739   3.476
   84   HG12  ILE  10          2HG1      ILE  10  -3.079  -7.093   4.664
   85   HG13  ILE  10          3HG1      ILE  10  -2.597  -7.009   2.985
   86   HG21  ILE  10          1HG2      ILE  10  -2.153  -3.542   5.556
   87   HG22  ILE  10          2HG2      ILE  10  -2.993  -4.994   6.146
   88   HG23  ILE  10          3HG2      ILE  10  -1.230  -4.996   5.921
   89   HD11  ILE  10          3HD1      ILE  10  -1.032  -8.370   4.072
   90   HD12  ILE  10          1HD1      ILE  10  -0.226  -6.865   3.605
   91   HD13  ILE  10          2HD1      ILE  10  -0.681  -7.144   5.311
   92    H    ALA  11           H        ALA  11  -2.573  -2.891   1.919
   93    HA   ALA  11           HA       ALA  11  -2.689  -0.452   3.281
   94    HB1  ALA  11           3HB      ALA  11  -1.393  -0.985   1.231
   95    HB2  ALA  11           1HB      ALA  11  -2.897  -0.991   0.269
   96    HB3  ALA  11           2HB      ALA  11  -2.322   0.495   1.051
   97    H    LYS  12           H        LYS  12  -5.057  -1.735   0.918
   98    HA   LYS  12           HA       LYS  12  -7.013   0.333   1.322
   99    HB2  LYS  12           2HB      LYS  12  -7.235  -2.438   0.091
  100    HB3  LYS  12           3HB      LYS  12  -8.475  -1.169  -0.020
  101    HG2  LYS  12           2HG      LYS  12  -6.790   0.351  -1.067
  102    HG3  LYS  12           3HG      LYS  12  -5.615  -0.957  -1.073
  103    HD2  LYS  12           2HD      LYS  12  -8.212  -0.849  -2.653
  104    HD3  LYS  12           3HD      LYS  12  -6.565  -0.645  -3.239
  105    HE2  LYS  12           2HE      LYS  12  -6.863  -2.797  -3.872
  106    HE3  LYS  12           3HE      LYS  12  -6.161  -3.060  -2.278
  107    HZ1  LYS  12           HZ1      LYS  12  -9.073  -3.118  -2.924
  108    HZ2  LYS  12           HZ2      LYS  12  -8.149  -4.431  -2.660
  109    HZ3  LYS  12           HZ3      LYS  12  -8.454  -3.396  -1.436
  110    H    LYS  13           H        LYS  13  -6.516  -2.670   3.133
  111    HA   LYS  13           HA       LYS  13  -9.075  -2.456   4.567
  112    HB2  LYS  13           2HB      LYS  13  -6.517  -3.895   5.405
  113    HB3  LYS  13           3HB      LYS  13  -8.076  -4.022   6.195
  114    HG2  LYS  13           2HG      LYS  13  -7.286  -5.078   3.480
  115    HG3  LYS  13           3HG      LYS  13  -7.752  -5.987   4.893
  116    HD2  LYS  13           2HD      LYS  13  -9.550  -4.245   3.162
  117    HD3  LYS  13           3HD      LYS  13  -9.508  -5.998   3.181
  118    HE2  LYS  13           2HE      LYS  13 -10.315  -4.269   5.570
  119    HE3  LYS  13           3HE      LYS  13 -11.448  -4.970   4.415
  120    HZ1  LYS  13           HZ1      LYS  13 -11.238  -6.379   6.362
  121    HZ2  LYS  13           HZ2      LYS  13 -10.670  -7.182   5.064
  122    HZ3  LYS  13           HZ3      LYS  13  -9.630  -6.549   6.157
  123    H    LYS  14           H        LYS  14  -5.752  -1.411   5.284
  124    HA   LYS  14           HA       LYS  14  -6.507  -0.177   7.847
  125    HB2  LYS  14           2HB      LYS  14  -3.958  -0.529   6.252
  126    HB3  LYS  14           3HB      LYS  14  -4.017   0.687   7.515
  127    HG2  LYS  14           2HG      LYS  14  -3.076  -1.377   8.355
  128    HG3  LYS  14           3HG      LYS  14  -4.540  -0.911   9.220
  129    HD2  LYS  14           2HD      LYS  14  -5.836  -2.636   8.047
  130    HD3  LYS  14           3HD      LYS  14  -4.415  -3.066   7.063
  131    HE2  LYS  14           2HE      LYS  14  -3.182  -3.720   9.091
  132    HE3  LYS  14           3HE      LYS  14  -4.521  -3.186  10.112
  133    HZ1  LYS  14           HZ1      LYS  14  -4.566  -5.586   9.783
  134    HZ2  LYS  14           HZ2      LYS  14  -5.901  -4.926   9.126
  135    HZ3  LYS  14           HZ3      LYS  14  -4.675  -5.428   8.164
  136    H    GLY  15           H        GLY  15  -6.212   1.003   4.585
  137    HA2  GLY  15           HA2      GLY  15  -6.989   3.074   3.745
  138    HA3  GLY  15           HA3      GLY  15  -7.030   3.755   5.377
  139    H    LYS  16           H        LYS  16  -4.266   1.903   4.274
  140    HA   LYS  16           HA       LYS  16  -2.503   4.314   4.405
  141    HB2  LYS  16           2HB      LYS  16  -2.261   1.503   5.561
  142    HB3  LYS  16           3HB      LYS  16  -0.921   2.619   5.407
  143    HG2  LYS  16           2HG      LYS  16  -2.347   4.332   6.718
  144    HG3  LYS  16           3HG      LYS  16  -3.451   2.997   7.053
  145    HD2  LYS  16           2HD      LYS  16  -1.984   3.242   8.938
  146    HD3  LYS  16           3HD      LYS  16  -1.514   1.747   8.105
  147    HE2  LYS  16           2HE      LYS  16   0.326   2.965   6.960
  148    HE3  LYS  16           3HE      LYS  16  -0.186   4.474   7.712
  149    HZ1  LYS  16           HZ1      LYS  16   1.664   3.460   8.928
  150    HZ2  LYS  16           HZ2      LYS  16   0.347   3.495   9.888
  151    HZ3  LYS  16           HZ3      LYS  16   0.817   2.091   9.193
  152    H    CYS  17           H        CYS  17  -3.186   4.142   2.053
  153    HA   CYS  17           HA       CYS  17  -1.179   2.536   0.509
  154    HB2  CYS  17           2HB      CYS  17  -3.638   1.982   0.212
  155    HB3  CYS  17           3HB      CYS  17  -3.847   3.553  -0.504
  156    H    LYS  18           H        LYS  18   0.441   3.761  -0.158
  157    HA   LYS  18           HA       LYS  18   0.128   6.543  -1.096
  158    HB2  LYS  18           2HB      LYS  18   1.508   7.514   0.665
  159    HB3  LYS  18           3HB      LYS  18   0.071   6.781   1.363
  160    HG2  LYS  18           2HG      LYS  18   1.412   4.769   2.009
  161    HG3  LYS  18           3HG      LYS  18   2.865   5.538   1.362
  162    HD2  LYS  18           2HD      LYS  18   1.150   6.632   3.636
  163    HD3  LYS  18           3HD      LYS  18   2.650   5.715   3.831
  164    HE2  LYS  18           2HE      LYS  18   3.886   7.474   2.565
  165    HE3  LYS  18           3HE      LYS  18   2.394   8.415   2.431
  166    HZ1  LYS  18           HZ1      LYS  18   2.339   8.552   4.865
  167    HZ2  LYS  18           HZ2      LYS  18   3.722   7.687   4.988
  168    HZ3  LYS  18           HZ3      LYS  18   3.741   9.165   4.301
  169    H    GLY  19           H        GLY  19   2.273   7.582  -1.540
  170    HA2  GLY  19           HA2      GLY  19   4.234   7.586  -2.790
  171    HA3  GLY  19           HA3      GLY  19   4.655   6.092  -1.947
  172    HA   PRO  20           HA       PRO  20   4.209   4.608  -6.287
  173    HB2  PRO  20           2HB      PRO  20   5.421   2.207  -4.909
  174    HB3  PRO  20           3HB      PRO  20   5.787   2.886  -6.526
  175    HG2  PRO  20           2HG      PRO  20   7.454   3.373  -4.452
  176    HG3  PRO  20           3HG      PRO  20   7.004   4.714  -5.558
  177    HD2  PRO  20           2HD      PRO  20   5.833   4.052  -2.839
  178    HD3  PRO  20           3HD      PRO  20   6.362   5.637  -3.485
  179    H    LEU  21           H        LEU  21   3.289   2.900  -3.242
  180    HA   LEU  21           HA       LEU  21   1.788   0.865  -4.487
  181    HB2  LEU  21           2HB      LEU  21   2.686   0.874  -2.147
  182    HB3  LEU  21           3HB      LEU  21   1.400   1.994  -1.695
  183    HG   LEU  21           HG       LEU  21  -0.305   0.263  -2.312
  184   HD11  LEU  21          1HD1      LEU  21   0.921  -1.070  -3.966
  185   HD12  LEU  21          2HD1      LEU  21   2.137  -1.507  -2.741
  186   HD13  LEU  21          3HD1      LEU  21   0.466  -2.090  -2.602
  187   HD21  LEU  21          3HD2      LEU  21   1.842  -0.642  -0.356
  188   HD22  LEU  21          1HD2      LEU  21   0.486   0.450  -0.000
  189   HD23  LEU  21          2HD2      LEU  21   0.171  -1.243  -0.422
  190    H    LYS  22           H        LYS  22   0.783   4.081  -3.524
  191    HA   LYS  22           HA       LYS  22  -2.066   3.939  -3.815
  192    HB2  LYS  22           2HB      LYS  22  -0.964   5.792  -2.797
  193    HB3  LYS  22           3HB      LYS  22  -0.012   6.133  -4.246
  194    HG2  LYS  22           2HG      LYS  22  -1.604   7.831  -4.119
  195    HG3  LYS  22           3HG      LYS  22  -2.170   6.781  -5.415
  196    HD2  LYS  22           2HD      LYS  22  -3.817   5.767  -3.845
  197    HD3  LYS  22           3HD      LYS  22  -3.165   6.751  -2.526
  198    HE2  LYS  22           2HE      LYS  22  -5.115   7.875  -3.197
  199    HE3  LYS  22           3HE      LYS  22  -3.789   8.811  -3.893
  200    HZ1  LYS  22           HZ1      LYS  22  -5.575   8.429  -5.504
  201    HZ2  LYS  22           HZ2      LYS  22  -4.237   7.644  -6.022
  202    HZ3  LYS  22           HZ3      LYS  22  -5.468   6.808  -5.322
  203    H    LEU  23           H        LEU  23   0.463   4.366  -6.241
  204    HA   LEU  23           HA       LEU  23  -1.468   4.459  -8.466
  205    HB2  LEU  23           2HB      LEU  23   0.564   5.840  -8.480
  206    HB3  LEU  23           3HB      LEU  23   1.571   4.396  -8.396
  207    HG   LEU  23           HG       LEU  23   0.765   3.679 -10.630
  208   HD11  LEU  23          1HD1      LEU  23  -0.478   5.306 -12.050
  209   HD12  LEU  23          2HD1      LEU  23  -1.462   4.717 -10.709
  210   HD13  LEU  23          3HD1      LEU  23  -0.734   6.340 -10.627
  211   HD21  LEU  23          3HD2      LEU  23   2.792   5.064 -10.410
  212   HD22  LEU  23          1HD2      LEU  23   1.934   5.407 -11.921
  213   HD23  LEU  23          2HD2      LEU  23   1.809   6.539 -10.555
  214    H    VAL  24           H        VAL  24   0.986   2.128  -7.273
  215    HA   VAL  24           HA       VAL  24   0.682   0.160  -9.309
  216    HB   VAL  24           HB       VAL  24   1.619  -0.019  -6.429
  217   HG11  VAL  24          1HG1      VAL  24   1.944  -2.132  -8.590
  218   HG12  VAL  24          2HG1      VAL  24   2.792  -2.107  -7.027
  219   HG13  VAL  24          3HG1      VAL  24   1.048  -2.305  -7.060
  220   HG21  VAL  24          3HG2      VAL  24   2.956   1.424  -8.010
  221   HG22  VAL  24          1HG2      VAL  24   3.854   0.055  -7.360
  222   HG23  VAL  24          2HG2      VAL  24   3.217  -0.004  -9.023
  223    H    CYS  25           H        CYS  25  -1.039   0.537  -6.240
  224    HA   CYS  25           HA       CYS  25  -2.702  -1.881  -6.670
  225    HB2  CYS  25           2HB      CYS  25  -1.567  -1.291  -4.503
  226    HB3  CYS  25           3HB      CYS  25  -2.577   0.143  -4.415
  227    H    LYS  26           H        LYS  26  -2.754   1.395  -7.439
  228    HA   LYS  26           HA       LYS  26  -4.223   3.005  -7.906
  229    HB2  LYS  26           2HB      LYS  26  -4.496   1.002  -9.669
  230    HB3  LYS  26           3HB      LYS  26  -6.170   1.094  -9.152
  231    HG2  LYS  26           2HG      LYS  26  -4.418   3.420 -10.072
  232    HG3  LYS  26           3HG      LYS  26  -5.517   2.541 -11.136
  233    HD2  LYS  26           2HD      LYS  26  -6.344   4.249  -8.745
  234    HD3  LYS  26           3HD      LYS  26  -6.445   4.714 -10.443
  235    HE2  LYS  26           2HE      LYS  26  -8.034   2.887 -10.900
  236    HE3  LYS  26           3HE      LYS  26  -7.919   2.339  -9.223
  237    HZ1  LYS  26           HZ1      LYS  26  -8.959   4.991 -10.059
  238    HZ2  LYS  26           HZ2      LYS  26  -9.872   3.734  -9.562
  239    HZ3  LYS  26           HZ3      LYS  26  -8.855   4.460  -8.514
  240    H    CYS  27           H        CYS  27  -4.348   2.963  -5.556
  241    HA   CYS  27           HA       CYS  27  -6.858   2.283  -4.219
  242    HB2  CYS  27           2HB      CYS  27  -4.397   3.832  -3.345
  243    HB3  CYS  27           3HB      CYS  27  -5.745   3.457  -2.293
  Start of MODEL    7
    1    H1   GLY   1           1H       GLY   1  11.268  -7.368   2.849
    2    H2   GLY   1           2H       GLY   1  11.474  -6.773   4.363
    3    H3   GLY   1           3H       GLY   1  10.928  -8.303   4.149
    4    HA2  GLY   1           HA2      GLY   1   9.110  -6.868   4.796
    5    HA3  GLY   1           HA3      GLY   1   9.482  -5.845   3.397
    6    H    LEU   2           H        LEU   2   6.958  -6.763   3.615
    7    HA   LEU   2           HA       LEU   2   6.522  -9.257   2.182
    8    HB2  LEU   2           2HB      LEU   2   4.649  -6.988   2.930
    9    HB3  LEU   2           3HB      LEU   2   4.126  -8.506   2.217
   10    HG   LEU   2           HG       LEU   2   5.532  -8.267   4.916
   11   HD11  LEU   2          1HD1      LEU   2   3.345  -8.691   5.904
   12   HD12  LEU   2          2HD1      LEU   2   3.292  -7.219   4.922
   13   HD13  LEU   2          3HD1      LEU   2   2.589  -8.728   4.299
   14   HD21  LEU   2          3HD2      LEU   2   4.713 -10.592   5.247
   15   HD22  LEU   2          1HD2      LEU   2   4.125 -10.619   3.571
   16   HD23  LEU   2          2HD2      LEU   2   5.866 -10.488   3.915
   17    HA   PRO   3           HA       PRO   3   6.632  -7.696  -1.995
   18    HB2  PRO   3           2HB      PRO   3   4.233  -9.407  -2.575
   19    HB3  PRO   3           3HB      PRO   3   5.805  -9.344  -3.424
   20    HG2  PRO   3           2HG      PRO   3   5.220 -11.397  -1.742
   21    HG3  PRO   3           3HG      PRO   3   6.857 -10.662  -1.745
   22    HD2  PRO   3           2HD      PRO   3   4.572 -10.135   0.178
   23    HD3  PRO   3           3HD      PRO   3   6.304 -10.434   0.512
   24    H    ARG   4           H        ARG   4   5.595  -6.191  -3.391
   25    HA   ARG   4           HA       ARG   4   3.773  -4.384  -2.212
   26    HB2  ARG   4           2HB      ARG   4   3.820  -3.128  -4.121
   27    HB3  ARG   4           3HB      ARG   4   5.432  -3.811  -3.891
   28    HG2  ARG   4           2HG      ARG   4   4.938  -5.533  -5.639
   29    HG3  ARG   4           3HG      ARG   4   3.307  -4.850  -5.807
   30    HD2  ARG   4           2HD      ARG   4   4.642  -2.582  -6.186
   31    HD3  ARG   4           3HD      ARG   4   5.954  -3.693  -6.645
   32    HE   ARG   4           HE       ARG   4   3.402  -4.397  -7.798
   33   HH11  ARG   4          2HH1      ARG   4   6.048  -2.167  -8.339
   34   HH12  ARG   4          1HH1      ARG   4   5.696  -1.988 -10.037
   35   HH21  ARG   4          1HH2      ARG   4   3.024  -4.157 -10.009
   36   HH22  ARG   4          2HH2      ARG   4   4.018  -3.085 -10.949
   37    H    LYS   5           H        LYS   5   2.960  -7.148  -4.203
   38    HA   LYS   5           HA       LYS   5   0.153  -6.384  -4.464
   39    HB2  LYS   5           2HB      LYS   5  -0.172  -8.475  -5.573
   40    HB3  LYS   5           3HB      LYS   5   1.275  -7.679  -6.180
   41    HG2  LYS   5           2HG      LYS   5   2.653  -9.224  -4.691
   42    HG3  LYS   5           3HG      LYS   5   1.142 -10.071  -4.303
   43    HD2  LYS   5           2HD      LYS   5   0.808 -10.534  -6.748
   44    HD3  LYS   5           3HD      LYS   5   2.320  -9.690  -7.088
   45    HE2  LYS   5           2HE      LYS   5   2.884 -11.970  -7.138
   46    HE3  LYS   5           3HE      LYS   5   3.517 -11.365  -5.607
   47    HZ1  LYS   5           HZ1      LYS   5   0.977 -12.885  -5.946
   48    HZ2  LYS   5           HZ2      LYS   5   2.362 -13.492  -5.342
   49    HZ3  LYS   5           HZ3      LYS   5   1.549 -12.349  -4.510
   50    H    ILE   6           H        ILE   6   1.921  -8.191  -2.017
   51    HA   ILE   6           HA       ILE   6  -0.506  -9.015  -0.569
   52    HB   ILE   6           HB       ILE   6   2.466  -9.029   0.028
   53   HG12  ILE   6          2HG1      ILE   6   2.119 -11.412   0.400
   54   HG13  ILE   6          3HG1      ILE   6   0.378 -11.239   0.165
   55   HG21  ILE   6          1HG2      ILE   6   1.507  -8.318   2.148
   56   HG22  ILE   6          2HG2      ILE   6   0.236  -9.559   2.035
   57   HG23  ILE   6          3HG2      ILE   6   1.936 -10.021   2.261
   58   HD11  ILE   6          3HD1      ILE   6   0.665 -10.851  -2.191
   59   HD12  ILE   6          1HD1      ILE   6   2.440 -10.746  -2.011
   60   HD13  ILE   6          2HD1      ILE   6   1.598 -12.283  -1.742
   61    H    LEU   7           H        LEU   7   1.952  -6.385  -0.293
   62    HA   LEU   7           HA       LEU   7   0.701  -5.018   1.868
   63    HB2  LEU   7           2HB      LEU   7   2.407  -3.973  -0.423
   64    HB3  LEU   7           3HB      LEU   7   1.942  -3.008   0.971
   65    HG   LEU   7           HG       LEU   7   3.606  -5.557   1.149
   66   HD11  LEU   7          1HD1      LEU   7   4.800  -3.737  -0.009
   67   HD12  LEU   7          2HD1      LEU   7   4.419  -2.624   1.326
   68   HD13  LEU   7          3HD1      LEU   7   5.481  -4.027   1.596
   69   HD21  LEU   7          3HD2      LEU   7   4.108  -4.691   3.450
   70   HD22  LEU   7          1HD2      LEU   7   2.876  -3.435   3.217
   71   HD23  LEU   7          2HD2      LEU   7   2.418  -5.154   3.247
   72    H    CYS   8           H        CYS   8  -0.048  -4.835  -1.608
   73    HA   CYS   8           HA       CYS   8  -1.823  -2.645  -1.548
   74    HB2  CYS   8           2HB      CYS   8  -0.961  -3.614  -3.578
   75    HB3  CYS   8           3HB      CYS   8  -1.728  -5.164  -3.245
   76    H    ALA   9           H        ALA   9  -2.469  -6.053  -0.615
   77    HA   ALA   9           HA       ALA   9  -5.337  -5.796  -0.397
   78    HB1  ALA   9           3HB      ALA   9  -3.388  -7.628   1.102
   79    HB2  ALA   9           1HB      ALA   9  -5.133  -7.868   0.906
   80    HB3  ALA   9           2HB      ALA   9  -4.065  -7.963  -0.511
   81    H    ILE  10           H        ILE  10  -2.625  -5.364   1.811
   82    HA   ILE  10           HA       ILE  10  -4.185  -4.930   4.193
   83    HB   ILE  10           HB       ILE  10  -1.239  -4.466   3.574
   84   HG12  ILE  10          2HG1      ILE  10  -2.569  -6.881   4.892
   85   HG13  ILE  10          3HG1      ILE  10  -2.160  -6.841   3.197
   86   HG21  ILE  10          1HG2      ILE  10  -0.895  -4.604   6.017
   87   HG22  ILE  10          2HG2      ILE  10  -1.964  -3.259   5.629
   88   HG23  ILE  10          3HG2      ILE  10  -2.644  -4.774   6.268
   89   HD11  ILE  10          3HD1      ILE  10  -0.144  -6.715   5.437
   90   HD12  ILE  10          1HD1      ILE  10  -0.462  -8.034   4.287
   91   HD13  ILE  10          2HD1      ILE  10   0.215  -6.510   3.699
   92    H    ALA  11           H        ALA  11  -2.384  -2.750   2.003
   93    HA   ALA  11           HA       ALA  11  -2.654  -0.338   3.364
   94    HB1  ALA  11           3HB      ALA  11  -2.710  -0.778   0.335
   95    HB2  ALA  11           1HB      ALA  11  -2.132   0.658   1.208
   96    HB3  ALA  11           2HB      ALA  11  -1.242  -0.845   1.345
   97    H    LYS  12           H        LYS  12  -4.945  -1.702   0.945
   98    HA   LYS  12           HA       LYS  12  -6.877   0.444   1.343
   99    HB2  LYS  12           2HB      LYS  12  -7.085  -2.173  -0.203
  100    HB3  LYS  12           3HB      LYS  12  -8.270  -0.851  -0.232
  101    HG2  LYS  12           2HG      LYS  12  -6.375   0.705  -0.915
  102    HG3  LYS  12           3HG      LYS  12  -5.369  -0.724  -1.148
  103    HD2  LYS  12           2HD      LYS  12  -7.905   0.007  -2.661
  104    HD3  LYS  12           3HD      LYS  12  -6.235   0.074  -3.243
  105    HE2  LYS  12           2HE      LYS  12  -6.110  -2.448  -2.844
  106    HE3  LYS  12           3HE      LYS  12  -7.858  -2.417  -2.589
  107    HZ1  LYS  12           HZ1      LYS  12  -8.103  -1.502  -4.835
  108    HZ2  LYS  12           HZ2      LYS  12  -6.485  -1.471  -5.065
  109    HZ3  LYS  12           HZ3      LYS  12  -7.269  -2.903  -4.919
  110    H    LYS  13           H        LYS  13  -6.566  -2.782   2.778
  111    HA   LYS  13           HA       LYS  13  -9.197  -2.730   4.049
  112    HB2  LYS  13           2HB      LYS  13  -6.665  -4.344   4.514
  113    HB3  LYS  13           3HB      LYS  13  -8.082  -4.499   5.559
  114    HG2  LYS  13           2HG      LYS  13  -9.503  -5.146   3.709
  115    HG3  LYS  13           3HG      LYS  13  -8.205  -4.882   2.539
  116    HD2  LYS  13           2HD      LYS  13  -6.846  -6.647   3.693
  117    HD3  LYS  13           3HD      LYS  13  -8.207  -6.976   4.770
  118    HE2  LYS  13           2HE      LYS  13  -8.269  -7.208   1.722
  119    HE3  LYS  13           3HE      LYS  13  -7.971  -8.557   2.821
  120    HZ1  LYS  13           HZ1      LYS  13 -10.478  -6.964   2.735
  121    HZ2  LYS  13           HZ2      LYS  13 -10.295  -8.485   2.179
  122    HZ3  LYS  13           HZ3      LYS  13 -10.184  -8.190   3.778
  123    H    LYS  14           H        LYS  14  -5.975  -1.660   5.121
  124    HA   LYS  14           HA       LYS  14  -7.022  -0.685   7.716
  125    HB2  LYS  14           2HB      LYS  14  -4.289  -0.805   6.406
  126    HB3  LYS  14           3HB      LYS  14  -4.563   0.239   7.785
  127    HG2  LYS  14           2HG      LYS  14  -3.630  -1.855   8.513
  128    HG3  LYS  14           3HG      LYS  14  -5.236  -1.596   9.195
  129    HD2  LYS  14           2HD      LYS  14  -6.206  -3.253   7.660
  130    HD3  LYS  14           3HD      LYS  14  -4.669  -3.384   6.797
  131    HE2  LYS  14           2HE      LYS  14  -4.866  -5.298   8.216
  132    HE3  LYS  14           3HE      LYS  14  -3.587  -4.265   8.858
  133    HZ1  LYS  14           HZ1      LYS  14  -6.371  -4.387   9.911
  134    HZ2  LYS  14           HZ2      LYS  14  -5.072  -5.080  10.609
  135    HZ3  LYS  14           HZ3      LYS  14  -5.175  -3.458  10.529
  136    H    GLY  15           H        GLY  15  -6.870   0.646   4.574
  137    HA2  GLY  15           HA2      GLY  15  -7.442   2.742   3.787
  138    HA3  GLY  15           HA3      GLY  15  -7.811   3.262   5.435
  139    H    LYS  16           H        LYS  16  -4.688   1.915   4.523
  140    HA   LYS  16           HA       LYS  16  -3.329   4.555   4.946
  141    HB2  LYS  16           2HB      LYS  16  -3.365   2.846   6.884
  142    HB3  LYS  16           3HB      LYS  16  -2.263   1.884   5.917
  143    HG2  LYS  16           2HG      LYS  16  -1.805   4.752   6.873
  144    HG3  LYS  16           3HG      LYS  16  -1.190   3.296   7.653
  145    HD2  LYS  16           2HD      LYS  16   0.145   2.789   5.567
  146    HD3  LYS  16           3HD      LYS  16  -0.410   4.331   4.898
  147    HE2  LYS  16           2HE      LYS  16   1.755   4.728   5.770
  148    HE3  LYS  16           3HE      LYS  16   0.605   5.528   6.844
  149    HZ1  LYS  16           HZ1      LYS  16   0.853   3.650   8.387
  150    HZ2  LYS  16           HZ2      LYS  16   1.889   2.893   7.371
  151    HZ3  LYS  16           HZ3      LYS  16   2.313   4.301   8.075
  152    H    CYS  17           H        CYS  17  -3.518   4.677   2.631
  153    HA   CYS  17           HA       CYS  17  -1.256   3.343   1.221
  154    HB2  CYS  17           2HB      CYS  17  -3.504   2.211   0.781
  155    HB3  CYS  17           3HB      CYS  17  -4.036   3.721   0.076
  156    H    LYS  18           H        LYS  18  -0.052   4.738   0.064
  157    HA   LYS  18           HA       LYS  18  -1.069   7.173  -1.180
  158    HB2  LYS  18           2HB      LYS  18   0.408   8.725   0.042
  159    HB3  LYS  18           3HB      LYS  18  -0.789   8.000   1.103
  160    HG2  LYS  18           2HG      LYS  18   0.896   6.465   2.040
  161    HG3  LYS  18           3HG      LYS  18   2.100   7.038   0.882
  162    HD2  LYS  18           2HD      LYS  18   2.516   8.054   3.027
  163    HD3  LYS  18           3HD      LYS  18   2.011   9.300   1.879
  164    HE2  LYS  18           2HE      LYS  18  -0.292   9.239   2.828
  165    HE3  LYS  18           3HE      LYS  18   0.205   7.970   3.956
  166    HZ1  LYS  18           HZ1      LYS  18   1.786   9.557   4.930
  167    HZ2  LYS  18           HZ2      LYS  18   1.324  10.725   3.884
  168    HZ3  LYS  18           HZ3      LYS  18   0.274  10.165   4.998
  169    H    GLY  19           H        GLY  19   0.755   8.402  -2.241
  170    HA2  GLY  19           HA2      GLY  19   2.537   8.479  -3.718
  171    HA3  GLY  19           HA3      GLY  19   3.361   7.607  -2.433
  172    HA   PRO  20           HA       PRO  20   3.935   4.773  -5.968
  173    HB2  PRO  20           2HB      PRO  20   5.412   3.284  -3.791
  174    HB3  PRO  20           3HB      PRO  20   5.881   3.543  -5.501
  175    HG2  PRO  20           2HG      PRO  20   7.001   5.053  -3.560
  176    HG3  PRO  20           3HG      PRO  20   6.433   5.839  -5.071
  177    HD2  PRO  20           2HD      PRO  20   5.016   5.673  -2.393
  178    HD3  PRO  20           3HD      PRO  20   5.243   7.087  -3.468
  179    H    LEU  21           H        LEU  21   2.941   3.703  -2.656
  180    HA   LEU  21           HA       LEU  21   1.937   1.154  -3.496
  181    HB2  LEU  21           2HB      LEU  21   2.385   2.339  -1.074
  182    HB3  LEU  21           3HB      LEU  21   0.657   2.567  -1.170
  183    HG   LEU  21           HG       LEU  21   1.064   0.597   0.077
  184   HD11  LEU  21          1HD1      LEU  21  -0.791   0.312  -1.572
  185   HD12  LEU  21          2HD1      LEU  21   0.354  -0.485  -2.677
  186   HD13  LEU  21          3HD1      LEU  21  -0.010  -1.203  -1.098
  187   HD21  LEU  21          3HD2      LEU  21   2.406  -1.292  -0.672
  188   HD22  LEU  21          1HD2      LEU  21   2.795  -0.464  -2.191
  189   HD23  LEU  21          2HD2      LEU  21   3.379   0.186  -0.642
  190    H    LYS  22           H        LYS  22   0.409   4.321  -3.254
  191    HA   LYS  22           HA       LYS  22  -2.285   3.532  -4.029
  192    HB2  LYS  22           2HB      LYS  22  -1.905   5.569  -2.802
  193    HB3  LYS  22           3HB      LYS  22  -0.834   6.204  -4.059
  194    HG2  LYS  22           2HG      LYS  22  -2.701   6.384  -5.633
  195    HG3  LYS  22           3HG      LYS  22  -3.804   5.645  -4.458
  196    HD2  LYS  22           2HD      LYS  22  -3.448   7.539  -2.908
  197    HD3  LYS  22           3HD      LYS  22  -2.238   8.218  -4.008
  198    HE2  LYS  22           2HE      LYS  22  -4.101   9.507  -4.489
  199    HE3  LYS  22           3HE      LYS  22  -4.101   8.310  -5.785
  200    HZ1  LYS  22           HZ1      LYS  22  -6.313   8.574  -4.840
  201    HZ2  LYS  22           HZ2      LYS  22  -5.809   7.063  -4.489
  202    HZ3  LYS  22           HZ3      LYS  22  -5.792   8.221  -3.337
  203    H    LEU  23           H        LEU  23   0.517   4.729  -5.890
  204    HA   LEU  23           HA       LEU  23  -0.774   4.697  -8.441
  205    HB2  LEU  23           2HB      LEU  23   1.334   5.876  -7.918
  206    HB3  LEU  23           3HB      LEU  23   2.154   4.334  -7.688
  207    HG   LEU  23           HG       LEU  23   1.822   3.775 -10.080
  208   HD11  LEU  23          1HD1      LEU  23   0.635   6.583 -10.270
  209   HD12  LEU  23          2HD1      LEU  23   1.109   5.570 -11.653
  210   HD13  LEU  23          3HD1      LEU  23  -0.212   5.053 -10.604
  211   HD21  LEU  23          3HD2      LEU  23   3.867   4.923  -9.324
  212   HD22  LEU  23          1HD2      LEU  23   3.424   5.408 -10.968
  213   HD23  LEU  23          2HD2      LEU  23   3.095   6.500  -9.604
  214    H    VAL  24           H        VAL  24   0.987   2.122  -6.705
  215    HA   VAL  24           HA       VAL  24   0.790   0.102  -8.768
  216    HB   VAL  24           HB       VAL  24   1.255  -0.030  -5.763
  217   HG11  VAL  24          1HG1      VAL  24   2.153  -2.310  -6.122
  218   HG12  VAL  24          2HG1      VAL  24   0.419  -2.235  -6.406
  219   HG13  VAL  24          3HG1      VAL  24   1.535  -2.283  -7.792
  220   HG21  VAL  24          3HG2      VAL  24   3.566  -0.305  -6.296
  221   HG22  VAL  24          1HG2      VAL  24   3.224  -0.459  -8.044
  222   HG23  VAL  24          2HG2      VAL  24   3.010   1.088  -7.216
  223    H    CYS  25           H        CYS  25  -1.149   0.780  -5.869
  224    HA   CYS  25           HA       CYS  25  -2.836  -1.577  -6.341
  225    HB2  CYS  25           2HB      CYS  25  -1.530  -1.047  -4.274
  226    HB3  CYS  25           3HB      CYS  25  -2.572   0.337  -4.010
  227    H    LYS  26           H        LYS  26  -3.149   1.728  -6.952
  228    HA   LYS  26           HA       LYS  26  -4.818   3.178  -7.446
  229    HB2  LYS  26           2HB      LYS  26  -6.263   0.657  -8.313
  230    HB3  LYS  26           3HB      LYS  26  -6.735   2.295  -8.762
  231    HG2  LYS  26           2HG      LYS  26  -3.997   1.090  -9.320
  232    HG3  LYS  26           3HG      LYS  26  -5.333   1.030 -10.469
  233    HD2  LYS  26           2HD      LYS  26  -3.950   3.557  -9.455
  234    HD3  LYS  26           3HD      LYS  26  -3.710   2.783 -11.020
  235    HE2  LYS  26           2HE      LYS  26  -6.124   3.144 -11.565
  236    HE3  LYS  26           3HE      LYS  26  -6.329   3.994 -10.028
  237    HZ1  LYS  26           HZ1      LYS  26  -4.507   4.847 -12.215
  238    HZ2  LYS  26           HZ2      LYS  26  -5.933   5.546 -11.850
  239    HZ3  LYS  26           HZ3      LYS  26  -4.694   5.635 -10.794
  240    H    CYS  27           H        CYS  27  -4.538   3.021  -5.079
  241    HA   CYS  27           HA       CYS  27  -6.816   2.446  -3.371
  242    HB2  CYS  27           2HB      CYS  27  -4.403   4.230  -2.851
  243    HB3  CYS  27           3HB      CYS  27  -5.540   3.656  -1.663
  Start of MODEL    8
    1    H1   GLY   1           1H       GLY   1  10.701 -10.418   4.474
    2    H2   GLY   1           2H       GLY   1   9.814 -11.507   3.626
    3    H3   GLY   1           3H       GLY   1  10.551 -10.270   2.847
    4    HA2  GLY   1           HA2      GLY   1   8.355  -9.993   4.796
    5    HA3  GLY   1           HA3      GLY   1   9.159  -8.649   3.963
    6    H    LEU   2           H        LEU   2   6.475  -8.810   3.743
    7    HA   LEU   2           HA       LEU   2   5.506 -10.330   1.504
    8    HB2  LEU   2           2HB      LEU   2   4.472  -8.000   3.132
    9    HB3  LEU   2           3HB      LEU   2   3.647  -8.488   1.659
   10    HG   LEU   2           HG       LEU   2   3.188 -10.694   2.522
   11   HD11  LEU   2          1HD1      LEU   2   5.068 -11.144   4.015
   12   HD12  LEU   2          2HD1      LEU   2   4.578  -9.803   5.086
   13   HD13  LEU   2          3HD1      LEU   2   3.557 -11.248   4.920
   14   HD21  LEU   2          3HD2      LEU   2   1.569 -10.034   4.231
   15   HD22  LEU   2          1HD2      LEU   2   2.471  -8.538   4.559
   16   HD23  LEU   2          2HD2      LEU   2   1.662  -8.765   2.999
   17    HA   PRO   3           HA       PRO   3   6.770  -7.477  -1.784
   18    HB2  PRO   3           2HB      PRO   3   5.387  -8.475  -3.889
   19    HB3  PRO   3           3HB      PRO   3   6.717  -9.396  -3.119
   20    HG2  PRO   3           2HG      PRO   3   3.737  -9.657  -2.601
   21    HG3  PRO   3           3HG      PRO   3   4.907 -10.965  -2.967
   22    HD2  PRO   3           2HD      PRO   3   4.175 -10.300  -0.404
   23    HD3  PRO   3           3HD      PRO   3   5.823 -10.875  -0.802
   24    H    ARG   4           H        ARG   4   5.874  -5.767  -3.056
   25    HA   ARG   4           HA       ARG   4   3.945  -4.171  -1.817
   26    HB2  ARG   4           2HB      ARG   4   4.089  -2.687  -3.614
   27    HB3  ARG   4           3HB      ARG   4   5.674  -3.310  -3.174
   28    HG2  ARG   4           2HG      ARG   4   5.601  -4.850  -5.177
   29    HG3  ARG   4           3HG      ARG   4   4.013  -4.168  -5.588
   30    HD2  ARG   4           2HD      ARG   4   5.491  -2.901  -6.883
   31    HD3  ARG   4           3HD      ARG   4   5.119  -1.882  -5.467
   32    HE   ARG   4           HE       ARG   4   7.472  -3.381  -4.901
   33   HH11  ARG   4          1HH1      ARG   4   6.571  -0.771  -7.058
   34   HH12  ARG   4          2HH1      ARG   4   8.185  -0.115  -7.082
   35   HH21  ARG   4          2HH2      ARG   4   9.505  -2.490  -4.976
   36   HH22  ARG   4          1HH2      ARG   4   9.796  -1.070  -5.937
   37    H    LYS   5           H        LYS   5   3.301  -6.530  -4.343
   38    HA   LYS   5           HA       LYS   5   0.578  -5.677  -4.858
   39    HB2  LYS   5           2HB      LYS   5   0.380  -7.655  -6.194
   40    HB3  LYS   5           3HB      LYS   5   1.934  -6.884  -6.506
   41    HG2  LYS   5           2HG      LYS   5   3.012  -8.567  -4.944
   42    HG3  LYS   5           3HG      LYS   5   1.451  -9.383  -4.819
   43    HD2  LYS   5           2HD      LYS   5   3.017  -8.962  -7.399
   44    HD3  LYS   5           3HD      LYS   5   2.996 -10.448  -6.440
   45    HE2  LYS   5           2HE      LYS   5   0.532 -10.630  -6.776
   46    HE3  LYS   5           3HE      LYS   5   0.567  -9.174  -7.781
   47    HZ1  LYS   5           HZ1      LYS   5   2.044 -10.353  -9.322
   48    HZ2  LYS   5           HZ2      LYS   5   2.006 -11.701  -8.398
   49    HZ3  LYS   5           HZ3      LYS   5   0.650 -11.181  -9.139
   50    H    ILE   6           H        ILE   6   1.936  -7.691  -2.358
   51    HA   ILE   6           HA       ILE   6  -0.778  -8.578  -1.475
   52    HB   ILE   6           HB       ILE   6   1.967  -9.343  -0.425
   53   HG12  ILE   6          2HG1      ILE   6  -0.090 -10.864  -2.109
   54   HG13  ILE   6          3HG1      ILE   6   1.463 -10.264  -2.677
   55   HG21  ILE   6          1HG2      ILE   6   0.768 -10.978   0.971
   56   HG22  ILE   6          2HG2      ILE   6   0.170  -9.372   1.346
   57   HG23  ILE   6          3HG2      ILE   6  -0.793 -10.437   0.311
   58   HD11  ILE   6          3HD1      ILE   6   1.692 -12.601  -2.338
   59   HD12  ILE   6          1HD1      ILE   6   2.614 -11.800  -1.055
   60   HD13  ILE   6          2HD1      ILE   6   1.024 -12.521  -0.702
   61    H    LEU   7           H        LEU   7   1.992  -6.539  -0.418
   62    HA   LEU   7           HA       LEU   7   0.849  -5.551   1.994
   63    HB2  LEU   7           2HB      LEU   7   2.620  -4.207  -0.085
   64    HB3  LEU   7           3HB      LEU   7   2.220  -3.469   1.454
   65    HG   LEU   7           HG       LEU   7   3.715  -6.108   1.180
   66   HD11  LEU   7          1HD1      LEU   7   4.713  -3.305   1.841
   67   HD12  LEU   7          2HD1      LEU   7   5.683  -4.795   1.868
   68   HD13  LEU   7          3HD1      LEU   7   5.029  -4.202   0.338
   69   HD21  LEU   7          3HD2      LEU   7   2.556  -5.995   3.328
   70   HD22  LEU   7          1HD2      LEU   7   4.271  -5.669   3.593
   71   HD23  LEU   7          2HD2      LEU   7   3.115  -4.324   3.584
   72    H    CYS   8           H        CYS   8   0.021  -4.725  -1.354
   73    HA   CYS   8           HA       CYS   8  -1.512  -2.398  -0.918
   74    HB2  CYS   8           2HB      CYS   8  -0.928  -3.248  -3.125
   75    HB3  CYS   8           3HB      CYS   8  -1.954  -4.667  -2.886
   76    H    ALA   9           H        ALA   9  -2.455  -5.790  -0.255
   77    HA   ALA   9           HA       ALA   9  -5.263  -5.411   0.077
   78    HB1  ALA   9           3HB      ALA   9  -4.066  -7.616  -0.043
   79    HB2  ALA   9           1HB      ALA   9  -3.353  -7.289   1.562
   80    HB3  ALA   9           2HB      ALA   9  -5.108  -7.476   1.392
   81    H    ILE  10           H        ILE  10  -2.535  -5.084   2.255
   82    HA   ILE  10           HA       ILE  10  -4.071  -4.492   4.652
   83    HB   ILE  10           HB       ILE  10  -1.082  -4.292   4.068
   84   HG12  ILE  10          2HG1      ILE  10  -2.660  -6.638   5.226
   85   HG13  ILE  10          3HG1      ILE  10  -2.028  -6.578   3.591
   86   HG21  ILE  10          1HG2      ILE  10  -0.815  -4.434   6.513
   87   HG22  ILE  10          2HG2      ILE  10  -1.799  -3.035   6.088
   88   HG23  ILE  10          3HG2      ILE  10  -2.579  -4.502   6.718
   89   HD11  ILE  10          3HD1      ILE  10  -0.576  -7.912   4.814
   90   HD12  ILE  10          1HD1      ILE  10   0.269  -6.407   4.413
   91   HD13  ILE  10          2HD1      ILE  10  -0.334  -6.678   6.076
   92    H    ALA  11           H        ALA  11  -1.998  -2.681   2.384
   93    HA   ALA  11           HA       ALA  11  -2.037  -0.183   3.607
   94    HB1  ALA  11           3HB      ALA  11  -1.967  -0.782   0.614
   95    HB2  ALA  11           1HB      ALA  11  -1.295   0.640   1.441
   96    HB3  ALA  11           2HB      ALA  11  -0.575  -0.944   1.711
   97    H    LYS  12           H        LYS  12  -4.399  -1.381   1.099
   98    HA   LYS  12           HA       LYS  12  -5.952   1.077   1.367
   99    HB2  LYS  12           2HB      LYS  12  -7.366   0.211  -0.322
  100    HB3  LYS  12           3HB      LYS  12  -5.687  -0.097  -0.736
  101    HG2  LYS  12           2HG      LYS  12  -6.134  -2.486   0.302
  102    HG3  LYS  12           3HG      LYS  12  -7.833  -2.072   0.123
  103    HD2  LYS  12           2HD      LYS  12  -7.629  -1.806  -2.257
  104    HD3  LYS  12           3HD      LYS  12  -5.852  -1.804  -2.182
  105    HE2  LYS  12           2HE      LYS  12  -5.759  -4.106  -1.542
  106    HE3  LYS  12           3HE      LYS  12  -7.522  -4.201  -1.351
  107    HZ1  LYS  12           HZ1      LYS  12  -6.123  -3.716  -3.934
  108    HZ2  LYS  12           HZ2      LYS  12  -6.808  -5.131  -3.486
  109    HZ3  LYS  12           HZ3      LYS  12  -7.743  -3.822  -3.743
  110    H    LYS  13           H        LYS  13  -6.249  -2.120   2.933
  111    HA   LYS  13           HA       LYS  13  -8.790  -1.592   4.133
  112    HB2  LYS  13           2HB      LYS  13  -7.595  -3.774   3.816
  113    HB3  LYS  13           3HB      LYS  13  -6.497  -3.338   5.142
  114    HG2  LYS  13           2HG      LYS  13  -8.429  -3.253   6.688
  115    HG3  LYS  13           3HG      LYS  13  -9.536  -3.514   5.321
  116    HD2  LYS  13           2HD      LYS  13  -8.306  -5.725   4.889
  117    HD3  LYS  13           3HD      LYS  13  -7.492  -5.476   6.458
  118    HE2  LYS  13           2HE      LYS  13  -9.728  -5.232   7.527
  119    HE3  LYS  13           3HE      LYS  13 -10.488  -5.482   5.948
  120    HZ1  LYS  13           HZ1      LYS  13  -9.531  -7.729   5.911
  121    HZ2  LYS  13           HZ2      LYS  13  -8.823  -7.505   7.367
  122    HZ3  LYS  13           HZ3      LYS  13 -10.448  -7.550   7.246
  123    H    LYS  14           H        LYS  14  -5.472  -0.852   5.247
  124    HA   LYS  14           HA       LYS  14  -6.417   0.442   7.729
  125    HB2  LYS  14           2HB      LYS  14  -3.724  -0.069   6.442
  126    HB3  LYS  14           3HB      LYS  14  -3.873   1.171   7.672
  127    HG2  LYS  14           2HG      LYS  14  -3.133  -0.895   8.658
  128    HG3  LYS  14           3HG      LYS  14  -4.676  -0.365   9.324
  129    HD2  LYS  14           2HD      LYS  14  -5.871  -2.080   8.027
  130    HD3  LYS  14           3HD      LYS  14  -4.347  -2.581   7.252
  131    HE2  LYS  14           2HE      LYS  14  -3.404  -3.184   9.448
  132    HE3  LYS  14           3HE      LYS  14  -4.860  -2.601  10.262
  133    HZ1  LYS  14           HZ1      LYS  14  -4.893  -5.010   9.995
  134    HZ2  LYS  14           HZ2      LYS  14  -6.123  -4.352   9.155
  135    HZ3  LYS  14           HZ3      LYS  14  -4.788  -4.895   8.373
  136    H    GLY  15           H        GLY  15  -5.613   1.562   4.500
  137    HA2  GLY  15           HA2      GLY  15  -6.395   3.660   3.623
  138    HA3  GLY  15           HA3      GLY  15  -6.383   4.362   5.242
  139    H    LYS  16           H        LYS  16  -3.671   2.402   4.458
  140    HA   LYS  16           HA       LYS  16  -1.810   4.701   4.394
  141    HB2  LYS  16           2HB      LYS  16  -1.513   1.691   4.800
  142    HB3  LYS  16           3HB      LYS  16  -0.163   2.791   4.774
  143    HG2  LYS  16           2HG      LYS  16  -2.452   2.831   6.782
  144    HG3  LYS  16           3HG      LYS  16  -0.840   2.193   7.064
  145    HD2  LYS  16           2HD      LYS  16  -1.557   5.119   6.584
  146    HD3  LYS  16           3HD      LYS  16  -1.123   4.368   8.120
  147    HE2  LYS  16           2HE      LYS  16   1.124   3.780   7.185
  148    HE3  LYS  16           3HE      LYS  16   0.703   4.620   5.687
  149    HZ1  LYS  16           HZ1      LYS  16   1.963   6.058   7.181
  150    HZ2  LYS  16           HZ2      LYS  16   0.464   6.673   6.990
  151    HZ3  LYS  16           HZ3      LYS  16   0.860   5.892   8.370
  152    H    CYS  17           H        CYS  17  -3.402   2.998   1.978
  153    HA   CYS  17           HA       CYS  17  -1.131   2.651   0.183
  154    HB2  CYS  17           2HB      CYS  17  -3.267   1.308   0.115
  155    HB3  CYS  17           3HB      CYS  17  -4.053   2.740  -0.566
  156    H    LYS  18           H        LYS  18  -0.064   4.458  -0.110
  157    HA   LYS  18           HA       LYS  18  -1.296   6.809  -1.489
  158    HB2  LYS  18           2HB      LYS  18   0.642   6.939   0.872
  159    HB3  LYS  18           3HB      LYS  18  -0.017   8.322   0.008
  160    HG2  LYS  18           2HG      LYS  18  -1.642   6.380   1.708
  161    HG3  LYS  18           3HG      LYS  18  -1.032   7.937   2.238
  162    HD2  LYS  18           2HD      LYS  18  -2.477   9.152   0.761
  163    HD3  LYS  18           3HD      LYS  18  -2.887   7.706  -0.157
  164    HE2  LYS  18           2HE      LYS  18  -4.759   8.261   1.249
  165    HE3  LYS  18           3HE      LYS  18  -4.051   6.734   1.777
  166    HZ1  LYS  18           HZ1      LYS  18  -2.956   7.939   3.586
  167    HZ2  LYS  18           HZ2      LYS  18  -3.600   9.365   3.090
  168    HZ3  LYS  18           HZ3      LYS  18  -4.560   8.166   3.652
  169    H    GLY  19           H        GLY  19   0.324   8.207  -2.490
  170    HA2  GLY  19           HA2      GLY  19   2.011   8.492  -4.043
  171    HA3  GLY  19           HA3      GLY  19   3.025   7.875  -2.756
  172    HA   PRO  20           HA       PRO  20   4.013   4.920  -6.015
  173    HB2  PRO  20           2HB      PRO  20   5.638   3.180  -4.642
  174    HB3  PRO  20           3HB      PRO  20   6.143   4.812  -5.175
  175    HG2  PRO  20           2HG      PRO  20   5.110   3.986  -2.443
  176    HG3  PRO  20           3HG      PRO  20   6.562   4.965  -2.830
  177    HD2  PRO  20           2HD      PRO  20   4.220   6.128  -2.128
  178    HD3  PRO  20           3HD      PRO  20   5.252   6.853  -3.400
  179    H    LEU  21           H        LEU  21   2.800   3.644  -2.830
  180    HA   LEU  21           HA       LEU  21   2.145   1.058  -3.895
  181    HB2  LEU  21           2HB      LEU  21   2.235   2.173  -1.373
  182    HB3  LEU  21           3HB      LEU  21   0.509   2.131  -1.632
  183    HG   LEU  21           HG       LEU  21   1.087   0.171  -0.453
  184   HD11  LEU  21          1HD1      LEU  21   0.530  -1.714  -1.877
  185   HD12  LEU  21          2HD1      LEU  21  -0.503  -0.332  -2.284
  186   HD13  LEU  21          3HD1      LEU  21   0.857  -0.780  -3.339
  187   HD21  LEU  21          3HD2      LEU  21   2.794  -1.431  -1.110
  188   HD22  LEU  21          1HD2      LEU  21   3.218  -0.451  -2.533
  189   HD23  LEU  21          2HD2      LEU  21   3.504   0.175  -0.893
  190    H    LYS  22           H        LYS  22   0.334   4.073  -3.678
  191    HA   LYS  22           HA       LYS  22  -2.201   3.066  -4.706
  192    HB2  LYS  22           2HB      LYS  22  -2.151   5.036  -3.332
  193    HB3  LYS  22           3HB      LYS  22  -1.022   5.859  -4.418
  194    HG2  LYS  22           2HG      LYS  22  -2.670   6.017  -6.169
  195    HG3  LYS  22           3HG      LYS  22  -3.813   4.989  -5.297
  196    HD2  LYS  22           2HD      LYS  22  -2.797   7.630  -4.181
  197    HD3  LYS  22           3HD      LYS  22  -4.201   7.524  -5.266
  198    HE2  LYS  22           2HE      LYS  22  -5.240   5.871  -3.662
  199    HE3  LYS  22           3HE      LYS  22  -3.921   6.195  -2.533
  200    HZ1  LYS  22           HZ1      LYS  22  -5.862   8.205  -3.550
  201    HZ2  LYS  22           HZ2      LYS  22  -5.863   7.566  -2.053
  202    HZ3  LYS  22           HZ3      LYS  22  -4.639   8.547  -2.522
  203    H    LEU  23           H        LEU  23   0.629   4.690  -6.215
  204    HA   LEU  23           HA       LEU  23  -0.404   4.703  -8.871
  205    HB2  LEU  23           2HB      LEU  23   1.518   6.031  -8.055
  206    HB3  LEU  23           3HB      LEU  23   2.462   4.558  -7.855
  207    HG   LEU  23           HG       LEU  23   2.411   4.170 -10.305
  208   HD11  LEU  23          1HD1      LEU  23   1.672   6.017 -11.804
  209   HD12  LEU  23          2HD1      LEU  23   0.316   5.299 -10.932
  210   HD13  LEU  23          3HD1      LEU  23   0.977   6.865 -10.404
  211   HD21  LEU  23          3HD2      LEU  23   3.357   6.952  -9.500
  212   HD22  LEU  23          1HD2      LEU  23   4.253   5.434  -9.262
  213   HD23  LEU  23          2HD2      LEU  23   3.919   6.013 -10.903
  214    H    VAL  24           H        VAL  24   1.388   2.175  -7.116
  215    HA   VAL  24           HA       VAL  24   1.699   0.339  -9.316
  216    HB   VAL  24           HB       VAL  24   1.798   0.045  -6.296
  217   HG11  VAL  24          1HG1      VAL  24   1.244  -2.193  -7.111
  218   HG12  VAL  24          2HG1      VAL  24   2.514  -2.083  -8.354
  219   HG13  VAL  24          3HG1      VAL  24   2.931  -2.128  -6.627
  220   HG21  VAL  24          3HG2      VAL  24   4.155   0.045  -6.553
  221   HG22  VAL  24          1HG2      VAL  24   4.053  -0.151  -8.329
  222   HG23  VAL  24          2HG2      VAL  24   3.589   1.372  -7.563
  223    H    CYS  25           H        CYS  25  -0.784   0.590  -6.760
  224    HA   CYS  25           HA       CYS  25  -2.082  -1.882  -7.798
  225    HB2  CYS  25           2HB      CYS  25  -1.078  -1.595  -5.459
  226    HB3  CYS  25           3HB      CYS  25  -2.443  -0.539  -5.117
  227    H    LYS  26           H        LYS  26  -2.603   1.419  -7.880
  228    HA   LYS  26           HA       LYS  26  -4.232   2.859  -8.096
  229    HB2  LYS  26           2HB      LYS  26  -4.595   1.059 -10.123
  230    HB3  LYS  26           3HB      LYS  26  -6.224   1.159  -9.481
  231    HG2  LYS  26           2HG      LYS  26  -4.396   3.434 -10.343
  232    HG3  LYS  26           3HG      LYS  26  -5.812   2.854 -11.231
  233    HD2  LYS  26           2HD      LYS  26  -5.787   4.362  -8.578
  234    HD3  LYS  26           3HD      LYS  26  -6.289   4.990 -10.139
  235    HE2  LYS  26           2HE      LYS  26  -8.254   3.612 -10.197
  236    HE3  LYS  26           3HE      LYS  26  -7.688   2.620  -8.849
  237    HZ1  LYS  26           HZ1      LYS  26  -7.866   4.548  -7.391
  238    HZ2  LYS  26           HZ2      LYS  26  -8.419   5.484  -8.621
  239    HZ3  LYS  26           HZ3      LYS  26  -9.315   4.226  -8.083
  240    H    CYS  27           H        CYS  27  -4.237   2.744  -5.857
  241    HA   CYS  27           HA       CYS  27  -6.685   1.873  -4.463
  242    HB2  CYS  27           2HB      CYS  27  -4.277   3.477  -3.512
  243    HB3  CYS  27           3HB      CYS  27  -5.593   2.944  -2.509
  Start of MODEL    9
    1    H1   GLY   1           1H       GLY   1  11.075  -6.582   3.053
    2    H2   GLY   1           2H       GLY   1  11.169  -6.168   4.636
    3    H3   GLY   1           3H       GLY   1  10.730  -7.688   4.208
    4    HA2  GLY   1           HA2      GLY   1   8.797  -6.445   4.920
    5    HA3  GLY   1           HA3      GLY   1   9.174  -5.239   3.676
    6    H    LEU   2           H        LEU   2   6.705  -6.296   3.624
    7    HA   LEU   2           HA       LEU   2   6.415  -8.661   1.995
    8    HB2  LEU   2           2HB      LEU   2   4.566  -6.430   2.890
    9    HB3  LEU   2           3HB      LEU   2   4.049  -7.599   1.684
   10    HG   LEU   2           HG       LEU   2   4.335  -9.457   3.217
   11   HD11  LEU   2          1HD1      LEU   2   6.114  -8.712   4.716
   12   HD12  LEU   2          2HD1      LEU   2   5.101  -7.366   5.301
   13   HD13  LEU   2          3HD1      LEU   2   4.661  -9.051   5.654
   14   HD21  LEU   2          3HD2      LEU   2   2.197  -8.182   3.089
   15   HD22  LEU   2          1HD2      LEU   2   2.451  -8.908   4.684
   16   HD23  LEU   2          2HD2      LEU   2   2.733  -7.169   4.444
   17    HA   PRO   3           HA       PRO   3   6.830  -6.686  -2.061
   18    HB2  PRO   3           2HB      PRO   3   5.734  -8.565  -3.680
   19    HB3  PRO   3           3HB      PRO   3   7.273  -8.858  -2.814
   20    HG2  PRO   3           2HG      PRO   3   4.484  -9.723  -1.984
   21    HG3  PRO   3           3HG      PRO   3   5.969 -10.723  -2.067
   22    HD2  PRO   3           2HD      PRO   3   5.079  -9.550   0.253
   23    HD3  PRO   3           3HD      PRO   3   6.822  -9.785  -0.086
   24    H    ARG   4           H        ARG   4   5.491  -5.558  -3.553
   25    HA   ARG   4           HA       ARG   4   3.200  -4.386  -2.492
   26    HB2  ARG   4           2HB      ARG   4   2.907  -3.220  -4.573
   27    HB3  ARG   4           3HB      ARG   4   4.602  -3.326  -4.130
   28    HG2  ARG   4           2HG      ARG   4   4.739  -3.788  -6.377
   29    HG3  ARG   4           3HG      ARG   4   4.661  -5.414  -5.710
   30    HD2  ARG   4           2HD      ARG   4   2.004  -5.031  -6.130
   31    HD3  ARG   4           3HD      ARG   4   2.628  -3.850  -7.282
   32    HE   ARG   4           HE       ARG   4   4.012  -6.352  -7.539
   33   HH11  ARG   4          1HH2      ARG   4   0.906  -4.954  -8.366
   34   HH12  ARG   4          2HH2      ARG   4   0.669  -6.036  -9.711
   35   HH21  ARG   4          2HH1      ARG   4   3.666  -7.671  -9.312
   36   HH22  ARG   4          1HH1      ARG   4   2.191  -7.536 -10.220
   37    H    LYS   5           H        LYS   5   3.227  -7.237  -4.525
   38    HA   LYS   5           HA       LYS   5   0.399  -7.278  -5.083
   39    HB2  LYS   5           2HB      LYS   5   0.759  -9.484  -5.943
   40    HB3  LYS   5           3HB      LYS   5   2.078  -8.436  -6.456
   41    HG2  LYS   5           2HG      LYS   5   3.495  -9.394  -4.590
   42    HG3  LYS   5           3HG      LYS   5   2.184 -10.521  -4.227
   43    HD2  LYS   5           2HD      LYS   5   3.663 -10.342  -6.886
   44    HD3  LYS   5           3HD      LYS   5   3.989 -11.516  -5.603
   45    HE2  LYS   5           2HE      LYS   5   1.651 -12.372  -5.801
   46    HE3  LYS   5           3HE      LYS   5   1.359 -11.243  -7.130
   47    HZ1  LYS   5           HZ1      LYS   5   3.127 -12.367  -8.382
   48    HZ2  LYS   5           HZ2      LYS   5   3.391 -13.412  -7.154
   49    HZ3  LYS   5           HZ3      LYS   5   1.973 -13.438  -7.957
   50    H    ILE   6           H        ILE   6   2.091  -8.104  -2.207
   51    HA   ILE   6           HA       ILE   6  -0.370  -9.369  -1.040
   52    HB   ILE   6           HB       ILE   6   2.470  -9.329   0.056
   53   HG12  ILE   6          2HG1      ILE   6   0.888 -11.618  -1.212
   54   HG13  ILE   6          3HG1      ILE   6   2.259 -10.787  -1.945
   55   HG21  ILE   6          1HG2      ILE   6   1.594 -10.842   1.786
   56   HG22  ILE   6          2HG2      ILE   6   0.654  -9.359   1.797
   57   HG23  ILE   6          3HG2      ILE   6  -0.018 -10.808   1.034
   58   HD11  ILE   6          3HD1      ILE   6   3.066 -12.850  -1.089
   59   HD12  ILE   6          1HD1      ILE   6   3.715 -11.561  -0.058
   60   HD13  ILE   6          2HD1      ILE   6   2.358 -12.567   0.506
   61    H    LEU   7           H        LEU   7   2.140  -6.874  -0.411
   62    HA   LEU   7           HA       LEU   7   1.044  -5.798   1.923
   63    HB2  LEU   7           2HB      LEU   7   3.316  -5.379   1.018
   64    HB3  LEU   7           3HB      LEU   7   2.626  -4.437  -0.298
   65    HG   LEU   7           HG       LEU   7   1.843  -2.721   1.285
   66   HD11  LEU   7          1HD1      LEU   7   1.440  -4.053   3.313
   67   HD12  LEU   7          2HD1      LEU   7   3.173  -4.443   3.427
   68   HD13  LEU   7          3HD1      LEU   7   2.605  -2.775   3.653
   69   HD21  LEU   7          3HD2      LEU   7   4.766  -3.469   1.690
   70   HD22  LEU   7          1HD2      LEU   7   4.104  -2.568   0.310
   71   HD23  LEU   7          2HD2      LEU   7   4.046  -1.862   1.933
   72    H    CYS   8           H        CYS   8   0.103  -5.114  -1.433
   73    HA   CYS   8           HA       CYS   8  -1.384  -2.734  -1.018
   74    HB2  CYS   8           2HB      CYS   8  -0.737  -3.620  -3.209
   75    HB3  CYS   8           3HB      CYS   8  -1.840  -4.982  -3.011
   76    H    ALA   9           H        ALA   9  -2.398  -6.133  -0.451
   77    HA   ALA   9           HA       ALA   9  -5.208  -5.674  -0.177
   78    HB1  ALA   9           3HB      ALA   9  -3.400  -7.714   1.210
   79    HB2  ALA   9           1HB      ALA   9  -5.158  -7.827   0.991
   80    HB3  ALA   9           2HB      ALA   9  -4.090  -7.907  -0.431
   81    H    ILE  10           H        ILE  10  -2.518  -5.156   1.969
   82    HA   ILE  10           HA       ILE  10  -4.178  -4.820   4.396
   83    HB   ILE  10           HB       ILE  10  -1.159  -4.742   3.992
   84   HG12  ILE  10          2HG1      ILE  10  -2.881  -7.058   4.997
   85   HG13  ILE  10          3HG1      ILE  10  -2.225  -6.964   3.374
   86   HG21  ILE  10          1HG2      ILE  10  -2.825  -5.017   6.536
   87   HG22  ILE  10          2HG2      ILE  10  -1.051  -5.016   6.441
   88   HG23  ILE  10          3HG2      ILE  10  -1.948  -3.554   6.035
   89   HD11  ILE  10          3HD1      ILE  10  -0.828  -8.396   4.570
   90   HD12  ILE  10          1HD1      ILE  10   0.070  -6.906   4.240
   91   HD13  ILE  10          2HD1      ILE  10  -0.571  -7.218   5.879
   92    H    ALA  11           H        ALA  11  -1.845  -3.010   2.381
   93    HA   ALA  11           HA       ALA  11  -1.930  -0.510   3.591
   94    HB1  ALA  11           3HB      ALA  11  -0.391  -1.277   1.766
   95    HB2  ALA  11           1HB      ALA  11  -1.742  -1.167   0.610
   96    HB3  ALA  11           2HB      ALA  11  -1.121   0.292   1.413
   97    H    LYS  12           H        LYS  12  -4.119  -1.723   0.984
   98    HA   LYS  12           HA       LYS  12  -5.638   0.783   1.063
   99    HB2  LYS  12           2HB      LYS  12  -6.463   0.217  -0.959
  100    HB3  LYS  12           3HB      LYS  12  -4.946  -0.672  -0.959
  101    HG2  LYS  12           2HG      LYS  12  -6.514  -2.652  -0.042
  102    HG3  LYS  12           3HG      LYS  12  -7.781  -1.681  -0.796
  103    HD2  LYS  12           2HD      LYS  12  -5.419  -3.087  -2.013
  104    HD3  LYS  12           3HD      LYS  12  -7.109  -3.265  -2.441
  105    HE2  LYS  12           2HE      LYS  12  -5.324  -0.860  -3.061
  106    HE3  LYS  12           3HE      LYS  12  -5.704  -2.157  -4.182
  107    HZ1  LYS  12           HZ1      LYS  12  -7.735  -0.310  -3.050
  108    HZ2  LYS  12           HZ2      LYS  12  -7.085  -0.216  -4.552
  109    HZ3  LYS  12           HZ3      LYS  12  -8.021  -1.496  -4.141
  110    H    LYS  13           H        LYS  13  -6.054  -2.355   2.533
  111    HA   LYS  13           HA       LYS  13  -8.816  -1.918   3.370
  112    HB2  LYS  13           2HB      LYS  13  -7.771  -4.121   3.146
  113    HB3  LYS  13           3HB      LYS  13  -6.655  -3.756   4.476
  114    HG2  LYS  13           2HG      LYS  13  -8.644  -3.525   6.001
  115    HG3  LYS  13           3HG      LYS  13  -9.696  -3.978   4.659
  116    HD2  LYS  13           2HD      LYS  13  -7.490  -5.667   5.920
  117    HD3  LYS  13           3HD      LYS  13  -9.216  -5.891   6.162
  118    HE2  LYS  13           2HE      LYS  13  -7.743  -6.235   3.505
  119    HE3  LYS  13           3HE      LYS  13  -8.188  -7.541   4.601
  120    HZ1  LYS  13           HZ1      LYS  13 -10.530  -6.951   4.276
  121    HZ2  LYS  13           HZ2      LYS  13 -10.130  -5.756   3.232
  122    HZ3  LYS  13           HZ3      LYS  13  -9.829  -7.313   2.850
  123    H    LYS  14           H        LYS  14  -5.658  -1.415   5.008
  124    HA   LYS  14           HA       LYS  14  -6.938  -0.224   7.383
  125    HB2  LYS  14           2HB      LYS  14  -4.067  -0.762   6.559
  126    HB3  LYS  14           3HB      LYS  14  -4.441   0.278   7.920
  127    HG2  LYS  14           2HG      LYS  14  -3.964  -1.930   8.712
  128    HG3  LYS  14           3HG      LYS  14  -5.625  -1.468   9.086
  129    HD2  LYS  14           2HD      LYS  14  -6.481  -2.947   7.320
  130    HD3  LYS  14           3HD      LYS  14  -4.834  -3.273   6.763
  131    HE2  LYS  14           2HE      LYS  14  -5.566  -5.165   8.036
  132    HE3  LYS  14           3HE      LYS  14  -4.299  -4.336   8.940
  133    HZ1  LYS  14           HZ1      LYS  14  -6.178  -4.960  10.359
  134    HZ2  LYS  14           HZ2      LYS  14  -6.033  -3.340  10.334
  135    HZ3  LYS  14           HZ3      LYS  14  -7.217  -4.070   9.472
  136    H    GLY  15           H        GLY  15  -5.606   1.063   4.412
  137    HA2  GLY  15           HA2      GLY  15  -6.259   3.200   3.578
  138    HA3  GLY  15           HA3      GLY  15  -6.531   3.788   5.220
  139    H    LYS  16           H        LYS  16  -3.665   1.951   4.606
  140    HA   LYS  16           HA       LYS  16  -1.854   4.249   5.077
  141    HB2  LYS  16           2HB      LYS  16  -1.415   1.236   4.911
  142    HB3  LYS  16           3HB      LYS  16  -0.228   2.413   5.397
  143    HG2  LYS  16           2HG      LYS  16  -2.751   1.675   6.930
  144    HG3  LYS  16           3HG      LYS  16  -1.101   1.208   7.297
  145    HD2  LYS  16           2HD      LYS  16  -1.404   2.886   8.815
  146    HD3  LYS  16           3HD      LYS  16  -0.632   3.781   7.502
  147    HE2  LYS  16           2HE      LYS  16  -2.891   4.564   6.751
  148    HE3  LYS  16           3HE      LYS  16  -3.642   3.612   8.034
  149    HZ1  LYS  16           HZ1      LYS  16  -2.470   4.999   9.660
  150    HZ2  LYS  16           HZ2      LYS  16  -1.763   5.874   8.474
  151    HZ3  LYS  16           HZ3      LYS  16  -3.380   5.937   8.685
  152    H    CYS  17           H        CYS  17  -3.130   2.702   2.371
  153    HA   CYS  17           HA       CYS  17  -0.840   2.569   0.660
  154    HB2  CYS  17           2HB      CYS  17  -3.024   1.352   0.366
  155    HB3  CYS  17           3HB      CYS  17  -3.763   2.889  -0.086
  156    H    LYS  18           H        LYS  18   0.348   4.217   0.075
  157    HA   LYS  18           HA       LYS  18  -0.810   6.765  -0.966
  158    HB2  LYS  18           2HB      LYS  18   1.394   6.515   1.141
  159    HB3  LYS  18           3HB      LYS  18   1.004   8.003   0.275
  160    HG2  LYS  18           2HG      LYS  18  -1.286   7.983   1.240
  161    HG3  LYS  18           3HG      LYS  18  -0.909   6.494   2.105
  162    HD2  LYS  18           2HD      LYS  18  -0.707   8.311   3.657
  163    HD3  LYS  18           3HD      LYS  18   0.880   7.617   3.358
  164    HE2  LYS  18           2HE      LYS  18   1.144   9.986   3.454
  165    HE3  LYS  18           3HE      LYS  18   1.388   9.503   1.778
  166    HZ1  LYS  18           HZ1      LYS  18  -0.905  10.246   1.317
  167    HZ2  LYS  18           HZ2      LYS  18  -1.121  10.666   2.884
  168    HZ3  LYS  18           HZ3      LYS  18  -0.040  11.467   1.965
  169    H    GLY  19           H        GLY  19   0.778   8.033  -2.152
  170    HA2  GLY  19           HA2      GLY  19   2.091   8.134  -4.086
  171    HA3  GLY  19           HA3      GLY  19   3.273   7.862  -2.833
  172    HA   PRO  20           HA       PRO  20   4.632   4.628  -5.539
  173    HB2  PRO  20           2HB      PRO  20   6.437   3.285  -3.984
  174    HB3  PRO  20           3HB      PRO  20   6.682   4.980  -4.504
  175    HG2  PRO  20           2HG      PRO  20   5.502   4.001  -1.877
  176    HG3  PRO  20           3HG      PRO  20   6.854   5.159  -2.111
  177    HD2  PRO  20           2HD      PRO  20   4.314   6.021  -1.719
  178    HD3  PRO  20           3HD      PRO  20   5.391   6.850  -2.883
  179    H    LEU  21           H        LEU  21   2.535   3.840  -3.007
  180    HA   LEU  21           HA       LEU  21   2.185   1.085  -4.134
  181    HB2  LEU  21           2HB      LEU  21   2.424   1.761  -1.492
  182    HB3  LEU  21           3HB      LEU  21   0.708   2.010  -1.676
  183    HG   LEU  21           HG       LEU  21   0.986  -0.161  -0.823
  184   HD11  LEU  21          1HD1      LEU  21   0.150  -1.709  -2.467
  185   HD12  LEU  21          2HD1      LEU  21  -0.643  -0.145  -2.704
  186   HD13  LEU  21          3HD1      LEU  21   0.653  -0.671  -3.805
  187   HD21  LEU  21          3HD2      LEU  21   2.461  -1.872  -1.738
  188   HD22  LEU  21          1HD2      LEU  21   3.024  -0.752  -3.001
  189   HD23  LEU  21          2HD2      LEU  21   3.377  -0.425  -1.290
  190    H    LYS  22           H        LYS  22   0.518   4.118  -3.325
  191    HA   LYS  22           HA       LYS  22  -2.107   3.506  -4.274
  192    HB2  LYS  22           2HB      LYS  22  -1.487   5.426  -2.849
  193    HB3  LYS  22           3HB      LYS  22  -0.643   6.185  -4.211
  194    HG2  LYS  22           2HG      LYS  22  -2.814   6.343  -5.437
  195    HG3  LYS  22           3HG      LYS  22  -3.623   5.573  -4.072
  196    HD2  LYS  22           2HD      LYS  22  -2.551   7.539  -2.667
  197    HD3  LYS  22           3HD      LYS  22  -2.381   8.324  -4.237
  198    HE2  LYS  22           2HE      LYS  22  -4.926   7.420  -2.820
  199    HE3  LYS  22           3HE      LYS  22  -4.416   9.070  -3.172
  200    HZ1  LYS  22           HZ1      LYS  22  -5.393   7.032  -5.087
  201    HZ2  LYS  22           HZ2      LYS  22  -6.045   8.482  -4.760
  202    HZ3  LYS  22           HZ3      LYS  22  -4.641   8.419  -5.598
  203    H    LEU  23           H        LEU  23   0.662   4.915  -5.999
  204    HA   LEU  23           HA       LEU  23  -0.634   5.157  -8.558
  205    HB2  LEU  23           2HB      LEU  23   1.295   6.436  -7.824
  206    HB3  LEU  23           3HB      LEU  23   2.300   5.002  -7.723
  207    HG   LEU  23           HG       LEU  23   1.041   5.693 -10.389
  208   HD11  LEU  23          1HD1      LEU  23   1.960   7.831  -9.599
  209   HD12  LEU  23          2HD1      LEU  23   3.512   7.049  -9.227
  210   HD13  LEU  23          3HD1      LEU  23   2.948   7.175 -10.910
  211   HD21  LEU  23          3HD2      LEU  23   3.793   4.602  -9.600
  212   HD22  LEU  23          1HD2      LEU  23   2.444   3.618 -10.194
  213   HD23  LEU  23          2HD2      LEU  23   3.187   4.811 -11.256
  214    H    VAL  24           H        VAL  24   1.022   2.454  -7.019
  215    HA   VAL  24           HA       VAL  24   1.430   0.982  -9.523
  216    HB   VAL  24           HB       VAL  24   2.039   0.292  -6.624
  217   HG11  VAL  24          1HG1      VAL  24   3.604  -1.396  -7.538
  218   HG12  VAL  24          2HG1      VAL  24   1.928  -1.786  -7.923
  219   HG13  VAL  24          3HG1      VAL  24   2.980  -1.088  -9.176
  220   HG21  VAL  24          3HG2      VAL  24   3.322   2.226  -7.427
  221   HG22  VAL  24          1HG2      VAL  24   4.373   0.821  -7.288
  222   HG23  VAL  24          2HG2      VAL  24   3.800   1.335  -8.892
  223    H    CYS  25           H        CYS  25  -0.812   0.788  -6.798
  224    HA   CYS  25           HA       CYS  25  -2.001  -1.730  -7.928
  225    HB2  CYS  25           2HB      CYS  25  -0.711  -1.769  -5.730
  226    HB3  CYS  25           3HB      CYS  25  -2.007  -0.786  -5.055
  227    H    LYS  26           H        LYS  26  -2.610   1.499  -7.489
  228    HA   LYS  26           HA       LYS  26  -4.274   2.913  -7.506
  229    HB2  LYS  26           2HB      LYS  26  -5.035   1.240  -9.411
  230    HB3  LYS  26           3HB      LYS  26  -6.425   1.012  -8.346
  231    HG2  LYS  26           2HG      LYS  26  -5.313   3.705  -9.247
  232    HG3  LYS  26           3HG      LYS  26  -6.605   2.860 -10.105
  233    HD2  LYS  26           2HD      LYS  26  -8.158   3.124  -8.293
  234    HD3  LYS  26           3HD      LYS  26  -6.888   3.604  -7.173
  235    HE2  LYS  26           2HE      LYS  26  -6.460   5.604  -8.742
  236    HE3  LYS  26           3HE      LYS  26  -8.051   5.236  -9.425
  237    HZ1  LYS  26           HZ1      LYS  26  -7.473   5.759  -6.544
  238    HZ2  LYS  26           HZ2      LYS  26  -8.182   6.832  -7.571
  239    HZ3  LYS  26           HZ3      LYS  26  -8.965   5.459  -7.160
  240    H    CYS  27           H        CYS  27  -4.533   3.697  -5.676
  241    HA   CYS  27           HA       CYS  27  -6.664   2.668  -3.891
  242    HB2  CYS  27           2HB      CYS  27  -4.080   3.933  -2.926
  243    HB3  CYS  27           3HB      CYS  27  -5.389   3.366  -1.934
  Start of MODEL   10
    1    H1   GLY   1           1H       GLY   1   8.899  -6.891   6.123
    2    H2   GLY   1           2H       GLY   1   9.926  -6.888   4.849
    3    H3   GLY   1           3H       GLY   1   9.810  -5.565   5.810
    4    HA2  GLY   1           HA2      GLY   1   7.546  -5.164   5.121
    5    HA3  GLY   1           HA3      GLY   1   8.654  -5.178   3.736
    6    H    LEU   2           H        LEU   2   6.680  -5.611   2.504
    7    HA   LEU   2           HA       LEU   2   6.109  -8.515   2.262
    8    HB2  LEU   2           2HB      LEU   2   4.092  -6.252   2.446
    9    HB3  LEU   2           3HB      LEU   2   3.687  -7.802   1.724
   10    HG   LEU   2           HG       LEU   2   4.588  -7.443   4.614
   11   HD11  LEU   2          1HD1      LEU   2   2.418  -6.372   4.178
   12   HD12  LEU   2          2HD1      LEU   2   1.816  -7.862   3.420
   13   HD13  LEU   2          3HD1      LEU   2   2.215  -7.835   5.153
   14   HD21  LEU   2          3HD2      LEU   2   5.055  -9.718   3.787
   15   HD22  LEU   2          1HD2      LEU   2   3.669  -9.747   4.879
   16   HD23  LEU   2          2HD2      LEU   2   3.409  -9.837   3.123
   17    HA   PRO   3           HA       PRO   3   6.521  -7.682  -2.176
   18    HB2  PRO   3           2HB      PRO   3   4.324  -9.733  -2.431
   19    HB3  PRO   3           3HB      PRO   3   5.884  -9.638  -3.306
   20    HG2  PRO   3           2HG      PRO   3   5.539 -11.423  -1.293
   21    HG3  PRO   3           3HG      PRO   3   7.072 -10.497  -1.421
   22    HD2  PRO   3           2HD      PRO   3   4.688  -9.931   0.370
   23    HD3  PRO   3           3HD      PRO   3   6.432  -9.959   0.771
   24    H    ARG   4           H        ARG   4   5.380  -6.428  -3.713
   25    HA   ARG   4           HA       ARG   4   3.402  -4.661  -2.794
   26    HB2  ARG   4           2HB      ARG   4   4.214  -5.456  -5.621
   27    HB3  ARG   4           3HB      ARG   4   3.080  -4.148  -5.306
   28    HG2  ARG   4           2HG      ARG   4   5.880  -4.187  -4.104
   29    HG3  ARG   4           3HG      ARG   4   5.514  -3.491  -5.682
   30    HD2  ARG   4           2HD      ARG   4   3.925  -1.898  -4.667
   31    HD3  ARG   4           3HD      ARG   4   4.161  -2.642  -3.089
   32    HE   ARG   4           HE       ARG   4   6.100  -1.472  -2.792
   33   HH11  ARG   4          1HH2      ARG   4   5.460  -1.288  -6.236
   34   HH12  ARG   4          2HH2      ARG   4   6.709  -0.100  -6.485
   35   HH21  ARG   4          1HH1      ARG   4   7.669   0.028  -3.191
   36   HH22  ARG   4          2HH1      ARG   4   7.925   0.612  -4.807
   37    H    LYS   5           H        LYS   5   2.826  -7.631  -4.641
   38    HA   LYS   5           HA       LYS   5  -0.003  -7.250  -4.975
   39    HB2  LYS   5           2HB      LYS   5  -0.067  -9.539  -5.695
   40    HB3  LYS   5           3HB      LYS   5   1.354  -8.748  -6.372
   41    HG2  LYS   5           2HG      LYS   5   2.752  -9.811  -4.550
   42    HG3  LYS   5           3HG      LYS   5   1.314 -10.687  -4.011
   43    HD2  LYS   5           2HD      LYS   5   2.564 -10.905  -6.782
   44    HD3  LYS   5           3HD      LYS   5   2.831 -12.033  -5.446
   45    HE2  LYS   5           2HE      LYS   5   0.396 -12.546  -5.385
   46    HE3  LYS   5           3HE      LYS   5   0.133 -11.452  -6.751
   47    HZ1  LYS   5           HZ1      LYS   5   1.586 -12.881  -8.090
   48    HZ2  LYS   5           HZ2      LYS   5   1.825 -13.895  -6.830
   49    HZ3  LYS   5           HZ3      LYS   5   0.341 -13.750  -7.493
   50    H    ILE   6           H        ILE   6   1.763  -8.290  -2.183
   51    HA   ILE   6           HA       ILE   6  -0.707  -9.265  -0.815
   52    HB   ILE   6           HB       ILE   6   2.176  -9.271   0.162
   53   HG12  ILE   6          2HG1      ILE   6   0.472 -11.486  -1.069
   54   HG13  ILE   6          3HG1      ILE   6   1.937 -10.774  -1.750
   55   HG21  ILE   6          1HG2      ILE   6   0.445  -9.171   1.964
   56   HG22  ILE   6          2HG2      ILE   6  -0.336 -10.606   1.276
   57   HG23  ILE   6          3HG2      ILE   6   1.301 -10.704   1.968
   58   HD11  ILE   6          3HD1      ILE   6   1.779 -12.557   0.696
   59   HD12  ILE   6          1HD1      ILE   6   2.525 -12.900  -0.871
   60   HD13  ILE   6          2HD1      ILE   6   3.242 -11.675   0.193
   61    H    LEU   7           H        LEU   7   1.902  -6.833  -0.447
   62    HA   LEU   7           HA       LEU   7   0.943  -5.427   1.773
   63    HB2  LEU   7           2HB      LEU   7   3.167  -5.184   0.645
   64    HB3  LEU   7           3HB      LEU   7   2.379  -4.404  -0.718
   65    HG   LEU   7           HG       LEU   7   1.714  -2.503   0.713
   66   HD11  LEU   7          1HD1      LEU   7   1.534  -3.580   2.916
   67   HD12  LEU   7          2HD1      LEU   7   3.277  -3.943   2.904
   68   HD13  LEU   7          3HD1      LEU   7   2.705  -2.263   2.978
   69   HD21  LEU   7          3HD2      LEU   7   4.671  -3.203   0.897
   70   HD22  LEU   7          1HD2      LEU   7   3.856  -2.463  -0.498
   71   HD23  LEU   7          2HD2      LEU   7   3.966  -1.575   1.029
   72    H    CYS   8           H        CYS   8  -0.086  -5.180  -1.610
   73    HA   CYS   8           HA       CYS   8  -1.647  -2.819  -1.463
   74    HB2  CYS   8           2HB      CYS   8  -0.980  -3.852  -3.539
   75    HB3  CYS   8           3HB      CYS   8  -1.844  -5.340  -3.160
   76    H    ALA   9           H        ALA   9  -2.500  -6.165  -0.497
   77    HA   ALA   9           HA       ALA   9  -5.341  -5.590  -0.171
   78    HB1  ALA   9           3HB      ALA   9  -4.485  -7.855  -0.676
   79    HB2  ALA   9           1HB      ALA   9  -3.612  -7.876   0.875
   80    HB3  ALA   9           2HB      ALA   9  -5.385  -7.823   0.856
   81    H    ILE  10           H        ILE  10  -2.472  -5.602   1.922
   82    HA   ILE  10           HA       ILE  10  -3.838  -5.043   4.408
   83    HB   ILE  10           HB       ILE  10  -0.987  -4.323   3.614
   84   HG12  ILE  10          2HG1      ILE  10  -1.246  -6.690   3.180
   85   HG13  ILE  10          3HG1      ILE  10  -0.241  -6.423   4.573
   86   HG21  ILE  10          1HG2      ILE  10  -1.677  -3.200   5.657
   87   HG22  ILE  10          2HG2      ILE  10  -2.275  -4.723   6.342
   88   HG23  ILE  10          3HG2      ILE  10  -0.538  -4.493   6.048
   89   HD11  ILE  10          3HD1      ILE  10  -3.167  -7.293   4.655
   90   HD12  ILE  10          1HD1      ILE  10  -1.751  -8.326   4.909
   91   HD13  ILE  10          2HD1      ILE  10  -2.123  -7.050   6.078
   92    H    ALA  11           H        ALA  11  -2.196  -2.951   2.010
   93    HA   ALA  11           HA       ALA  11  -2.377  -0.522   3.306
   94    HB1  ALA  11           3HB      ALA  11  -2.559  -1.017   0.292
   95    HB2  ALA  11           1HB      ALA  11  -1.911   0.419   1.110
   96    HB3  ALA  11           2HB      ALA  11  -1.069  -1.116   1.262
   97    H    LYS  12           H        LYS  12  -4.753  -1.736   0.900
   98    HA   LYS  12           HA       LYS  12  -6.595   0.454   1.349
   99    HB2  LYS  12           2HB      LYS  12  -6.941  -2.171  -0.155
  100    HB3  LYS  12           3HB      LYS  12  -8.083  -0.814  -0.177
  101    HG2  LYS  12           2HG      LYS  12  -6.192   0.680  -0.948
  102    HG3  LYS  12           3HG      LYS  12  -5.189  -0.758  -1.134
  103    HD2  LYS  12           2HD      LYS  12  -7.742  -0.104  -2.656
  104    HD3  LYS  12           3HD      LYS  12  -6.079  -0.025  -3.255
  105    HE2  LYS  12           2HE      LYS  12  -5.895  -2.525  -2.777
  106    HE3  LYS  12           3HE      LYS  12  -7.641  -2.522  -2.489
  107    HZ1  LYS  12           HZ1      LYS  12  -6.314  -1.672  -5.023
  108    HZ2  LYS  12           HZ2      LYS  12  -7.119  -3.082  -4.805
  109    HZ3  LYS  12           HZ3      LYS  12  -7.931  -1.664  -4.766
  110    H    LYS  13           H        LYS  13  -6.367  -2.717   2.900
  111    HA   LYS  13           HA       LYS  13  -8.985  -2.462   4.217
  112    HB2  LYS  13           2HB      LYS  13  -6.599  -4.296   4.638
  113    HB3  LYS  13           3HB      LYS  13  -8.000  -4.296   5.715
  114    HG2  LYS  13           2HG      LYS  13  -9.521  -4.783   3.864
  115    HG3  LYS  13           3HG      LYS  13  -8.179  -4.746   2.708
  116    HD2  LYS  13           2HD      LYS  13  -7.141  -6.699   3.798
  117    HD3  LYS  13           3HD      LYS  13  -8.355  -6.657   5.080
  118    HE2  LYS  13           2HE      LYS  13  -8.950  -8.420   3.567
  119    HE3  LYS  13           3HE      LYS  13 -10.147  -7.131   3.437
  120    HZ1  LYS  13           HZ1      LYS  13  -7.910  -7.577   1.530
  121    HZ2  LYS  13           HZ2      LYS  13  -9.469  -7.966   1.255
  122    HZ3  LYS  13           HZ3      LYS  13  -9.039  -6.399   1.391
  123    H    LYS  14           H        LYS  14  -5.650  -1.655   5.162
  124    HA   LYS  14           HA       LYS  14  -6.477  -0.580   7.785
  125    HB2  LYS  14           2HB      LYS  14  -3.868  -0.829   6.265
  126    HB3  LYS  14           3HB      LYS  14  -3.984   0.292   7.603
  127    HG2  LYS  14           2HG      LYS  14  -3.064  -1.840   8.320
  128    HG3  LYS  14           3HG      LYS  14  -4.545  -1.417   9.178
  129    HD2  LYS  14           2HD      LYS  14  -5.827  -3.049   7.867
  130    HD3  LYS  14           3HD      LYS  14  -4.387  -3.433   6.894
  131    HE2  LYS  14           2HE      LYS  14  -3.213  -4.223   8.911
  132    HE3  LYS  14           3HE      LYS  14  -4.583  -3.750   9.923
  133    HZ1  LYS  14           HZ1      LYS  14  -4.685  -5.850   7.819
  134    HZ2  LYS  14           HZ2      LYS  14  -4.628  -6.123   9.425
  135    HZ3  LYS  14           HZ3      LYS  14  -5.939  -5.409   8.774
  136    H    GLY  15           H        GLY  15  -6.425   0.703   4.602
  137    HA2  GLY  15           HA2      GLY  15  -7.111   2.774   3.830
  138    HA3  GLY  15           HA3      GLY  15  -7.359   3.323   5.492
  139    H    LYS  16           H        LYS  16  -4.280   1.980   4.413
  140    HA   LYS  16           HA       LYS  16  -2.978   4.683   4.485
  141    HB2  LYS  16           2HB      LYS  16  -2.741   3.461   6.658
  142    HB3  LYS  16           3HB      LYS  16  -1.914   2.160   5.793
  143    HG2  LYS  16           2HG      LYS  16  -0.177   3.851   5.041
  144    HG3  LYS  16           3HG      LYS  16  -1.041   5.087   5.960
  145    HD2  LYS  16           2HD      LYS  16   0.840   4.351   7.259
  146    HD3  LYS  16           3HD      LYS  16  -0.632   3.768   8.056
  147    HE2  LYS  16           2HE      LYS  16  -0.299   1.528   7.030
  148    HE3  LYS  16           3HE      LYS  16   1.128   2.123   6.174
  149    HZ1  LYS  16           HZ1      LYS  16   1.740   0.945   8.213
  150    HZ2  LYS  16           HZ2      LYS  16   2.184   2.510   8.341
  151    HZ3  LYS  16           HZ3      LYS  16   0.862   1.966   9.134
  152    H    CYS  17           H        CYS  17  -2.823   4.830   2.330
  153    HA   CYS  17           HA       CYS  17  -0.770   3.212   0.946
  154    HB2  CYS  17           2HB      CYS  17  -3.042   2.129   0.590
  155    HB3  CYS  17           3HB      CYS  17  -3.581   3.627  -0.129
  156    H    LYS  18           H        LYS  18   0.444   4.512  -0.423
  157    HA   LYS  18           HA       LYS  18  -0.527   7.074  -1.474
  158    HB2  LYS  18           2HB      LYS  18   1.055   8.479  -0.214
  159    HB3  LYS  18           3HB      LYS  18  -0.076   7.684   0.868
  160    HG2  LYS  18           2HG      LYS  18   1.649   6.022   1.506
  161    HG3  LYS  18           3HG      LYS  18   2.775   6.723   0.339
  162    HD2  LYS  18           2HD      LYS  18   3.355   7.495   2.538
  163    HD3  LYS  18           3HD      LYS  18   2.758   8.864   1.591
  164    HE2  LYS  18           2HE      LYS  18   0.541   8.665   2.710
  165    HE3  LYS  18           3HE      LYS  18   1.126   7.270   3.627
  166    HZ1  LYS  18           HZ1      LYS  18   2.241  10.021   3.813
  167    HZ2  LYS  18           HZ2      LYS  18   1.278   9.318   4.927
  168    HZ3  LYS  18           HZ3      LYS  18   2.778   8.734   4.665
  169    H    GLY  19           H        GLY  19   1.233   8.354  -2.504
  170    HA2  GLY  19           HA2      GLY  19   2.839   8.542  -4.147
  171    HA3  GLY  19           HA3      GLY  19   3.800   7.592  -3.034
  172    HA   PRO  20           HA       PRO  20   3.841   4.970  -6.766
  173    HB2  PRO  20           2HB      PRO  20   5.582   3.030  -5.918
  174    HB3  PRO  20           3HB      PRO  20   6.100   4.660  -6.444
  175    HG2  PRO  20           2HG      PRO  20   5.648   3.676  -3.610
  176    HG3  PRO  20           3HG      PRO  20   7.048   4.589  -4.258
  177    HD2  PRO  20           2HD      PRO  20   5.009   5.817  -2.946
  178    HD3  PRO  20           3HD      PRO  20   5.817   6.603  -4.337
  179    H    LEU  21           H        LEU  21   3.288   3.661  -3.430
  180    HA   LEU  21           HA       LEU  21   2.175   1.187  -4.333
  181    HB2  LEU  21           2HB      LEU  21   3.033   1.661  -2.022
  182    HB3  LEU  21           3HB      LEU  21   1.623   2.684  -1.742
  183    HG   LEU  21           HG       LEU  21   0.133   0.691  -2.083
  184   HD11  LEU  21          1HD1      LEU  21   2.764  -0.833  -2.193
  185   HD12  LEU  21          2HD1      LEU  21   1.159  -1.571  -1.976
  186   HD13  LEU  21          3HD1      LEU  21   1.538  -0.740  -3.485
  187   HD21  LEU  21          3HD2      LEU  21   2.311   0.369   0.015
  188   HD22  LEU  21          1HD2      LEU  21   0.839   1.360   0.163
  189   HD23  LEU  21          2HD2      LEU  21   0.710  -0.400   0.039
  190    H    LYS  22           H        LYS  22   0.682   4.332  -3.698
  191    HA   LYS  22           HA       LYS  22  -2.074   3.574  -4.101
  192    HB2  LYS  22           2HB      LYS  22  -1.525   5.635  -3.014
  193    HB3  LYS  22           3HB      LYS  22  -0.616   6.223  -4.415
  194    HG2  LYS  22           2HG      LYS  22  -2.659   6.426  -5.730
  195    HG3  LYS  22           3HG      LYS  22  -3.615   5.683  -4.436
  196    HD2  LYS  22           2HD      LYS  22  -3.087   7.572  -2.935
  197    HD3  LYS  22           3HD      LYS  22  -2.028   8.267  -4.172
  198    HE2  LYS  22           2HE      LYS  22  -3.994   9.522  -4.352
  199    HE3  LYS  22           3HE      LYS  22  -4.057   8.397  -5.710
  200    HZ1  LYS  22           HZ1      LYS  22  -5.509   8.066  -3.134
  201    HZ2  LYS  22           HZ2      LYS  22  -6.184   8.524  -4.545
  202    HZ3  LYS  22           HZ3      LYS  22  -5.602   7.011  -4.382
  203    H    LEU  23           H        LEU  23   0.393   4.636  -6.413
  204    HA   LEU  23           HA       LEU  23  -1.340   4.453  -8.720
  205    HB2  LEU  23           2HB      LEU  23   0.727   5.799  -8.634
  206    HB3  LEU  23           3HB      LEU  23   1.692   4.334  -8.468
  207    HG   LEU  23           HG       LEU  23   0.999   3.596 -10.733
  208   HD11  LEU  23          1HD1      LEU  23  -0.410   6.302 -10.863
  209   HD12  LEU  23          2HD1      LEU  23  -0.104   5.233 -12.251
  210   HD13  LEU  23          3HD1      LEU  23  -1.185   4.703 -10.962
  211   HD21  LEU  23          3HD2      LEU  23   3.051   4.924 -10.409
  212   HD22  LEU  23          1HD2      LEU  23   2.298   5.269 -11.974
  213   HD23  LEU  23          2HD2      LEU  23   2.124   6.425 -10.634
  214    H    VAL  24           H        VAL  24   0.884   2.118  -7.201
  215    HA   VAL  24           HA       VAL  24   0.622   0.042  -9.184
  216    HB   VAL  24           HB       VAL  24   1.612   0.085  -6.315
  217   HG11  VAL  24          1HG1      VAL  24   2.805  -2.042  -6.820
  218   HG12  VAL  24          2HG1      VAL  24   1.056  -2.246  -6.739
  219   HG13  VAL  24          3HG1      VAL  24   1.867  -2.188  -8.323
  220   HG21  VAL  24          3HG2      VAL  24   2.872   1.388  -8.125
  221   HG22  VAL  24          1HG2      VAL  24   3.800   0.180  -7.248
  222   HG23  VAL  24          2HG2      VAL  24   3.206  -0.166  -8.896
  223    H    CYS  25           H        CYS  25  -1.039   0.613  -6.103
  224    HA   CYS  25           HA       CYS  25  -2.561  -1.920  -6.283
  225    HB2  CYS  25           2HB      CYS  25  -1.259  -1.260  -4.287
  226    HB3  CYS  25           3HB      CYS  25  -2.223   0.198  -4.136
  227    H    LYS  26           H        LYS  26  -2.994   1.335  -7.063
  228    HA   LYS  26           HA       LYS  26  -4.659   2.741  -7.500
  229    HB2  LYS  26           2HB      LYS  26  -5.154   0.484  -8.959
  230    HB3  LYS  26           3HB      LYS  26  -6.721   0.708  -8.195
  231    HG2  LYS  26           2HG      LYS  26  -5.124   2.841  -9.683
  232    HG3  LYS  26           3HG      LYS  26  -6.415   1.873 -10.408
  233    HD2  LYS  26           2HD      LYS  26  -8.076   2.835  -8.866
  234    HD3  LYS  26           3HD      LYS  26  -6.813   3.787  -8.054
  235    HE2  LYS  26           2HE      LYS  26  -6.309   4.975 -10.135
  236    HE3  LYS  26           3HE      LYS  26  -7.509   4.011 -11.010
  237    HZ1  LYS  26           HZ1      LYS  26  -8.124   5.871  -8.770
  238    HZ2  LYS  26           HZ2      LYS  26  -8.417   6.165 -10.347
  239    HZ3  LYS  26           HZ3      LYS  26  -9.231   4.980  -9.580
  240    H    CYS  27           H        CYS  27  -4.431   3.182  -5.272
  241    HA   CYS  27           HA       CYS  27  -6.592   2.375  -3.427
  242    HB2  CYS  27           2HB      CYS  27  -4.142   4.118  -2.993
  243    HB3  CYS  27           3HB      CYS  27  -5.259   3.573  -1.757
  Start of MODEL   11
    1    H1   GLY   1           1H       GLY   1  10.807  -7.036   3.607
    2    H2   GLY   1           2H       GLY   1  10.835  -6.404   5.119
    3    H3   GLY   1           3H       GLY   1  10.162  -7.875   4.855
    4    HA2  GLY   1           HA2      GLY   1   8.437  -6.227   5.163
    5    HA3  GLY   1           HA3      GLY   1   9.140  -5.308   3.820
    6    H    LEU   2           H        LEU   2   6.504  -6.000   3.705
    7    HA   LEU   2           HA       LEU   2   6.048  -8.479   2.254
    8    HB2  LEU   2           2HB      LEU   2   4.314  -6.012   2.649
    9    HB3  LEU   2           3HB      LEU   2   3.761  -7.510   1.911
   10    HG   LEU   2           HG       LEU   2   4.724  -7.233   4.795
   11   HD11  LEU   2          1HD1      LEU   2   2.598  -6.061   4.382
   12   HD12  LEU   2          2HD1      LEU   2   1.918  -7.533   3.654
   13   HD13  LEU   2          3HD1      LEU   2   2.353  -7.505   5.376
   14   HD21  LEU   2          3HD2      LEU   2   5.087  -9.520   3.982
   15   HD22  LEU   2          1HD2      LEU   2   3.706  -9.487   5.081
   16   HD23  LEU   2          2HD2      LEU   2   3.433  -9.575   3.328
   17    HA   PRO   3           HA       PRO   3   6.853  -6.780  -1.858
   18    HB2  PRO   3           2HB      PRO   3   5.772  -8.680  -3.449
   19    HB3  PRO   3           3HB      PRO   3   7.209  -9.027  -2.434
   20    HG2  PRO   3           2HG      PRO   3   4.301  -9.590  -1.794
   21    HG3  PRO   3           3HG      PRO   3   5.674 -10.742  -1.714
   22    HD2  PRO   3           2HD      PRO   3   4.742  -9.382   0.476
   23    HD3  PRO   3           3HD      PRO   3   6.473  -9.768   0.269
   24    H    ARG   4           H        ARG   4   5.665  -5.790  -3.600
   25    HA   ARG   4           HA       ARG   4   3.563  -4.180  -2.728
   26    HB2  ARG   4           2HB      ARG   4   4.447  -4.884  -5.555
   27    HB3  ARG   4           3HB      ARG   4   3.260  -3.623  -5.200
   28    HG2  ARG   4           2HG      ARG   4   4.859  -2.382  -3.851
   29    HG3  ARG   4           3HG      ARG   4   6.092  -3.631  -4.065
   30    HD2  ARG   4           2HD      ARG   4   4.868  -1.951  -6.294
   31    HD3  ARG   4           3HD      ARG   4   6.421  -1.639  -5.540
   32    HE   ARG   4           HE       ARG   4   5.777  -3.704  -7.520
   33   HH11  ARG   4          1HH1      ARG   4   8.198  -2.739  -5.172
   34   HH12  ARG   4          2HH1      ARG   4   9.436  -3.705  -5.927
   35   HH21  ARG   4          1HH2      ARG   4   7.401  -4.910  -8.420
   36   HH22  ARG   4          2HH2      ARG   4   8.990  -4.896  -7.715
   37    H    LYS   5           H        LYS   5   3.138  -7.193  -4.593
   38    HA   LYS   5           HA       LYS   5   0.351  -6.822  -5.090
   39    HB2  LYS   5           2HB      LYS   5   2.006  -8.336  -6.277
   40    HB3  LYS   5           3HB      LYS   5   1.840  -9.489  -4.956
   41    HG2  LYS   5           2HG      LYS   5  -0.547  -8.406  -6.505
   42    HG3  LYS   5           3HG      LYS   5   0.409  -9.738  -7.134
   43    HD2  LYS   5           2HD      LYS   5  -0.468 -11.280  -5.709
   44    HD3  LYS   5           3HD      LYS   5  -0.478 -10.188  -4.339
   45    HE2  LYS   5           2HE      LYS   5  -2.745 -10.652  -4.789
   46    HE3  LYS   5           3HE      LYS   5  -2.434  -8.987  -5.294
   47    HZ1  LYS   5           HZ1      LYS   5  -2.566 -11.338  -7.122
   48    HZ2  LYS   5           HZ2      LYS   5  -3.734 -10.213  -6.959
   49    HZ3  LYS   5           HZ3      LYS   5  -2.294  -9.800  -7.604
   50    H    ILE   6           H        ILE   6   2.011  -8.457  -2.387
   51    HA   ILE   6           HA       ILE   6  -0.504  -9.198  -1.057
   52    HB   ILE   6           HB       ILE   6   2.425  -9.332  -0.270
   53   HG12  ILE   6          2HG1      ILE   6   1.940 -11.754  -0.042
   54   HG13  ILE   6          3HG1      ILE   6   0.280 -11.493  -0.570
   55   HG21  ILE   6          1HG2      ILE   6   0.014  -9.984   1.481
   56   HG22  ILE   6          2HG2      ILE   6   1.686 -10.471   1.833
   57   HG23  ILE   6          3HG2      ILE   6   1.269  -8.764   1.799
   58   HD11  ILE   6          3HD1      ILE   6   1.092 -10.929  -2.828
   59   HD12  ILE   6          1HD1      ILE   6   2.779 -11.060  -2.263
   60   HD13  ILE   6          2HD1      ILE   6   1.735 -12.485  -2.302
   61    H    LEU   7           H        LEU   7   2.007  -6.660  -0.621
   62    HA   LEU   7           HA       LEU   7   0.915  -5.423   1.658
   63    HB2  LEU   7           2HB      LEU   7   3.184  -5.062   0.719
   64    HB3  LEU   7           3HB      LEU   7   2.481  -4.243  -0.673
   65    HG   LEU   7           HG       LEU   7   1.653  -2.427   0.788
   66   HD11  LEU   7          1HD1      LEU   7   2.471  -2.249   3.119
   67   HD12  LEU   7          2HD1      LEU   7   1.371  -3.614   2.928
   68   HD13  LEU   7          3HD1      LEU   7   3.127  -3.896   3.017
   69   HD21  LEU   7          3HD2      LEU   7   3.850  -1.447   1.295
   70   HD22  LEU   7          1HD2      LEU   7   4.613  -3.046   1.129
   71   HD23  LEU   7          2HD2      LEU   7   3.862  -2.259  -0.278
   72    H    CYS   8           H        CYS   8   0.053  -4.952  -1.763
   73    HA   CYS   8           HA       CYS   8  -1.653  -2.714  -1.535
   74    HB2  CYS   8           2HB      CYS   8  -0.864  -3.583  -3.636
   75    HB3  CYS   8           3HB      CYS   8  -1.622  -5.147  -3.359
   76    H    ALA   9           H        ALA   9  -2.341  -6.153  -0.783
   77    HA   ALA   9           HA       ALA   9  -5.220  -5.753  -0.543
   78    HB1  ALA   9           3HB      ALA   9  -3.420  -8.012   0.437
   79    HB2  ALA   9           1HB      ALA   9  -5.192  -8.047   0.306
   80    HB3  ALA   9           2HB      ALA   9  -4.197  -7.924  -1.162
   81    H    ILE  10           H        ILE  10  -2.435  -5.693   1.657
   82    HA   ILE  10           HA       ILE  10  -3.949  -5.351   4.110
   83    HB   ILE  10           HB       ILE  10  -1.102  -4.474   3.483
   84   HG12  ILE  10          2HG1      ILE  10  -1.254  -6.836   2.951
   85   HG13  ILE  10          3HG1      ILE  10  -0.307  -6.577   4.383
   86   HG21  ILE  10          1HG2      ILE  10  -2.493  -5.035   6.131
   87   HG22  ILE  10          2HG2      ILE  10  -0.755  -4.726   5.929
   88   HG23  ILE  10          3HG2      ILE  10  -1.925  -3.462   5.535
   89   HD11  ILE  10          3HD1      ILE  10  -3.195  -7.567   4.331
   90   HD12  ILE  10          1HD1      ILE  10  -1.748  -8.551   4.602
   91   HD13  ILE  10          2HD1      ILE  10  -2.214  -7.334   5.801
   92    H    ALA  11           H        ALA  11  -2.347  -3.075   1.856
   93    HA   ALA  11           HA       ALA  11  -2.702  -0.717   3.259
   94    HB1  ALA  11           3HB      ALA  11  -2.203   0.353   1.140
   95    HB2  ALA  11           1HB      ALA  11  -1.302  -1.155   1.229
   96    HB3  ALA  11           2HB      ALA  11  -2.764  -1.059   0.219
   97    H    LYS  12           H        LYS  12  -4.900  -1.906   0.678
   98    HA   LYS  12           HA       LYS  12  -6.923   0.096   1.195
   99    HB2  LYS  12           2HB      LYS  12  -7.041  -2.482  -0.426
  100    HB3  LYS  12           3HB      LYS  12  -8.271  -1.201  -0.430
  101    HG2  LYS  12           2HG      LYS  12  -6.474   0.441  -1.096
  102    HG3  LYS  12           3HG      LYS  12  -5.360  -0.913  -1.287
  103    HD2  LYS  12           2HD      LYS  12  -7.892  -0.388  -2.890
  104    HD3  LYS  12           3HD      LYS  12  -6.213  -0.190  -3.414
  105    HE2  LYS  12           2HE      LYS  12  -5.893  -2.686  -3.000
  106    HE3  LYS  12           3HE      LYS  12  -7.645  -2.802  -2.797
  107    HZ1  LYS  12           HZ1      LYS  12  -7.895  -1.904  -5.054
  108    HZ2  LYS  12           HZ2      LYS  12  -6.276  -1.759  -5.234
  109    HZ3  LYS  12           HZ3      LYS  12  -6.960  -3.243  -5.105
  110    H    LYS  13           H        LYS  13  -6.449  -3.097   2.595
  111    HA   LYS  13           HA       LYS  13  -9.096  -3.249   3.813
  112    HB2  LYS  13           2HB      LYS  13  -7.747  -5.221   3.329
  113    HB3  LYS  13           3HB      LYS  13  -6.495  -4.687   4.464
  114    HG2  LYS  13           2HG      LYS  13  -8.002  -4.988   6.351
  115    HG3  LYS  13           3HG      LYS  13  -9.380  -5.239   5.269
  116    HD2  LYS  13           2HD      LYS  13  -8.645  -7.362   6.189
  117    HD3  LYS  13           3HD      LYS  13  -8.390  -7.333   4.439
  118    HE2  LYS  13           2HE      LYS  13  -5.985  -6.859   4.778
  119    HE3  LYS  13           3HE      LYS  13  -6.230  -6.817   6.533
  120    HZ1  LYS  13           HZ1      LYS  13  -5.409  -8.990   5.809
  121    HZ2  LYS  13           HZ2      LYS  13  -6.909  -9.160   6.422
  122    HZ3  LYS  13           HZ3      LYS  13  -6.680  -9.197   4.805
  123    H    LYS  14           H        LYS  14  -5.928  -2.094   4.973
  124    HA   LYS  14           HA       LYS  14  -6.998  -1.166   7.562
  125    HB2  LYS  14           2HB      LYS  14  -4.310  -1.100   6.161
  126    HB3  LYS  14           3HB      LYS  14  -4.610   0.002   7.488
  127    HG2  LYS  14           2HG      LYS  14  -3.491  -1.984   8.282
  128    HG3  LYS  14           3HG      LYS  14  -5.075  -1.781   9.033
  129    HD2  LYS  14           2HD      LYS  14  -6.017  -3.578   7.642
  130    HD3  LYS  14           3HD      LYS  14  -4.514  -3.677   6.715
  131    HE2  LYS  14           2HE      LYS  14  -4.532  -5.505   8.267
  132    HE3  LYS  14           3HE      LYS  14  -3.287  -4.360   8.768
  133    HZ1  LYS  14           HZ1      LYS  14  -6.002  -4.560   9.979
  134    HZ2  LYS  14           HZ2      LYS  14  -4.632  -5.137  10.648
  135    HZ3  LYS  14           HZ3      LYS  14  -4.828  -3.531  10.468
  136    H    GLY  15           H        GLY  15  -6.809   0.209   4.394
  137    HA2  GLY  15           HA2      GLY  15  -7.610   2.239   3.604
  138    HA3  GLY  15           HA3      GLY  15  -8.036   2.733   5.247
  139    H    LYS  16           H        LYS  16  -4.804   1.601   4.387
  140    HA   LYS  16           HA       LYS  16  -3.668   4.359   4.687
  141    HB2  LYS  16           2HB      LYS  16  -3.541   3.033   6.811
  142    HB3  LYS  16           3HB      LYS  16  -2.623   1.801   5.954
  143    HG2  LYS  16           2HG      LYS  16  -1.106   3.163   7.216
  144    HG3  LYS  16           3HG      LYS  16  -0.819   3.485   5.505
  145    HD2  LYS  16           2HD      LYS  16  -2.077   5.610   5.671
  146    HD3  LYS  16           3HD      LYS  16  -2.497   5.242   7.359
  147    HE2  LYS  16           2HE      LYS  16  -0.071   5.226   7.936
  148    HE3  LYS  16           3HE      LYS  16   0.327   5.626   6.260
  149    HZ1  LYS  16           HZ1      LYS  16  -1.272   7.341   8.091
  150    HZ2  LYS  16           HZ2      LYS  16   0.276   7.612   7.660
  151    HZ3  LYS  16           HZ3      LYS  16  -0.908   7.717   6.542
  152    H    CYS  17           H        CYS  17  -3.370   4.613   2.541
  153    HA   CYS  17           HA       CYS  17  -1.185   3.092   1.222
  154    HB2  CYS  17           2HB      CYS  17  -3.407   2.040   0.682
  155    HB3  CYS  17           3HB      CYS  17  -3.948   3.572   0.048
  156    H    LYS  18           H        LYS  18   0.142   4.453   0.051
  157    HA   LYS  18           HA       LYS  18  -0.700   7.105  -0.882
  158    HB2  LYS  18           2HB      LYS  18   0.900   8.333   0.625
  159    HB3  LYS  18           3HB      LYS  18  -0.502   7.666   1.416
  160    HG2  LYS  18           2HG      LYS  18   1.373   7.419   2.846
  161    HG3  LYS  18           3HG      LYS  18   0.843   5.816   2.357
  162    HD2  LYS  18           2HD      LYS  18   2.744   5.599   0.829
  163    HD3  LYS  18           3HD      LYS  18   3.204   7.297   1.110
  164    HE2  LYS  18           2HE      LYS  18   3.571   6.770   3.516
  165    HE3  LYS  18           3HE      LYS  18   3.123   5.087   3.217
  166    HZ1  LYS  18           HZ1      LYS  18   5.043   4.916   1.717
  167    HZ2  LYS  18           HZ2      LYS  18   5.453   6.476   1.996
  168    HZ3  LYS  18           HZ3      LYS  18   5.533   5.382   3.201
  169    H    GLY  19           H        GLY  19   1.173   8.440  -1.635
  170    HA2  GLY  19           HA2      GLY  19   2.952   8.739  -3.070
  171    HA3  GLY  19           HA3      GLY  19   3.756   7.557  -2.056
  172    HA   PRO  20           HA       PRO  20   3.760   5.431  -6.110
  173    HB2  PRO  20           2HB      PRO  20   5.381   3.318  -5.487
  174    HB3  PRO  20           3HB      PRO  20   5.997   4.972  -5.786
  175    HG2  PRO  20           2HG      PRO  20   5.427   3.653  -3.114
  176    HG3  PRO  20           3HG      PRO  20   6.887   4.565  -3.612
  177    HD2  PRO  20           2HD      PRO  20   4.866   5.712  -2.185
  178    HD3  PRO  20           3HD      PRO  20   5.774   6.635  -3.422
  179    H    LEU  21           H        LEU  21   3.065   3.823  -2.952
  180    HA   LEU  21           HA       LEU  21   1.938   1.462  -4.081
  181    HB2  LEU  21           2HB      LEU  21   2.781   1.754  -1.740
  182    HB3  LEU  21           3HB      LEU  21   1.376   2.752  -1.383
  183    HG   LEU  21           HG       LEU  21  -0.119   0.806  -1.828
  184   HD11  LEU  21          1HD1      LEU  21   0.874  -1.469  -1.948
  185   HD12  LEU  21          2HD1      LEU  21   1.221  -0.517  -3.392
  186   HD13  LEU  21          3HD1      LEU  21   2.484  -0.741  -2.156
  187   HD21  LEU  21          3HD2      LEU  21   2.130   0.305   0.161
  188   HD22  LEU  21          1HD2      LEU  21   0.668   1.279   0.444
  189   HD23  LEU  21          2HD2      LEU  21   0.533  -0.465   0.182
  190    H    LYS  22           H        LYS  22   0.479   4.540  -3.215
  191    HA   LYS  22           HA       LYS  22  -2.304   4.040  -3.683
  192    HB2  LYS  22           2HB      LYS  22  -1.632   6.038  -2.618
  193    HB3  LYS  22           3HB      LYS  22  -0.486   6.450  -3.888
  194    HG2  LYS  22           2HG      LYS  22  -2.238   7.991  -4.019
  195    HG3  LYS  22           3HG      LYS  22  -2.378   6.953  -5.432
  196    HD2  LYS  22           2HD      LYS  22  -4.238   5.722  -4.351
  197    HD3  LYS  22           3HD      LYS  22  -4.030   6.703  -2.875
  198    HE2  LYS  22           2HE      LYS  22  -4.454   8.767  -4.269
  199    HE3  LYS  22           3HE      LYS  22  -4.782   7.719  -5.656
  200    HZ1  LYS  22           HZ1      LYS  22  -6.847   8.310  -4.584
  201    HZ2  LYS  22           HZ2      LYS  22  -6.597   6.708  -4.338
  202    HZ3  LYS  22           HZ3      LYS  22  -6.336   7.777  -3.126
  203    H    LEU  23           H        LEU  23   0.233   4.970  -5.965
  204    HA   LEU  23           HA       LEU  23  -1.492   4.895  -8.300
  205    HB2  LEU  23           2HB      LEU  23   0.504   6.293  -8.056
  206    HB3  LEU  23           3HB      LEU  23   1.550   4.883  -8.051
  207    HG   LEU  23           HG       LEU  23  -0.293   5.442 -10.407
  208   HD11  LEU  23          1HD1      LEU  23   1.553   6.696 -11.461
  209   HD12  LEU  23          2HD1      LEU  23   0.984   7.507  -9.998
  210   HD13  LEU  23          3HD1      LEU  23   2.500   6.579  -9.959
  211   HD21  LEU  23          3HD2      LEU  23   1.549   4.336 -11.686
  212   HD22  LEU  23          1HD2      LEU  23   2.427   4.060 -10.167
  213   HD23  LEU  23          2HD2      LEU  23   0.875   3.255 -10.475
  214    H    VAL  24           H        VAL  24   0.882   2.571  -6.958
  215    HA   VAL  24           HA       VAL  24   0.680   0.582  -8.995
  216    HB   VAL  24           HB       VAL  24   1.452   0.433  -6.058
  217   HG11  VAL  24          1HG1      VAL  24   0.881  -1.857  -6.706
  218   HG12  VAL  24          2HG1      VAL  24   1.867  -1.710  -8.181
  219   HG13  VAL  24          3HG1      VAL  24   2.625  -1.681  -6.572
  220   HG21  VAL  24          3HG2      VAL  24   3.213   0.363  -8.543
  221   HG22  VAL  24          1HG2      VAL  24   2.893   1.827  -7.607
  222   HG23  VAL  24          2HG2      VAL  24   3.727   0.480  -6.839
  223    H    CYS  25           H        CYS  25  -1.064   0.878  -5.910
  224    HA   CYS  25           HA       CYS  25  -2.557  -1.613  -6.348
  225    HB2  CYS  25           2HB      CYS  25  -1.336  -0.999  -4.280
  226    HB3  CYS  25           3HB      CYS  25  -2.400   0.378  -4.069
  227    H    LYS  26           H        LYS  26  -3.125   1.667  -6.973
  228    HA   LYS  26           HA       LYS  26  -4.908   3.021  -7.348
  229    HB2  LYS  26           2HB      LYS  26  -6.021   0.418  -8.432
  230    HB3  LYS  26           3HB      LYS  26  -6.845   1.969  -8.638
  231    HG2  LYS  26           2HG      LYS  26  -3.930   1.635  -9.396
  232    HG3  LYS  26           3HG      LYS  26  -5.223   1.169 -10.511
  233    HD2  LYS  26           2HD      LYS  26  -6.028   3.410 -10.710
  234    HD3  LYS  26           3HD      LYS  26  -5.153   3.951  -9.281
  235    HE2  LYS  26           2HE      LYS  26  -4.014   4.812 -11.194
  236    HE3  LYS  26           3HE      LYS  26  -2.999   3.608 -10.398
  237    HZ1  LYS  26           HZ1      LYS  26  -3.020   3.335 -12.826
  238    HZ2  LYS  26           HZ2      LYS  26  -3.652   2.010 -12.118
  239    HZ3  LYS  26           HZ3      LYS  26  -4.634   3.106 -12.836
  240    H    CYS  27           H        CYS  27  -4.670   3.021  -5.088
  241    HA   CYS  27           HA       CYS  27  -6.804   2.038  -3.346
  242    HB2  CYS  27           2HB      CYS  27  -4.572   4.038  -2.836
  243    HB3  CYS  27           3HB      CYS  27  -5.641   3.366  -1.618
  Start of MODEL   12
    1    H1   GLY   1           1H       GLY   1  10.708  -9.740   1.709
    2    H2   GLY   1           2H       GLY   1  10.840  -8.195   2.239
    3    H3   GLY   1           3H       GLY   1  10.544  -9.402   3.303
    4    HA2  GLY   1           HA2      GLY   1   8.680  -8.498   1.188
    5    HA3  GLY   1           HA3      GLY   1   8.360  -9.808   2.343
    6    H    LEU   2           H        LEU   2   6.672  -6.957   3.692
    7    HA   LEU   2           HA       LEU   2   6.204  -9.288   2.011
    8    HB2  LEU   2           2HB      LEU   2   4.470  -6.986   2.959
    9    HB3  LEU   2           3HB      LEU   2   3.852  -8.298   1.974
   10    HG   LEU   2           HG       LEU   2   5.091  -8.673   4.737
   11   HD11  LEU   2          1HD1      LEU   2   2.170  -8.635   3.876
   12   HD12  LEU   2          2HD1      LEU   2   2.782  -9.007   5.503
   13   HD13  LEU   2          3HD1      LEU   2   2.992  -7.382   4.831
   14   HD21  LEU   2          3HD2      LEU   2   3.987 -10.905   4.614
   15   HD22  LEU   2          1HD2      LEU   2   3.532 -10.578   2.928
   16   HD23  LEU   2          2HD2      LEU   2   5.244 -10.725   3.390
   17    HA   PRO   3           HA       PRO   3   6.531  -7.183  -1.931
   18    HB2  PRO   3           2HB      PRO   3   5.102  -8.787  -3.579
   19    HB3  PRO   3           3HB      PRO   3   6.594  -9.362  -2.772
   20    HG2  PRO   3           2HG      PRO   3   3.721  -9.779  -1.873
   21    HG3  PRO   3           3HG      PRO   3   5.004 -11.017  -2.062
   22    HD2  PRO   3           2HD      PRO   3   4.434  -9.839   0.346
   23    HD3  PRO   3           3HD      PRO   3   6.099 -10.317  -0.101
   24    H    ARG   4           H        ARG   4   5.343  -5.955  -3.478
   25    HA   ARG   4           HA       ARG   4   3.296  -4.283  -2.513
   26    HB2  ARG   4           2HB      ARG   4   4.240  -4.934  -5.329
   27    HB3  ARG   4           3HB      ARG   4   2.964  -3.753  -5.021
   28    HG2  ARG   4           2HG      ARG   4   4.412  -2.388  -3.653
   29    HG3  ARG   4           3HG      ARG   4   5.730  -3.577  -3.759
   30    HD2  ARG   4           2HD      ARG   4   5.899  -3.222  -6.179
   31    HD3  ARG   4           3HD      ARG   4   4.517  -2.110  -6.135
   32    HE   ARG   4           HE       ARG   4   6.528  -1.196  -4.315
   33   HH11  ARG   4          1HH1      ARG   4   6.021  -1.370  -7.779
   34   HH12  ARG   4          2HH1      ARG   4   7.029   0.016  -8.087
   35   HH21  ARG   4          2HH2      ARG   4   7.819   0.552  -4.783
   36   HH22  ARG   4          1HH2      ARG   4   8.026   1.063  -6.432
   37    H    LYS   5           H        LYS   5   2.846  -7.267  -4.399
   38    HA   LYS   5           HA       LYS   5   0.018  -6.878  -4.808
   39    HB2  LYS   5           2HB      LYS   5  -0.040  -9.161  -5.584
   40    HB3  LYS   5           3HB      LYS   5   1.314  -8.286  -6.288
   41    HG2  LYS   5           2HG      LYS   5   2.896  -9.425  -4.795
   42    HG3  LYS   5           3HG      LYS   5   1.562 -10.221  -3.940
   43    HD2  LYS   5           2HD      LYS   5   0.882 -11.377  -5.998
   44    HD3  LYS   5           3HD      LYS   5   2.183 -10.604  -6.907
   45    HE2  LYS   5           2HE      LYS   5   2.658 -12.373  -4.462
   46    HE3  LYS   5           3HE      LYS   5   2.541 -13.017  -6.099
   47    HZ1  LYS   5           HZ1      LYS   5   4.845 -12.613  -5.506
   48    HZ2  LYS   5           HZ2      LYS   5   4.429 -11.643  -6.746
   49    HZ3  LYS   5           HZ3      LYS   5   4.571 -11.028  -5.238
   50    H    ILE   6           H        ILE   6   1.712  -7.954  -2.006
   51    HA   ILE   6           HA       ILE   6  -0.824  -8.902  -0.730
   52    HB   ILE   6           HB       ILE   6   2.060  -9.083   0.201
   53   HG12  ILE   6          2HG1      ILE   6   0.027 -11.202  -0.665
   54   HG13  ILE   6          3HG1      ILE   6   1.392 -10.651  -1.629
   55   HG21  ILE   6          1HG2      ILE   6   1.149 -10.351   2.135
   56   HG22  ILE   6          2HG2      ILE   6   0.535  -8.706   2.127
   57   HG23  ILE   6          3HG2      ILE   6  -0.505 -10.031   1.566
   58   HD11  ILE   6          3HD1      ILE   6   2.956 -11.512   0.127
   59   HD12  ILE   6          1HD1      ILE   6   1.552 -12.236   0.951
   60   HD13  ILE   6          2HD1      ILE   6   1.984 -12.749  -0.686
   61    H    LEU   7           H        LEU   7   1.792  -6.451  -0.308
   62    HA   LEU   7           HA       LEU   7   0.659  -5.041   1.869
   63    HB2  LEU   7           2HB      LEU   7   2.279  -4.081  -0.526
   64    HB3  LEU   7           3HB      LEU   7   1.876  -3.041   0.831
   65    HG   LEU   7           HG       LEU   7   3.529  -5.590   1.072
   66   HD11  LEU   7          1HD1      LEU   7   5.418  -4.025   1.382
   67   HD12  LEU   7          2HD1      LEU   7   4.684  -3.838  -0.216
   68   HD13  LEU   7          3HD1      LEU   7   4.340  -2.648   1.063
   69   HD21  LEU   7          3HD2      LEU   7   4.121  -4.617   3.310
   70   HD22  LEU   7          1HD2      LEU   7   2.886  -3.367   3.063
   71   HD23  LEU   7          2HD2      LEU   7   2.420  -5.078   3.193
   72    H    CYS   8           H        CYS   8  -0.233  -4.864  -1.562
   73    HA   CYS   8           HA       CYS   8  -1.896  -2.577  -1.473
   74    HB2  CYS   8           2HB      CYS   8  -1.146  -3.609  -3.517
   75    HB3  CYS   8           3HB      CYS   8  -1.954  -5.125  -3.134
   76    H    ALA   9           H        ALA   9  -2.636  -5.944  -0.487
   77    HA   ALA   9           HA       ALA   9  -5.501  -5.462  -0.186
   78    HB1  ALA   9           3HB      ALA   9  -5.488  -7.708   0.800
   79    HB2  ALA   9           1HB      ALA   9  -4.566  -7.689  -0.718
   80    HB3  ALA   9           2HB      ALA   9  -3.711  -7.708   0.842
   81    H    ILE  10           H        ILE  10  -2.647  -5.422   1.936
   82    HA   ILE  10           HA       ILE  10  -4.050  -4.925   4.415
   83    HB   ILE  10           HB       ILE  10  -1.215  -4.132   3.631
   84   HG12  ILE  10          2HG1      ILE  10  -1.448  -6.519   3.233
   85   HG13  ILE  10          3HG1      ILE  10  -0.418  -6.203   4.598
   86   HG21  ILE  10          1HG2      ILE  10  -2.509  -4.516   6.359
   87   HG22  ILE  10          2HG2      ILE  10  -0.770  -4.282   6.076
   88   HG23  ILE  10          3HG2      ILE  10  -1.909  -2.999   5.661
   89   HD11  ILE  10          3HD1      ILE  10  -3.327  -7.126   4.755
   90   HD12  ILE  10          1HD1      ILE  10  -1.888  -8.130   4.996
   91   HD13  ILE  10          2HD1      ILE  10  -2.258  -6.841   6.152
   92    H    ALA  11           H        ALA  11  -2.497  -2.759   2.026
   93    HA   ALA  11           HA       ALA  11  -2.788  -0.344   3.356
   94    HB1  ALA  11           3HB      ALA  11  -2.873  -0.815   0.332
   95    HB2  ALA  11           1HB      ALA  11  -2.304   0.635   1.187
   96    HB3  ALA  11           2HB      ALA  11  -1.404  -0.859   1.343
   97    H    LYS  12           H        LYS  12  -5.041  -1.609   0.844
   98    HA   LYS  12           HA       LYS  12  -6.989   0.484   1.298
   99    HB2  LYS  12           2HB      LYS  12  -7.206  -2.139  -0.237
  100    HB3  LYS  12           3HB      LYS  12  -8.396  -0.821  -0.267
  101    HG2  LYS  12           2HG      LYS  12  -6.536   0.744  -0.983
  102    HG3  LYS  12           3HG      LYS  12  -5.492  -0.664  -1.176
  103    HD2  LYS  12           2HD      LYS  12  -8.032  -0.043  -2.728
  104    HD3  LYS  12           3HD      LYS  12  -6.359   0.068  -3.294
  105    HE2  LYS  12           2HE      LYS  12  -6.153  -2.438  -2.838
  106    HE3  LYS  12           3HE      LYS  12  -7.904  -2.462  -2.602
  107    HZ1  LYS  12           HZ1      LYS  12  -6.530  -1.533  -5.084
  108    HZ2  LYS  12           HZ2      LYS  12  -7.280  -2.980  -4.912
  109    HZ3  LYS  12           HZ3      LYS  12  -8.152  -1.600  -4.873
  110    H    LYS  13           H        LYS  13  -6.581  -2.630   2.857
  111    HA   LYS  13           HA       LYS  13  -9.223  -2.620   4.117
  112    HB2  LYS  13           2HB      LYS  13  -7.907  -4.656   3.707
  113    HB3  LYS  13           3HB      LYS  13  -6.679  -4.120   4.867
  114    HG2  LYS  13           2HG      LYS  13  -8.343  -4.188   6.686
  115    HG3  LYS  13           3HG      LYS  13  -9.617  -4.627   5.541
  116    HD2  LYS  13           2HD      LYS  13  -7.143  -6.311   6.143
  117    HD3  LYS  13           3HD      LYS  13  -8.743  -6.547   6.865
  118    HE2  LYS  13           2HE      LYS  13  -9.700  -6.906   4.580
  119    HE3  LYS  13           3HE      LYS  13  -8.075  -6.768   3.895
  120    HZ1  LYS  13           HZ1      LYS  13  -8.689  -9.086   4.257
  121    HZ2  LYS  13           HZ2      LYS  13  -7.427  -8.712   5.221
  122    HZ3  LYS  13           HZ3      LYS  13  -8.931  -8.837   5.849
  123    H    LYS  14           H        LYS  14  -5.985  -1.523   5.137
  124    HA   LYS  14           HA       LYS  14  -6.942  -0.425   7.698
  125    HB2  LYS  14           2HB      LYS  14  -4.306  -0.548   6.215
  126    HB3  LYS  14           3HB      LYS  14  -4.512   0.660   7.465
  127    HG2  LYS  14           2HG      LYS  14  -3.446  -1.313   8.362
  128    HG3  LYS  14           3HG      LYS  14  -4.984  -0.975   9.156
  129    HD2  LYS  14           2HD      LYS  14  -6.069  -2.809   7.926
  130    HD3  LYS  14           3HD      LYS  14  -4.563  -3.121   7.029
  131    HE2  LYS  14           2HE      LYS  14  -3.391  -3.631   9.138
  132    HE3  LYS  14           3HE      LYS  14  -4.837  -3.226  10.068
  133    HZ1  LYS  14           HZ1      LYS  14  -4.647  -5.482   8.141
  134    HZ2  LYS  14           HZ2      LYS  14  -4.621  -5.621   9.765
  135    HZ3  LYS  14           HZ3      LYS  14  -5.975  -5.102   9.024
  136    H    GLY  15           H        GLY  15  -6.809   0.816   4.469
  137    HA2  GLY  15           HA2      GLY  15  -7.480   2.875   3.618
  138    HA3  GLY  15           HA3      GLY  15  -7.827   3.461   5.250
  139    H    LYS  16           H        LYS  16  -4.744   2.029   4.320
  140    HA   LYS  16           HA       LYS  16  -3.315   4.647   4.651
  141    HB2  LYS  16           2HB      LYS  16  -3.422   3.133   6.693
  142    HB3  LYS  16           3HB      LYS  16  -2.426   1.985   5.822
  143    HG2  LYS  16           2HG      LYS  16  -1.681   4.890   6.433
  144    HG3  LYS  16           3HG      LYS  16  -1.259   3.531   7.461
  145    HD2  LYS  16           2HD      LYS  16  -0.222   3.996   4.636
  146    HD3  LYS  16           3HD      LYS  16   0.647   4.256   6.146
  147    HE2  LYS  16           2HE      LYS  16   0.446   1.843   6.706
  148    HE3  LYS  16           3HE      LYS  16  -0.403   1.560   5.181
  149    HZ1  LYS  16           HZ1      LYS  16   1.587   2.289   3.997
  150    HZ2  LYS  16           HZ2      LYS  16   2.380   2.570   5.402
  151    HZ3  LYS  16           HZ3      LYS  16   1.961   1.050   4.991
  152    H    CYS  17           H        CYS  17  -3.329   4.744   2.390
  153    HA   CYS  17           HA       CYS  17  -1.181   3.186   1.032
  154    HB2  CYS  17           2HB      CYS  17  -3.526   2.238   0.607
  155    HB3  CYS  17           3HB      CYS  17  -3.920   3.770  -0.134
  156    H    LYS  18           H        LYS  18   0.099   4.488  -0.294
  157    HA   LYS  18           HA       LYS  18  -0.788   7.114  -1.252
  158    HB2  LYS  18           2HB      LYS  18   0.863   8.422   0.039
  159    HB3  LYS  18           3HB      LYS  18  -0.330   7.670   1.085
  160    HG2  LYS  18           2HG      LYS  18   1.281   5.923   1.748
  161    HG3  LYS  18           3HG      LYS  18   2.466   6.544   0.592
  162    HD2  LYS  18           2HD      LYS  18   3.063   7.277   2.807
  163    HD3  LYS  18           3HD      LYS  18   2.587   8.679   1.840
  164    HE2  LYS  18           2HE      LYS  18   0.341   8.655   2.916
  165    HE3  LYS  18           3HE      LYS  18   0.803   7.230   3.856
  166    HZ1  LYS  18           HZ1      LYS  18   2.114   9.893   4.040
  167    HZ2  LYS  18           HZ2      LYS  18   1.084   9.274   5.141
  168    HZ3  LYS  18           HZ3      LYS  18   2.542   8.580   4.912
  169    H    GLY  19           H        GLY  19   0.918   8.347  -2.317
  170    HA2  GLY  19           HA2      GLY  19   2.486   8.539  -3.996
  171    HA3  GLY  19           HA3      GLY  19   3.492   7.689  -2.844
  172    HA   PRO  20           HA       PRO  20   3.759   4.948  -6.460
  173    HB2  PRO  20           2HB      PRO  20   5.503   3.070  -5.476
  174    HB3  PRO  20           3HB      PRO  20   6.004   4.699  -6.022
  175    HG2  PRO  20           2HG      PRO  20   5.434   3.781  -3.186
  176    HG3  PRO  20           3HG      PRO  20   6.844   4.711  -3.789
  177    HD2  PRO  20           2HD      PRO  20   4.718   5.927  -2.616
  178    HD3  PRO  20           3HD      PRO  20   5.567   6.690  -3.996
  179    H    LEU  21           H        LEU  21   3.059   3.688  -3.128
  180    HA   LEU  21           HA       LEU  21   2.004   1.198  -4.089
  181    HB2  LEU  21           2HB      LEU  21   2.787   1.622  -1.749
  182    HB3  LEU  21           3HB      LEU  21   1.382   2.650  -1.487
  183    HG   LEU  21           HG       LEU  21  -0.132   0.716  -1.849
  184   HD11  LEU  21          1HD1      LEU  21   1.164  -0.691  -3.368
  185   HD12  LEU  21          2HD1      LEU  21   2.433  -0.899  -2.134
  186   HD13  LEU  21          3HD1      LEU  21   0.810  -1.586  -1.892
  187   HD21  LEU  21          3HD2      LEU  21   0.494  -0.546   0.179
  188   HD22  LEU  21          1HD2      LEU  21   2.093   0.223   0.162
  189   HD23  LEU  21          2HD2      LEU  21   0.627   1.207   0.409
  190    H    LYS  22           H        LYS  22   0.508   4.344  -3.506
  191    HA   LYS  22           HA       LYS  22  -2.238   3.563  -4.049
  192    HB2  LYS  22           2HB      LYS  22  -1.813   5.587  -2.860
  193    HB3  LYS  22           3HB      LYS  22  -0.803   6.243  -4.159
  194    HG2  LYS  22           2HG      LYS  22  -2.683   6.541  -5.615
  195    HG3  LYS  22           3HG      LYS  22  -3.746   5.596  -4.563
  196    HD2  LYS  22           2HD      LYS  22  -3.569   7.303  -2.800
  197    HD3  LYS  22           3HD      LYS  22  -2.451   8.252  -3.809
  198    HE2  LYS  22           2HE      LYS  22  -4.215   8.477  -5.543
  199    HE3  LYS  22           3HE      LYS  22  -5.321   7.522  -4.551
  200    HZ1  LYS  22           HZ1      LYS  22  -4.179  10.151  -3.766
  201    HZ2  LYS  22           HZ2      LYS  22  -5.712   9.896  -4.262
  202    HZ3  LYS  22           HZ3      LYS  22  -5.201   9.262  -2.850
  203    H    LEU  23           H        LEU  23   0.348   4.778  -6.173
  204    HA   LEU  23           HA       LEU  23  -1.219   4.669  -8.572
  205    HB2  LEU  23           2HB      LEU  23   0.884   5.942  -8.313
  206    HB3  LEU  23           3HB      LEU  23   1.788   4.440  -8.146
  207    HG   LEU  23           HG       LEU  23   1.223   3.812 -10.476
  208   HD11  LEU  23          1HD1      LEU  23   0.258   5.534 -11.994
  209   HD12  LEU  23          2HD1      LEU  23  -0.915   4.984 -10.795
  210   HD13  LEU  23          3HD1      LEU  23  -0.107   6.558 -10.587
  211   HD21  LEU  23          3HD2      LEU  23   2.639   5.491 -11.569
  212   HD22  LEU  23          1HD2      LEU  23   2.411   6.602 -10.199
  213   HD23  LEU  23          2HD2      LEU  23   3.282   5.069  -9.974
  214    H    VAL  24           H        VAL  24   0.818   2.193  -7.019
  215    HA   VAL  24           HA       VAL  24   0.513   0.159  -9.042
  216    HB   VAL  24           HB       VAL  24   1.283   0.082  -6.103
  217   HG11  VAL  24          1HG1      VAL  24   1.475  -2.185  -8.126
  218   HG12  VAL  24          2HG1      VAL  24   2.269  -2.147  -6.535
  219   HG13  VAL  24          3HG1      VAL  24   0.511  -2.174  -6.630
  220   HG21  VAL  24          3HG2      VAL  24   3.535  -0.040  -6.855
  221   HG22  VAL  24          1HG2      VAL  24   3.046  -0.308  -8.554
  222   HG23  VAL  24          2HG2      VAL  24   2.808   1.265  -7.784
  223    H    CYS  25           H        CYS  25  -1.178   0.722  -5.956
  224    HA   CYS  25           HA       CYS  25  -2.867  -1.650  -6.306
  225    HB2  CYS  25           2HB      CYS  25  -1.560  -1.056  -4.279
  226    HB3  CYS  25           3HB      CYS  25  -2.546   0.379  -4.082
  227    H    LYS  26           H        LYS  26  -3.214   1.635  -7.030
  228    HA   LYS  26           HA       LYS  26  -4.896   3.047  -7.586
  229    HB2  LYS  26           2HB      LYS  26  -6.330   0.485  -8.342
  230    HB3  LYS  26           3HB      LYS  26  -6.817   2.101  -8.849
  231    HG2  LYS  26           2HG      LYS  26  -4.075   0.897  -9.385
  232    HG3  LYS  26           3HG      LYS  26  -5.421   0.780 -10.517
  233    HD2  LYS  26           2HD      LYS  26  -4.057   3.359  -9.617
  234    HD3  LYS  26           3HD      LYS  26  -3.816   2.524 -11.151
  235    HE2  LYS  26           2HE      LYS  26  -6.236   2.837 -11.696
  236    HE3  LYS  26           3HE      LYS  26  -6.445   3.745 -10.193
  237    HZ1  LYS  26           HZ1      LYS  26  -4.835   5.374 -11.031
  238    HZ2  LYS  26           HZ2      LYS  26  -4.641   4.533 -12.420
  239    HZ3  LYS  26           HZ3      LYS  26  -6.076   5.227 -12.078
  240    H    CYS  27           H        CYS  27  -4.594   2.972  -5.216
  241    HA   CYS  27           HA       CYS  27  -6.863   2.455  -3.478
  242    HB2  CYS  27           2HB      CYS  27  -4.403   4.186  -3.025
  243    HB3  CYS  27           3HB      CYS  27  -5.549   3.690  -1.804
  Start of MODEL   13
    1    H1   GLY   1           1H       GLY   1   9.804  -9.041   5.256
    2    H2   GLY   1           2H       GLY   1   9.017 -10.306   4.571
    3    H3   GLY   1           3H       GLY   1   9.871  -9.271   3.634
    4    HA2  GLY   1           HA2      GLY   1   7.444  -8.585   5.163
    5    HA3  GLY   1           HA3      GLY   1   8.373  -7.457   4.160
    6    H    LEU   2           H        LEU   2   5.726  -7.727   3.646
    7    HA   LEU   2           HA       LEU   2   5.138  -9.710   1.610
    8    HB2  LEU   2           2HB      LEU   2   3.712  -7.149   2.419
    9    HB3  LEU   2           3HB      LEU   2   3.061  -8.329   1.293
   10    HG   LEU   2           HG       LEU   2   3.661  -8.883   4.234
   11   HD11  LEU   2          1HD1      LEU   2   1.033  -8.383   2.777
   12   HD12  LEU   2          2HD1      LEU   2   1.204  -8.872   4.478
   13   HD13  LEU   2          3HD1      LEU   2   1.814  -7.300   3.946
   14   HD21  LEU   2          3HD2      LEU   2   2.293 -10.930   3.842
   15   HD22  LEU   2          1HD2      LEU   2   2.262 -10.561   2.105
   16   HD23  LEU   2          2HD2      LEU   2   3.796 -10.946   2.917
   17    HA   PRO   3           HA       PRO   3   6.480  -7.223  -1.958
   18    HB2  PRO   3           2HB      PRO   3   5.179  -8.495  -3.975
   19    HB3  PRO   3           3HB      PRO   3   6.555  -9.251  -3.112
   20    HG2  PRO   3           2HG      PRO   3   3.594  -9.667  -2.617
   21    HG3  PRO   3           3HG      PRO   3   4.863 -10.916  -2.806
   22    HD2  PRO   3           2HD      PRO   3   3.986 -10.025  -0.360
   23    HD3  PRO   3           3HD      PRO   3   5.678 -10.543  -0.624
   24    H    ARG   4           H        ARG   4   5.534  -5.603  -3.292
   25    HA   ARG   4           HA       ARG   4   3.594  -4.058  -2.054
   26    HB2  ARG   4           2HB      ARG   4   3.662  -2.581  -3.872
   27    HB3  ARG   4           3HB      ARG   4   5.268  -3.171  -3.460
   28    HG2  ARG   4           2HG      ARG   4   5.164  -4.741  -5.448
   29    HG3  ARG   4           3HG      ARG   4   3.569  -4.061  -5.835
   30    HD2  ARG   4           2HD      ARG   4   5.020  -2.792  -7.159
   31    HD3  ARG   4           3HD      ARG   4   4.685  -1.774  -5.732
   32    HE   ARG   4           HE       ARG   4   7.041  -3.274  -5.212
   33   HH11  ARG   4          1HH2      ARG   4   6.115  -0.693  -7.392
   34   HH12  ARG   4          2HH2      ARG   4   7.732  -0.049  -7.459
   35   HH21  ARG   4          1HH1      ARG   4   9.077  -2.399  -5.341
   36   HH22  ARG   4          2HH1      ARG   4   9.359  -0.998  -6.330
   37    H    LYS   5           H        LYS   5   2.918  -6.402  -4.593
   38    HA   LYS   5           HA       LYS   5   0.171  -5.592  -5.019
   39    HB2  LYS   5           2HB      LYS   5  -0.027  -7.555  -6.382
   40    HB3  LYS   5           3HB      LYS   5   1.514  -6.765  -6.709
   41    HG2  LYS   5           2HG      LYS   5   2.646  -8.472  -5.221
   42    HG3  LYS   5           3HG      LYS   5   1.076  -9.277  -5.033
   43    HD2  LYS   5           2HD      LYS   5   0.956  -9.632  -7.482
   44    HD3  LYS   5           3HD      LYS   5   2.535  -8.838  -7.672
   45    HE2  LYS   5           2HE      LYS   5   3.575 -10.564  -6.215
   46    HE3  LYS   5           3HE      LYS   5   2.003 -11.349  -6.016
   47    HZ1  LYS   5           HZ1      LYS   5   3.316 -12.426  -7.752
   48    HZ2  LYS   5           HZ2      LYS   5   1.982 -11.768  -8.419
   49    HZ3  LYS   5           HZ3      LYS   5   3.435 -11.041  -8.604
   50    H    ILE   6           H        ILE   6   1.612  -7.641  -2.587
   51    HA   ILE   6           HA       ILE   6  -1.075  -8.557  -1.651
   52    HB   ILE   6           HB       ILE   6   1.673  -9.334  -0.615
   53   HG12  ILE   6          2HG1      ILE   6  -0.266 -10.843  -2.438
   54   HG13  ILE   6          3HG1      ILE   6   1.287 -10.166  -2.919
   55   HG21  ILE   6          1HG2      ILE   6  -0.150  -9.479   1.093
   56   HG22  ILE   6          2HG2      ILE   6  -1.115 -10.451  -0.030
   57   HG23  ILE   6          3HG2      ILE   6   0.409 -11.077   0.633
   58   HD11  ILE   6          3HD1      ILE   6   0.854 -12.516  -1.055
   59   HD12  ILE   6          1HD1      ILE   6   1.615 -12.496  -2.651
   60   HD13  ILE   6          2HD1      ILE   6   2.425 -11.708  -1.285
   61    H    LEU   7           H        LEU   7   1.737  -6.577  -0.632
   62    HA   LEU   7           HA       LEU   7   0.759  -5.703   1.864
   63    HB2  LEU   7           2HB      LEU   7   3.041  -5.384   0.781
   64    HB3  LEU   7           3HB      LEU   7   2.355  -4.082  -0.165
   65    HG   LEU   7           HG       LEU   7   3.742  -3.394   1.752
   66   HD11  LEU   7          1HD1      LEU   7   1.863  -1.912   0.869
   67   HD12  LEU   7          2HD1      LEU   7   0.961  -2.370   2.331
   68   HD13  LEU   7          3HD1      LEU   7   2.514  -1.551   2.475
   69   HD21  LEU   7          3HD2      LEU   7   3.110  -5.140   3.377
   70   HD22  LEU   7          1HD2      LEU   7   2.954  -3.512   4.044
   71   HD23  LEU   7          2HD2      LEU   7   1.502  -4.400   3.549
   72    H    CYS   8           H        CYS   8  -0.197  -4.685  -1.405
   73    HA   CYS   8           HA       CYS   8  -1.677  -2.372  -0.761
   74    HB2  CYS   8           2HB      CYS   8  -1.121  -3.121  -3.041
   75    HB3  CYS   8           3HB      CYS   8  -2.263  -4.459  -2.889
   76    H    ALA   9           H        ALA   9  -2.580  -5.771  -0.209
   77    HA   ALA   9           HA       ALA   9  -5.408  -5.249   0.241
   78    HB1  ALA   9           3HB      ALA   9  -4.476  -7.465  -0.403
   79    HB2  ALA   9           1HB      ALA   9  -3.643  -7.555   1.166
   80    HB3  ALA   9           2HB      ALA   9  -5.418  -7.531   1.104
   81    H    ILE  10           H        ILE  10  -2.493  -5.036   2.180
   82    HA   ILE  10           HA       ILE  10  -3.874  -4.569   4.736
   83    HB   ILE  10           HB       ILE  10  -0.993  -3.898   4.052
   84   HG12  ILE  10          2HG1      ILE  10  -1.183  -6.201   3.370
   85   HG13  ILE  10          3HG1      ILE  10  -0.259  -6.069   4.837
   86   HG21  ILE  10          1HG2      ILE  10  -0.652  -4.249   6.465
   87   HG22  ILE  10          2HG2      ILE  10  -1.820  -2.963   6.125
   88   HG23  ILE  10          3HG2      ILE  10  -2.391  -4.559   6.665
   89   HD11  ILE  10          3HD1      ILE  10  -1.756  -8.018   4.864
   90   HD12  ILE  10          1HD1      ILE  10  -2.189  -6.889   6.164
   91   HD13  ILE  10          2HD1      ILE  10  -3.172  -6.970   4.681
   92    H    ALA  11           H        ALA  11  -2.082  -2.668   2.302
   93    HA   ALA  11           HA       ALA  11  -2.231  -0.143   3.422
   94    HB1  ALA  11           3HB      ALA  11  -2.422  -0.679   0.426
   95    HB2  ALA  11           1HB      ALA  11  -1.593   0.646   1.259
   96    HB3  ALA  11           2HB      ALA  11  -0.927  -0.980   1.355
   97    H    LYS  12           H        LYS  12  -4.690  -1.658   1.282
   98    HA   LYS  12           HA       LYS  12  -6.459   0.682   1.410
   99    HB2  LYS  12           2HB      LYS  12  -6.858  -2.121   0.299
  100    HB3  LYS  12           3HB      LYS  12  -8.001  -0.777   0.114
  101    HG2  LYS  12           2HG      LYS  12  -6.213   0.581  -0.987
  102    HG3  LYS  12           3HG      LYS  12  -5.123  -0.799  -0.912
  103    HD2  LYS  12           2HD      LYS  12  -7.694  -0.567  -2.504
  104    HD3  LYS  12           3HD      LYS  12  -6.029  -0.643  -3.107
  105    HE2  LYS  12           2HE      LYS  12  -5.834  -2.963  -2.152
  106    HE3  LYS  12           3HE      LYS  12  -7.538  -2.885  -1.690
  107    HZ1  LYS  12           HZ1      LYS  12  -7.251  -3.986  -3.840
  108    HZ2  LYS  12           HZ2      LYS  12  -8.107  -2.612  -4.039
  109    HZ3  LYS  12           HZ3      LYS  12  -6.533  -2.665  -4.481
  110    H    LYS  13           H        LYS  13  -6.273  -2.376   3.183
  111    HA   LYS  13           HA       LYS  13  -8.824  -2.112   4.539
  112    HB2  LYS  13           2HB      LYS  13  -7.591  -4.219   4.238
  113    HB3  LYS  13           3HB      LYS  13  -6.308  -3.650   5.318
  114    HG2  LYS  13           2HG      LYS  13  -7.963  -3.519   7.179
  115    HG3  LYS  13           3HG      LYS  13  -9.231  -4.095   6.089
  116    HD2  LYS  13           2HD      LYS  13  -6.710  -5.634   6.872
  117    HD3  LYS  13           3HD      LYS  13  -8.323  -5.872   7.560
  118    HE2  LYS  13           2HE      LYS  13  -9.182  -6.465   5.281
  119    HE3  LYS  13           3HE      LYS  13  -7.539  -6.321   4.644
  120    HZ1  LYS  13           HZ1      LYS  13  -8.075  -8.623   5.188
  121    HZ2  LYS  13           HZ2      LYS  13  -6.869  -8.113   6.161
  122    HZ3  LYS  13           HZ3      LYS  13  -8.391  -8.247   6.742
  123    H    LYS  14           H        LYS  14  -5.524  -1.104   5.405
  124    HA   LYS  14           HA       LYS  14  -6.396   0.200   7.915
  125    HB2  LYS  14           2HB      LYS  14  -3.738  -0.242   6.516
  126    HB3  LYS  14           3HB      LYS  14  -3.877   0.941   7.801
  127    HG2  LYS  14           2HG      LYS  14  -3.053  -1.137   8.685
  128    HG3  LYS  14           3HG      LYS  14  -4.606  -0.707   9.402
  129    HD2  LYS  14           2HD      LYS  14  -5.751  -2.426   8.077
  130    HD3  LYS  14           3HD      LYS  14  -4.274  -2.738   7.156
  131    HE2  LYS  14           2HE      LYS  14  -4.524  -4.501   8.759
  132    HE3  LYS  14           3HE      LYS  14  -3.141  -3.510   9.230
  133    HZ1  LYS  14           HZ1      LYS  14  -5.858  -3.328  10.440
  134    HZ2  LYS  14           HZ2      LYS  14  -4.571  -4.054  11.128
  135    HZ3  LYS  14           HZ3      LYS  14  -4.562  -2.441  10.902
  136    H    GLY  15           H        GLY  15  -6.360   1.203   4.662
  137    HA2  GLY  15           HA2      GLY  15  -6.797   3.253   3.692
  138    HA3  GLY  15           HA3      GLY  15  -7.002   3.967   5.296
  139    H    LYS  16           H        LYS  16  -4.057   2.269   4.453
  140    HA   LYS  16           HA       LYS  16  -2.463   4.744   4.856
  141    HB2  LYS  16           2HB      LYS  16  -2.267   2.672   6.307
  142    HB3  LYS  16           3HB      LYS  16  -1.563   1.838   4.916
  143    HG2  LYS  16           2HG      LYS  16   0.354   3.369   4.929
  144    HG3  LYS  16           3HG      LYS  16  -0.443   4.413   6.113
  145    HD2  LYS  16           2HD      LYS  16   1.273   3.118   7.205
  146    HD3  LYS  16           3HD      LYS  16  -0.309   2.599   7.802
  147    HE2  LYS  16           2HE      LYS  16  -0.237   0.622   6.305
  148    HE3  LYS  16           3HE      LYS  16   1.305   1.173   5.633
  149    HZ1  LYS  16           HZ1      LYS  16   0.867   0.414   8.477
  150    HZ2  LYS  16           HZ2      LYS  16   1.639  -0.500   7.367
  151    HZ3  LYS  16           HZ3      LYS  16   2.289   0.915   7.848
  152    H    CYS  17           H        CYS  17  -3.579   3.057   2.170
  153    HA   CYS  17           HA       CYS  17  -1.205   2.890   0.592
  154    HB2  CYS  17           2HB      CYS  17  -3.406   1.676   0.218
  155    HB3  CYS  17           3HB      CYS  17  -4.034   3.198  -0.423
  156    H    LYS  18           H        LYS  18   0.016   4.520   0.073
  157    HA   LYS  18           HA       LYS  18  -1.024   7.005  -1.198
  158    HB2  LYS  18           2HB      LYS  18   0.852   6.897   1.219
  159    HB3  LYS  18           3HB      LYS  18   0.578   8.333   0.231
  160    HG2  LYS  18           2HG      LYS  18  -1.838   8.301   0.845
  161    HG3  LYS  18           3HG      LYS  18  -1.548   6.888   1.865
  162    HD2  LYS  18           2HD      LYS  18  -1.626   8.807   3.277
  163    HD3  LYS  18           3HD      LYS  18   0.037   8.204   3.253
  164    HE2  LYS  18           2HE      LYS  18   0.659   9.976   1.623
  165    HE3  LYS  18           3HE      LYS  18  -1.017  10.541   1.589
  166    HZ1  LYS  18           HZ1      LYS  18  -0.808  11.091   3.955
  167    HZ2  LYS  18           HZ2      LYS  18   0.740  10.564   3.988
  168    HZ3  LYS  18           HZ3      LYS  18   0.341  11.872   3.100
  169    H    GLY  19           H        GLY  19   0.749   8.270  -2.187
  170    HA2  GLY  19           HA2      GLY  19   2.560   8.468  -3.617
  171    HA3  GLY  19           HA3      GLY  19   3.395   7.571  -2.355
  172    HA   PRO  20           HA       PRO  20   4.126   4.912  -5.981
  173    HB2  PRO  20           2HB      PRO  20   5.457   3.256  -3.829
  174    HB3  PRO  20           3HB      PRO  20   6.030   3.628  -5.487
  175    HG2  PRO  20           2HG      PRO  20   7.041   4.989  -3.383
  176    HG3  PRO  20           3HG      PRO  20   6.567   5.884  -4.866
  177    HD2  PRO  20           2HD      PRO  20   4.993   5.545  -2.294
  178    HD3  PRO  20           3HD      PRO  20   5.291   7.027  -3.252
  179    H    LEU  21           H        LEU  21   2.915   3.605  -2.830
  180    HA   LEU  21           HA       LEU  21   2.001   1.124  -3.948
  181    HB2  LEU  21           2HB      LEU  21   2.293   2.125  -1.402
  182    HB3  LEU  21           3HB      LEU  21   0.565   2.282  -1.577
  183    HG   LEU  21           HG       LEU  21   0.964   0.226  -0.494
  184   HD11  LEU  21          1HD1      LEU  21   0.553  -0.613  -3.392
  185   HD12  LEU  21          2HD1      LEU  21   0.173  -1.541  -1.939
  186   HD13  LEU  21          3HD1      LEU  21  -0.726  -0.056  -2.288
  187   HD21  LEU  21          3HD2      LEU  21   2.474  -1.525  -1.335
  188   HD22  LEU  21          1HD2      LEU  21   2.985  -0.461  -2.662
  189   HD23  LEU  21          2HD2      LEU  21   3.333  -0.019  -0.974
  190    H    LYS  22           H        LYS  22   0.449   4.245  -3.544
  191    HA   LYS  22           HA       LYS  22  -2.207   3.471  -4.508
  192    HB2  LYS  22           2HB      LYS  22  -1.940   5.310  -2.974
  193    HB3  LYS  22           3HB      LYS  22  -0.864   6.166  -4.087
  194    HG2  LYS  22           2HG      LYS  22  -2.660   6.555  -5.660
  195    HG3  LYS  22           3HG      LYS  22  -3.767   5.504  -4.754
  196    HD2  LYS  22           2HD      LYS  22  -3.747   7.020  -2.852
  197    HD3  LYS  22           3HD      LYS  22  -2.461   7.991  -3.591
  198    HE2  LYS  22           2HE      LYS  22  -4.263   9.315  -4.087
  199    HE3  LYS  22           3HE      LYS  22  -4.148   8.347  -5.558
  200    HZ1  LYS  22           HZ1      LYS  22  -6.428   8.421  -4.791
  201    HZ2  LYS  22           HZ2      LYS  22  -5.914   6.883  -4.571
  202    HZ3  LYS  22           HZ3      LYS  22  -6.028   7.896  -3.299
  203    H    LEU  23           H        LEU  23   0.686   4.916  -6.018
  204    HA   LEU  23           HA       LEU  23  -0.416   5.206  -8.651
  205    HB2  LEU  23           2HB      LEU  23   1.596   6.298  -7.813
  206    HB3  LEU  23           3HB      LEU  23   2.454   4.771  -7.709
  207    HG   LEU  23           HG       LEU  23   1.340   5.706 -10.376
  208   HD11  LEU  23          1HD1      LEU  23   3.485   6.851 -10.808
  209   HD12  LEU  23          2HD1      LEU  23   2.613   7.607  -9.469
  210   HD13  LEU  23          3HD1      LEU  23   3.997   6.540  -9.132
  211   HD21  LEU  23          3HD2      LEU  23   3.349   4.519 -11.254
  212   HD22  LEU  23          1HD2      LEU  23   3.812   4.076  -9.598
  213   HD23  LEU  23          2HD2      LEU  23   2.332   3.423 -10.327
  214    H    VAL  24           H        VAL  24   1.261   2.460  -7.104
  215    HA   VAL  24           HA       VAL  24   1.221   0.682  -9.366
  216    HB   VAL  24           HB       VAL  24   1.518   0.264  -6.372
  217   HG11  VAL  24          1HG1      VAL  24   2.470  -1.967  -6.868
  218   HG12  VAL  24          2HG1      VAL  24   0.753  -1.890  -7.232
  219   HG13  VAL  24          3HG1      VAL  24   1.938  -1.814  -8.557
  220   HG21  VAL  24          3HG2      VAL  24   3.635  -0.027  -8.535
  221   HG22  VAL  24          1HG2      VAL  24   3.316   1.516  -7.738
  222   HG23  VAL  24          2HG2      VAL  24   3.836   0.149  -6.763
  223    H    CYS  25           H        CYS  25  -1.002   1.050  -6.592
  224    HA   CYS  25           HA       CYS  25  -2.649  -1.196  -7.615
  225    HB2  CYS  25           2HB      CYS  25  -1.279  -1.165  -5.427
  226    HB3  CYS  25           3HB      CYS  25  -2.553  -0.135  -4.802
  227    H    LYS  26           H        LYS  26  -2.834   1.996  -7.799
  228    HA   LYS  26           HA       LYS  26  -4.422   3.607  -7.994
  229    HB2  LYS  26           2HB      LYS  26  -6.266   3.116  -9.494
  230    HB3  LYS  26           3HB      LYS  26  -4.722   2.537 -10.083
  231    HG2  LYS  26           2HG      LYS  26  -6.512   0.630  -8.577
  232    HG3  LYS  26           3HG      LYS  26  -6.926   1.058 -10.239
  233    HD2  LYS  26           2HD      LYS  26  -4.933   0.129 -11.130
  234    HD3  LYS  26           3HD      LYS  26  -4.132   0.123  -9.569
  235    HE2  LYS  26           2HE      LYS  26  -4.693  -2.146 -10.057
  236    HE3  LYS  26           3HE      LYS  26  -5.719  -1.591  -8.729
  237    HZ1  LYS  26           HZ1      LYS  26  -6.987  -2.826 -10.413
  238    HZ2  LYS  26           HZ2      LYS  26  -7.525  -1.288 -10.351
  239    HZ3  LYS  26           HZ3      LYS  26  -6.563  -1.772 -11.581
  240    H    CYS  27           H        CYS  27  -4.346   2.706  -5.567
  241    HA   CYS  27           HA       CYS  27  -6.670   2.065  -4.143
  242    HB2  CYS  27           2HB      CYS  27  -4.359   3.862  -3.293
  243    HB3  CYS  27           3HB      CYS  27  -5.534   3.166  -2.219
  Start of MODEL   14
    1    H1   GLY   1           1H       GLY   1  10.576  -7.481   3.896
    2    H2   GLY   1           2H       GLY   1  10.618  -6.130   4.824
    3    H3   GLY   1           3H       GLY   1   9.625  -7.373   5.222
    4    HA2  GLY   1           HA2      GLY   1   8.355  -5.572   4.246
    5    HA3  GLY   1           HA3      GLY   1   9.382  -5.698   2.807
    6    H    LEU   2           H        LEU   2   7.085  -5.915   1.926
    7    HA   LEU   2           HA       LEU   2   6.414  -8.791   1.591
    8    HB2  LEU   2           2HB      LEU   2   4.506  -6.505   2.197
    9    HB3  LEU   2           3HB      LEU   2   3.962  -8.032   1.513
   10    HG   LEU   2           HG       LEU   2   5.372  -7.780   4.207
   11   HD11  LEU   2          1HD1      LEU   2   2.413  -8.100   3.570
   12   HD12  LEU   2          2HD1      LEU   2   3.148  -8.129   5.186
   13   HD13  LEU   2          3HD1      LEU   2   3.190  -6.643   4.226
   14   HD21  LEU   2          3HD2      LEU   2   5.604 -10.033   3.232
   15   HD22  LEU   2          1HD2      LEU   2   4.459 -10.066   4.574
   16   HD23  LEU   2          2HD2      LEU   2   3.857 -10.091   2.902
   17    HA   PRO   3           HA       PRO   3   6.307  -7.646  -2.749
   18    HB2  PRO   3           2HB      PRO   3   4.115  -9.638  -3.124
   19    HB3  PRO   3           3HB      PRO   3   5.699  -9.538  -3.942
   20    HG2  PRO   3           2HG      PRO   3   5.205 -11.443  -2.048
   21    HG3  PRO   3           3HG      PRO   3   6.800 -10.629  -2.155
   22    HD2  PRO   3           2HD      PRO   3   4.497  -9.996  -0.285
   23    HD3  PRO   3           3HD      PRO   3   6.236 -10.199   0.080
   24    H    ARG   4           H        ARG   4   5.008  -6.300  -4.094
   25    HA   ARG   4           HA       ARG   4   3.252  -4.673  -2.562
   26    HB2  ARG   4           2HB      ARG   4   3.643  -4.599  -5.573
   27    HB3  ARG   4           3HB      ARG   4   3.002  -3.307  -4.557
   28    HG2  ARG   4           2HG      ARG   4   5.851  -4.388  -4.560
   29    HG3  ARG   4           3HG      ARG   4   5.296  -2.809  -5.109
   30    HD2  ARG   4           2HD      ARG   4   4.619  -2.249  -2.777
   31    HD3  ARG   4           3HD      ARG   4   5.236  -3.808  -2.222
   32    HE   ARG   4           HE       ARG   4   6.849  -1.549  -3.331
   33   HH11  ARG   4          1HH1      ARG   4   6.909  -4.562  -1.438
   34   HH12  ARG   4          2HH1      ARG   4   8.596  -4.352  -1.101
   35   HH21  ARG   4          1HH2      ARG   4   8.967  -1.400  -2.785
   36   HH22  ARG   4          2HH2      ARG   4   9.710  -2.623  -1.800
   37    H    LYS   5           H        LYS   5   2.378  -7.252  -4.740
   38    HA   LYS   5           HA       LYS   5  -0.446  -6.730  -4.910
   39    HB2  LYS   5           2HB      LYS   5   0.821  -8.334  -6.315
   40    HB3  LYS   5           3HB      LYS   5   1.063  -9.385  -4.915
   41    HG2  LYS   5           2HG      LYS   5  -1.409  -9.667  -4.717
   42    HG3  LYS   5           3HG      LYS   5  -1.641  -8.630  -6.125
   43    HD2  LYS   5           2HD      LYS   5  -0.155 -11.296  -6.060
   44    HD3  LYS   5           3HD      LYS   5  -1.802 -11.075  -6.633
   45    HE2  LYS   5           2HE      LYS   5   0.676  -9.805  -7.893
   46    HE3  LYS   5           3HE      LYS   5  -0.100 -11.284  -8.450
   47    HZ1  LYS   5           HZ1      LYS   5  -0.867  -9.394  -9.733
   48    HZ2  LYS   5           HZ2      LYS   5  -2.122 -10.002  -8.891
   49    HZ3  LYS   5           HZ3      LYS   5  -1.403  -8.614  -8.406
   50    H    ILE   6           H        ILE   6   1.468  -8.432  -2.423
   51    HA   ILE   6           HA       ILE   6  -0.881  -9.099  -0.788
   52    HB   ILE   6           HB       ILE   6   2.119  -9.353  -0.333
   53   HG12  ILE   6          2HG1      ILE   6   1.584 -11.790  -0.200
   54   HG13  ILE   6          3HG1      ILE   6  -0.083 -11.453  -0.660
   55   HG21  ILE   6          1HG2      ILE   6   1.548 -10.593   1.751
   56   HG22  ILE   6          2HG2      ILE   6   1.102  -8.896   1.847
   57   HG23  ILE   6          3HG2      ILE   6  -0.153 -10.117   1.551
   58   HD11  ILE   6          3HD1      ILE   6   2.351 -10.855  -2.395
   59   HD12  ILE   6          1HD1      ILE   6   1.397 -12.344  -2.482
   60   HD13  ILE   6          2HD1      ILE   6   0.636 -10.808  -2.899
   61    H    LEU   7           H        LEU   7   1.832  -6.746  -0.609
   62    HA   LEU   7           HA       LEU   7   1.063  -5.529   1.813
   63    HB2  LEU   7           2HB      LEU   7   3.258  -5.328   0.625
   64    HB3  LEU   7           3HB      LEU   7   2.489  -4.293  -0.573
   65    HG   LEU   7           HG       LEU   7   2.076  -2.556   1.093
   66   HD11  LEU   7          1HD1      LEU   7   3.057  -2.726   3.375
   67   HD12  LEU   7          2HD1      LEU   7   1.735  -3.868   3.143
   68   HD13  LEU   7          3HD1      LEU   7   3.421  -4.439   3.083
   69   HD21  LEU   7          3HD2      LEU   7   4.935  -3.611   1.231
   70   HD22  LEU   7          1HD2      LEU   7   4.258  -2.633  -0.087
   71   HD23  LEU   7          2HD2      LEU   7   4.411  -1.938   1.533
   72    H    CYS   8           H        CYS   8  -0.132  -4.880  -1.481
   73    HA   CYS   8           HA       CYS   8  -1.618  -2.525  -0.847
   74    HB2  CYS   8           2HB      CYS   8  -1.015  -3.279  -3.118
   75    HB3  CYS   8           3HB      CYS   8  -2.156  -4.618  -2.976
   76    H    ALA   9           H        ALA   9  -2.396  -5.945  -0.251
   77    HA   ALA   9           HA       ALA   9  -5.247  -5.490   0.177
   78    HB1  ALA   9           3HB      ALA   9  -3.462  -7.765   1.145
   79    HB2  ALA   9           1HB      ALA   9  -5.233  -7.751   1.077
   80    HB3  ALA   9           2HB      ALA   9  -4.294  -7.707  -0.428
   81    H    ILE  10           H        ILE  10  -2.329  -5.342   2.164
   82    HA   ILE  10           HA       ILE  10  -3.691  -4.757   4.679
   83    HB   ILE  10           HB       ILE  10  -0.844  -4.050   3.875
   84   HG12  ILE  10          2HG1      ILE  10  -1.090  -6.430   3.442
   85   HG13  ILE  10          3HG1      ILE  10  -0.063  -6.134   4.809
   86   HG21  ILE  10          1HG2      ILE  10  -2.156  -4.451   6.589
   87   HG22  ILE  10          2HG2      ILE  10  -0.420  -4.193   6.312
   88   HG23  ILE  10          3HG2      ILE  10  -1.577  -2.924   5.895
   89   HD11  ILE  10          3HD1      ILE  10  -1.553  -8.055   5.191
   90   HD12  ILE  10          1HD1      ILE  10  -1.900  -6.776   6.363
   91   HD13  ILE  10          2HD1      ILE  10  -2.981  -7.030   4.970
   92    H    ALA  11           H        ALA  11  -2.038  -2.793   2.165
   93    HA   ALA  11           HA       ALA  11  -2.334  -0.290   3.308
   94    HB1  ALA  11           3HB      ALA  11  -0.977  -0.982   1.257
   95    HB2  ALA  11           1HB      ALA  11  -2.487  -0.838   0.312
   96    HB3  ALA  11           2HB      ALA  11  -1.799   0.572   1.139
   97    H    LYS  12           H        LYS  12  -4.677  -1.887   1.096
   98    HA   LYS  12           HA       LYS  12  -6.572   0.335   1.220
   99    HB2  LYS  12           2HB      LYS  12  -6.822  -2.497   0.146
  100    HB3  LYS  12           3HB      LYS  12  -8.029  -1.216  -0.074
  101    HG2  LYS  12           2HG      LYS  12  -6.312   0.207  -1.194
  102    HG3  LYS  12           3HG      LYS  12  -5.141  -1.100  -1.068
  103    HD2  LYS  12           2HD      LYS  12  -7.707  -1.087  -2.686
  104    HD3  LYS  12           3HD      LYS  12  -6.037  -1.055  -3.280
  105    HE2  LYS  12           2HE      LYS  12  -5.675  -3.328  -2.271
  106    HE3  LYS  12           3HE      LYS  12  -7.378  -3.366  -1.804
  107    HZ1  LYS  12           HZ1      LYS  12  -7.026  -4.500  -3.922
  108    HZ2  LYS  12           HZ2      LYS  12  -7.972  -3.193  -4.160
  109    HZ3  LYS  12           HZ3      LYS  12  -6.399  -3.154  -4.605
  110    H    LYS  13           H        LYS  13  -6.199  -2.620   3.098
  111    HA   LYS  13           HA       LYS  13  -8.800  -2.470   4.406
  112    HB2  LYS  13           2HB      LYS  13  -7.486  -4.534   4.156
  113    HB3  LYS  13           3HB      LYS  13  -6.233  -3.895   5.230
  114    HG2  LYS  13           2HG      LYS  13  -7.903  -3.785   7.078
  115    HG3  LYS  13           3HG      LYS  13  -9.145  -4.422   5.994
  116    HD2  LYS  13           2HD      LYS  13  -6.581  -5.867   6.811
  117    HD3  LYS  13           3HD      LYS  13  -8.184  -6.135   7.512
  118    HE2  LYS  13           2HE      LYS  13  -9.035  -6.804   5.251
  119    HE3  LYS  13           3HE      LYS  13  -7.399  -6.629   4.602
  120    HZ1  LYS  13           HZ1      LYS  13  -8.188  -8.530   6.748
  121    HZ2  LYS  13           HZ2      LYS  13  -7.868  -8.932   5.201
  122    HZ3  LYS  13           HZ3      LYS  13  -6.672  -8.367   6.157
  123    H    LYS  14           H        LYS  14  -5.536  -1.332   5.289
  124    HA   LYS  14           HA       LYS  14  -6.492  -0.074   7.785
  125    HB2  LYS  14           2HB      LYS  14  -3.800  -0.376   6.425
  126    HB3  LYS  14           3HB      LYS  14  -4.026   0.783   7.725
  127    HG2  LYS  14           2HG      LYS  14  -3.111  -1.255   8.604
  128    HG3  LYS  14           3HG      LYS  14  -4.699  -0.913   9.291
  129    HD2  LYS  14           2HD      LYS  14  -5.722  -2.676   7.918
  130    HD3  LYS  14           3HD      LYS  14  -4.203  -2.907   7.043
  131    HE2  LYS  14           2HE      LYS  14  -4.412  -4.690   8.627
  132    HE3  LYS  14           3HE      LYS  14  -3.097  -3.634   9.145
  133    HZ1  LYS  14           HZ1      LYS  14  -4.553  -4.262  10.996
  134    HZ2  LYS  14           HZ2      LYS  14  -4.619  -2.650  10.779
  135    HZ3  LYS  14           HZ3      LYS  14  -5.853  -3.598  10.273
  136    H    GLY  15           H        GLY  15  -6.108   1.022   4.511
  137    HA2  GLY  15           HA2      GLY  15  -6.932   3.047   3.628
  138    HA3  GLY  15           HA3      GLY  15  -7.069   3.736   5.251
  139    H    LYS  16           H        LYS  16  -4.202   2.094   4.136
  140    HA   LYS  16           HA       LYS  16  -2.513   4.512   4.550
  141    HB2  LYS  16           2HB      LYS  16  -2.118   1.500   4.728
  142    HB3  LYS  16           3HB      LYS  16  -0.761   2.612   4.658
  143    HG2  LYS  16           2HG      LYS  16  -1.554   3.783   6.678
  144    HG3  LYS  16           3HG      LYS  16  -2.968   2.728   6.757
  145    HD2  LYS  16           2HD      LYS  16  -1.205   2.037   8.345
  146    HD3  LYS  16           3HD      LYS  16  -1.541   0.768   7.153
  147    HE2  LYS  16           2HE      LYS  16   0.421   1.406   5.841
  148    HE3  LYS  16           3HE      LYS  16   0.737   2.777   6.908
  149    HZ1  LYS  16           HZ1      LYS  16   0.849  -0.079   7.743
  150    HZ2  LYS  16           HZ2      LYS  16   2.144   0.877   7.482
  151    HZ3  LYS  16           HZ3      LYS  16   1.141   1.195   8.725
  152    H    CYS  17           H        CYS  17  -3.772   2.958   1.867
  153    HA   CYS  17           HA       CYS  17  -1.396   2.857   0.228
  154    HB2  CYS  17           2HB      CYS  17  -3.528   1.473  -0.071
  155    HB3  CYS  17           3HB      CYS  17  -4.242   2.931  -0.771
  156    H    LYS  18           H        LYS  18  -0.338   4.556  -0.391
  157    HA   LYS  18           HA       LYS  18  -1.546   6.808  -1.830
  158    HB2  LYS  18           2HB      LYS  18  -0.466   8.527  -0.383
  159    HB3  LYS  18           3HB      LYS  18  -1.796   7.680   0.396
  160    HG2  LYS  18           2HG      LYS  18  -0.258   6.307   1.695
  161    HG3  LYS  18           3HG      LYS  18   1.143   7.005   0.856
  162    HD2  LYS  18           2HD      LYS  18   0.574   9.238   1.775
  163    HD3  LYS  18           3HD      LYS  18  -0.840   8.539   2.599
  164    HE2  LYS  18           2HE      LYS  18   0.658   7.021   3.875
  165    HE3  LYS  18           3HE      LYS  18   2.064   7.713   3.057
  166    HZ1  LYS  18           HZ1      LYS  18   1.510   9.864   4.065
  167    HZ2  LYS  18           HZ2      LYS  18   0.211   9.226   4.824
  168    HZ3  LYS  18           HZ3      LYS  18   1.715   8.741   5.229
  169    H    GLY  19           H        GLY  19   0.205   8.277  -2.676
  170    HA2  GLY  19           HA2      GLY  19   2.126   8.551  -3.946
  171    HA3  GLY  19           HA3      GLY  19   2.925   7.772  -2.586
  172    HA   PRO  20           HA       PRO  20   4.052   4.996  -6.012
  173    HB2  PRO  20           2HB      PRO  20   5.330   3.503  -3.715
  174    HB3  PRO  20           3HB      PRO  20   5.993   3.859  -5.341
  175    HG2  PRO  20           2HG      PRO  20   6.767   5.344  -3.221
  176    HG3  PRO  20           3HG      PRO  20   6.352   6.160  -4.766
  177    HD2  PRO  20           2HD      PRO  20   4.615   5.807  -2.301
  178    HD3  PRO  20           3HD      PRO  20   4.898   7.275  -3.286
  179    H    LEU  21           H        LEU  21   2.784   3.679  -2.878
  180    HA   LEU  21           HA       LEU  21   2.083   1.127  -3.963
  181    HB2  LEU  21           2HB      LEU  21   2.160   2.205  -1.445
  182    HB3  LEU  21           3HB      LEU  21   0.438   2.273  -1.718
  183    HG   LEU  21           HG       LEU  21   0.880   0.275  -0.541
  184   HD11  LEU  21          1HD1      LEU  21  -0.702  -0.147  -2.411
  185   HD12  LEU  21          2HD1      LEU  21   0.659  -0.684  -3.423
  186   HD13  LEU  21          3HD1      LEU  21   0.237  -1.576  -1.956
  187   HD21  LEU  21          3HD2      LEU  21   2.508  -1.417  -1.211
  188   HD22  LEU  21          1HD2      LEU  21   3.016  -0.418  -2.591
  189   HD23  LEU  21          2HD2      LEU  21   3.290   0.147  -0.926
  190    H    LYS  22           H        LYS  22   0.289   4.136  -3.745
  191    HA   LYS  22           HA       LYS  22  -2.259   3.177  -4.782
  192    HB2  LYS  22           2HB      LYS  22  -2.100   5.157  -3.399
  193    HB3  LYS  22           3HB      LYS  22  -1.067   5.976  -4.585
  194    HG2  LYS  22           2HG      LYS  22  -2.889   6.050  -6.204
  195    HG3  LYS  22           3HG      LYS  22  -3.912   5.049  -5.161
  196    HD2  LYS  22           2HD      LYS  22  -3.901   6.830  -3.430
  197    HD3  LYS  22           3HD      LYS  22  -2.874   7.837  -4.479
  198    HE2  LYS  22           2HE      LYS  22  -4.643   7.812  -6.225
  199    HE3  LYS  22           3HE      LYS  22  -5.657   6.799  -5.190
  200    HZ1  LYS  22           HZ1      LYS  22  -4.774   9.560  -4.526
  201    HZ2  LYS  22           HZ2      LYS  22  -6.273   9.138  -5.009
  202    HZ3  LYS  22           HZ3      LYS  22  -5.710   8.619  -3.569
  203    H    LEU  23           H        LEU  23   0.628   4.647  -6.318
  204    HA   LEU  23           HA       LEU  23  -0.460   4.651  -8.982
  205    HB2  LEU  23           2HB      LEU  23   1.436   6.040  -8.215
  206    HB3  LEU  23           3HB      LEU  23   2.411   4.595  -7.970
  207    HG   LEU  23           HG       LEU  23   2.362   4.124 -10.406
  208   HD11  LEU  23          1HD1      LEU  23   1.581   5.905 -11.963
  209   HD12  LEU  23          2HD1      LEU  23   0.242   5.188 -11.064
  210   HD13  LEU  23          3HD1      LEU  23   0.872   6.784 -10.590
  211   HD21  LEU  23          3HD2      LEU  23   3.829   5.974 -11.071
  212   HD22  LEU  23          1HD2      LEU  23   3.253   6.950  -9.699
  213   HD23  LEU  23          2HD2      LEU  23   4.179   5.459  -9.414
  214    H    VAL  24           H        VAL  24   1.400   2.215  -7.169
  215    HA   VAL  24           HA       VAL  24   1.769   0.348  -9.331
  216    HB   VAL  24           HB       VAL  24   1.907   0.109  -6.306
  217   HG11  VAL  24          1HG1      VAL  24   3.205  -1.992  -6.654
  218   HG12  VAL  24          2HG1      VAL  24   1.497  -2.167  -7.058
  219   HG13  VAL  24          3HG1      VAL  24   2.701  -1.995  -8.358
  220   HG21  VAL  24          3HG2      VAL  24   3.620   1.519  -7.582
  221   HG22  VAL  24          1HG2      VAL  24   4.268   0.217  -6.586
  222   HG23  VAL  24          2HG2      VAL  24   4.154   0.026  -8.359
  223    H    CYS  25           H        CYS  25  -0.732   0.610  -6.816
  224    HA   CYS  25           HA       CYS  25  -1.993  -1.918  -7.774
  225    HB2  CYS  25           2HB      CYS  25  -1.082  -1.603  -5.436
  226    HB3  CYS  25           3HB      CYS  25  -2.365  -0.429  -5.166
  227    H    LYS  26           H        LYS  26  -2.534   1.424  -7.905
  228    HA   LYS  26           HA       LYS  26  -4.213   2.812  -8.303
  229    HB2  LYS  26           2HB      LYS  26  -4.311   0.961 -10.282
  230    HB3  LYS  26           3HB      LYS  26  -5.983   0.894  -9.739
  231    HG2  LYS  26           2HG      LYS  26  -4.411   3.421 -10.420
  232    HG3  LYS  26           3HG      LYS  26  -5.485   2.584 -11.549
  233    HD2  LYS  26           2HD      LYS  26  -7.436   3.051 -10.141
  234    HD3  LYS  26           3HD      LYS  26  -6.411   3.813  -8.905
  235    HE2  LYS  26           2HE      LYS  26  -5.689   5.529 -10.478
  236    HE3  LYS  26           3HE      LYS  26  -6.641   4.787 -11.775
  237    HZ1  LYS  26           HZ1      LYS  26  -8.650   5.257 -10.480
  238    HZ2  LYS  26           HZ2      LYS  26  -7.775   5.933  -9.276
  239    HZ3  LYS  26           HZ3      LYS  26  -7.832   6.642 -10.745
  240    H    CYS  27           H        CYS  27  -4.285   2.623  -6.004
  241    HA   CYS  27           HA       CYS  27  -6.614   1.493  -4.666
  242    HB2  CYS  27           2HB      CYS  27  -4.507   3.467  -3.678
  243    HB3  CYS  27           3HB      CYS  27  -5.728   2.718  -2.704
  Start of MODEL   15
    1    H1   GLY   1           1H       GLY   1  10.937  -7.230   4.570
    2    H2   GLY   1           2H       GLY   1  10.435  -8.720   4.106
    3    H3   GLY   1           3H       GLY   1  10.816  -7.598   2.978
    4    HA2  GLY   1           HA2      GLY   1   8.558  -7.420   4.865
    5    HA3  GLY   1           HA3      GLY   1   8.975  -6.198   3.650
    6    H    LEU   2           H        LEU   2   6.465  -7.144   3.581
    7    HA   LEU   2           HA       LEU   2   6.099  -9.437   1.860
    8    HB2  LEU   2           2HB      LEU   2   4.275  -7.200   2.824
    9    HB3  LEU   2           3HB      LEU   2   3.728  -8.408   1.693
   10    HG   LEU   2           HG       LEU   2   2.941  -8.964   3.850
   11   HD11  LEU   2          1HD1      LEU   2   3.639 -10.846   2.361
   12   HD12  LEU   2          2HD1      LEU   2   5.186 -10.925   3.236
   13   HD13  LEU   2          3HD1      LEU   2   3.664 -11.248   4.085
   14   HD21  LEU   2          3HD2      LEU   2   5.782  -9.210   4.894
   15   HD22  LEU   2          1HD2      LEU   2   4.679  -7.849   5.235
   16   HD23  LEU   2          2HD2      LEU   2   4.272  -9.485   5.773
   17    HA   PRO   3           HA       PRO   3   6.470  -7.403  -2.112
   18    HB2  PRO   3           2HB      PRO   3   5.055  -9.045  -3.747
   19    HB3  PRO   3           3HB      PRO   3   6.561  -9.580  -2.942
   20    HG2  PRO   3           2HG      PRO   3   3.702 -10.054  -2.025
   21    HG3  PRO   3           3HG      PRO   3   5.016 -11.261  -2.206
   22    HD2  PRO   3           2HD      PRO   3   4.424 -10.073   0.187
   23    HD3  PRO   3           3HD      PRO   3   6.102 -10.506  -0.252
   24    H    ARG   4           H        ARG   4   5.250  -6.229  -3.704
   25    HA   ARG   4           HA       ARG   4   3.235  -4.533  -2.722
   26    HB2  ARG   4           2HB      ARG   4   4.099  -5.227  -5.553
   27    HB3  ARG   4           3HB      ARG   4   2.851  -4.022  -5.216
   28    HG2  ARG   4           2HG      ARG   4   4.383  -2.694  -3.864
   29    HG3  ARG   4           3HG      ARG   4   5.676  -3.893  -4.078
   30    HD2  ARG   4           2HD      ARG   4   5.705  -3.487  -6.493
   31    HD3  ARG   4           3HD      ARG   4   4.332  -2.372  -6.347
   32    HE   ARG   4           HE       ARG   4   6.451  -1.498  -4.633
   33   HH11  ARG   4          1HH1      ARG   4   5.739  -1.606  -8.061
   34   HH12  ARG   4          2HH1      ARG   4   6.732  -0.216  -8.405
   35   HH21  ARG   4          1HH2      ARG   4   7.717   0.255  -5.144
   36   HH22  ARG   4          2HH2      ARG   4   7.828   0.798  -6.792
   37    H    LYS   5           H        LYS   5   2.731  -7.542  -4.525
   38    HA   LYS   5           HA       LYS   5  -0.099  -7.222  -4.909
   39    HB2  LYS   5           2HB      LYS   5  -0.113  -9.562  -5.521
   40    HB3  LYS   5           3HB      LYS   5   1.259  -8.735  -6.256
   41    HG2  LYS   5           2HG      LYS   5   2.762  -9.696  -4.497
   42    HG3  LYS   5           3HG      LYS   5   1.370 -10.547  -3.802
   43    HD2  LYS   5           2HD      LYS   5   1.046 -11.770  -5.933
   44    HD3  LYS   5           3HD      LYS   5   2.446 -10.922  -6.629
   45    HE2  LYS   5           2HE      LYS   5   3.904 -11.882  -4.861
   46    HE3  LYS   5           3HE      LYS   5   2.512 -12.719  -4.160
   47    HZ1  LYS   5           HZ1      LYS   5   2.296 -13.967  -6.245
   48    HZ2  LYS   5           HZ2      LYS   5   3.582 -13.194  -6.894
   49    HZ3  LYS   5           HZ3      LYS   5   3.784 -14.188  -5.616
   50    H    ILE   6           H        ILE   6   1.657  -8.164  -2.068
   51    HA   ILE   6           HA       ILE   6  -0.850  -8.991  -0.667
   52    HB   ILE   6           HB       ILE   6   2.080  -9.240   0.067
   53   HG12  ILE   6          2HG1      ILE   6  -0.144 -11.300  -0.342
   54   HG13  ILE   6          3HG1      ILE   6   1.066 -10.886  -1.548
   55   HG21  ILE   6          1HG2      ILE   6   1.265 -10.332   2.182
   56   HG22  ILE   6          2HG2      ILE   6   0.889  -8.620   2.113
   57   HG23  ILE   6          3HG2      ILE   6  -0.384  -9.815   1.776
   58   HD11  ILE   6          3HD1      ILE   6   1.611 -12.256   1.105
   59   HD12  ILE   6          1HD1      ILE   6   1.713 -12.941  -0.523
   60   HD13  ILE   6          2HD1      ILE   6   2.865 -11.693  -0.030
   61    H    LEU   7           H        LEU   7   1.776  -6.521  -0.497
   62    HA   LEU   7           HA       LEU   7   0.703  -5.033   1.675
   63    HB2  LEU   7           2HB      LEU   7   2.224  -4.099  -0.790
   64    HB3  LEU   7           3HB      LEU   7   1.887  -3.082   0.604
   65    HG   LEU   7           HG       LEU   7   3.570  -5.619   0.714
   66   HD11  LEU   7          1HD1      LEU   7   4.639  -3.827  -0.597
   67   HD12  LEU   7          2HD1      LEU   7   4.349  -2.669   0.723
   68   HD13  LEU   7          3HD1      LEU   7   5.457  -4.040   0.958
   69   HD21  LEU   7          3HD2      LEU   7   3.029  -3.440   2.781
   70   HD22  LEU   7          1HD2      LEU   7   2.552  -5.152   2.895
   71   HD23  LEU   7          2HD2      LEU   7   4.261  -4.710   2.935
   72    H    CYS   8           H        CYS   8  -0.281  -5.001  -1.742
   73    HA   CYS   8           HA       CYS   8  -1.974  -2.728  -1.638
   74    HB2  CYS   8           2HB      CYS   8  -1.208  -3.758  -3.684
   75    HB3  CYS   8           3HB      CYS   8  -2.051  -5.259  -3.321
   76    H    ALA   9           H        ALA   9  -2.640  -6.075  -0.569
   77    HA   ALA   9           HA       ALA   9  -5.504  -5.744  -0.224
   78    HB1  ALA   9           3HB      ALA   9  -4.322  -7.958  -0.350
   79    HB2  ALA   9           1HB      ALA   9  -3.528  -7.600   1.207
   80    HB3  ALA   9           2HB      ALA   9  -5.289  -7.779   1.130
   81    H    ILE  10           H        ILE  10  -2.646  -5.325   1.795
   82    HA   ILE  10           HA       ILE  10  -4.051  -4.818   4.259
   83    HB   ILE  10           HB       ILE  10  -1.141  -4.444   3.439
   84   HG12  ILE  10          2HG1      ILE  10  -2.444  -6.757   4.954
   85   HG13  ILE  10          3HG1      ILE  10  -2.169  -6.800   3.232
   86   HG21  ILE  10          1HG2      ILE  10  -2.363  -4.585   6.235
   87   HG22  ILE  10          2HG2      ILE  10  -0.630  -4.492   5.857
   88   HG23  ILE  10          3HG2      ILE  10  -1.679  -3.128   5.481
   89   HD11  ILE  10          3HD1      ILE  10  -0.429  -8.003   4.249
   90   HD12  ILE  10          1HD1      ILE  10   0.245  -6.532   3.531
   91   HD13  ILE  10          2HD1      ILE  10   0.021  -6.640   5.301
   92    H    ALA  11           H        ALA  11  -2.316  -2.701   1.950
   93    HA   ALA  11           HA       ALA  11  -2.437  -0.288   3.321
   94    HB1  ALA  11           3HB      ALA  11  -2.657  -0.724   0.299
   95    HB2  ALA  11           1HB      ALA  11  -1.997   0.697   1.137
   96    HB3  ALA  11           2HB      ALA  11  -1.146  -0.834   1.239
   97    H    LYS  12           H        LYS  12  -4.885  -1.552   1.018
   98    HA   LYS  12           HA       LYS  12  -6.723   0.655   1.489
   99    HB2  LYS  12           2HB      LYS  12  -7.099  -1.971  -0.009
  100    HB3  LYS  12           3HB      LYS  12  -8.230  -0.603  -0.006
  101    HG2  LYS  12           2HG      LYS  12  -6.313   0.865  -0.805
  102    HG3  LYS  12           3HG      LYS  12  -5.369  -0.604  -1.053
  103    HD2  LYS  12           2HD      LYS  12  -7.948   0.178  -2.467
  104    HD3  LYS  12           3HD      LYS  12  -6.304   0.192  -3.123
  105    HE2  LYS  12           2HE      LYS  12  -6.223  -2.325  -2.687
  106    HE3  LYS  12           3HE      LYS  12  -7.957  -2.245  -2.350
  107    HZ1  LYS  12           HZ1      LYS  12  -8.285  -1.361  -4.599
  108    HZ2  LYS  12           HZ2      LYS  12  -6.679  -1.378  -4.905
  109    HZ3  LYS  12           HZ3      LYS  12  -7.493  -2.786  -4.697
  110    H    LYS  13           H        LYS  13  -6.491  -2.601   2.910
  111    HA   LYS  13           HA       LYS  13  -9.064  -2.393   4.288
  112    HB2  LYS  13           2HB      LYS  13  -6.670  -4.235   4.607
  113    HB3  LYS  13           3HB      LYS  13  -8.079  -4.310   5.671
  114    HG2  LYS  13           2HG      LYS  13  -9.581  -4.710   3.786
  115    HG3  LYS  13           3HG      LYS  13  -8.243  -4.577   2.638
  116    HD2  LYS  13           2HD      LYS  13  -7.144  -6.547   3.705
  117    HD3  LYS  13           3HD      LYS  13  -8.512  -6.680   4.834
  118    HE2  LYS  13           2HE      LYS  13 -10.056  -6.958   2.887
  119    HE3  LYS  13           3HE      LYS  13  -8.671  -6.879   1.790
  120    HZ1  LYS  13           HZ1      LYS  13  -9.087  -8.961   3.873
  121    HZ2  LYS  13           HZ2      LYS  13  -9.289  -9.177   2.270
  122    HZ3  LYS  13           HZ3      LYS  13  -7.798  -8.894   2.869
  123    H    LYS  14           H        LYS  14  -5.734  -1.584   5.244
  124    HA   LYS  14           HA       LYS  14  -6.584  -0.614   7.911
  125    HB2  LYS  14           2HB      LYS  14  -3.948  -0.790   6.422
  126    HB3  LYS  14           3HB      LYS  14  -4.101   0.255   7.815
  127    HG2  LYS  14           2HG      LYS  14  -3.172  -1.896   8.436
  128    HG3  LYS  14           3HG      LYS  14  -4.676  -1.544   9.283
  129    HD2  LYS  14           2HD      LYS  14  -5.905  -3.124   7.873
  130    HD3  LYS  14           3HD      LYS  14  -4.452  -3.419   6.887
  131    HE2  LYS  14           2HE      LYS  14  -3.274  -4.304   8.869
  132    HE3  LYS  14           3HE      LYS  14  -4.665  -3.927   9.891
  133    HZ1  LYS  14           HZ1      LYS  14  -4.650  -6.265   9.250
  134    HZ2  LYS  14           HZ2      LYS  14  -5.968  -5.543   8.623
  135    HZ3  LYS  14           HZ3      LYS  14  -4.689  -5.896   7.663
  136    H    GLY  15           H        GLY  15  -6.582   0.738   4.775
  137    HA2  GLY  15           HA2      GLY  15  -7.287   2.813   4.060
  138    HA3  GLY  15           HA3      GLY  15  -7.537   3.308   5.738
  139    H    LYS  16           H        LYS  16  -4.409   2.109   4.619
  140    HA   LYS  16           HA       LYS  16  -3.246   4.871   4.634
  141    HB2  LYS  16           2HB      LYS  16  -2.910   3.779   6.825
  142    HB3  LYS  16           3HB      LYS  16  -2.056   2.449   6.031
  143    HG2  LYS  16           2HG      LYS  16  -0.330   4.004   5.205
  144    HG3  LYS  16           3HG      LYS  16  -1.206   5.384   5.874
  145    HD2  LYS  16           2HD      LYS  16  -0.050   3.093   7.527
  146    HD3  LYS  16           3HD      LYS  16   0.755   4.645   7.238
  147    HE2  LYS  16           2HE      LYS  16  -1.176   5.834   8.278
  148    HE3  LYS  16           3HE      LYS  16  -1.937   4.279   8.628
  149    HZ1  LYS  16           HZ1      LYS  16  -0.014   3.725  10.026
  150    HZ2  LYS  16           HZ2      LYS  16   0.687   5.167   9.708
  151    HZ3  LYS  16           HZ3      LYS  16  -0.708   5.105  10.550
  152    H    CYS  17           H        CYS  17  -3.089   5.006   2.503
  153    HA   CYS  17           HA       CYS  17  -1.016   3.410   1.107
  154    HB2  CYS  17           2HB      CYS  17  -3.283   2.329   0.748
  155    HB3  CYS  17           3HB      CYS  17  -3.835   3.834   0.051
  156    H    LYS  18           H        LYS  18   0.196   4.712  -0.216
  157    HA   LYS  18           HA       LYS  18  -0.794   7.218  -1.373
  158    HB2  LYS  18           2HB      LYS  18   0.847   8.661  -0.244
  159    HB3  LYS  18           3HB      LYS  18  -0.269   7.947   0.910
  160    HG2  LYS  18           2HG      LYS  18   1.444   6.297   1.601
  161    HG3  LYS  18           3HG      LYS  18   2.552   6.905   0.366
  162    HD2  LYS  18           2HD      LYS  18   3.204   7.794   2.501
  163    HD3  LYS  18           3HD      LYS  18   2.607   9.115   1.487
  164    HE2  LYS  18           2HE      LYS  18   0.418   9.031   2.670
  165    HE3  LYS  18           3HE      LYS  18   0.999   7.681   3.654
  166    HZ1  LYS  18           HZ1      LYS  18   1.224   9.800   4.824
  167    HZ2  LYS  18           HZ2      LYS  18   2.706   9.170   4.562
  168    HZ3  LYS  18           HZ3      LYS  18   2.171  10.414   3.647
  169    H    GLY  19           H        GLY  19   0.928   8.375  -2.571
  170    HA2  GLY  19           HA2      GLY  19   2.469   8.414  -4.290
  171    HA3  GLY  19           HA3      GLY  19   3.486   7.660  -3.081
  172    HA   PRO  20           HA       PRO  20   3.755   4.630  -6.438
  173    HB2  PRO  20           2HB      PRO  20   5.411   2.778  -5.272
  174    HB3  PRO  20           3HB      PRO  20   5.974   4.353  -5.908
  175    HG2  PRO  20           2HG      PRO  20   5.288   3.646  -3.038
  176    HG3  PRO  20           3HG      PRO  20   6.742   4.493  -3.654
  177    HD2  PRO  20           2HD      PRO  20   4.618   5.848  -2.641
  178    HD3  PRO  20           3HD      PRO  20   5.530   6.487  -4.043
  179    H    LEU  21           H        LEU  21   2.931   3.597  -3.062
  180    HA   LEU  21           HA       LEU  21   1.825   1.067  -3.845
  181    HB2  LEU  21           2HB      LEU  21   2.436   2.239  -1.451
  182    HB3  LEU  21           3HB      LEU  21   0.717   2.533  -1.461
  183    HG   LEU  21           HG       LEU  21   1.092   0.555  -0.226
  184   HD11  LEU  21          1HD1      LEU  21  -0.075  -1.224  -1.351
  185   HD12  LEU  21          2HD1      LEU  21  -0.828   0.310  -1.806
  186   HD13  LEU  21          3HD1      LEU  21   0.254  -0.523  -2.945
  187   HD21  LEU  21          3HD2      LEU  21   2.716  -0.559  -2.548
  188   HD22  LEU  21          1HD2      LEU  21   3.363   0.071  -1.014
  189   HD23  LEU  21          2HD2      LEU  21   2.349  -1.379  -1.018
  190    H    LYS  22           H        LYS  22   0.420   4.289  -3.523
  191    HA   LYS  22           HA       LYS  22  -2.333   3.587  -4.134
  192    HB2  LYS  22           2HB      LYS  22  -1.802   5.624  -2.956
  193    HB3  LYS  22           3HB      LYS  22  -0.809   6.215  -4.298
  194    HG2  LYS  22           2HG      LYS  22  -2.774   6.440  -5.730
  195    HG3  LYS  22           3HG      LYS  22  -3.812   5.715  -4.487
  196    HD2  LYS  22           2HD      LYS  22  -3.329   7.598  -2.962
  197    HD3  LYS  22           3HD      LYS  22  -2.183   8.264  -4.133
  198    HE2  LYS  22           2HE      LYS  22  -4.058   9.579  -4.487
  199    HE3  LYS  22           3HE      LYS  22  -4.149   8.392  -5.790
  200    HZ1  LYS  22           HZ1      LYS  22  -6.298   8.674  -4.711
  201    HZ2  LYS  22           HZ2      LYS  22  -5.791   7.152  -4.406
  202    HZ3  LYS  22           HZ3      LYS  22  -5.691   8.299  -3.246
  203    H    LEU  23           H        LEU  23   0.359   4.716  -6.191
  204    HA   LEU  23           HA       LEU  23  -1.095   4.673  -8.648
  205    HB2  LEU  23           2HB      LEU  23   1.067   5.813  -8.281
  206    HB3  LEU  23           3HB      LEU  23   1.868   4.256  -8.076
  207    HG   LEU  23           HG       LEU  23   1.377   3.670 -10.436
  208   HD11  LEU  23          1HD1      LEU  23   0.603   5.456 -11.989
  209   HD12  LEU  23          2HD1      LEU  23  -0.661   4.982 -10.852
  210   HD13  LEU  23          3HD1      LEU  23   0.237   6.498 -10.596
  211   HD21  LEU  23          3HD2      LEU  23   2.953   5.257 -11.447
  212   HD22  LEU  23          1HD2      LEU  23   2.730   6.376 -10.082
  213   HD23  LEU  23          2HD2      LEU  23   3.488   4.787  -9.826
  214    H    VAL  24           H        VAL  24   0.724   2.088  -7.002
  215    HA   VAL  24           HA       VAL  24   0.398   0.067  -9.044
  216    HB   VAL  24           HB       VAL  24   1.077  -0.035  -6.082
  217   HG11  VAL  24          1HG1      VAL  24   0.233  -2.257  -6.631
  218   HG12  VAL  24          2HG1      VAL  24   1.238  -2.308  -8.099
  219   HG13  VAL  24          3HG1      VAL  24   1.986  -2.301  -6.487
  220   HG21  VAL  24          3HG2      VAL  24   2.698   1.077  -7.745
  221   HG22  VAL  24          1HG2      VAL  24   3.335  -0.216  -6.739
  222   HG23  VAL  24          2HG2      VAL  24   2.919  -0.527  -8.451
  223    H    CYS  25           H        CYS  25  -1.364   0.761  -6.037
  224    HA   CYS  25           HA       CYS  25  -3.103  -1.588  -6.401
  225    HB2  CYS  25           2HB      CYS  25  -1.683  -1.101  -4.404
  226    HB3  CYS  25           3HB      CYS  25  -2.668   0.316  -4.087
  227    H    LYS  26           H        LYS  26  -3.376   1.720  -6.994
  228    HA   LYS  26           HA       LYS  26  -5.037   3.209  -7.398
  229    HB2  LYS  26           2HB      LYS  26  -6.570   0.718  -8.190
  230    HB3  LYS  26           3HB      LYS  26  -7.050   2.364  -8.597
  231    HG2  LYS  26           2HG      LYS  26  -4.357   1.149  -9.321
  232    HG3  LYS  26           3HG      LYS  26  -5.759   1.089 -10.389
  233    HD2  LYS  26           2HD      LYS  26  -4.320   3.618  -9.455
  234    HD3  LYS  26           3HD      LYS  26  -4.167   2.843 -11.031
  235    HE2  LYS  26           2HE      LYS  26  -6.607   3.201 -11.442
  236    HE3  LYS  26           3HE      LYS  26  -6.729   4.051  -9.897
  237    HZ1  LYS  26           HZ1      LYS  26  -5.139   5.694 -10.753
  238    HZ2  LYS  26           HZ2      LYS  26  -5.031   4.905 -12.182
  239    HZ3  LYS  26           HZ3      LYS  26  -6.436   5.602 -11.738
  240    H    CYS  27           H        CYS  27  -4.636   3.100  -5.067
  241    HA   CYS  27           HA       CYS  27  -6.823   2.559  -3.224
  242    HB2  CYS  27           2HB      CYS  27  -4.356   4.306  -2.862
  243    HB3  CYS  27           3HB      CYS  27  -5.437   3.768  -1.602
  Start of MODEL   16
    1    H1   GLY   1           1H       GLY   1  11.036 -10.101   3.838
    2    H2   GLY   1           2H       GLY   1   9.990 -11.275   3.376
    3    H3   GLY   1           3H       GLY   1  10.730 -10.350   2.248
    4    HA2  GLY   1           HA2      GLY   1   8.776  -9.382   4.231
    5    HA3  GLY   1           HA3      GLY   1   9.586  -8.374   3.019
    6    H    LEU   2           H        LEU   2   6.862  -8.382   3.113
    7    HA   LEU   2           HA       LEU   2   5.668 -10.288   1.275
    8    HB2  LEU   2           2HB      LEU   2   4.715  -7.648   2.436
    9    HB3  LEU   2           3HB      LEU   2   3.717  -8.654   1.400
   10    HG   LEU   2           HG       LEU   2   4.835  -9.533   4.099
   11   HD11  LEU   2          1HD1      LEU   2   2.510  -9.260   4.885
   12   HD12  LEU   2          2HD1      LEU   2   3.191  -7.724   4.329
   13   HD13  LEU   2          3HD1      LEU   2   2.046  -8.606   3.298
   14   HD21  LEU   2          3HD2      LEU   2   3.143 -11.358   3.882
   15   HD22  LEU   2          1HD2      LEU   2   2.805 -10.826   2.220
   16   HD23  LEU   2          2HD2      LEU   2   4.405 -11.469   2.655
   17    HA   PRO   3           HA       PRO   3   6.480  -8.005  -2.533
   18    HB2  PRO   3           2HB      PRO   3   4.679  -9.126  -4.226
   19    HB3  PRO   3           3HB      PRO   3   6.054 -10.062  -3.562
   20    HG2  PRO   3           2HG      PRO   3   3.196  -9.981  -2.536
   21    HG3  PRO   3           3HG      PRO   3   4.195 -11.425  -2.898
   22    HD2  PRO   3           2HD      PRO   3   3.957 -10.382  -0.375
   23    HD3  PRO   3           3HD      PRO   3   5.474 -11.143  -0.942
   24    H    ARG   4           H        ARG   4   5.451  -6.432  -3.935
   25    HA   ARG   4           HA       ARG   4   3.829  -4.494  -2.669
   26    HB2  ARG   4           2HB      ARG   4   4.350  -5.004  -5.624
   27    HB3  ARG   4           3HB      ARG   4   3.541  -3.563  -4.997
   28    HG2  ARG   4           2HG      ARG   4   5.512  -2.973  -3.654
   29    HG3  ARG   4           3HG      ARG   4   6.369  -4.411  -4.219
   30    HD2  ARG   4           2HD      ARG   4   5.404  -2.118  -5.979
   31    HD3  ARG   4           3HD      ARG   4   7.050  -2.325  -5.407
   32    HE   ARG   4           HE       ARG   4   5.709  -3.788  -7.570
   33   HH11  ARG   4          2HH1      ARG   4   8.517  -3.849  -5.467
   34   HH12  ARG   4          1HH1      ARG   4   9.390  -4.924  -6.525
   35   HH21  ARG   4          1HH2      ARG   4   6.880  -5.155  -8.859
   36   HH22  ARG   4          2HH2      ARG   4   8.483  -5.637  -8.391
   37    H    LYS   5           H        LYS   5   2.771  -7.162  -4.734
   38    HA   LYS   5           HA       LYS   5   0.052  -6.665  -5.113
   39    HB2  LYS   5           2HB      LYS   5   1.339  -8.441  -6.176
   40    HB3  LYS   5           3HB      LYS   5   1.743  -9.162  -4.621
   41    HG2  LYS   5           2HG      LYS   5   0.116 -10.508  -5.745
   42    HG3  LYS   5           3HG      LYS   5  -0.578  -9.840  -4.271
   43    HD2  LYS   5           2HD      LYS   5  -1.746  -8.080  -5.667
   44    HD3  LYS   5           3HD      LYS   5  -1.076  -8.863  -7.128
   45    HE2  LYS   5           2HE      LYS   5  -2.082 -11.007  -6.393
   46    HE3  LYS   5           3HE      LYS   5  -2.742 -10.202  -4.964
   47    HZ1  LYS   5           HZ1      LYS   5  -4.417 -10.377  -6.740
   48    HZ2  LYS   5           HZ2      LYS   5  -4.090  -8.804  -6.459
   49    HZ3  LYS   5           HZ3      LYS   5  -3.476  -9.547  -7.780
   50    H    ILE   6           H        ILE   6   1.679  -7.951  -2.217
   51    HA   ILE   6           HA       ILE   6  -0.954  -8.326  -0.861
   52    HB   ILE   6           HB       ILE   6   1.777  -9.433  -0.139
   53   HG12  ILE   6          2HG1      ILE   6  -0.675 -10.753  -1.416
   54   HG13  ILE   6          3HG1      ILE   6   0.823 -10.373  -2.259
   55   HG21  ILE   6          1HG2      ILE   6  -1.007  -9.980   1.004
   56   HG22  ILE   6          2HG2      ILE   6   0.485 -10.821   1.482
   57   HG23  ILE   6          3HG2      ILE   6   0.294  -9.111   1.835
   58   HD11  ILE   6          3HD1      ILE   6   0.838 -12.689  -1.805
   59   HD12  ILE   6          1HD1      ILE   6   2.057 -11.936  -0.757
   60   HD13  ILE   6          2HD1      ILE   6   0.486 -12.452  -0.087
   61    H    LEU   7           H        LEU   7   2.111  -6.504  -0.543
   62    HA   LEU   7           HA       LEU   7   1.471  -5.109   1.876
   63    HB2  LEU   7           2HB      LEU   7   2.884  -4.217  -0.672
   64    HB3  LEU   7           3HB      LEU   7   2.805  -3.230   0.777
   65    HG   LEU   7           HG       LEU   7   4.103  -5.986   0.684
   66   HD11  LEU   7          1HD1      LEU   7   5.317  -4.367  -0.718
   67   HD12  LEU   7          2HD1      LEU   7   5.344  -3.202   0.627
   68   HD13  LEU   7          3HD1      LEU   7   6.230  -4.740   0.749
   69   HD21  LEU   7          3HD2      LEU   7   3.377  -5.389   2.955
   70   HD22  LEU   7          1HD2      LEU   7   5.132  -5.240   2.832
   71   HD23  LEU   7          2HD2      LEU   7   4.120  -3.782   2.796
   72    H    CYS   8           H        CYS   8   0.177  -4.718  -1.423
   73    HA   CYS   8           HA       CYS   8  -1.337  -2.336  -0.818
   74    HB2  CYS   8           2HB      CYS   8  -0.741  -3.049  -3.088
   75    HB3  CYS   8           3HB      CYS   8  -1.809  -4.448  -2.945
   76    H    ALA   9           H        ALA   9  -2.000  -5.772  -0.204
   77    HA   ALA   9           HA       ALA   9  -4.857  -5.400   0.283
   78    HB1  ALA   9           3HB      ALA   9  -3.869  -7.595  -0.352
   79    HB2  ALA   9           1HB      ALA   9  -2.998  -7.640   1.200
   80    HB3  ALA   9           2HB      ALA   9  -4.769  -7.662   1.175
   81    H    ILE  10           H        ILE  10  -1.897  -5.460   2.276
   82    HA   ILE  10           HA       ILE  10  -3.106  -4.812   4.805
   83    HB   ILE  10           HB       ILE  10  -0.360  -4.007   3.761
   84   HG12  ILE  10          2HG1      ILE  10  -0.598  -6.425   3.536
   85   HG13  ILE  10          3HG1      ILE  10   0.570  -5.988   4.741
   86   HG21  ILE  10          1HG2      ILE  10  -0.929  -2.745   5.747
   87   HG22  ILE  10          2HG2      ILE  10  -1.438  -4.218   6.596
   88   HG23  ILE  10          3HG2      ILE  10   0.269  -3.973   6.167
   89   HD11  ILE  10          3HD1      ILE  10  -2.276  -6.950   5.297
   90   HD12  ILE  10          1HD1      ILE  10  -0.794  -7.910   5.438
   91   HD13  ILE  10          2HD1      ILE  10  -1.062  -6.551   6.541
   92    H    ALA  11           H        ALA  11  -1.693  -2.695   2.256
   93    HA   ALA  11           HA       ALA  11  -2.111  -0.240   3.467
   94    HB1  ALA  11           3HB      ALA  11  -2.359  -0.788   0.471
   95    HB2  ALA  11           1HB      ALA  11  -1.805   0.695   1.268
   96    HB3  ALA  11           2HB      ALA  11  -0.805  -0.748   1.355
   97    H    LYS  12           H        LYS  12  -4.425  -1.934   1.287
   98    HA   LYS  12           HA       LYS  12  -6.441   0.141   1.485
   99    HB2  LYS  12           2HB      LYS  12  -6.549  -2.739   0.521
  100    HB3  LYS  12           3HB      LYS  12  -7.880  -1.580   0.350
  101    HG2  LYS  12           2HG      LYS  12  -6.445  -0.050  -0.945
  102    HG3  LYS  12           3HG      LYS  12  -5.078  -1.143  -0.800
  103    HD2  LYS  12           2HD      LYS  12  -7.658  -1.636  -2.315
  104    HD3  LYS  12           3HD      LYS  12  -6.032  -1.364  -2.970
  105    HE2  LYS  12           2HE      LYS  12  -5.267  -3.485  -1.890
  106    HE3  LYS  12           3HE      LYS  12  -6.919  -3.780  -1.336
  107    HZ1  LYS  12           HZ1      LYS  12  -7.631  -3.829  -3.664
  108    HZ2  LYS  12           HZ2      LYS  12  -6.106  -3.557  -4.187
  109    HZ3  LYS  12           HZ3      LYS  12  -6.473  -4.949  -3.416
  110    H    LYS  13           H        LYS  13  -5.957  -2.879   3.361
  111    HA   LYS  13           HA       LYS  13  -8.383  -2.672   4.858
  112    HB2  LYS  13           2HB      LYS  13  -6.869  -4.662   4.442
  113    HB3  LYS  13           3HB      LYS  13  -5.753  -4.003   5.652
  114    HG2  LYS  13           2HG      LYS  13  -7.532  -4.163   7.365
  115    HG3  LYS  13           3HG      LYS  13  -8.695  -4.652   6.112
  116    HD2  LYS  13           2HD      LYS  13  -7.180  -6.659   5.631
  117    HD3  LYS  13           3HD      LYS  13  -6.271  -6.220   7.102
  118    HE2  LYS  13           2HE      LYS  13  -8.407  -6.286   8.384
  119    HE3  LYS  13           3HE      LYS  13  -9.263  -6.717   6.896
  120    HZ1  LYS  13           HZ1      LYS  13  -7.965  -8.785   6.821
  121    HZ2  LYS  13           HZ2      LYS  13  -7.168  -8.392   8.194
  122    HZ3  LYS  13           HZ3      LYS  13  -8.769  -8.696   8.237
  123    H    LYS  14           H        LYS  14  -5.119  -1.379   5.467
  124    HA   LYS  14           HA       LYS  14  -5.883  -0.161   8.046
  125    HB2  LYS  14           2HB      LYS  14  -3.359  -0.330   6.384
  126    HB3  LYS  14           3HB      LYS  14  -3.503   0.918   7.607
  127    HG2  LYS  14           2HG      LYS  14  -2.342  -0.991   8.498
  128    HG3  LYS  14           3HG      LYS  14  -3.827  -0.649   9.381
  129    HD2  LYS  14           2HD      LYS  14  -4.953  -2.556   8.313
  130    HD3  LYS  14           3HD      LYS  14  -3.510  -2.874   7.318
  131    HE2  LYS  14           2HE      LYS  14  -2.171  -3.264   9.351
  132    HE3  LYS  14           3HE      LYS  14  -3.554  -2.856  10.371
  133    HZ1  LYS  14           HZ1      LYS  14  -3.449  -5.185   8.525
  134    HZ2  LYS  14           HZ2      LYS  14  -3.291  -5.256  10.147
  135    HZ3  LYS  14           HZ3      LYS  14  -4.713  -4.800   9.498
  136    H    GLY  15           H        GLY  15  -5.874   0.941   4.736
  137    HA2  GLY  15           HA2      GLY  15  -6.984   2.890   3.947
  138    HA3  GLY  15           HA3      GLY  15  -6.924   3.613   5.559
  139    H    LYS  16           H        LYS  16  -4.096   2.080   4.232
  140    HA   LYS  16           HA       LYS  16  -2.608   4.656   4.209
  141    HB2  LYS  16           2HB      LYS  16  -1.896   1.753   4.805
  142    HB3  LYS  16           3HB      LYS  16  -0.687   2.997   4.658
  143    HG2  LYS  16           2HG      LYS  16  -2.954   2.987   6.691
  144    HG3  LYS  16           3HG      LYS  16  -1.292   2.506   7.007
  145    HD2  LYS  16           2HD      LYS  16  -2.253   5.315   6.304
  146    HD3  LYS  16           3HD      LYS  16  -1.737   4.726   7.884
  147    HE2  LYS  16           2HE      LYS  16   0.538   4.247   6.944
  148    HE3  LYS  16           3HE      LYS  16   0.026   4.945   5.402
  149    HZ1  LYS  16           HZ1      LYS  16  -0.359   7.058   6.573
  150    HZ2  LYS  16           HZ2      LYS  16   0.124   6.406   7.991
  151    HZ3  LYS  16           HZ3      LYS  16   1.188   6.579   6.769
  152    H    CYS  17           H        CYS  17  -3.994   2.942   1.799
  153    HA   CYS  17           HA       CYS  17  -1.664   2.736   0.041
  154    HB2  CYS  17           2HB      CYS  17  -3.726   1.261  -0.079
  155    HB3  CYS  17           3HB      CYS  17  -4.538   2.649  -0.827
  156    H    LYS  18           H        LYS  18  -0.792   4.681   0.140
  157    HA   LYS  18           HA       LYS  18  -2.016   7.000  -1.311
  158    HB2  LYS  18           2HB      LYS  18  -0.760   6.953   1.471
  159    HB3  LYS  18           3HB      LYS  18  -0.955   8.438   0.533
  160    HG2  LYS  18           2HG      LYS  18  -3.366   8.195   0.477
  161    HG3  LYS  18           3HG      LYS  18  -3.280   6.614   1.278
  162    HD2  LYS  18           2HD      LYS  18  -2.473   7.580   3.331
  163    HD3  LYS  18           3HD      LYS  18  -2.244   9.156   2.569
  164    HE2  LYS  18           2HE      LYS  18  -4.241   9.170   3.965
  165    HE3  LYS  18           3HE      LYS  18  -4.639   9.453   2.271
  166    HZ1  LYS  18           HZ1      LYS  18  -6.169   7.885   3.336
  167    HZ2  LYS  18           HZ2      LYS  18  -5.390   7.154   2.110
  168    HZ3  LYS  18           HZ3      LYS  18  -4.971   6.828   3.658
  169    H    GLY  19           H        GLY  19  -0.410   8.579  -1.998
  170    HA2  GLY  19           HA2      GLY  19   1.460   9.096  -3.248
  171    HA3  GLY  19           HA3      GLY  19   2.348   8.434  -1.889
  172    HA   PRO  20           HA       PRO  20   3.853   5.774  -5.219
  173    HB2  PRO  20           2HB      PRO  20   5.468   4.065  -3.796
  174    HB3  PRO  20           3HB      PRO  20   5.902   5.757  -4.188
  175    HG2  PRO  20           2HG      PRO  20   4.690   4.698  -1.614
  176    HG3  PRO  20           3HG      PRO  20   6.096   5.793  -1.809
  177    HD2  PRO  20           2HD      PRO  20   3.617   6.749  -1.267
  178    HD3  PRO  20           3HD      PRO  20   4.707   7.621  -2.388
  179    H    LEU  21           H        LEU  21   2.461   4.241  -2.232
  180    HA   LEU  21           HA       LEU  21   2.071   1.689  -3.490
  181    HB2  LEU  21           2HB      LEU  21   1.856   2.692  -0.905
  182    HB3  LEU  21           3HB      LEU  21   0.177   2.455  -1.321
  183    HG   LEU  21           HG       LEU  21   0.960   0.527  -0.165
  184   HD11  LEU  21          1HD1      LEU  21  -0.529  -0.031  -2.060
  185   HD12  LEU  21          2HD1      LEU  21   0.891  -0.281  -3.102
  186   HD13  LEU  21          3HD1      LEU  21   0.626  -1.325  -1.700
  187   HD21  LEU  21          3HD2      LEU  21   2.858  -0.831  -0.830
  188   HD22  LEU  21          1HD2      LEU  21   3.192   0.233  -2.213
  189   HD23  LEU  21          2HD2      LEU  21   3.375   0.840  -0.552
  190    H    LYS  22           H        LYS  22   0.073   4.551  -3.288
  191    HA   LYS  22           HA       LYS  22  -2.332   3.503  -4.557
  192    HB2  LYS  22           2HB      LYS  22  -2.353   5.488  -3.146
  193    HB3  LYS  22           3HB      LYS  22  -1.270   6.342  -4.247
  194    HG2  LYS  22           2HG      LYS  22  -2.980   6.338  -6.002
  195    HG3  LYS  22           3HG      LYS  22  -4.057   5.352  -4.991
  196    HD2  LYS  22           2HD      LYS  22  -4.219   7.143  -3.335
  197    HD3  LYS  22           3HD      LYS  22  -2.986   8.083  -4.189
  198    HE2  LYS  22           2HE      LYS  22  -4.961   9.136  -4.818
  199    HE3  LYS  22           3HE      LYS  22  -4.563   8.120  -6.205
  200    HZ1  LYS  22           HZ1      LYS  22  -6.555   7.458  -4.095
  201    HZ2  LYS  22           HZ2      LYS  22  -6.908   7.938  -5.613
  202    HZ3  LYS  22           HZ3      LYS  22  -6.207   6.487  -5.365
  203    H    LEU  23           H        LEU  23   0.587   5.186  -5.813
  204    HA   LEU  23           HA       LEU  23  -0.286   5.188  -8.548
  205    HB2  LEU  23           2HB      LEU  23   1.467   6.662  -7.614
  206    HB3  LEU  23           3HB      LEU  23   2.505   5.267  -7.332
  207    HG   LEU  23           HG       LEU  23   2.657   4.861  -9.773
  208   HD11  LEU  23          1HD1      LEU  23   1.018   7.425 -10.009
  209   HD12  LEU  23          2HD1      LEU  23   1.879   6.629 -11.346
  210   HD13  LEU  23          3HD1      LEU  23   0.530   5.806 -10.563
  211   HD21  LEU  23          3HD2      LEU  23   3.317   7.717  -8.949
  212   HD22  LEU  23          1HD2      LEU  23   4.314   6.280  -8.626
  213   HD23  LEU  23          2HD2      LEU  23   4.050   6.813 -10.294
  214    H    VAL  24           H        VAL  24   1.578   2.817  -6.659
  215    HA   VAL  24           HA       VAL  24   2.138   0.970  -8.791
  216    HB   VAL  24           HB       VAL  24   2.003   0.702  -5.769
  217   HG11  VAL  24          1HG1      VAL  24   3.246  -1.410  -5.970
  218   HG12  VAL  24          2HG1      VAL  24   1.620  -1.563  -6.623
  219   HG13  VAL  24          3HG1      VAL  24   3.003  -1.397  -7.734
  220   HG21  VAL  24          3HG2      VAL  24   4.404   0.737  -5.865
  221   HG22  VAL  24          1HG2      VAL  24   4.402   0.655  -7.647
  222   HG23  VAL  24          2HG2      VAL  24   3.836   2.109  -6.814
  223    H    CYS  25           H        CYS  25  -0.485   1.019  -6.351
  224    HA   CYS  25           HA       CYS  25  -1.651  -1.412  -7.570
  225    HB2  CYS  25           2HB      CYS  25  -0.916  -1.120  -5.153
  226    HB3  CYS  25           3HB      CYS  25  -2.316  -0.081  -4.944
  227    H    LYS  26           H        LYS  26  -2.286   1.897  -7.701
  228    HA   LYS  26           HA       LYS  26  -3.992   3.233  -8.357
  229    HB2  LYS  26           2HB      LYS  26  -4.878   0.789  -9.909
  230    HB3  LYS  26           3HB      LYS  26  -5.429   2.438 -10.200
  231    HG2  LYS  26           2HG      LYS  26  -2.524   1.537 -10.284
  232    HG3  LYS  26           3HG      LYS  26  -3.554   1.646 -11.707
  233    HD2  LYS  26           2HD      LYS  26  -2.604   3.938  -9.934
  234    HD3  LYS  26           3HD      LYS  26  -2.043   3.570 -11.551
  235    HE2  LYS  26           2HE      LYS  26  -4.882   4.443 -10.837
  236    HE3  LYS  26           3HE      LYS  26  -3.612   5.502 -11.445
  237    HZ1  LYS  26           HZ1      LYS  26  -5.046   4.778 -13.245
  238    HZ2  LYS  26           HZ2      LYS  26  -3.553   4.173 -13.487
  239    HZ3  LYS  26           HZ3      LYS  26  -4.752   3.203 -12.945
  240    H    CYS  27           H        CYS  27  -4.203   2.747  -6.054
  241    HA   CYS  27           HA       CYS  27  -6.719   1.693  -5.017
  242    HB2  CYS  27           2HB      CYS  27  -4.572   3.445  -3.743
  243    HB3  CYS  27           3HB      CYS  27  -5.963   2.828  -2.904
  Start of MODEL   17
    1    H1   GLY   1           1H       GLY   1   9.023  -9.690   4.571
    2    H2   GLY   1           2H       GLY   1   7.867  -9.689   5.730
    3    H3   GLY   1           3H       GLY   1   8.096 -11.021   4.802
    4    HA2  GLY   1           HA2      GLY   1   7.367  -9.814   2.816
    5    HA3  GLY   1           HA3      GLY   1   6.108  -9.827   4.069
    6    H    LEU   2           H        LEU   2   6.402  -6.435   2.801
    7    HA   LEU   2           HA       LEU   2   5.693  -9.101   1.681
    8    HB2  LEU   2           2HB      LEU   2   3.871  -6.762   2.369
    9    HB3  LEU   2           3HB      LEU   2   3.391  -8.024   1.248
   10    HG   LEU   2           HG       LEU   2   4.085  -8.525   4.171
   11   HD11  LEU   2          1HD1      LEU   2   1.637  -8.748   4.466
   12   HD12  LEU   2          2HD1      LEU   2   2.090  -7.114   3.958
   13   HD13  LEU   2          3HD1      LEU   2   1.387  -8.242   2.780
   14   HD21  LEU   2          3HD2      LEU   2   2.919 -10.686   3.773
   15   HD22  LEU   2          1HD2      LEU   2   2.748 -10.274   2.055
   16   HD23  LEU   2          2HD2      LEU   2   4.355 -10.546   2.754
   17    HA   PRO   3           HA       PRO   3   6.477  -6.894  -2.205
   18    HB2  PRO   3           2HB      PRO   3   5.221  -8.493  -4.003
   19    HB3  PRO   3           3HB      PRO   3   6.709  -9.019  -3.153
   20    HG2  PRO   3           2HG      PRO   3   3.831  -9.658  -2.436
   21    HG3  PRO   3           3HG      PRO   3   5.204 -10.798  -2.591
   22    HD2  PRO   3           2HD      PRO   3   4.392  -9.763  -0.186
   23    HD3  PRO   3           3HD      PRO   3   6.112 -10.129  -0.526
   24    H    ARG   4           H        ARG   4   5.294  -5.519  -3.620
   25    HA   ARG   4           HA       ARG   4   3.217  -4.123  -2.357
   26    HB2  ARG   4           2HB      ARG   4   4.084  -4.039  -5.272
   27    HB3  ARG   4           3HB      ARG   4   2.980  -2.876  -4.511
   28    HG2  ARG   4           2HG      ARG   4   4.685  -2.280  -2.857
   29    HG3  ARG   4           3HG      ARG   4   5.836  -3.403  -3.594
   30    HD2  ARG   4           2HD      ARG   4   4.631  -0.966  -4.933
   31    HD3  ARG   4           3HD      ARG   4   6.208  -1.007  -4.176
   32    HE   ARG   4           HE       ARG   4   5.469  -2.180  -6.771
   33   HH11  ARG   4          1HH2      ARG   4   7.965  -2.138  -4.306
   34   HH12  ARG   4          2HH2      ARG   4   9.171  -2.755  -5.401
   35   HH21  ARG   4          1HH1      ARG   4   7.055  -2.967  -8.100
   36   HH22  ARG   4          2HH1      ARG   4   8.663  -3.205  -7.485
   37    H    LYS   5           H        LYS   5   2.823  -6.648  -4.775
   38    HA   LYS   5           HA       LYS   5   0.003  -6.243  -5.216
   39    HB2  LYS   5           2HB      LYS   5   0.049  -8.324  -6.398
   40    HB3  LYS   5           3HB      LYS   5   1.489  -7.392  -6.801
   41    HG2  LYS   5           2HG      LYS   5   2.783  -8.801  -5.122
   42    HG3  LYS   5           3HG      LYS   5   1.337  -9.798  -4.928
   43    HD2  LYS   5           2HD      LYS   5   2.841  -9.365  -7.543
   44    HD3  LYS   5           3HD      LYS   5   3.002 -10.772  -6.482
   45    HE2  LYS   5           2HE      LYS   5   0.582 -11.281  -6.790
   46    HE3  LYS   5           3HE      LYS   5   0.437  -9.905  -7.890
   47    HZ1  LYS   5           HZ1      LYS   5   2.049 -10.993  -9.360
   48    HZ2  LYS   5           HZ2      LYS   5   2.180 -12.269  -8.345
   49    HZ3  LYS   5           HZ3      LYS   5   0.770 -11.974  -9.110
   50    H    ILE   6           H        ILE   6   1.646  -7.803  -2.582
   51    HA   ILE   6           HA       ILE   6  -0.932  -8.929  -1.551
   52    HB   ILE   6           HB       ILE   6   1.885  -9.352  -0.494
   53   HG12  ILE   6          2HG1      ILE   6   0.103 -11.211  -2.145
   54   HG13  ILE   6          3HG1      ILE   6   1.563 -10.409  -2.720
   55   HG21  ILE   6          1HG2      ILE   6   0.100  -9.528   1.243
   56   HG22  ILE   6          2HG2      ILE   6  -0.782 -10.673   0.217
   57   HG23  ILE   6          3HG2      ILE   6   0.796 -11.102   0.908
   58   HD11  ILE   6          3HD1      ILE   6   2.893 -11.650  -0.984
   59   HD12  ILE   6          1HD1      ILE   6   1.431 -12.613  -0.648
   60   HD13  ILE   6          2HD1      ILE   6   2.164 -12.647  -2.257
   61    H    LEU   7           H        LEU   7   1.725  -6.667  -0.726
   62    HA   LEU   7           HA       LEU   7   0.735  -5.744   1.740
   63    HB2  LEU   7           2HB      LEU   7   2.996  -5.345   0.739
   64    HB3  LEU   7           3HB      LEU   7   2.265  -4.237  -0.414
   65    HG   LEU   7           HG       LEU   7   1.666  -2.678   1.379
   66   HD11  LEU   7          1HD1      LEU   7   2.515  -3.018   3.687
   67   HD12  LEU   7          2HD1      LEU   7   1.292  -4.217   3.270
   68   HD13  LEU   7          3HD1      LEU   7   3.013  -4.670   3.263
   69   HD21  LEU   7          3HD2      LEU   7   3.936  -2.000   2.001
   70   HD22  LEU   7          1HD2      LEU   7   4.559  -3.612   1.585
   71   HD23  LEU   7          2HD2      LEU   7   3.907  -2.554   0.321
   72    H    CYS   8           H        CYS   8  -0.379  -4.933  -1.521
   73    HA   CYS   8           HA       CYS   8  -1.935  -2.632  -0.867
   74    HB2  CYS   8           2HB      CYS   8  -1.285  -3.459  -3.142
   75    HB3  CYS   8           3HB      CYS   8  -2.535  -4.696  -3.002
   76    H    ALA   9           H        ALA   9  -2.612  -6.048  -0.188
   77    HA   ALA   9           HA       ALA   9  -5.468  -5.713   0.284
   78    HB1  ALA   9           3HB      ALA   9  -3.520  -7.779   1.388
   79    HB2  ALA   9           1HB      ALA   9  -5.291  -7.879   1.378
   80    HB3  ALA   9           2HB      ALA   9  -4.396  -7.907  -0.157
   81    H    ILE  10           H        ILE  10  -2.534  -5.486   2.264
   82    HA   ILE  10           HA       ILE  10  -3.816  -4.799   4.765
   83    HB   ILE  10           HB       ILE  10  -1.019  -4.019   3.871
   84   HG12  ILE  10          2HG1      ILE  10  -1.123  -6.371   3.367
   85   HG13  ILE  10          3HG1      ILE  10  -0.136  -6.098   4.775
   86   HG21  ILE  10          1HG2      ILE  10  -0.500  -4.197   6.272
   87   HG22  ILE  10          2HG2      ILE  10  -1.735  -2.981   5.929
   88   HG23  ILE  10          3HG2      ILE  10  -2.208  -4.554   6.609
   89   HD11  ILE  10          3HD1      ILE  10  -3.010  -7.133   4.822
   90   HD12  ILE  10          1HD1      ILE  10  -1.538  -8.100   5.020
   91   HD13  ILE  10          2HD1      ILE  10  -1.971  -6.895   6.250
   92    H    ALA  11           H        ALA  11  -2.346  -2.897   2.124
   93    HA   ALA  11           HA       ALA  11  -2.517  -0.400   3.304
   94    HB1  ALA  11           3HB      ALA  11  -2.719  -0.914   0.322
   95    HB2  ALA  11           1HB      ALA  11  -1.971   0.464   1.159
   96    HB3  ALA  11           2HB      ALA  11  -1.210  -1.122   1.256
   97    H    LYS  12           H        LYS  12  -5.130  -1.930   1.310
   98    HA   LYS  12           HA       LYS  12  -6.884   0.421   1.678
   99    HB2  LYS  12           2HB      LYS  12  -7.415  -2.399   0.681
  100    HB3  LYS  12           3HB      LYS  12  -8.708  -1.286   1.062
  101    HG2  LYS  12           2HG      LYS  12  -8.548  -0.839  -1.156
  102    HG3  LYS  12           3HG      LYS  12  -7.536   0.422  -0.482
  103    HD2  LYS  12           2HD      LYS  12  -6.312  -0.304  -2.281
  104    HD3  LYS  12           3HD      LYS  12  -5.530  -1.199  -0.988
  105    HE2  LYS  12           2HE      LYS  12  -7.731  -2.250  -2.842
  106    HE3  LYS  12           3HE      LYS  12  -5.997  -2.476  -3.107
  107    HZ1  LYS  12           HZ1      LYS  12  -6.862  -4.433  -2.111
  108    HZ2  LYS  12           HZ2      LYS  12  -5.926  -3.683  -0.984
  109    HZ3  LYS  12           HZ3      LYS  12  -7.573  -3.622  -0.888
  110    H    LYS  13           H        LYS  13  -6.544  -2.745   3.244
  111    HA   LYS  13           HA       LYS  13  -8.734  -2.560   5.042
  112    HB2  LYS  13           2HB      LYS  13  -7.414  -4.586   4.537
  113    HB3  LYS  13           3HB      LYS  13  -6.056  -3.953   5.479
  114    HG2  LYS  13           2HG      LYS  13  -7.478  -3.964   7.518
  115    HG3  LYS  13           3HG      LYS  13  -8.838  -4.579   6.572
  116    HD2  LYS  13           2HD      LYS  13  -6.171  -6.009   6.987
  117    HD3  LYS  13           3HD      LYS  13  -7.661  -6.329   7.886
  118    HE2  LYS  13           2HE      LYS  13  -8.806  -6.924   5.737
  119    HE3  LYS  13           3HE      LYS  13  -7.274  -6.702   4.881
  120    HZ1  LYS  13           HZ1      LYS  13  -7.751  -8.691   7.040
  121    HZ2  LYS  13           HZ2      LYS  13  -7.640  -9.033   5.450
  122    HZ3  LYS  13           HZ3      LYS  13  -6.331  -8.488   6.257
  123    H    LYS  14           H        LYS  14  -5.448  -1.308   5.474
  124    HA   LYS  14           HA       LYS  14  -6.117  -0.049   8.072
  125    HB2  LYS  14           2HB      LYS  14  -3.582  -0.454   6.461
  126    HB3  LYS  14           3HB      LYS  14  -3.629   0.760   7.721
  127    HG2  LYS  14           2HG      LYS  14  -2.684  -1.293   8.561
  128    HG3  LYS  14           3HG      LYS  14  -4.154  -0.845   9.429
  129    HD2  LYS  14           2HD      LYS  14  -5.426  -2.605   8.305
  130    HD3  LYS  14           3HD      LYS  14  -4.072  -2.936   7.217
  131    HE2  LYS  14           2HE      LYS  14  -4.111  -4.658   8.883
  132    HE3  LYS  14           3HE      LYS  14  -2.688  -3.652   9.156
  133    HZ1  LYS  14           HZ1      LYS  14  -3.901  -2.542  10.960
  134    HZ2  LYS  14           HZ2      LYS  14  -5.237  -3.446  10.683
  135    HZ3  LYS  14           HZ3      LYS  14  -3.870  -4.147  11.229
  136    H    GLY  15           H        GLY  15  -6.513   0.937   4.856
  137    HA2  GLY  15           HA2      GLY  15  -7.042   2.972   3.918
  138    HA3  GLY  15           HA3      GLY  15  -7.127   3.678   5.537
  139    H    LYS  16           H        LYS  16  -4.290   2.077   4.217
  140    HA   LYS  16           HA       LYS  16  -2.662   4.507   4.732
  141    HB2  LYS  16           2HB      LYS  16  -2.279   2.597   6.175
  142    HB3  LYS  16           3HB      LYS  16  -2.111   1.515   4.799
  143    HG2  LYS  16           2HG      LYS  16   0.036   1.942   5.842
  144    HG3  LYS  16           3HG      LYS  16   0.011   2.507   4.184
  145    HD2  LYS  16           2HD      LYS  16  -0.567   4.864   5.275
  146    HD3  LYS  16           3HD      LYS  16   0.045   4.134   6.757
  147    HE2  LYS  16           2HE      LYS  16   1.503   4.262   4.077
  148    HE3  LYS  16           3HE      LYS  16   1.713   5.450   5.368
  149    HZ1  LYS  16           HZ1      LYS  16   2.543   3.662   6.807
  150    HZ2  LYS  16           HZ2      LYS  16   2.383   2.562   5.607
  151    HZ3  LYS  16           HZ3      LYS  16   3.460   3.779   5.464
  152    H    CYS  17           H        CYS  17  -3.780   2.851   1.995
  153    HA   CYS  17           HA       CYS  17  -1.415   2.738   0.440
  154    HB2  CYS  17           2HB      CYS  17  -3.612   1.512   0.039
  155    HB3  CYS  17           3HB      CYS  17  -4.226   3.015  -0.645
  156    H    LYS  18           H        LYS  18  -0.190   4.340  -0.118
  157    HA   LYS  18           HA       LYS  18  -1.217   6.838  -1.383
  158    HB2  LYS  18           2HB      LYS  18   0.690   6.697   1.006
  159    HB3  LYS  18           3HB      LYS  18   0.450   8.137   0.013
  160    HG2  LYS  18           2HG      LYS  18  -1.965   8.156   0.618
  161    HG3  LYS  18           3HG      LYS  18  -1.694   6.771   1.691
  162    HD2  LYS  18           2HD      LYS  18  -0.065   8.094   3.007
  163    HD3  LYS  18           3HD      LYS  18  -0.346   9.492   1.942
  164    HE2  LYS  18           2HE      LYS  18  -2.757   9.467   2.566
  165    HE3  LYS  18           3HE      LYS  18  -2.465   8.092   3.639
  166    HZ1  LYS  18           HZ1      LYS  18  -0.967   9.518   4.940
  167    HZ2  LYS  18           HZ2      LYS  18  -1.241  10.787   3.945
  168    HZ3  LYS  18           HZ3      LYS  18  -2.450  10.191   4.863
  169    H    GLY  19           H        GLY  19   0.527   8.046  -2.426
  170    HA2  GLY  19           HA2      GLY  19   2.114   8.073  -4.140
  171    HA3  GLY  19           HA3      GLY  19   3.105   7.796  -2.731
  172    HA   PRO  20           HA       PRO  20   4.686   4.479  -5.226
  173    HB2  PRO  20           2HB      PRO  20   6.311   3.162  -3.467
  174    HB3  PRO  20           3HB      PRO  20   6.635   4.834  -4.017
  175    HG2  PRO  20           2HG      PRO  20   5.200   3.967  -1.478
  176    HG3  PRO  20           3HG      PRO  20   6.586   5.099  -1.627
  177    HD2  PRO  20           2HD      PRO  20   4.034   6.007  -1.500
  178    HD3  PRO  20           3HD      PRO  20   5.229   6.781  -2.586
  179    H    LEU  21           H        LEU  21   2.393   3.773  -2.786
  180    HA   LEU  21           HA       LEU  21   2.120   0.980  -3.828
  181    HB2  LEU  21           2HB      LEU  21   2.095   1.804  -1.216
  182    HB3  LEU  21           3HB      LEU  21   0.406   2.027  -1.586
  183    HG   LEU  21           HG       LEU  21   0.618  -0.103  -0.595
  184   HD11  LEU  21          1HD1      LEU  21   0.567  -0.765  -3.567
  185   HD12  LEU  21          2HD1      LEU  21  -0.045  -1.748  -2.232
  186   HD13  LEU  21          3HD1      LEU  21  -0.831  -0.210  -2.620
  187   HD21  LEU  21          3HD2      LEU  21   2.857  -0.731  -2.551
  188   HD22  LEU  21          1HD2      LEU  21   3.036  -0.355  -0.822
  189   HD23  LEU  21          2HD2      LEU  21   2.190  -1.832  -1.324
  190    H    LYS  22           H        LYS  22   0.395   4.064  -3.382
  191    HA   LYS  22           HA       LYS  22  -2.110   3.318  -4.578
  192    HB2  LYS  22           2HB      LYS  22  -1.803   5.296  -3.184
  193    HB3  LYS  22           3HB      LYS  22  -0.731   6.026  -4.393
  194    HG2  LYS  22           2HG      LYS  22  -2.594   6.163  -5.997
  195    HG3  LYS  22           3HG      LYS  22  -3.668   5.344  -4.848
  196    HD2  LYS  22           2HD      LYS  22  -3.407   7.215  -3.249
  197    HD3  LYS  22           3HD      LYS  22  -2.238   7.984  -4.333
  198    HE2  LYS  22           2HE      LYS  22  -4.217   9.167  -4.719
  199    HE3  LYS  22           3HE      LYS  22  -4.068   8.081  -6.101
  200    HZ1  LYS  22           HZ1      LYS  22  -5.805   7.610  -3.730
  201    HZ2  LYS  22           HZ2      LYS  22  -6.325   8.098  -5.196
  202    HZ3  LYS  22           HZ3      LYS  22  -5.708   6.602  -5.017
  203    H    LEU  23           H        LEU  23   0.837   4.713  -6.052
  204    HA   LEU  23           HA       LEU  23  -0.170   4.815  -8.735
  205    HB2  LEU  23           2HB      LEU  23   1.760   6.084  -7.823
  206    HB3  LEU  23           3HB      LEU  23   2.666   4.583  -7.641
  207    HG   LEU  23           HG       LEU  23   2.700   4.287 -10.103
  208   HD11  LEU  23          1HD1      LEU  23   1.280   6.990 -10.163
  209   HD12  LEU  23          2HD1      LEU  23   2.016   6.183 -11.566
  210   HD13  LEU  23          3HD1      LEU  23   0.629   5.446 -10.760
  211   HD21  LEU  23          3HD2      LEU  23   4.510   5.507  -8.962
  212   HD22  LEU  23          1HD2      LEU  23   4.232   6.135 -10.595
  213   HD23  LEU  23          2HD2      LEU  23   3.630   7.036  -9.184
  214    H    VAL  24           H        VAL  24   1.116   2.158  -6.863
  215    HA   VAL  24           HA       VAL  24   1.740   0.444  -9.182
  216    HB   VAL  24           HB       VAL  24   2.010   0.123  -6.173
  217   HG11  VAL  24          1HG1      VAL  24   3.368  -1.874  -6.571
  218   HG12  VAL  24          2HG1      VAL  24   1.709  -2.144  -7.071
  219   HG13  VAL  24          3HG1      VAL  24   2.955  -1.834  -8.304
  220   HG21  VAL  24          3HG2      VAL  24   4.032   0.498  -8.429
  221   HG22  VAL  24          1HG2      VAL  24   3.551   1.721  -7.229
  222   HG23  VAL  24          2HG2      VAL  24   4.423   0.292  -6.708
  223    H    CYS  25           H        CYS  25  -0.750   0.677  -6.696
  224    HA   CYS  25           HA       CYS  25  -2.091  -1.788  -7.732
  225    HB2  CYS  25           2HB      CYS  25  -1.200  -1.613  -5.370
  226    HB3  CYS  25           3HB      CYS  25  -2.421  -0.385  -5.071
  227    H    LYS  26           H        LYS  26  -2.414   1.576  -7.773
  228    HA   LYS  26           HA       LYS  26  -3.986   3.082  -8.216
  229    HB2  LYS  26           2HB      LYS  26  -4.126   1.287 -10.204
  230    HB3  LYS  26           3HB      LYS  26  -5.800   1.205  -9.685
  231    HG2  LYS  26           2HG      LYS  26  -4.219   3.740 -10.312
  232    HG3  LYS  26           3HG      LYS  26  -5.237   2.916 -11.486
  233    HD2  LYS  26           2HD      LYS  26  -6.182   4.279  -8.924
  234    HD3  LYS  26           3HD      LYS  26  -6.346   4.917 -10.549
  235    HE2  LYS  26           2HE      LYS  26  -7.662   2.351  -9.544
  236    HE3  LYS  26           3HE      LYS  26  -8.444   3.928  -9.617
  237    HZ1  LYS  26           HZ1      LYS  26  -8.119   3.916 -12.035
  238    HZ2  LYS  26           HZ2      LYS  26  -7.423   2.437 -11.975
  239    HZ3  LYS  26           HZ3      LYS  26  -8.990   2.619 -11.568
  240    H    CYS  27           H        CYS  27  -4.111   2.837  -5.882
  241    HA   CYS  27           HA       CYS  27  -6.559   1.839  -4.647
  242    HB2  CYS  27           2HB      CYS  27  -4.349   3.626  -3.537
  243    HB3  CYS  27           3HB      CYS  27  -5.649   2.936  -2.623
  Start of MODEL   18
    1    H1   GLY   1           1H       GLY   1  10.407  -8.590   3.654
    2    H2   GLY   1           2H       GLY   1  10.522  -7.403   4.779
    3    H3   GLY   1           3H       GLY   1   9.557  -8.701   5.049
    4    HA2  GLY   1           HA2      GLY   1   8.227  -6.776   4.468
    5    HA3  GLY   1           HA3      GLY   1   9.140  -6.671   2.952
    6    H    LEU   2           H        LEU   2   6.967  -6.802   1.995
    7    HA   LEU   2           HA       LEU   2   6.156  -9.606   1.449
    8    HB2  LEU   2           2HB      LEU   2   4.353  -7.287   2.227
    9    HB3  LEU   2           3HB      LEU   2   3.742  -8.703   1.384
   10    HG   LEU   2           HG       LEU   2   5.081  -8.791   4.122
   11   HD11  LEU   2          1HD1      LEU   2   2.799  -9.131   4.981
   12   HD12  LEU   2          2HD1      LEU   2   2.954  -7.559   4.185
   13   HD13  LEU   2          3HD1      LEU   2   2.138  -8.898   3.348
   14   HD21  LEU   2          3HD2      LEU   2   4.050 -11.056   4.233
   15   HD22  LEU   2          1HD2      LEU   2   3.516 -10.891   2.545
   16   HD23  LEU   2          2HD2      LEU   2   5.249 -10.950   2.945
   17    HA   PRO   3           HA       PRO   3   6.044  -8.215  -2.857
   18    HB2  PRO   3           2HB      PRO   3   3.610  -9.992  -3.035
   19    HB3  PRO   3           3HB      PRO   3   5.032  -9.918  -4.120
   20    HG2  PRO   3           2HG      PRO   3   4.784 -11.927  -2.321
   21    HG3  PRO   3           3HG      PRO   3   6.374 -11.131  -2.562
   22    HD2  PRO   3           2HD      PRO   3   4.342 -10.625  -0.364
   23    HD3  PRO   3           3HD      PRO   3   6.115 -10.848  -0.250
   24    H    ARG   4           H        ARG   4   4.855  -6.671  -4.078
   25    HA   ARG   4           HA       ARG   4   3.283  -4.848  -2.644
   26    HB2  ARG   4           2HB      ARG   4   3.437  -5.297  -5.661
   27    HB3  ARG   4           3HB      ARG   4   2.634  -3.918  -4.921
   28    HG2  ARG   4           2HG      ARG   4   5.607  -4.557  -4.691
   29    HG3  ARG   4           3HG      ARG   4   4.857  -3.320  -5.705
   30    HD2  ARG   4           2HD      ARG   4   3.889  -2.326  -3.534
   31    HD3  ARG   4           3HD      ARG   4   4.981  -3.405  -2.669
   32    HE   ARG   4           HE       ARG   4   6.862  -2.203  -3.456
   33   HH11  ARG   4          1HH1      ARG   4   3.949  -0.748  -4.715
   34   HH12  ARG   4          2HH1      ARG   4   4.711   0.811  -4.956
   35   HH21  ARG   4          1HH2      ARG   4   7.805  -0.220  -3.907
   36   HH22  ARG   4          2HH2      ARG   4   6.840   1.047  -4.611
   37    H    LYS   5           H        LYS   5   1.958  -7.324  -4.878
   38    HA   LYS   5           HA       LYS   5  -0.761  -6.511  -4.517
   39    HB2  LYS   5           2HB      LYS   5  -1.367  -8.575  -5.609
   40    HB3  LYS   5           3HB      LYS   5   0.043  -7.880  -6.405
   41    HG2  LYS   5           2HG      LYS   5   1.509  -9.504  -5.153
   42    HG3  LYS   5           3HG      LYS   5   0.052 -10.219  -4.438
   43    HD2  LYS   5           2HD      LYS   5  -0.784 -10.793  -6.699
   44    HD3  LYS   5           3HD      LYS   5   0.680 -10.086  -7.419
   45    HE2  LYS   5           2HE      LYS   5   2.077 -11.710  -6.156
   46    HE3  LYS   5           3HE      LYS   5   0.620 -12.412  -5.440
   47    HZ1  LYS   5           HZ1      LYS   5   1.247 -12.394  -8.348
   48    HZ2  LYS   5           HZ2      LYS   5   1.363 -13.691  -7.366
   49    HZ3  LYS   5           HZ3      LYS   5  -0.099 -13.043  -7.684
   50    H    ILE   6           H        ILE   6   1.222  -8.381  -2.369
   51    HA   ILE   6           HA       ILE   6  -1.100  -9.320  -0.769
   52    HB   ILE   6           HB       ILE   6   1.890  -9.682  -0.331
   53   HG12  ILE   6          2HG1      ILE   6  -0.255 -11.575  -1.410
   54   HG13  ILE   6          3HG1      ILE   6   1.074 -10.872  -2.332
   55   HG21  ILE   6          1HG2      ILE   6   1.209 -11.278   1.429
   56   HG22  ILE   6          2HG2      ILE   6   0.570  -9.681   1.784
   57   HG23  ILE   6          3HG2      ILE   6  -0.505 -10.917   1.107
   58   HD11  ILE   6          3HD1      ILE   6   1.321 -12.944  -0.132
   59   HD12  ILE   6          1HD1      ILE   6   1.651 -13.128  -1.861
   60   HD13  ILE   6          2HD1      ILE   6   2.701 -12.096  -0.874
   61    H    LEU   7           H        LEU   7   1.724  -7.122  -0.428
   62    HA   LEU   7           HA       LEU   7   1.092  -6.040   2.105
   63    HB2  LEU   7           2HB      LEU   7   3.215  -5.868   0.780
   64    HB3  LEU   7           3HB      LEU   7   2.451  -4.731  -0.303
   65    HG   LEU   7           HG       LEU   7   4.048  -3.841   1.435
   66   HD11  LEU   7          1HD1      LEU   7   2.448  -2.380   0.233
   67   HD12  LEU   7          2HD1      LEU   7   1.311  -2.546   1.590
   68   HD13  LEU   7          3HD1      LEU   7   2.891  -1.794   1.841
   69   HD21  LEU   7          3HD2      LEU   7   3.248  -5.177   3.368
   70   HD22  LEU   7          1HD2      LEU   7   3.313  -3.437   3.697
   71   HD23  LEU   7          2HD2      LEU   7   1.749  -4.215   3.390
   72    H    CYS   8           H        CYS   8  -0.103  -5.167  -1.115
   73    HA   CYS   8           HA       CYS   8  -1.570  -2.841  -0.288
   74    HB2  CYS   8           2HB      CYS   8  -1.646  -4.586  -2.753
   75    HB3  CYS   8           3HB      CYS   8  -2.671  -3.163  -2.565
   76    H    ALA   9           H        ALA   9  -2.396  -6.226   0.065
   77    HA   ALA   9           HA       ALA   9  -5.270  -5.688   0.405
   78    HB1  ALA   9           3HB      ALA   9  -3.620  -8.132   1.147
   79    HB2  ALA   9           1HB      ALA   9  -5.390  -8.004   1.096
   80    HB3  ALA   9           2HB      ALA   9  -4.453  -7.878  -0.409
   81    H    ILE  10           H        ILE  10  -2.412  -5.289   2.285
   82    HA   ILE  10           HA       ILE  10  -3.927  -4.942   4.818
   83    HB   ILE  10           HB       ILE  10  -1.000  -4.306   4.332
   84   HG12  ILE  10          2HG1      ILE  10  -1.191  -6.635   3.714
   85   HG13  ILE  10          3HG1      ILE  10  -0.359  -6.463   5.231
   86   HG21  ILE  10          1HG2      ILE  10  -2.609  -4.869   6.852
   87   HG22  ILE  10          2HG2      ILE  10  -0.854  -4.598   6.782
   88   HG23  ILE  10          3HG2      ILE  10  -1.966  -3.302   6.323
   89   HD11  ILE  10          3HD1      ILE  10  -2.389  -7.193   6.463
   90   HD12  ILE  10          1HD1      ILE  10  -3.274  -7.322   4.922
   91   HD13  ILE  10          2HD1      ILE  10  -1.894  -8.383   5.246
   92    H    ALA  11           H        ALA  11  -1.904  -3.016   2.533
   93    HA   ALA  11           HA       ALA  11  -2.292  -0.542   3.738
   94    HB1  ALA  11           3HB      ALA  11  -1.934  -0.961   0.738
   95    HB2  ALA  11           1HB      ALA  11  -1.401   0.408   1.724
   96    HB3  ALA  11           2HB      ALA  11  -0.624  -1.166   1.930
   97    H    LYS  12           H        LYS  12  -4.315  -1.912   1.059
   98    HA   LYS  12           HA       LYS  12  -6.060   0.435   1.071
   99    HB2  LYS  12           2HB      LYS  12  -6.372  -2.237  -0.359
  100    HB3  LYS  12           3HB      LYS  12  -7.323  -0.767  -0.634
  101    HG2  LYS  12           2HG      LYS  12  -5.086   0.427  -1.068
  102    HG3  LYS  12           3HG      LYS  12  -4.348  -1.168  -1.174
  103    HD2  LYS  12           2HD      LYS  12  -6.553  -0.041  -2.931
  104    HD3  LYS  12           3HD      LYS  12  -4.855  -0.282  -3.368
  105    HE2  LYS  12           2HE      LYS  12  -5.130  -2.731  -3.144
  106    HE3  LYS  12           3HE      LYS  12  -6.833  -2.501  -2.720
  107    HZ1  LYS  12           HZ1      LYS  12  -7.158  -1.449  -4.902
  108    HZ2  LYS  12           HZ2      LYS  12  -5.601  -1.662  -5.304
  109    HZ3  LYS  12           HZ3      LYS  12  -6.575  -2.966  -5.101
  110    H    LYS  13           H        LYS  13  -6.116  -2.612   2.766
  111    HA   LYS  13           HA       LYS  13  -8.858  -2.373   3.734
  112    HB2  LYS  13           2HB      LYS  13  -7.638  -4.488   3.559
  113    HB3  LYS  13           3HB      LYS  13  -6.470  -3.946   4.778
  114    HG2  LYS  13           2HG      LYS  13  -8.177  -3.963   6.506
  115    HG3  LYS  13           3HG      LYS  13  -9.459  -4.197   5.307
  116    HD2  LYS  13           2HD      LYS  13  -8.998  -6.292   6.458
  117    HD3  LYS  13           3HD      LYS  13  -8.583  -6.420   4.744
  118    HE2  LYS  13           2HE      LYS  13  -6.182  -6.076   5.298
  119    HE3  LYS  13           3HE      LYS  13  -6.600  -5.945   7.014
  120    HZ1  LYS  13           HZ1      LYS  13  -7.443  -8.238   6.900
  121    HZ2  LYS  13           HZ2      LYS  13  -7.040  -8.348   5.320
  122    HZ3  LYS  13           HZ3      LYS  13  -5.875  -8.196   6.452
  123    H    LYS  14           H        LYS  14  -5.695  -1.350   5.028
  124    HA   LYS  14           HA       LYS  14  -6.906  -0.081   7.413
  125    HB2  LYS  14           2HB      LYS  14  -4.092  -0.528   6.379
  126    HB3  LYS  14           3HB      LYS  14  -4.381   0.719   7.574
  127    HG2  LYS  14           2HG      LYS  14  -3.687  -1.287   8.677
  128    HG3  LYS  14           3HG      LYS  14  -5.328  -0.846   9.150
  129    HD2  LYS  14           2HD      LYS  14  -6.255  -2.646   7.741
  130    HD3  LYS  14           3HD      LYS  14  -4.643  -2.994   7.101
  131    HE2  LYS  14           2HE      LYS  14  -5.139  -4.657   8.753
  132    HE3  LYS  14           3HE      LYS  14  -3.866  -3.610   9.380
  133    HZ1  LYS  14           HZ1      LYS  14  -5.586  -4.063  11.047
  134    HZ2  LYS  14           HZ2      LYS  14  -5.552  -2.468  10.722
  135    HZ3  LYS  14           HZ3      LYS  14  -6.746  -3.403  10.110
  136    H    GLY  15           H        GLY  15  -6.185   0.997   4.208
  137    HA2  GLY  15           HA2      GLY  15  -6.512   3.089   3.230
  138    HA3  GLY  15           HA3      GLY  15  -6.900   3.796   4.802
  139    H    LYS  16           H        LYS  16  -3.988   1.904   4.363
  140    HA   LYS  16           HA       LYS  16  -2.299   4.262   5.045
  141    HB2  LYS  16           2HB      LYS  16  -2.525   2.223   6.570
  142    HB3  LYS  16           3HB      LYS  16  -1.671   1.312   5.337
  143    HG2  LYS  16           2HG      LYS  16   0.072   3.434   5.673
  144    HG3  LYS  16           3HG      LYS  16  -0.721   3.455   7.232
  145    HD2  LYS  16           2HD      LYS  16   1.304   2.116   7.366
  146    HD3  LYS  16           3HD      LYS  16  -0.102   1.082   7.600
  147    HE2  LYS  16           2HE      LYS  16   1.539  -0.044   6.196
  148    HE3  LYS  16           3HE      LYS  16   0.068   0.272   5.267
  149    HZ1  LYS  16           HZ1      LYS  16   1.135   2.085   4.171
  150    HZ2  LYS  16           HZ2      LYS  16   2.477   1.999   5.125
  151    HZ3  LYS  16           HZ3      LYS  16   2.145   0.808   4.057
  152    H    CYS  17           H        CYS  17  -2.973   4.242   2.419
  153    HA   CYS  17           HA       CYS  17  -0.516   3.341   0.966
  154    HB2  CYS  17           2HB      CYS  17  -2.483   1.966   0.415
  155    HB3  CYS  17           3HB      CYS  17  -3.399   3.420   0.024
  156    H    LYS  18           H        LYS  18   0.559   4.824  -0.158
  157    HA   LYS  18           HA       LYS  18  -0.620   7.343  -1.160
  158    HB2  LYS  18           2HB      LYS  18   1.665   7.172   0.876
  159    HB3  LYS  18           3HB      LYS  18   1.370   8.617  -0.058
  160    HG2  LYS  18           2HG      LYS  18  -0.741   7.530   1.847
  161    HG3  LYS  18           3HG      LYS  18   0.605   8.504   2.372
  162    HD2  LYS  18           2HD      LYS  18  -1.204   9.991   2.125
  163    HD3  LYS  18           3HD      LYS  18  -0.044  10.338   0.858
  164    HE2  LYS  18           2HE      LYS  18  -2.230  10.554  -0.059
  165    HE3  LYS  18           3HE      LYS  18  -1.501   9.127  -0.785
  166    HZ1  LYS  18           HZ1      LYS  18  -2.811   7.749   0.716
  167    HZ2  LYS  18           HZ2      LYS  18  -3.406   9.062   1.504
  168    HZ3  LYS  18           HZ3      LYS  18  -3.824   8.775  -0.046
  169    H    GLY  19           H        GLY  19   0.950   8.593  -2.403
  170    HA2  GLY  19           HA2      GLY  19   2.210   8.644  -4.369
  171    HA3  GLY  19           HA3      GLY  19   3.419   8.399  -3.137
  172    HA   PRO  20           HA       PRO  20   4.701   5.131  -5.846
  173    HB2  PRO  20           2HB      PRO  20   6.600   3.853  -4.350
  174    HB3  PRO  20           3HB      PRO  20   6.794   5.539  -4.920
  175    HG2  PRO  20           2HG      PRO  20   5.759   4.607  -2.215
  176    HG3  PRO  20           3HG      PRO  20   7.079   5.779  -2.544
  177    HD2  PRO  20           2HD      PRO  20   4.544   6.609  -2.047
  178    HD3  PRO  20           3HD      PRO  20   5.554   7.431  -3.275
  179    H    LEU  21           H        LEU  21   2.747   4.398  -3.182
  180    HA   LEU  21           HA       LEU  21   2.392   1.588  -4.137
  181    HB2  LEU  21           2HB      LEU  21   2.836   2.178  -1.641
  182    HB3  LEU  21           3HB      LEU  21   1.226   2.887  -1.651
  183    HG   LEU  21           HG       LEU  21   0.320   0.613  -2.378
  184   HD11  LEU  21          1HD1      LEU  21   3.222  -0.140  -1.821
  185   HD12  LEU  21          2HD1      LEU  21   1.897  -1.312  -1.781
  186   HD13  LEU  21          3HD1      LEU  21   2.256  -0.468  -3.291
  187   HD21  LEU  21          3HD2      LEU  21   0.534  -0.372  -0.145
  188   HD22  LEU  21          1HD2      LEU  21   1.882   0.732   0.232
  189   HD23  LEU  21          2HD2      LEU  21   0.245   1.372  -0.044
  190    H    LYS  22           H        LYS  22   0.688   4.622  -3.458
  191    HA   LYS  22           HA       LYS  22  -1.970   4.013  -4.318
  192    HB2  LYS  22           2HB      LYS  22  -1.465   6.038  -3.126
  193    HB3  LYS  22           3HB      LYS  22  -0.238   6.500  -4.303
  194    HG2  LYS  22           2HG      LYS  22  -1.976   7.988  -4.614
  195    HG3  LYS  22           3HG      LYS  22  -2.010   6.919  -6.006
  196    HD2  LYS  22           2HD      LYS  22  -3.935   5.689  -4.979
  197    HD3  LYS  22           3HD      LYS  22  -3.859   6.791  -3.580
  198    HE2  LYS  22           2HE      LYS  22  -4.108   8.720  -5.259
  199    HE3  LYS  22           3HE      LYS  22  -4.449   7.499  -6.489
  200    HZ1  LYS  22           HZ1      LYS  22  -6.048   8.033  -4.045
  201    HZ2  LYS  22           HZ2      LYS  22  -6.521   8.267  -5.591
  202    HZ3  LYS  22           HZ3      LYS  22  -6.311   6.744  -5.008
  203    H    LEU  23           H        LEU  23   0.796   5.102  -6.125
  204    HA   LEU  23           HA       LEU  23  -0.457   5.034  -8.721
  205    HB2  LEU  23           2HB      LEU  23   1.412   6.519  -7.965
  206    HB3  LEU  23           3HB      LEU  23   2.479   5.120  -7.907
  207    HG   LEU  23           HG       LEU  23   2.342   4.882 -10.361
  208   HD11  LEU  23          1HD1      LEU  23   1.263   6.675 -11.714
  209   HD12  LEU  23          2HD1      LEU  23   0.075   5.738 -10.807
  210   HD13  LEU  23          3HD1      LEU  23   0.551   7.355 -10.234
  211   HD21  LEU  23          3HD2      LEU  23   4.053   6.339  -9.357
  212   HD22  LEU  23          1HD2      LEU  23   3.546   6.930 -10.947
  213   HD23  LEU  23          2HD2      LEU  23   2.951   7.728  -9.474
  214    H    VAL  24           H        VAL  24   0.616   2.362  -6.874
  215    HA   VAL  24           HA       VAL  24   1.377   0.766  -9.311
  216    HB   VAL  24           HB       VAL  24   2.173   0.451  -6.396
  217   HG11  VAL  24          1HG1      VAL  24   3.695  -1.360  -7.217
  218   HG12  VAL  24          2HG1      VAL  24   1.992  -1.798  -7.329
  219   HG13  VAL  24          3HG1      VAL  24   2.876  -1.299  -8.790
  220   HG21  VAL  24          3HG2      VAL  24   3.760   1.143  -8.908
  221   HG22  VAL  24          1HG2      VAL  24   3.380   2.242  -7.562
  222   HG23  VAL  24          2HG2      VAL  24   4.454   0.866  -7.297
  223    H    CYS  25           H        CYS  25  -0.689   0.866  -6.432
  224    HA   CYS  25           HA       CYS  25  -1.847  -1.803  -7.099
  225    HB2  CYS  25           2HB      CYS  25  -1.120  -0.206  -4.658
  226    HB3  CYS  25           3HB      CYS  25  -2.517  -1.211  -4.559
  227    H    LYS  26           H        LYS  26  -2.542   1.368  -7.472
  228    HA   LYS  26           HA       LYS  26  -4.079   2.855  -7.194
  229    HB2  LYS  26           2HB      LYS  26  -4.805   1.748  -9.287
  230    HB3  LYS  26           3HB      LYS  26  -6.089   0.926  -8.356
  231    HG2  LYS  26           2HG      LYS  26  -6.966   3.091  -7.596
  232    HG3  LYS  26           3HG      LYS  26  -5.554   3.934  -8.246
  233    HD2  LYS  26           2HD      LYS  26  -7.461   4.348  -9.608
  234    HD3  LYS  26           3HD      LYS  26  -6.232   3.447 -10.516
  235    HE2  LYS  26           2HE      LYS  26  -7.512   1.338 -10.154
  236    HE3  LYS  26           3HE      LYS  26  -8.721   2.229  -9.218
  237    HZ1  LYS  26           HZ1      LYS  26  -9.241   3.503 -11.232
  238    HZ2  LYS  26           HZ2      LYS  26  -8.120   2.684 -12.095
  239    HZ3  LYS  26           HZ3      LYS  26  -9.434   1.910 -11.519
  240    H    CYS  27           H        CYS  27  -4.591   3.679  -5.497
  241    HA   CYS  27           HA       CYS  27  -6.208   2.236  -3.426
  242    HB2  CYS  27           2HB      CYS  27  -4.053   4.330  -3.007
  243    HB3  CYS  27           3HB      CYS  27  -4.981   3.521  -1.757
  Start of MODEL   19
    1    H1   GLY   1           1H       GLY   1  10.571  -6.825   3.280
    2    H2   GLY   1           2H       GLY   1  10.278  -7.859   4.514
    3    H3   GLY   1           3H       GLY   1  10.651  -8.442   3.029
    4    HA2  GLY   1           HA2      GLY   1   8.582  -7.549   2.107
    5    HA3  GLY   1           HA3      GLY   1   8.266  -8.673   3.444
    6    H    LEU   2           H        LEU   2   6.174  -5.823   4.061
    7    HA   LEU   2           HA       LEU   2   6.159  -8.419   2.710
    8    HB2  LEU   2           2HB      LEU   2   4.031  -6.288   3.116
    9    HB3  LEU   2           3HB      LEU   2   3.737  -7.857   2.378
   10    HG   LEU   2           HG       LEU   2   4.694  -7.448   5.249
   11   HD11  LEU   2          1HD1      LEU   2   2.392  -6.623   4.869
   12   HD12  LEU   2          2HD1      LEU   2   1.944  -8.207   4.199
   13   HD13  LEU   2          3HD1      LEU   2   2.428  -8.061   5.900
   14   HD21  LEU   2          3HD2      LEU   2   5.381  -9.649   4.398
   15   HD22  LEU   2          1HD2      LEU   2   4.037  -9.835   5.523
   16   HD23  LEU   2          2HD2      LEU   2   3.742  -9.946   3.774
   17    HA   PRO   3           HA       PRO   3   6.762  -6.693  -1.384
   18    HB2  PRO   3           2HB      PRO   3   5.889  -8.683  -2.994
   19    HB3  PRO   3           3HB      PRO   3   7.313  -8.908  -1.928
   20    HG2  PRO   3           2HG      PRO   3   4.438  -9.703  -1.383
   21    HG3  PRO   3           3HG      PRO   3   5.899 -10.736  -1.247
   22    HD2  PRO   3           2HD      PRO   3   4.783  -9.442   0.898
   23    HD3  PRO   3           3HD      PRO   3   6.545  -9.693   0.755
   24    H    ARG   4           H        ARG   4   5.577  -5.793  -3.161
   25    HA   ARG   4           HA       ARG   4   3.233  -4.424  -2.476
   26    HB2  ARG   4           2HB      ARG   4   4.440  -5.050  -5.201
   27    HB3  ARG   4           3HB      ARG   4   3.066  -3.959  -4.980
   28    HG2  ARG   4           2HG      ARG   4   4.362  -2.483  -3.546
   29    HG3  ARG   4           3HG      ARG   4   5.762  -3.571  -3.609
   30    HD2  ARG   4           2HD      ARG   4   5.955  -3.217  -6.036
   31    HD3  ARG   4           3HD      ARG   4   4.528  -2.162  -6.008
   32    HE   ARG   4           HE       ARG   4   6.447  -1.177  -4.137
   33   HH11  ARG   4          2HH2      ARG   4   6.076  -1.375  -7.616
   34   HH12  ARG   4          1HH2      ARG   4   7.070   0.029  -7.893
   35   HH21  ARG   4          1HH1      ARG   4   7.731   0.585  -4.564
   36   HH22  ARG   4          2HH1      ARG   4   7.990   1.096  -6.206
   37    H    LYS   5           H        LYS   5   3.374  -7.506  -4.202
   38    HA   LYS   5           HA       LYS   5   0.643  -7.677  -5.028
   39    HB2  LYS   5           2HB      LYS   5   2.632  -9.872  -4.292
   40    HB3  LYS   5           3HB      LYS   5   1.068 -10.148  -5.069
   41    HG2  LYS   5           2HG      LYS   5   1.755  -8.782  -7.014
   42    HG3  LYS   5           3HG      LYS   5   3.301  -8.431  -6.242
   43    HD2  LYS   5           2HD      LYS   5   3.655 -10.172  -7.870
   44    HD3  LYS   5           3HD      LYS   5   3.900 -10.816  -6.252
   45    HE2  LYS   5           2HE      LYS   5   2.731 -12.469  -7.527
   46    HE3  LYS   5           3HE      LYS   5   1.613 -11.837  -6.321
   47    HZ1  LYS   5           HZ1      LYS   5   0.581 -12.024  -8.521
   48    HZ2  LYS   5           HZ2      LYS   5   0.617 -10.456  -8.082
   49    HZ3  LYS   5           HZ3      LYS   5   1.683 -11.024  -9.185
   50    H    ILE   6           H        ILE   6   2.139  -8.678  -1.955
   51    HA   ILE   6           HA       ILE   6  -0.437  -9.563  -0.808
   52    HB   ILE   6           HB       ILE   6   2.429  -9.461   0.182
   53   HG12  ILE   6          2HG1      ILE   6   2.108 -11.872   0.527
   54   HG13  ILE   6          3HG1      ILE   6   0.446 -11.772  -0.047
   55   HG21  ILE   6          1HG2      ILE   6  -0.035 -10.149   1.839
   56   HG22  ILE   6          2HG2      ILE   6   1.644 -10.477   2.317
   57   HG23  ILE   6          3HG2      ILE   6   1.103  -8.814   2.128
   58   HD11  ILE   6          3HD1      ILE   6   2.035 -12.766  -1.675
   59   HD12  ILE   6          1HD1      ILE   6   1.231 -11.334  -2.324
   60   HD13  ILE   6          2HD1      ILE   6   2.917 -11.235  -1.744
   61    H    LEU   7           H        LEU   7   1.882  -6.865  -0.374
   62    HA   LEU   7           HA       LEU   7   0.553  -5.636   1.783
   63    HB2  LEU   7           2HB      LEU   7   2.906  -5.302   1.096
   64    HB3  LEU   7           3HB      LEU   7   2.371  -4.440  -0.343
   65    HG   LEU   7           HG       LEU   7   1.469  -2.614   1.027
   66   HD11  LEU   7          1HD1      LEU   7   0.780  -3.788   3.068
   67   HD12  LEU   7          2HD1      LEU   7   2.467  -4.233   3.417
   68   HD13  LEU   7          3HD1      LEU   7   1.948  -2.533   3.475
   69   HD21  LEU   7          3HD2      LEU   7   4.290  -3.390   1.883
   70   HD22  LEU   7          1HD2      LEU   7   3.865  -2.610   0.349
   71   HD23  LEU   7          2HD2      LEU   7   3.596  -1.753   1.875
   72    H    CYS   8           H        CYS   8  -0.115  -5.299  -1.696
   73    HA   CYS   8           HA       CYS   8  -1.771  -3.003  -1.624
   74    HB2  CYS   8           2HB      CYS   8  -0.997  -3.983  -3.672
   75    HB3  CYS   8           3HB      CYS   8  -1.806  -5.510  -3.339
   76    H    ALA   9           H        ALA   9  -2.609  -6.391  -0.742
   77    HA   ALA   9           HA       ALA   9  -5.444  -5.918  -0.473
   78    HB1  ALA   9           3HB      ALA   9  -5.422  -8.036   0.700
   79    HB2  ALA   9           1HB      ALA   9  -4.366  -8.157  -0.732
   80    HB3  ALA   9           2HB      ALA   9  -3.658  -7.961   0.903
   81    H    ILE  10           H        ILE  10  -2.820  -4.911   1.460
   82    HA   ILE  10           HA       ILE  10  -4.411  -4.759   3.985
   83    HB   ILE  10           HB       ILE  10  -1.414  -4.653   3.484
   84   HG12  ILE  10          2HG1      ILE  10  -3.062  -6.901   4.738
   85   HG13  ILE  10          3HG1      ILE  10  -2.546  -6.911   3.060
   86   HG21  ILE  10          1HG2      ILE  10  -1.191  -4.808   5.934
   87   HG22  ILE  10          2HG2      ILE  10  -2.104  -3.365   5.505
   88   HG23  ILE  10          3HG2      ILE  10  -2.957  -4.800   6.114
   89   HD11  ILE  10          3HD1      ILE  10  -1.042  -8.268   4.248
   90   HD12  ILE  10          1HD1      ILE  10  -0.180  -6.808   3.739
   91   HD13  ILE  10          2HD1      ILE  10  -0.689  -6.998   5.440
   92    H    ALA  11           H        ALA  11  -2.307  -2.871   1.799
   93    HA   ALA  11           HA       ALA  11  -2.285  -0.411   3.052
   94    HB1  ALA  11           3HB      ALA  11  -0.963  -1.137   1.059
   95    HB2  ALA  11           1HB      ALA  11  -2.420  -0.968   0.048
   96    HB3  ALA  11           2HB      ALA  11  -1.697   0.449   0.843
   97    H    LYS  12           H        LYS  12  -4.753  -1.413   0.568
   98    HA   LYS  12           HA       LYS  12  -6.376   0.936   1.286
   99    HB2  LYS  12           2HB      LYS  12  -7.790   0.347  -0.554
  100    HB3  LYS  12           3HB      LYS  12  -6.100   0.481  -1.009
  101    HG2  LYS  12           2HG      LYS  12  -5.963  -2.043  -0.962
  102    HG3  LYS  12           3HG      LYS  12  -7.718  -2.083  -0.713
  103    HD2  LYS  12           2HD      LYS  12  -8.046  -0.846  -2.834
  104    HD3  LYS  12           3HD      LYS  12  -6.286  -0.713  -3.040
  105    HE2  LYS  12           2HE      LYS  12  -6.107  -3.186  -3.129
  106    HE3  LYS  12           3HE      LYS  12  -7.863  -3.324  -2.956
  107    HZ1  LYS  12           HZ1      LYS  12  -6.480  -1.953  -5.214
  108    HZ2  LYS  12           HZ2      LYS  12  -7.174  -3.434  -5.295
  109    HZ3  LYS  12           HZ3      LYS  12  -8.100  -2.111  -5.057
  110    H    LYS  13           H        LYS  13  -6.490  -2.504   2.129
  111    HA   LYS  13           HA       LYS  13  -9.128  -2.417   3.287
  112    HB2  LYS  13           2HB      LYS  13  -7.844  -4.445   2.848
  113    HB3  LYS  13           3HB      LYS  13  -6.686  -4.024   4.127
  114    HG2  LYS  13           2HG      LYS  13  -8.528  -4.164   5.803
  115    HG3  LYS  13           3HG      LYS  13  -9.663  -4.593   4.515
  116    HD2  LYS  13           2HD      LYS  13  -7.192  -6.203   5.315
  117    HD3  LYS  13           3HD      LYS  13  -8.850  -6.545   5.832
  118    HE2  LYS  13           2HE      LYS  13  -9.522  -6.859   3.449
  119    HE3  LYS  13           3HE      LYS  13  -7.850  -6.570   2.947
  120    HZ1  LYS  13           HZ1      LYS  13  -7.190  -8.530   4.231
  121    HZ2  LYS  13           HZ2      LYS  13  -8.734  -8.800   4.701
  122    HZ3  LYS  13           HZ3      LYS  13  -8.321  -8.942   3.130
  123    H    LYS  14           H        LYS  14  -5.973  -1.472   4.682
  124    HA   LYS  14           HA       LYS  14  -7.246  -0.508   7.187
  125    HB2  LYS  14           2HB      LYS  14  -4.385  -0.807   6.219
  126    HB3  LYS  14           3HB      LYS  14  -4.759   0.194   7.603
  127    HG2  LYS  14           2HG      LYS  14  -4.074  -1.990   8.333
  128    HG3  LYS  14           3HG      LYS  14  -5.730  -1.639   8.826
  129    HD2  LYS  14           2HD      LYS  14  -6.617  -3.157   7.122
  130    HD3  LYS  14           3HD      LYS  14  -5.006  -3.360   6.420
  131    HE2  LYS  14           2HE      LYS  14  -5.495  -5.317   7.714
  132    HE3  LYS  14           3HE      LYS  14  -4.217  -4.412   8.529
  133    HZ1  LYS  14           HZ1      LYS  14  -5.927  -5.184  10.083
  134    HZ2  LYS  14           HZ2      LYS  14  -5.898  -3.556  10.075
  135    HZ3  LYS  14           HZ3      LYS  14  -7.093  -4.360   9.298
  136    H    GLY  15           H        GLY  15  -6.561   0.900   4.138
  137    HA2  GLY  15           HA2      GLY  15  -6.908   3.067   3.389
  138    HA3  GLY  15           HA3      GLY  15  -7.395   3.558   5.015
  139    H    LYS  16           H        LYS  16  -4.327   1.996   4.293
  140    HA   LYS  16           HA       LYS  16  -2.779   4.473   4.950
  141    HB2  LYS  16           2HB      LYS  16  -2.984   2.772   6.821
  142    HB3  LYS  16           3HB      LYS  16  -2.166   1.613   5.785
  143    HG2  LYS  16           2HG      LYS  16  -0.586   2.506   7.338
  144    HG3  LYS  16           3HG      LYS  16  -0.152   3.129   5.746
  145    HD2  LYS  16           2HD      LYS  16  -1.191   5.300   6.273
  146    HD3  LYS  16           3HD      LYS  16  -1.758   4.694   7.832
  147    HE2  LYS  16           2HE      LYS  16   1.176   4.882   7.001
  148    HE3  LYS  16           3HE      LYS  16   0.317   6.145   7.888
  149    HZ1  LYS  16           HZ1      LYS  16  -0.078   4.543   9.681
  150    HZ2  LYS  16           HZ2      LYS  16   0.748   3.378   8.882
  151    HZ3  LYS  16           HZ3      LYS  16   1.519   4.713   9.409
  152    H    CYS  17           H        CYS  17  -2.930   4.686   2.610
  153    HA   CYS  17           HA       CYS  17  -0.792   3.240   1.118
  154    HB2  CYS  17           2HB      CYS  17  -3.077   2.179   0.813
  155    HB3  CYS  17           3HB      CYS  17  -3.632   3.712   0.151
  156    H    LYS  18           H        LYS  18   0.358   4.571  -0.210
  157    HA   LYS  18           HA       LYS  18  -0.666   7.069  -1.319
  158    HB2  LYS  18           2HB      LYS  18   0.979   8.537  -0.208
  159    HB3  LYS  18           3HB      LYS  18  -0.131   7.835   0.956
  160    HG2  LYS  18           2HG      LYS  18   1.556   6.202   1.669
  161    HG3  LYS  18           3HG      LYS  18   2.687   6.786   0.428
  162    HD2  LYS  18           2HD      LYS  18   2.609   9.060   1.492
  163    HD3  LYS  18           3HD      LYS  18   1.624   8.394   2.798
  164    HE2  LYS  18           2HE      LYS  18   4.431   7.449   2.030
  165    HE3  LYS  18           3HE      LYS  18   4.084   8.617   3.305
  166    HZ1  LYS  18           HZ1      LYS  18   3.159   5.794   3.296
  167    HZ2  LYS  18           HZ2      LYS  18   4.344   6.409   4.230
  168    HZ3  LYS  18           HZ3      LYS  18   2.804   6.894   4.460
  169    H    GLY  19           H        GLY  19   1.077   8.276  -2.486
  170    HA2  GLY  19           HA2      GLY  19   2.590   8.335  -4.228
  171    HA3  GLY  19           HA3      GLY  19   3.612   7.533  -3.057
  172    HA   PRO  20           HA       PRO  20   3.769   4.587  -6.494
  173    HB2  PRO  20           2HB      PRO  20   5.418   2.682  -5.410
  174    HB3  PRO  20           3HB      PRO  20   5.994   4.264  -6.017
  175    HG2  PRO  20           2HG      PRO  20   5.355   3.492  -3.152
  176    HG3  PRO  20           3HG      PRO  20   6.809   4.336  -3.776
  177    HD2  PRO  20           2HD      PRO  20   4.724   5.692  -2.685
  178    HD3  PRO  20           3HD      PRO  20   5.619   6.355  -4.088
  179    H    LEU  21           H        LEU  21   2.997   3.475  -3.128
  180    HA   LEU  21           HA       LEU  21   1.877   0.971  -3.961
  181    HB2  LEU  21           2HB      LEU  21   2.545   2.052  -1.552
  182    HB3  LEU  21           3HB      LEU  21   0.828   2.368  -1.509
  183    HG   LEU  21           HG       LEU  21   1.197   0.342  -0.350
  184   HD11  LEU  21          1HD1      LEU  21  -0.741   0.164  -1.926
  185   HD12  LEU  21          2HD1      LEU  21   0.329  -0.652  -3.090
  186   HD13  LEU  21          3HD1      LEU  21   0.001  -1.388  -1.512
  187   HD21  LEU  21          3HD2      LEU  21   2.407  -1.588  -1.266
  188   HD22  LEU  21          1HD2      LEU  21   2.799  -0.669  -2.733
  189   HD23  LEU  21          2HD2      LEU  21   3.443  -0.156  -1.156
  190    H    LYS  22           H        LYS  22   0.465   4.192  -3.552
  191    HA   LYS  22           HA       LYS  22  -2.302   3.516  -4.019
  192    HB2  LYS  22           2HB      LYS  22  -1.517   5.588  -2.955
  193    HB3  LYS  22           3HB      LYS  22  -0.777   6.115  -4.474
  194    HG2  LYS  22           2HG      LYS  22  -3.035   6.186  -5.536
  195    HG3  LYS  22           3HG      LYS  22  -3.747   5.595  -4.031
  196    HD2  LYS  22           2HD      LYS  22  -4.090   7.931  -4.018
  197    HD3  LYS  22           3HD      LYS  22  -2.768   7.632  -2.871
  198    HE2  LYS  22           2HE      LYS  22  -1.112   8.314  -4.584
  199    HE3  LYS  22           3HE      LYS  22  -2.401   8.503  -5.778
  200    HZ1  LYS  22           HZ1      LYS  22  -2.157  10.122  -3.294
  201    HZ2  LYS  22           HZ2      LYS  22  -1.783  10.638  -4.797
  202    HZ3  LYS  22           HZ3      LYS  22  -3.329  10.291  -4.419
  203    H    LEU  23           H        LEU  23   0.280   4.585  -6.219
  204    HA   LEU  23           HA       LEU  23  -1.251   4.471  -8.637
  205    HB2  LEU  23           2HB      LEU  23   0.867   5.674  -8.301
  206    HB3  LEU  23           3HB      LEU  23   1.743   4.171  -8.132
  207    HG   LEU  23           HG       LEU  23   2.013   5.397 -10.283
  208   HD11  LEU  23          1HD1      LEU  23   2.522   2.960 -10.076
  209   HD12  LEU  23          2HD1      LEU  23   0.923   2.610 -10.773
  210   HD13  LEU  23          3HD1      LEU  23   2.118   3.507 -11.711
  211   HD21  LEU  23          3HD2      LEU  23   0.341   5.288 -12.022
  212   HD22  LEU  23          1HD2      LEU  23  -0.783   4.417 -10.965
  213   HD23  LEU  23          2HD2      LEU  23  -0.340   6.103 -10.604
  214    H    VAL  24           H        VAL  24   0.825   1.999  -7.091
  215    HA   VAL  24           HA       VAL  24   0.537  -0.046  -9.068
  216    HB   VAL  24           HB       VAL  24   1.277  -0.076  -6.122
  217   HG11  VAL  24          1HG1      VAL  24   2.322  -2.290  -6.499
  218   HG12  VAL  24          2HG1      VAL  24   0.568  -2.360  -6.597
  219   HG13  VAL  24          3HG1      VAL  24   1.536  -2.382  -8.091
  220   HG21  VAL  24          3HG2      VAL  24   3.079  -0.499  -8.537
  221   HG22  VAL  24          1HG2      VAL  24   2.778   1.100  -7.849
  222   HG23  VAL  24          2HG2      VAL  24   3.528  -0.133  -6.844
  223    H    CYS  25           H        CYS  25  -1.348   0.626  -6.143
  224    HA   CYS  25           HA       CYS  25  -2.868  -1.911  -6.433
  225    HB2  CYS  25           2HB      CYS  25  -1.510  -1.354  -4.425
  226    HB3  CYS  25           3HB      CYS  25  -2.532   0.048  -4.143
  227    H    LYS  26           H        LYS  26  -3.316   1.414  -6.963
  228    HA   LYS  26           HA       LYS  26  -4.997   2.842  -7.191
  229    HB2  LYS  26           2HB      LYS  26  -5.508   0.773  -8.882
  230    HB3  LYS  26           3HB      LYS  26  -7.054   0.857  -8.049
  231    HG2  LYS  26           2HG      LYS  26  -5.566   3.207  -9.302
  232    HG3  LYS  26           3HG      LYS  26  -6.834   2.279 -10.120
  233    HD2  LYS  26           2HD      LYS  26  -8.490   3.001  -8.404
  234    HD3  LYS  26           3HD      LYS  26  -7.225   3.890  -7.553
  235    HE2  LYS  26           2HE      LYS  26  -8.444   5.492  -8.796
  236    HE3  LYS  26           3HE      LYS  26  -6.861   5.316  -9.555
  237    HZ1  LYS  26           HZ1      LYS  26  -9.372   4.041 -10.529
  238    HZ2  LYS  26           HZ2      LYS  26  -8.669   5.353 -11.195
  239    HZ3  LYS  26           HZ3      LYS  26  -7.912   3.911 -11.258
  240    H    CYS  27           H        CYS  27  -4.632   2.846  -4.899
  241    HA   CYS  27           HA       CYS  27  -6.655   1.922  -3.031
  242    HB2  CYS  27           2HB      CYS  27  -4.400   3.943  -2.709
  243    HB3  CYS  27           3HB      CYS  27  -5.379   3.300  -1.419
  Start of MODEL   20
    1    H1   GLY   1           1H       GLY   1  10.526  -6.299   3.898
    2    H2   GLY   1           2H       GLY   1  11.028  -6.701   2.390
    3    H3   GLY   1           3H       GLY   1  10.449  -5.197   2.691
    4    HA2  GLY   1           HA2      GLY   1   8.763  -6.486   1.527
    5    HA3  GLY   1           HA3      GLY   1   8.846  -7.681   2.838
    6    H    LEU   2           H        LEU   2   5.984  -5.688   3.613
    7    HA   LEU   2           HA       LEU   2   6.730  -8.180   2.313
    8    HB2  LEU   2           2HB      LEU   2   4.065  -6.741   2.604
    9    HB3  LEU   2           3HB      LEU   2   4.255  -8.372   1.979
   10    HG   LEU   2           HG       LEU   2   4.942  -7.477   4.814
   11   HD11  LEU   2          1HD1      LEU   2   2.989  -8.760   5.476
   12   HD12  LEU   2          2HD1      LEU   2   2.509  -7.532   4.293
   13   HD13  LEU   2          3HD1      LEU   2   2.678  -9.232   3.794
   14   HD21  LEU   2          3HD2      LEU   2   6.377  -9.363   4.178
   15   HD22  LEU   2          1HD2      LEU   2   5.116  -9.922   5.277
   16   HD23  LEU   2          2HD2      LEU   2   4.972 -10.249   3.536
   17    HA   PRO   3           HA       PRO   3   6.859  -6.919  -1.968
   18    HB2  PRO   3           2HB      PRO   3   4.859  -9.096  -2.573
   19    HB3  PRO   3           3HB      PRO   3   6.433  -8.762  -3.358
   20    HG2  PRO   3           2HG      PRO   3   6.196 -10.796  -1.589
   21    HG3  PRO   3           3HG      PRO   3   7.632  -9.719  -1.521
   22    HD2  PRO   3           2HD      PRO   3   5.118  -9.610   0.174
   23    HD3  PRO   3           3HD      PRO   3   6.831  -9.531   0.685
   24    H    ARG   4           H        ARG   4   5.689  -5.621  -3.463
   25    HA   ARG   4           HA       ARG   4   3.611  -4.089  -2.452
   26    HB2  ARG   4           2HB      ARG   4   3.452  -3.000  -4.597
   27    HB3  ARG   4           3HB      ARG   4   5.120  -3.331  -4.161
   28    HG2  ARG   4           2HG      ARG   4   5.145  -3.909  -6.387
   29    HG3  ARG   4           3HG      ARG   4   4.872  -5.472  -5.632
   30    HD2  ARG   4           2HD      ARG   4   2.268  -4.649  -6.045
   31    HD3  ARG   4           3HD      ARG   4   3.091  -3.799  -7.353
   32    HE   ARG   4           HE       ARG   4   4.023  -6.469  -7.341
   33   HH11  ARG   4          2HH2      ARG   4   1.002  -4.834  -8.030
   34   HH12  ARG   4          1HH2      ARG   4   0.485  -6.060  -9.153
   35   HH21  ARG   4          1HH1      ARG   4   3.332  -7.961  -8.852
   36   HH22  ARG   4          2HH1      ARG   4   1.777  -7.778  -9.604
   37    H    LYS   5           H        LYS   5   3.172  -6.959  -4.404
   38    HA   LYS   5           HA       LYS   5   0.379  -6.816  -4.974
   39    HB2  LYS   5           2HB      LYS   5   2.024  -8.462  -5.900
   40    HB3  LYS   5           3HB      LYS   5   2.142  -9.229  -4.314
   41    HG2  LYS   5           2HG      LYS   5  -0.389  -9.681  -4.492
   42    HG3  LYS   5           3HG      LYS   5  -0.266  -9.155  -6.174
   43    HD2  LYS   5           2HD      LYS   5   1.125 -11.518  -4.835
   44    HD3  LYS   5           3HD      LYS   5  -0.193 -11.580  -6.012
   45    HE2  LYS   5           2HE      LYS   5   1.343 -10.514  -7.706
   46    HE3  LYS   5           3HE      LYS   5   2.654 -10.614  -6.517
   47    HZ1  LYS   5           HZ1      LYS   5   2.685 -12.517  -8.025
   48    HZ2  LYS   5           HZ2      LYS   5   2.372 -13.035  -6.511
   49    HZ3  LYS   5           HZ3      LYS   5   1.167 -12.944  -7.610
   50    H    ILE   6           H        ILE   6   2.082  -7.961  -2.102
   51    HA   ILE   6           HA       ILE   6  -0.406  -8.881  -0.786
   52    HB   ILE   6           HB       ILE   6   2.548  -9.172  -0.125
   53   HG12  ILE   6          2HG1      ILE   6   0.535 -11.309  -0.975
   54   HG13  ILE   6          3HG1      ILE   6   1.536 -10.455  -2.138
   55   HG21  ILE   6          1HG2      ILE   6   0.114 -10.348   1.296
   56   HG22  ILE   6          2HG2      ILE   6   1.811 -10.758   1.645
   57   HG23  ILE   6          3HG2      ILE   6   1.219  -9.127   1.955
   58   HD11  ILE   6          3HD1      ILE   6   2.580 -12.240   0.078
   59   HD12  ILE   6          1HD1      ILE   6   2.568 -12.549  -1.669
   60   HD13  ILE   6          2HD1      ILE   6   3.588 -11.256  -1.016
   61    H    LEU   7           H        LEU   7   2.253  -6.542  -0.235
   62    HA   LEU   7           HA       LEU   7   1.308  -5.385   2.174
   63    HB2  LEU   7           2HB      LEU   7   3.549  -5.030   1.115
   64    HB3  LEU   7           3HB      LEU   7   2.784  -4.138  -0.194
   65    HG   LEU   7           HG       LEU   7   2.070  -2.376   1.406
   66   HD11  LEU   7          1HD1      LEU   7   3.638  -4.013   3.449
   67   HD12  LEU   7          2HD1      LEU   7   3.064  -2.349   3.690
   68   HD13  LEU   7          3HD1      LEU   7   1.894  -3.655   3.494
   69   HD21  LEU   7          3HD2      LEU   7   4.213  -2.191   0.211
   70   HD22  LEU   7          1HD2      LEU   7   4.309  -1.455   1.819
   71   HD23  LEU   7          2HD2      LEU   7   5.034  -3.054   1.530
   72    H    CYS   8           H        CYS   8   0.306  -4.823  -1.211
   73    HA   CYS   8           HA       CYS   8  -1.329  -2.533  -0.668
   74    HB2  CYS   8           2HB      CYS   8  -0.640  -3.164  -2.937
   75    HB3  CYS   8           3HB      CYS   8  -1.652  -4.611  -2.856
   76    H    ALA   9           H        ALA   9  -2.026  -6.038  -0.292
   77    HA   ALA   9           HA       ALA   9  -4.888  -5.733  -0.110
   78    HB1  ALA   9           3HB      ALA   9  -4.839  -7.993   0.819
   79    HB2  ALA   9           1HB      ALA   9  -3.743  -7.891  -0.573
   80    HB3  ALA   9           2HB      ALA   9  -3.089  -7.890   1.083
   81    H    ILE  10           H        ILE  10  -2.261  -5.537   2.245
   82    HA   ILE  10           HA       ILE  10  -3.901  -5.049   4.589
   83    HB   ILE  10           HB       ILE  10  -1.026  -4.161   4.089
   84   HG12  ILE  10          2HG1      ILE  10  -1.059  -6.510   3.500
   85   HG13  ILE  10          3HG1      ILE  10  -0.188  -6.241   4.973
   86   HG21  ILE  10          1HG2      ILE  10  -2.545  -4.802   6.643
   87   HG22  ILE  10          2HG2      ILE  10  -0.805  -4.452   6.546
   88   HG23  ILE  10          3HG2      ILE  10  -1.978  -3.211   6.092
   89   HD11  ILE  10          3HD1      ILE  10  -3.033  -7.334   4.788
   90   HD12  ILE  10          1HD1      ILE  10  -1.561  -8.275   5.081
   91   HD13  ILE  10          2HD1      ILE  10  -2.111  -7.108   6.296
   92    H    ALA  11           H        ALA  11  -2.164  -2.933   2.269
   93    HA   ALA  11           HA       ALA  11  -2.729  -0.479   3.505
   94    HB1  ALA  11           3HB      ALA  11  -1.941   0.485   1.459
   95    HB2  ALA  11           1HB      ALA  11  -1.034  -1.005   1.705
   96    HB3  ALA  11           2HB      ALA  11  -2.370  -0.954   0.521
   97    H    LYS  12           H        LYS  12  -4.711  -2.199   1.047
   98    HA   LYS  12           HA       LYS  12  -6.836  -0.256   0.805
   99    HB2  LYS  12           2HB      LYS  12  -6.943  -3.315   0.704
  100    HB3  LYS  12           3HB      LYS  12  -8.228  -2.245   0.157
  101    HG2  LYS  12           2HG      LYS  12  -5.441  -2.238  -1.038
  102    HG3  LYS  12           3HG      LYS  12  -6.735  -3.289  -1.600
  103    HD2  LYS  12           2HD      LYS  12  -8.068  -1.366  -2.290
  104    HD3  LYS  12           3HD      LYS  12  -6.856  -0.237  -1.595
  105    HE2  LYS  12           2HE      LYS  12  -5.130  -1.070  -3.004
  106    HE3  LYS  12           3HE      LYS  12  -6.117  -2.413  -3.571
  107    HZ1  LYS  12           HZ1      LYS  12  -5.956  -0.566  -5.221
  108    HZ2  LYS  12           HZ2      LYS  12  -7.509  -0.869  -4.793
  109    HZ3  LYS  12           HZ3      LYS  12  -6.733   0.434  -4.185
  110    H    LYS  13           H        LYS  13  -6.448  -3.064   2.873
  111    HA   LYS  13           HA       LYS  13  -8.826  -2.941   4.367
  112    HB2  LYS  13           2HB      LYS  13  -6.877  -4.743   4.214
  113    HB3  LYS  13           3HB      LYS  13  -6.227  -3.909   5.611
  114    HG2  LYS  13           2HG      LYS  13  -7.483  -5.638   6.534
  115    HG3  LYS  13           3HG      LYS  13  -8.601  -4.269   6.656
  116    HD2  LYS  13           2HD      LYS  13  -9.668  -5.033   4.488
  117    HD3  LYS  13           3HD      LYS  13  -8.541  -6.411   4.470
  118    HE2  LYS  13           2HE      LYS  13  -9.424  -7.142   6.668
  119    HE3  LYS  13           3HE      LYS  13 -10.542  -5.769   6.675
  120    HZ1  LYS  13           HZ1      LYS  13 -10.561  -7.972   4.674
  121    HZ2  LYS  13           HZ2      LYS  13 -11.634  -7.800   5.890
  122    HZ3  LYS  13           HZ3      LYS  13 -11.595  -6.706   4.682
  123    H    LYS  14           H        LYS  14  -5.704  -1.476   5.193
  124    HA   LYS  14           HA       LYS  14  -6.790  -0.181   7.614
  125    HB2  LYS  14           2HB      LYS  14  -4.036  -0.529   6.401
  126    HB3  LYS  14           3HB      LYS  14  -4.301   0.714   7.607
  127    HG2  LYS  14           2HG      LYS  14  -3.442  -1.245   8.673
  128    HG3  LYS  14           3HG      LYS  14  -5.071  -0.890   9.250
  129    HD2  LYS  14           2HD      LYS  14  -5.991  -2.745   7.927
  130    HD3  LYS  14           3HD      LYS  14  -4.421  -2.996   7.148
  131    HE2  LYS  14           2HE      LYS  14  -4.690  -4.696   8.809
  132    HE3  LYS  14           3HE      LYS  14  -3.425  -3.590   9.347
  133    HZ1  LYS  14           HZ1      LYS  14  -4.973  -4.150  11.141
  134    HZ2  LYS  14           HZ2      LYS  14  -5.058  -2.552  10.835
  135    HZ3  LYS  14           HZ3      LYS  14  -6.242  -3.553  10.310
  136    H    GLY  15           H        GLY  15  -6.686   0.761   4.358
  137    HA2  GLY  15           HA2      GLY  15  -7.069   2.779   3.308
  138    HA3  GLY  15           HA3      GLY  15  -7.377   3.538   4.876
  139    H    LYS  16           H        LYS  16  -4.396   1.819   4.173
  140    HA   LYS  16           HA       LYS  16  -2.824   4.284   4.736
  141    HB2  LYS  16           2HB      LYS  16  -2.782   2.182   6.183
  142    HB3  LYS  16           3HB      LYS  16  -1.893   1.395   4.873
  143    HG2  LYS  16           2HG      LYS  16  -0.045   3.005   5.141
  144    HG3  LYS  16           3HG      LYS  16  -1.015   3.973   6.257
  145    HD2  LYS  16           2HD      LYS  16   0.611   2.704   7.500
  146    HD3  LYS  16           3HD      LYS  16  -1.005   2.098   7.886
  147    HE2  LYS  16           2HE      LYS  16  -0.669   0.184   6.349
  148    HE3  LYS  16           3HE      LYS  16   0.908   0.827   5.870
  149    HZ1  LYS  16           HZ1      LYS  16   0.201  -0.058   8.622
  150    HZ2  LYS  16           HZ2      LYS  16   1.132  -0.895   7.573
  151    HZ3  LYS  16           HZ3      LYS  16   1.657   0.527   8.168
  152    H    CYS  17           H        CYS  17  -3.774   2.799   1.980
  153    HA   CYS  17           HA       CYS  17  -1.318   2.539   0.502
  154    HB2  CYS  17           2HB      CYS  17  -3.575   1.445   0.026
  155    HB3  CYS  17           3HB      CYS  17  -4.092   3.023  -0.584
  156    H    LYS  18           H        LYS  18  -0.026   4.141  -0.003
  157    HA   LYS  18           HA       LYS  18  -1.004   6.827  -0.876
  158    HB2  LYS  18           2HB      LYS  18   0.835   6.279   1.509
  159    HB3  LYS  18           3HB      LYS  18   0.664   7.861   0.748
  160    HG2  LYS  18           2HG      LYS  18  -1.753   7.896   1.309
  161    HG3  LYS  18           3HG      LYS  18  -1.594   6.319   2.086
  162    HD2  LYS  18           2HD      LYS  18  -1.591   7.984   3.793
  163    HD3  LYS  18           3HD      LYS  18   0.024   7.264   3.711
  164    HE2  LYS  18           2HE      LYS  18   0.834   9.224   2.414
  165    HE3  LYS  18           3HE      LYS  18  -0.794   9.917   2.432
  166    HZ1  LYS  18           HZ1      LYS  18   0.867   9.411   4.845
  167    HZ2  LYS  18           HZ2      LYS  18   0.599  10.874   4.176
  168    HZ3  LYS  18           HZ3      LYS  18  -0.635  10.057   4.860
  169    H    GLY  19           H        GLY  19   0.673   8.227  -1.669
  170    HA2  GLY  19           HA2      GLY  19   2.352   8.697  -3.176
  171    HA3  GLY  19           HA3      GLY  19   3.332   7.787  -2.044
  172    HA   PRO  20           HA       PRO  20   4.047   5.434  -5.856
  173    HB2  PRO  20           2HB      PRO  20   5.718   3.481  -4.888
  174    HB3  PRO  20           3HB      PRO  20   6.235   5.164  -5.201
  175    HG2  PRO  20           2HG      PRO  20   5.386   3.941  -2.558
  176    HG3  PRO  20           3HG      PRO  20   6.827   4.950  -2.901
  177    HD2  PRO  20           2HD      PRO  20   4.556   6.004  -1.847
  178    HD3  PRO  20           3HD      PRO  20   5.527   6.920  -3.041
  179    H    LEU  21           H        LEU  21   3.068   3.748  -2.787
  180    HA   LEU  21           HA       LEU  21   2.189   1.377  -4.142
  181    HB2  LEU  21           2HB      LEU  21   2.768   1.564  -1.709
  182    HB3  LEU  21           3HB      LEU  21   1.293   2.499  -1.457
  183    HG   LEU  21           HG       LEU  21  -0.065   0.526  -2.201
  184   HD11  LEU  21          1HD1      LEU  21   1.500  -0.667  -3.635
  185   HD12  LEU  21          2HD1      LEU  21   2.631  -0.879  -2.274
  186   HD13  LEU  21          3HD1      LEU  21   1.054  -1.699  -2.272
  187   HD21  LEU  21          3HD2      LEU  21   0.415   0.889   0.174
  188   HD22  LEU  21          1HD2      LEU  21   0.348  -0.840  -0.213
  189   HD23  LEU  21          2HD2      LEU  21   1.921  -0.046   0.026
  190    H    LYS  22           H        LYS  22   0.563   4.394  -3.364
  191    HA   LYS  22           HA       LYS  22  -2.115   3.631  -4.197
  192    HB2  LYS  22           2HB      LYS  22  -1.838   5.491  -2.730
  193    HB3  LYS  22           3HB      LYS  22  -0.746   6.326  -3.844
  194    HG2  LYS  22           2HG      LYS  22  -2.511   6.809  -5.386
  195    HG3  LYS  22           3HG      LYS  22  -3.631   5.708  -4.570
  196    HD2  LYS  22           2HD      LYS  22  -3.625   7.144  -2.566
  197    HD3  LYS  22           3HD      LYS  22  -2.479   8.256  -3.357
  198    HE2  LYS  22           2HE      LYS  22  -4.141   8.663  -5.163
  199    HE3  LYS  22           3HE      LYS  22  -5.269   7.551  -4.381
  200    HZ1  LYS  22           HZ1      LYS  22  -4.275  10.083  -3.182
  201    HZ2  LYS  22           HZ2      LYS  22  -5.765   9.853  -3.807
  202    HZ3  LYS  22           HZ3      LYS  22  -5.318   9.049  -2.460
  203    H    LEU  23           H        LEU  23   0.597   5.113  -5.931
  204    HA   LEU  23           HA       LEU  23  -0.775   5.255  -8.464
  205    HB2  LEU  23           2HB      LEU  23   1.206   6.571  -7.825
  206    HB3  LEU  23           3HB      LEU  23   2.197   5.131  -7.773
  207    HG   LEU  23           HG       LEU  23   2.492   6.645  -9.734
  208   HD11  LEU  23          1HD1      LEU  23   3.216   4.256  -9.782
  209   HD12  LEU  23          2HD1      LEU  23   1.705   3.855 -10.629
  210   HD13  LEU  23          3HD1      LEU  23   2.864   4.963 -11.366
  211   HD21  LEU  23          3HD2      LEU  23   0.957   6.614 -11.597
  212   HD22  LEU  23          1HD2      LEU  23  -0.147   5.521 -10.743
  213   HD23  LEU  23          2HD2      LEU  23   0.108   7.180 -10.148
  214    H    VAL  24           H        VAL  24   1.301   2.739  -7.016
  215    HA   VAL  24           HA       VAL  24   1.369   1.001  -9.305
  216    HB   VAL  24           HB       VAL  24   1.940   0.604  -6.350
  217   HG11  VAL  24          1HG1      VAL  24   3.183  -1.450  -6.975
  218   HG12  VAL  24          2HG1      VAL  24   1.439  -1.629  -7.173
  219   HG13  VAL  24          3HG1      VAL  24   2.470  -1.371  -8.602
  220   HG21  VAL  24          3HG2      VAL  24   4.246   0.752  -6.974
  221   HG22  VAL  24          1HG2      VAL  24   3.859   0.695  -8.715
  222   HG23  VAL  24          2HG2      VAL  24   3.447   2.117  -7.750
  223    H    CYS  25           H        CYS  25  -0.677   0.997  -6.375
  224    HA   CYS  25           HA       CYS  25  -2.224  -1.299  -7.455
  225    HB2  CYS  25           2HB      CYS  25  -0.916  -1.205  -5.240
  226    HB3  CYS  25           3HB      CYS  25  -2.254  -0.241  -4.642
  227    H    LYS  26           H        LYS  26  -2.545   1.803  -7.764
  228    HA   LYS  26           HA       LYS  26  -4.217   3.328  -8.170
  229    HB2  LYS  26           2HB      LYS  26  -5.477   0.777  -9.208
  230    HB3  LYS  26           3HB      LYS  26  -6.056   2.393  -9.608
  231    HG2  LYS  26           2HG      LYS  26  -3.190   1.484 -10.057
  232    HG3  LYS  26           3HG      LYS  26  -4.449   1.293 -11.277
  233    HD2  LYS  26           2HD      LYS  26  -3.446   3.947 -10.147
  234    HD3  LYS  26           3HD      LYS  26  -3.003   3.238 -11.698
  235    HE2  LYS  26           2HE      LYS  26  -5.396   3.312 -12.412
  236    HE3  LYS  26           3HE      LYS  26  -5.817   4.095 -10.884
  237    HZ1  LYS  26           HZ1      LYS  26  -5.489   5.725 -12.649
  238    HZ2  LYS  26           HZ2      LYS  26  -4.349   5.943 -11.503
  239    HZ3  LYS  26           HZ3      LYS  26  -3.964   5.217 -12.918
  240    H    CYS  27           H        CYS  27  -4.154   3.287  -5.844
  241    HA   CYS  27           HA       CYS  27  -6.693   2.662  -4.442
  242    HB2  CYS  27           2HB      CYS  27  -4.172   3.975  -3.394
  243    HB3  CYS  27           3HB      CYS  27  -5.527   3.425  -2.438
  Start of MODEL   21
    1    H1   GLY   1           1H       GLY   1  10.891  -6.069   4.422
    2    H2   GLY   1           2H       GLY   1  10.290  -7.593   4.443
    3    H3   GLY   1           3H       GLY   1  10.795  -6.935   3.033
    4    HA2  GLY   1           HA2      GLY   1   8.496  -6.002   4.626
    5    HA3  GLY   1           HA3      GLY   1   9.048  -5.275   3.106
    6    H    LEU   2           H        LEU   2   6.450  -6.120   3.335
    7    HA   LEU   2           HA       LEU   2   6.062  -8.806   2.298
    8    HB2  LEU   2           2HB      LEU   2   4.197  -6.421   2.532
    9    HB3  LEU   2           3HB      LEU   2   3.685  -8.026   2.024
   10    HG   LEU   2           HG       LEU   2   4.904  -7.389   4.751
   11   HD11  LEU   2          1HD1      LEU   2   2.638  -7.630   5.623
   12   HD12  LEU   2          2HD1      LEU   2   2.691  -6.328   4.427
   13   HD13  LEU   2          3HD1      LEU   2   2.004  -7.908   3.990
   14   HD21  LEU   2          3HD2      LEU   2   4.002  -9.624   5.374
   15   HD22  LEU   2          1HD2      LEU   2   3.543  -9.904   3.680
   16   HD23  LEU   2          2HD2      LEU   2   5.255  -9.744   4.138
   17    HA   PRO   3           HA       PRO   3   6.500  -7.891  -2.088
   18    HB2  PRO   3           2HB      PRO   3   4.282  -9.874  -2.506
   19    HB3  PRO   3           3HB      PRO   3   5.899  -9.813  -3.268
   20    HG2  PRO   3           2HG      PRO   3   5.355 -11.620  -1.311
   21    HG3  PRO   3           3HG      PRO   3   6.931 -10.763  -1.347
   22    HD2  PRO   3           2HD      PRO   3   4.489 -10.125   0.339
   23    HD3  PRO   3           3HD      PRO   3   6.212 -10.235   0.815
   24    H    ARG   4           H        ARG   4   5.393  -6.715  -3.743
   25    HA   ARG   4           HA       ARG   4   3.517  -4.807  -2.892
   26    HB2  ARG   4           2HB      ARG   4   4.263  -5.738  -5.695
   27    HB3  ARG   4           3HB      ARG   4   3.186  -4.370  -5.388
   28    HG2  ARG   4           2HG      ARG   4   4.939  -3.223  -4.092
   29    HG3  ARG   4           3HG      ARG   4   6.060  -4.568  -4.385
   30    HD2  ARG   4           2HD      ARG   4   5.968  -4.172  -6.801
   31    HD3  ARG   4           3HD      ARG   4   4.748  -2.902  -6.573
   32    HE   ARG   4           HE       ARG   4   7.090  -2.295  -5.027
   33   HH11  ARG   4          1HH2      ARG   4   6.057  -2.264  -8.375
   34   HH12  ARG   4          2HH2      ARG   4   7.158  -0.981  -8.798
   35   HH21  ARG   4          2HH1      ARG   4   8.475  -0.668  -5.637
   36   HH22  ARG   4          1HH1      ARG   4   8.493  -0.111  -7.283
   37    H    LYS   5           H        LYS   5   2.764  -7.854  -4.537
   38    HA   LYS   5           HA       LYS   5  -0.016  -7.413  -5.012
   39    HB2  LYS   5           2HB      LYS   5   1.385  -9.232  -5.976
   40    HB3  LYS   5           3HB      LYS   5   1.445 -10.023  -4.397
   41    HG2  LYS   5           2HG      LYS   5  -1.065 -10.267  -4.465
   42    HG3  LYS   5           3HG      LYS   5  -1.067  -9.452  -6.032
   43    HD2  LYS   5           2HD      LYS   5  -1.179 -11.753  -6.562
   44    HD3  LYS   5           3HD      LYS   5   0.483 -11.270  -6.881
   45    HE2  LYS   5           2HE      LYS   5   0.655 -13.363  -5.825
   46    HE3  LYS   5           3HE      LYS   5   1.100 -12.195  -4.581
   47    HZ1  LYS   5           HZ1      LYS   5  -0.450 -13.875  -3.736
   48    HZ2  LYS   5           HZ2      LYS   5  -1.195 -12.421  -3.696
   49    HZ3  LYS   5           HZ3      LYS   5  -1.563 -13.502  -4.864
   50    H    ILE   6           H        ILE   6   1.569  -8.915  -2.209
   51    HA   ILE   6           HA       ILE   6  -0.866  -9.234  -0.644
   52    HB   ILE   6           HB       ILE   6   2.089  -9.368   0.084
   53   HG12  ILE   6          2HG1      ILE   6   1.566 -11.764   0.552
   54   HG13  ILE   6          3HG1      ILE   6  -0.071 -11.529  -0.052
   55   HG21  ILE   6          1HG2      ILE   6  -0.322  -9.865   1.888
   56   HG22  ILE   6          2HG2      ILE   6   1.360 -10.277   2.287
   57   HG23  ILE   6          3HG2      ILE   6   0.902  -8.592   2.087
   58   HD11  ILE   6          3HD1      ILE   6   2.449 -11.160  -1.729
   59   HD12  ILE   6          1HD1      ILE   6   1.520 -12.665  -1.629
   60   HD13  ILE   6          2HD1      ILE   6   0.763 -11.227  -2.315
   61    H    LEU   7           H        LEU   7   1.831  -6.860  -0.558
   62    HA   LEU   7           HA       LEU   7   0.865  -5.350   1.609
   63    HB2  LEU   7           2HB      LEU   7   3.172  -5.353   0.660
   64    HB3  LEU   7           3HB      LEU   7   2.583  -4.475  -0.748
   65    HG   LEU   7           HG       LEU   7   2.025  -2.528   0.663
   66   HD11  LEU   7          1HD1      LEU   7   1.509  -3.581   2.817
   67   HD12  LEU   7          2HD1      LEU   7   3.181  -4.177   2.957
   68   HD13  LEU   7          3HD1      LEU   7   2.834  -2.435   3.018
   69   HD21  LEU   7          3HD2      LEU   7   4.282  -2.756  -0.336
   70   HD22  LEU   7          1HD2      LEU   7   4.328  -1.874   1.199
   71   HD23  LEU   7          2HD2      LEU   7   4.849  -3.573   1.135
   72    H    CYS   8           H        CYS   8   0.000  -5.091  -1.827
   73    HA   CYS   8           HA       CYS   8  -1.504  -2.674  -1.706
   74    HB2  CYS   8           2HB      CYS   8  -0.814  -3.674  -3.776
   75    HB3  CYS   8           3HB      CYS   8  -1.665  -5.173  -3.426
   76    H    ALA   9           H        ALA   9  -2.441  -6.036  -0.824
   77    HA   ALA   9           HA       ALA   9  -5.256  -5.375  -0.454
   78    HB1  ALA   9           3HB      ALA   9  -3.614  -7.715   0.615
   79    HB2  ALA   9           1HB      ALA   9  -5.383  -7.593   0.571
   80    HB3  ALA   9           2HB      ALA   9  -4.463  -7.674  -0.946
   81    H    ILE  10           H        ILE  10  -2.409  -5.684   1.691
   82    HA   ILE  10           HA       ILE  10  -3.657  -4.987   4.157
   83    HB   ILE  10           HB       ILE  10  -0.821  -4.438   3.201
   84   HG12  ILE  10          2HG1      ILE  10  -1.360  -6.829   3.025
   85   HG13  ILE  10          3HG1      ILE  10  -0.147  -6.502   4.225
   86   HG21  ILE  10          1HG2      ILE  10  -1.243  -3.101   5.174
   87   HG22  ILE  10          2HG2      ILE  10  -1.949  -4.491   6.022
   88   HG23  ILE  10          3HG2      ILE  10  -0.218  -4.468   5.618
   89   HD11  ILE  10          3HD1      ILE  10  -3.089  -7.107   4.792
   90   HD12  ILE  10          1HD1      ILE  10  -1.732  -8.232   4.960
   91   HD13  ILE  10          2HD1      ILE  10  -1.836  -6.828   6.031
   92    H    ALA  11           H        ALA  11  -2.086  -2.848   1.728
   93    HA   ALA  11           HA       ALA  11  -2.390  -0.417   3.071
   94    HB1  ALA  11           3HB      ALA  11  -1.006  -0.870   1.022
   95    HB2  ALA  11           1HB      ALA  11  -2.502  -0.881   0.049
   96    HB3  ALA  11           2HB      ALA  11  -1.982   0.590   0.895
   97    H    LYS  12           H        LYS  12  -4.716  -1.938   0.784
   98    HA   LYS  12           HA       LYS  12  -6.669   0.213   1.161
   99    HB2  LYS  12           2HB      LYS  12  -6.801  -2.405  -0.385
  100    HB3  LYS  12           3HB      LYS  12  -8.068  -1.163  -0.371
  101    HG2  LYS  12           2HG      LYS  12  -6.330   0.526  -1.101
  102    HG3  LYS  12           3HG      LYS  12  -5.196  -0.801  -1.329
  103    HD2  LYS  12           2HD      LYS  12  -7.813  -0.365  -2.826
  104    HD3  LYS  12           3HD      LYS  12  -6.174  -0.077  -3.419
  105    HE2  LYS  12           2HE      LYS  12  -5.736  -2.580  -2.989
  106    HE3  LYS  12           3HE      LYS  12  -7.487  -2.748  -2.826
  107    HZ1  LYS  12           HZ1      LYS  12  -7.708  -1.818  -5.079
  108    HZ2  LYS  12           HZ2      LYS  12  -6.088  -1.643  -5.224
  109    HZ3  LYS  12           HZ3      LYS  12  -6.749  -3.139  -5.124
  110    H    LYS  13           H        LYS  13  -6.256  -2.966   2.649
  111    HA   LYS  13           HA       LYS  13  -8.844  -2.950   3.994
  112    HB2  LYS  13           2HB      LYS  13  -6.239  -4.441   4.482
  113    HB3  LYS  13           3HB      LYS  13  -7.648  -4.615   5.535
  114    HG2  LYS  13           2HG      LYS  13  -9.035  -5.432   3.723
  115    HG3  LYS  13           3HG      LYS  13  -7.796  -5.081   2.529
  116    HD2  LYS  13           2HD      LYS  13  -7.794  -7.461   2.952
  117    HD3  LYS  13           3HD      LYS  13  -6.291  -6.757   3.535
  118    HE2  LYS  13           2HE      LYS  13  -7.003  -8.373   5.146
  119    HE3  LYS  13           3HE      LYS  13  -7.196  -6.779   5.872
  120    HZ1  LYS  13           HZ1      LYS  13  -9.589  -6.924   5.363
  121    HZ2  LYS  13           HZ2      LYS  13  -9.391  -8.389   4.664
  122    HZ3  LYS  13           HZ3      LYS  13  -9.135  -8.206   6.262
  123    H    LYS  14           H        LYS  14  -5.622  -1.737   4.946
  124    HA   LYS  14           HA       LYS  14  -6.677  -0.677   7.507
  125    HB2  LYS  14           2HB      LYS  14  -3.939  -0.802   6.211
  126    HB3  LYS  14           3HB      LYS  14  -4.247   0.322   7.518
  127    HG2  LYS  14           2HG      LYS  14  -3.306  -1.602   8.483
  128    HG3  LYS  14           3HG      LYS  14  -4.988  -1.497   8.999
  129    HD2  LYS  14           2HD      LYS  14  -5.593  -3.252   7.328
  130    HD3  LYS  14           3HD      LYS  14  -3.899  -3.373   6.846
  131    HE2  LYS  14           2HE      LYS  14  -5.048  -3.931   9.623
  132    HE3  LYS  14           3HE      LYS  14  -4.648  -5.160   8.424
  133    HZ1  LYS  14           HZ1      LYS  14  -2.310  -4.447   8.575
  134    HZ2  LYS  14           HZ2      LYS  14  -2.688  -3.338   9.718
  135    HZ3  LYS  14           HZ3      LYS  14  -2.867  -4.924  10.030
  136    H    GLY  15           H        GLY  15  -6.513   0.543   4.307
  137    HA2  GLY  15           HA2      GLY  15  -7.128   2.601   3.444
  138    HA3  GLY  15           HA3      GLY  15  -7.548   3.159   5.068
  139    H    LYS  16           H        LYS  16  -4.387   1.867   4.198
  140    HA   LYS  16           HA       LYS  16  -3.094   4.463   4.935
  141    HB2  LYS  16           2HB      LYS  16  -2.905   2.305   6.391
  142    HB3  LYS  16           3HB      LYS  16  -1.837   1.721   5.125
  143    HG2  LYS  16           2HG      LYS  16  -0.685   4.174   5.600
  144    HG3  LYS  16           3HG      LYS  16  -1.502   3.959   7.130
  145    HD2  LYS  16           2HD      LYS  16   0.798   3.174   7.288
  146    HD3  LYS  16           3HD      LYS  16  -0.315   1.827   7.504
  147    HE2  LYS  16           2HE      LYS  16   1.618   1.189   6.128
  148    HE3  LYS  16           3HE      LYS  16   0.110   1.028   5.228
  149    HZ1  LYS  16           HZ1      LYS  16   1.954   3.346   4.981
  150    HZ2  LYS  16           HZ2      LYS  16   1.885   2.102   3.928
  151    HZ3  LYS  16           HZ3      LYS  16   0.596   3.094   4.084
  152    H    CYS  17           H        CYS  17  -3.957   3.661   2.197
  153    HA   CYS  17           HA       CYS  17  -1.449   3.128   0.741
  154    HB2  CYS  17           2HB      CYS  17  -3.638   1.933   0.289
  155    HB3  CYS  17           3HB      CYS  17  -4.262   3.466  -0.314
  156    H    LYS  18           H        LYS  18  -0.210   4.753   0.130
  157    HA   LYS  18           HA       LYS  18  -1.195   7.128  -1.255
  158    HB2  LYS  18           2HB      LYS  18  -0.161   8.747   0.332
  159    HB3  LYS  18           3HB      LYS  18  -1.520   7.891   1.038
  160    HG2  LYS  18           2HG      LYS  18  -0.009   6.410   2.297
  161    HG3  LYS  18           3HG      LYS  18   1.404   7.175   1.537
  162    HD2  LYS  18           2HD      LYS  18   0.770   9.349   2.554
  163    HD3  LYS  18           3HD      LYS  18  -0.645   8.583   3.310
  164    HE2  LYS  18           2HE      LYS  18   0.854   7.042   4.553
  165    HE3  LYS  18           3HE      LYS  18   2.266   7.788   3.790
  166    HZ1  LYS  18           HZ1      LYS  18   0.356   9.200   5.581
  167    HZ2  LYS  18           HZ2      LYS  18   1.859   8.720   5.996
  168    HZ3  LYS  18           HZ3      LYS  18   1.660   9.887   4.875
  169    H    GLY  19           H        GLY  19   0.698   8.641  -1.759
  170    HA2  GLY  19           HA2      GLY  19   2.660   8.939  -2.940
  171    HA3  GLY  19           HA3      GLY  19   3.384   7.845  -1.772
  172    HA   PRO  20           HA       PRO  20   3.862   5.552  -5.712
  173    HB2  PRO  20           2HB      PRO  20   5.537   3.564  -4.852
  174    HB3  PRO  20           3HB      PRO  20   6.083   5.238  -5.177
  175    HG2  PRO  20           2HG      PRO  20   5.337   4.013  -2.502
  176    HG3  PRO  20           3HG      PRO  20   6.797   4.970  -2.913
  177    HD2  PRO  20           2HD      PRO  20   4.624   6.097  -1.733
  178    HD3  PRO  20           3HD      PRO  20   5.573   6.991  -2.961
  179    H    LEU  21           H        LEU  21   2.841   4.125  -2.572
  180    HA   LEU  21           HA       LEU  21   2.027   1.611  -3.642
  181    HB2  LEU  21           2HB      LEU  21   2.285   2.663  -1.121
  182    HB3  LEU  21           3HB      LEU  21   0.545   2.720  -1.285
  183    HG   LEU  21           HG       LEU  21   1.164   0.710  -0.155
  184   HD11  LEU  21          1HD1      LEU  21  -0.670   0.413  -1.822
  185   HD12  LEU  21          2HD1      LEU  21   0.534  -0.189  -2.989
  186   HD13  LEU  21          3HD1      LEU  21   0.236  -1.070  -1.480
  187   HD21  LEU  21          3HD2      LEU  21   2.967  -0.013  -2.504
  188   HD22  LEU  21          1HD2      LEU  21   3.503   0.549  -0.905
  189   HD23  LEU  21          2HD2      LEU  21   2.650  -0.993  -1.066
  190    H    LYS  22           H        LYS  22   0.286   4.662  -3.308
  191    HA   LYS  22           HA       LYS  22  -2.320   3.816  -4.191
  192    HB2  LYS  22           2HB      LYS  22  -1.944   5.911  -3.045
  193    HB3  LYS  22           3HB      LYS  22  -0.893   6.499  -4.342
  194    HG2  LYS  22           2HG      LYS  22  -2.799   6.561  -5.899
  195    HG3  LYS  22           3HG      LYS  22  -3.863   5.882  -4.653
  196    HD2  LYS  22           2HD      LYS  22  -3.486   7.875  -3.231
  197    HD3  LYS  22           3HD      LYS  22  -2.331   8.503  -4.415
  198    HE2  LYS  22           2HE      LYS  22  -4.284   9.718  -4.838
  199    HE3  LYS  22           3HE      LYS  22  -4.216   8.513  -6.126
  200    HZ1  LYS  22           HZ1      LYS  22  -6.439   8.682  -5.156
  201    HZ2  LYS  22           HZ2      LYS  22  -5.861   7.186  -4.869
  202    HZ3  LYS  22           HZ3      LYS  22  -5.885   8.304  -3.671
  203    H    LEU  23           H        LEU  23   0.523   4.810  -6.036
  204    HA   LEU  23           HA       LEU  23  -0.775   4.577  -8.633
  205    HB2  LEU  23           2HB      LEU  23   1.143   6.014  -8.167
  206    HB3  LEU  23           3HB      LEU  23   2.176   4.629  -7.859
  207    HG   LEU  23           HG       LEU  23   0.779   4.924 -10.541
  208   HD11  LEU  23          1HD1      LEU  23   3.416   6.215  -9.717
  209   HD12  LEU  23          2HD1      LEU  23   2.754   6.154 -11.368
  210   HD13  LEU  23          3HD1      LEU  23   1.908   7.070 -10.115
  211   HD21  LEU  23          3HD2      LEU  23   2.003   2.791 -10.174
  212   HD22  LEU  23          1HD2      LEU  23   2.835   3.779 -11.366
  213   HD23  LEU  23          2HD2      LEU  23   3.454   3.697  -9.703
  214    H    VAL  24           H        VAL  24   1.284   2.374  -6.707
  215    HA   VAL  24           HA       VAL  24   1.407   0.200  -8.564
  216    HB   VAL  24           HB       VAL  24   1.654   0.347  -5.537
  217   HG11  VAL  24          1HG1      VAL  24   2.853  -1.808  -5.612
  218   HG12  VAL  24          2HG1      VAL  24   1.153  -1.993  -6.018
  219   HG13  VAL  24          3HG1      VAL  24   2.372  -2.015  -7.315
  220   HG21  VAL  24          3HG2      VAL  24   4.035   0.272  -5.925
  221   HG22  VAL  24          1HG2      VAL  24   3.798   0.018  -7.675
  222   HG23  VAL  24          2HG2      VAL  24   3.371   1.561  -6.925
  223    H    CYS  25           H        CYS  25  -0.987   0.992  -6.112
  224    HA   CYS  25           HA       CYS  25  -2.366  -1.630  -6.436
  225    HB2  CYS  25           2HB      CYS  25  -1.204  -1.001  -4.349
  226    HB3  CYS  25           3HB      CYS  25  -2.247   0.401  -4.188
  227    H    LYS  26           H        LYS  26  -2.800   1.566  -7.255
  228    HA   LYS  26           HA       LYS  26  -4.446   2.944  -7.850
  229    HB2  LYS  26           2HB      LYS  26  -4.633   0.727  -9.368
  230    HB3  LYS  26           3HB      LYS  26  -6.281   0.754  -8.757
  231    HG2  LYS  26           2HG      LYS  26  -4.794   3.074 -10.074
  232    HG3  LYS  26           3HG      LYS  26  -5.913   1.993 -10.911
  233    HD2  LYS  26           2HD      LYS  26  -7.787   2.769  -9.511
  234    HD3  LYS  26           3HD      LYS  26  -6.695   3.841  -8.603
  235    HE2  LYS  26           2HE      LYS  26  -6.140   5.081 -10.632
  236    HE3  LYS  26           3HE      LYS  26  -7.159   4.008 -11.605
  237    HZ1  LYS  26           HZ1      LYS  26  -8.145   5.784  -9.431
  238    HZ2  LYS  26           HZ2      LYS  26  -8.331   6.057 -11.029
  239    HZ3  LYS  26           HZ3      LYS  26  -9.086   4.791 -10.330
  240    H    CYS  27           H        CYS  27  -4.543   3.417  -5.618
  241    HA   CYS  27           HA       CYS  27  -6.890   2.504  -4.071
  242    HB2  CYS  27           2HB      CYS  27  -4.539   4.254  -3.277
  243    HB3  CYS  27           3HB      CYS  27  -5.772   3.622  -2.204
  Start of MODEL   22
    1    H1   GLY   1           1H       GLY   1  11.025  -6.393   3.339
    2    H2   GLY   1           2H       GLY   1  10.242  -7.831   3.409
    3    H3   GLY   1           3H       GLY   1  10.820  -7.284   1.978
    4    HA2  GLY   1           HA2      GLY   1   8.654  -6.031   3.539
    5    HA3  GLY   1           HA3      GLY   1   9.288  -5.419   2.001
    6    H    LEU   2           H        LEU   2   6.561  -6.106   2.477
    7    HA   LEU   2           HA       LEU   2   5.937  -8.726   1.440
    8    HB2  LEU   2           2HB      LEU   2   4.351  -6.215   2.024
    9    HB3  LEU   2           3HB      LEU   2   3.621  -7.545   1.137
   10    HG   LEU   2           HG       LEU   2   3.987  -9.086   2.995
   11   HD11  LEU   2          1HD1      LEU   2   5.929  -8.146   4.144
   12   HD12  LEU   2          2HD1      LEU   2   5.027  -6.650   4.509
   13   HD13  LEU   2          3HD1      LEU   2   4.558  -8.194   5.253
   14   HD21  LEU   2          3HD2      LEU   2   1.897  -7.760   2.778
   15   HD22  LEU   2          1HD2      LEU   2   2.275  -8.127   4.466
   16   HD23  LEU   2          2HD2      LEU   2   2.592  -6.502   3.821
   17    HA   PRO   3           HA       PRO   3   6.015  -7.721  -2.968
   18    HB2  PRO   3           2HB      PRO   3   4.497  -9.731  -3.991
   19    HB3  PRO   3           3HB      PRO   3   6.130 -10.023  -3.314
   20    HG2  PRO   3           2HG      PRO   3   3.453 -10.388  -1.943
   21    HG3  PRO   3           3HG      PRO   3   4.825 -11.538  -2.001
   22    HD2  PRO   3           2HD      PRO   3   4.383  -9.835   0.105
   23    HD3  PRO   3           3HD      PRO   3   6.037 -10.308  -0.392
   24    H    ARG   4           H        ARG   4   4.639  -6.649  -4.415
   25    HA   ARG   4           HA       ARG   4   2.711  -5.061  -3.049
   26    HB2  ARG   4           2HB      ARG   4   3.231  -5.169  -6.042
   27    HB3  ARG   4           3HB      ARG   4   2.421  -3.873  -5.162
   28    HG2  ARG   4           2HG      ARG   4   5.355  -4.671  -4.949
   29    HG3  ARG   4           3HG      ARG   4   4.686  -3.196  -5.639
   30    HD2  ARG   4           2HD      ARG   4   3.810  -2.575  -3.369
   31    HD3  ARG   4           3HD      ARG   4   4.603  -4.003  -2.696
   32    HE   ARG   4           HE       ARG   4   5.956  -1.631  -3.914
   33   HH11  ARG   4          2HH1      ARG   4   6.330  -4.474  -1.804
   34   HH12  ARG   4          1HH1      ARG   4   7.936  -3.984  -1.380
   35   HH21  ARG   4          1HH2      ARG   4   7.991  -1.134  -3.267
   36   HH22  ARG   4          2HH2      ARG   4   8.837  -2.168  -2.156
   37    H    LYS   5           H        LYS   5   2.122  -7.884  -4.982
   38    HA   LYS   5           HA       LYS   5  -0.728  -7.525  -5.271
   39    HB2  LYS   5           2HB      LYS   5  -0.796  -9.823  -5.927
   40    HB3  LYS   5           3HB      LYS   5   0.630  -9.071  -6.636
   41    HG2  LYS   5           2HG      LYS   5   2.009 -10.108  -4.755
   42    HG3  LYS   5           3HG      LYS   5   0.539 -10.959  -4.242
   43    HD2  LYS   5           2HD      LYS   5   0.394 -12.016  -6.517
   44    HD3  LYS   5           3HD      LYS   5   1.869 -11.162  -6.978
   45    HE2  LYS   5           2HE      LYS   5   2.573 -13.342  -6.438
   46    HE3  LYS   5           3HE      LYS   5   3.073 -12.333  -5.080
   47    HZ1  LYS   5           HZ1      LYS   5   2.036 -14.412  -4.344
   48    HZ2  LYS   5           HZ2      LYS   5   1.105 -13.161  -3.861
   49    HZ3  LYS   5           HZ3      LYS   5   0.657 -14.075  -5.142
   50    H    ILE   6           H        ILE   6   1.164  -8.385  -2.507
   51    HA   ILE   6           HA       ILE   6  -1.282  -9.121  -0.945
   52    HB   ILE   6           HB       ILE   6   1.648  -9.294  -0.147
   53   HG12  ILE   6          2HG1      ILE   6  -0.328 -11.483  -0.951
   54   HG13  ILE   6          3HG1      ILE   6   1.060 -10.945  -1.896
   55   HG21  ILE   6          1HG2      ILE   6   0.070  -8.875   1.759
   56   HG22  ILE   6          2HG2      ILE   6  -0.865 -10.299   1.271
   57   HG23  ILE   6          3HG2      ILE   6   0.810 -10.463   1.850
   58   HD11  ILE   6          3HD1      ILE   6   2.570 -11.680  -0.015
   59   HD12  ILE   6          1HD1      ILE   6   1.147 -12.437   0.742
   60   HD13  ILE   6          2HD1      ILE   6   1.695 -12.976  -0.852
   61    H    LEU   7           H        LEU   7   1.537  -6.868  -0.880
   62    HA   LEU   7           HA       LEU   7   0.745  -5.416   1.377
   63    HB2  LEU   7           2HB      LEU   7   2.979  -5.362   0.242
   64    HB3  LEU   7           3HB      LEU   7   2.270  -4.405  -1.053
   65    HG   LEU   7           HG       LEU   7   1.823  -2.553   0.498
   66   HD11  LEU   7          1HD1      LEU   7   2.798  -2.548   2.770
   67   HD12  LEU   7          2HD1      LEU   7   1.510  -3.740   2.631
   68   HD13  LEU   7          3HD1      LEU   7   3.209  -4.266   2.605
   69   HD21  LEU   7          3HD2      LEU   7   3.964  -2.645  -0.694
   70   HD22  LEU   7          1HD2      LEU   7   4.164  -1.908   0.899
   71   HD23  LEU   7          2HD2      LEU   7   4.683  -3.588   0.632
   72    H    CYS   8           H        CYS   8  -0.436  -5.039  -1.939
   73    HA   CYS   8           HA       CYS   8  -1.738  -2.514  -1.656
   74    HB2  CYS   8           2HB      CYS   8  -1.309  -3.541  -3.781
   75    HB3  CYS   8           3HB      CYS   8  -2.263  -4.957  -3.378
   76    H    ALA   9           H        ALA   9  -2.807  -5.780  -0.633
   77    HA   ALA   9           HA       ALA   9  -5.554  -4.979  -0.083
   78    HB1  ALA   9           3HB      ALA   9  -5.677  -7.130   1.086
   79    HB2  ALA   9           1HB      ALA   9  -4.885  -7.333  -0.489
   80    HB3  ALA   9           2HB      ALA   9  -3.914  -7.315   1.001
   81    H    ILE  10           H        ILE  10  -2.558  -5.211   1.829
   82    HA   ILE  10           HA       ILE  10  -3.622  -4.313   4.341
   83    HB   ILE  10           HB       ILE  10  -0.800  -3.906   3.287
   84   HG12  ILE  10          2HG1      ILE  10  -1.283  -6.250   2.928
   85   HG13  ILE  10          3HG1      ILE  10  -0.158  -6.049   4.238
   86   HG21  ILE  10          1HG2      ILE  10  -1.224  -2.702   5.352
   87   HG22  ILE  10          2HG2      ILE  10  -1.878  -4.163   6.119
   88   HG23  ILE  10          3HG2      ILE  10  -0.162  -4.077   5.671
   89   HD11  ILE  10          3HD1      ILE  10  -3.137  -6.651   4.556
   90   HD12  ILE  10          1HD1      ILE  10  -1.805  -7.806   4.724
   91   HD13  ILE  10          2HD1      ILE  10  -1.969  -6.486   5.892
   92    H    ALA  11           H        ALA  11  -2.083  -2.552   1.636
   93    HA   ALA  11           HA       ALA  11  -2.024   0.023   2.646
   94    HB1  ALA  11           3HB      ALA  11  -2.710  -0.622  -0.259
   95    HB2  ALA  11           1HB      ALA  11  -1.689   0.683   0.385
   96    HB3  ALA  11           2HB      ALA  11  -1.109  -0.969   0.436
   97    H    LYS  12           H        LYS  12  -4.667  -1.401   0.733
   98    HA   LYS  12           HA       LYS  12  -6.554   0.744   1.040
   99    HB2  LYS  12           2HB      LYS  12  -6.885  -2.201   0.334
  100    HB3  LYS  12           3HB      LYS  12  -8.192  -1.007   0.228
  101    HG2  LYS  12           2HG      LYS  12  -6.928   0.337  -1.357
  102    HG3  LYS  12           3HG      LYS  12  -5.539  -0.739  -1.251
  103    HD2  LYS  12           2HD      LYS  12  -8.264  -1.357  -2.434
  104    HD3  LYS  12           3HD      LYS  12  -6.734  -1.097  -3.293
  105    HE2  LYS  12           2HE      LYS  12  -5.789  -3.124  -2.196
  106    HE3  LYS  12           3HE      LYS  12  -7.348  -3.419  -1.416
  107    HZ1  LYS  12           HZ1      LYS  12  -6.909  -3.356  -4.356
  108    HZ2  LYS  12           HZ2      LYS  12  -7.133  -4.709  -3.467
  109    HZ3  LYS  12           HZ3      LYS  12  -8.346  -3.632  -3.629
  110    H    LYS  13           H        LYS  13  -6.240  -2.324   2.897
  111    HA   LYS  13           HA       LYS  13  -8.596  -1.865   4.496
  112    HB2  LYS  13           2HB      LYS  13  -6.180  -3.681   4.837
  113    HB3  LYS  13           3HB      LYS  13  -7.510  -3.640   6.000
  114    HG2  LYS  13           2HG      LYS  13  -9.137  -4.263   4.306
  115    HG3  LYS  13           3HG      LYS  13  -7.913  -4.210   3.032
  116    HD2  LYS  13           2HD      LYS  13  -6.663  -6.047   4.153
  117    HD3  LYS  13           3HD      LYS  13  -7.902  -6.098   5.430
  118    HE2  LYS  13           2HE      LYS  13  -9.632  -6.596   3.695
  119    HE3  LYS  13           3HE      LYS  13  -8.374  -6.599   2.453
  120    HZ1  LYS  13           HZ1      LYS  13  -8.505  -8.472   4.761
  121    HZ2  LYS  13           HZ2      LYS  13  -8.867  -8.851   3.217
  122    HZ3  LYS  13           HZ3      LYS  13  -7.330  -8.479   3.623
  123    H    LYS  14           H        LYS  14  -5.204  -0.998   5.099
  124    HA   LYS  14           HA       LYS  14  -5.889   0.183   7.741
  125    HB2  LYS  14           2HB      LYS  14  -3.292  -0.302   6.250
  126    HB3  LYS  14           3HB      LYS  14  -3.364   0.760   7.640
  127    HG2  LYS  14           2HG      LYS  14  -2.623  -1.417   8.325
  128    HG3  LYS  14           3HG      LYS  14  -4.155  -0.999   9.092
  129    HD2  LYS  14           2HD      LYS  14  -5.369  -2.551   7.638
  130    HD3  LYS  14           3HD      LYS  14  -3.919  -2.820   6.663
  131    HE2  LYS  14           2HE      LYS  14  -4.197  -4.719   8.090
  132    HE3  LYS  14           3HE      LYS  14  -2.786  -3.820   8.649
  133    HZ1  LYS  14           HZ1      LYS  14  -4.223  -4.506  10.493
  134    HZ2  LYS  14           HZ2      LYS  14  -4.176  -2.880  10.424
  135    HZ3  LYS  14           HZ3      LYS  14  -5.494  -3.687   9.884
  136    H    GLY  15           H        GLY  15  -5.910   1.351   4.535
  137    HA2  GLY  15           HA2      GLY  15  -6.138   3.489   3.679
  138    HA3  GLY  15           HA3      GLY  15  -6.332   4.119   5.324
  139    H    LYS  16           H        LYS  16  -3.623   2.261   3.994
  140    HA   LYS  16           HA       LYS  16  -1.675   4.310   4.993
  141    HB2  LYS  16           2HB      LYS  16  -1.780   1.940   5.907
  142    HB3  LYS  16           3HB      LYS  16  -1.207   1.372   4.336
  143    HG2  LYS  16           2HG      LYS  16   0.860   2.781   4.631
  144    HG3  LYS  16           3HG      LYS  16   0.261   3.282   6.215
  145    HD2  LYS  16           2HD      LYS  16   0.999   0.451   5.343
  146    HD3  LYS  16           3HD      LYS  16   1.935   1.513   6.407
  147    HE2  LYS  16           2HE      LYS  16  -0.032   1.537   7.999
  148    HE3  LYS  16           3HE      LYS  16  -0.821   0.338   6.967
  149    HZ1  LYS  16           HZ1      LYS  16   1.071  -1.162   7.395
  150    HZ2  LYS  16           HZ2      LYS  16   1.791  -0.045   8.345
  151    HZ3  LYS  16           HZ3      LYS  16   0.383  -0.720   8.811
  152    H    CYS  17           H        CYS  17  -3.025   3.087   2.189
  153    HA   CYS  17           HA       CYS  17  -0.954   3.095   0.298
  154    HB2  CYS  17           2HB      CYS  17  -2.732   2.941  -1.255
  155    HB3  CYS  17           3HB      CYS  17  -3.231   2.120   0.152
  156    H    LYS  18           H        LYS  18   0.332   4.658  -0.270
  157    HA   LYS  18           HA       LYS  18  -0.591   7.448  -0.779
  158    HB2  LYS  18           2HB      LYS  18   1.781   6.600   0.964
  159    HB3  LYS  18           3HB      LYS  18   1.537   8.245   0.429
  160    HG2  LYS  18           2HG      LYS  18  -0.526   6.870   2.199
  161    HG3  LYS  18           3HG      LYS  18   0.956   7.533   2.837
  162    HD2  LYS  18           2HD      LYS  18  -0.599   9.227   3.179
  163    HD3  LYS  18           3HD      LYS  18   0.392   9.765   1.838
  164    HE2  LYS  18           2HE      LYS  18  -1.877  10.359   1.395
  165    HE3  LYS  18           3HE      LYS  18  -1.433   9.094   0.250
  166    HZ1  LYS  18           HZ1      LYS  18  -3.652   8.806   1.365
  167    HZ2  LYS  18           HZ2      LYS  18  -2.673   7.509   1.530
  168    HZ3  LYS  18           HZ3      LYS  18  -2.896   8.551   2.786
  169    H    GLY  19           H        GLY  19   0.776   8.671  -2.086
  170    HA2  GLY  19           HA2      GLY  19   1.962   8.952  -4.063
  171    HA3  GLY  19           HA3      GLY  19   3.245   8.399  -3.012
  172    HA   PRO  20           HA       PRO  20   3.725   5.418  -6.355
  173    HB2  PRO  20           2HB      PRO  20   5.635   3.765  -5.282
  174    HB3  PRO  20           3HB      PRO  20   5.976   5.407  -5.905
  175    HG2  PRO  20           2HG      PRO  20   5.486   4.575  -3.028
  176    HG3  PRO  20           3HG      PRO  20   6.802   5.606  -3.675
  177    HD2  PRO  20           2HD      PRO  20   4.563   6.672  -2.567
  178    HD3  PRO  20           3HD      PRO  20   5.341   7.438  -3.987
  179    H    LEU  21           H        LEU  21   3.206   4.146  -2.972
  180    HA   LEU  21           HA       LEU  21   2.405   1.547  -3.924
  181    HB2  LEU  21           2HB      LEU  21   3.240   1.983  -1.625
  182    HB3  LEU  21           3HB      LEU  21   1.785   2.924  -1.289
  183    HG   LEU  21           HG       LEU  21   0.377   0.901  -1.594
  184   HD11  LEU  21          1HD1      LEU  21   1.726  -0.427  -3.164
  185   HD12  LEU  21          2HD1      LEU  21   3.030  -0.562  -1.958
  186   HD13  LEU  21          3HD1      LEU  21   1.453  -1.341  -1.683
  187   HD21  LEU  21          3HD2      LEU  21   1.095  -0.265   0.427
  188   HD22  LEU  21          1HD2      LEU  21   2.689   0.514   0.332
  189   HD23  LEU  21          2HD2      LEU  21   1.227   1.490   0.619
  190    H    LYS  22           H        LYS  22   0.565   4.503  -3.219
  191    HA   LYS  22           HA       LYS  22  -2.079   3.371  -3.691
  192    HB2  LYS  22           2HB      LYS  22  -2.010   5.406  -2.495
  193    HB3  LYS  22           3HB      LYS  22  -0.944   6.190  -3.669
  194    HG2  LYS  22           2HG      LYS  22  -2.664   6.378  -5.299
  195    HG3  LYS  22           3HG      LYS  22  -3.761   5.314  -4.417
  196    HD2  LYS  22           2HD      LYS  22  -2.763   7.959  -3.309
  197    HD3  LYS  22           3HD      LYS  22  -4.208   7.808  -4.338
  198    HE2  LYS  22           2HE      LYS  22  -5.058   6.060  -2.660
  199    HE3  LYS  22           3HE      LYS  22  -3.774   6.607  -1.572
  200    HZ1  LYS  22           HZ1      LYS  22  -4.766   8.868  -1.742
  201    HZ2  LYS  22           HZ2      LYS  22  -5.956   8.287  -2.698
  202    HZ3  LYS  22           HZ3      LYS  22  -5.853   7.792  -1.152
  203    H    LEU  23           H        LEU  23   0.267   5.058  -5.799
  204    HA   LEU  23           HA       LEU  23  -1.289   4.836  -8.174
  205    HB2  LEU  23           2HB      LEU  23   0.651   6.333  -7.881
  206    HB3  LEU  23           3HB      LEU  23   1.732   4.944  -7.818
  207    HG   LEU  23           HG       LEU  23   1.186   4.384 -10.169
  208   HD11  LEU  23          1HD1      LEU  23  -0.019   6.059 -11.566
  209   HD12  LEU  23          2HD1      LEU  23  -1.084   5.304 -10.380
  210   HD13  LEU  23          3HD1      LEU  23  -0.468   6.950 -10.095
  211   HD21  LEU  23          3HD2      LEU  23   3.092   5.852  -9.635
  212   HD22  LEU  23          1HD2      LEU  23   2.361   6.282 -11.189
  213   HD23  LEU  23          2HD2      LEU  23   2.037   7.278  -9.751
  214    H    VAL  24           H        VAL  24   1.041   2.511  -6.797
  215    HA   VAL  24           HA       VAL  24   0.838   0.531  -8.892
  216    HB   VAL  24           HB       VAL  24   1.659   0.357  -5.969
  217   HG11  VAL  24          1HG1      VAL  24   1.938  -1.763  -8.139
  218   HG12  VAL  24          2HG1      VAL  24   2.782  -1.785  -6.576
  219   HG13  VAL  24          3HG1      VAL  24   1.022  -1.907  -6.620
  220   HG21  VAL  24          3HG2      VAL  24   3.096   1.728  -7.562
  221   HG22  VAL  24          1HG2      VAL  24   3.910   0.382  -6.773
  222   HG23  VAL  24          2HG2      VAL  24   3.387   0.244  -8.474
  223    H    CYS  25           H        CYS  25  -0.804   0.824  -5.708
  224    HA   CYS  25           HA       CYS  25  -2.395  -1.547  -6.110
  225    HB2  CYS  25           2HB      CYS  25  -1.480  -0.697  -3.987
  226    HB3  CYS  25           3HB      CYS  25  -2.518   0.719  -4.089
  227    H    LYS  26           H        LYS  26  -2.902   1.723  -7.049
  228    HA   LYS  26           HA       LYS  26  -4.612   3.006  -7.768
  229    HB2  LYS  26           2HB      LYS  26  -5.775   0.381  -8.748
  230    HB3  LYS  26           3HB      LYS  26  -6.352   1.974  -9.227
  231    HG2  LYS  26           2HG      LYS  26  -3.483   1.028  -9.572
  232    HG3  LYS  26           3HG      LYS  26  -4.711   0.839 -10.818
  233    HD2  LYS  26           2HD      LYS  26  -3.626   3.463  -9.704
  234    HD3  LYS  26           3HD      LYS  26  -3.240   2.764 -11.263
  235    HE2  LYS  26           2HE      LYS  26  -6.010   3.732 -10.411
  236    HE3  LYS  26           3HE      LYS  26  -4.860   4.652 -11.379
  237    HZ1  LYS  26           HZ1      LYS  26  -6.462   3.539 -12.797
  238    HZ2  LYS  26           HZ2      LYS  26  -4.985   2.913 -13.084
  239    HZ3  LYS  26           HZ3      LYS  26  -6.078   2.070 -12.205
  240    H    CYS  27           H        CYS  27  -4.505   2.818  -5.370
  241    HA   CYS  27           HA       CYS  27  -6.799   1.891  -3.863
  242    HB2  CYS  27           2HB      CYS  27  -4.458   2.109  -3.001
  243    HB3  CYS  27           3HB      CYS  27  -4.648   3.863  -3.042
  Start of MODEL   23
    1    H1   GLY   1           1H       GLY   1   8.669  -4.631   3.244
    2    H2   GLY   1           2H       GLY   1   7.578  -4.013   4.297
    3    H3   GLY   1           3H       GLY   1   9.059  -4.474   4.828
    4    HA2  GLY   1           HA2      GLY   1   8.597  -6.779   4.316
    5    HA3  GLY   1           HA3      GLY   1   7.431  -6.112   5.475
    6    H    LEU   2           H        LEU   2   7.120  -8.348   3.683
    7    HA   LEU   2           HA       LEU   2   5.774  -9.391   2.292
    8    HB2  LEU   2           2HB      LEU   2   3.898  -7.069   2.774
    9    HB3  LEU   2           3HB      LEU   2   3.437  -8.513   1.902
   10    HG   LEU   2           HG       LEU   2   4.397  -8.514   4.798
   11   HD11  LEU   2          1HD1      LEU   2   2.022  -8.819   5.370
   12   HD12  LEU   2          2HD1      LEU   2   2.290  -7.271   4.553
   13   HD13  LEU   2          3HD1      LEU   2   1.576  -8.629   3.659
   14   HD21  LEU   2          3HD2      LEU   2   4.701 -10.705   3.712
   15   HD22  LEU   2          1HD2      LEU   2   3.346 -10.771   4.840
   16   HD23  LEU   2          2HD2      LEU   2   3.035 -10.652   3.095
   17    HA   PRO   3           HA       PRO   3   6.464  -7.926  -1.875
   18    HB2  PRO   3           2HB      PRO   3   5.160  -9.787  -3.352
   19    HB3  PRO   3           3HB      PRO   3   6.616 -10.202  -2.395
   20    HG2  PRO   3           2HG      PRO   3   3.707 -10.576  -1.607
   21    HG3  PRO   3           3HG      PRO   3   5.030 -11.781  -1.535
   22    HD2  PRO   3           2HD      PRO   3   4.267 -10.285   0.628
   23    HD3  PRO   3           3HD      PRO   3   5.968 -10.776   0.372
   24    H    ARG   4           H        ARG   4   5.335  -6.835  -3.565
   25    HA   ARG   4           HA       ARG   4   3.274  -5.115  -2.825
   26    HB2  ARG   4           2HB      ARG   4   4.142  -6.067  -5.589
   27    HB3  ARG   4           3HB      ARG   4   2.966  -4.771  -5.343
   28    HG2  ARG   4           2HG      ARG   4   4.587  -3.428  -4.116
   29    HG3  ARG   4           3HG      ARG   4   5.812  -4.708  -4.248
   30    HD2  ARG   4           2HD      ARG   4   5.866  -4.502  -6.667
   31    HD3  ARG   4           3HD      ARG   4   4.490  -3.386  -6.648
   32    HE   ARG   4           HE       ARG   4   6.676  -2.382  -5.041
   33   HH11  ARG   4          1HH2      ARG   4   5.716  -2.651  -8.402
   34   HH12  ARG   4          2HH2      ARG   4   6.642  -1.253  -8.871
   35   HH21  ARG   4          1HH1      ARG   4   7.841  -0.613  -5.713
   36   HH22  ARG   4          2HH1      ARG   4   7.815  -0.139  -7.385
   37    H    LYS   5           H        LYS   5   2.813  -8.223  -4.485
   38    HA   LYS   5           HA       LYS   5   0.008  -7.882  -4.984
   39    HB2  LYS   5           2HB      LYS   5   0.001 -10.194  -5.625
   40    HB3  LYS   5           3HB      LYS   5   1.464  -9.423  -6.235
   41    HG2  LYS   5           2HG      LYS   5   2.724 -10.406  -4.256
   42    HG3  LYS   5           3HG      LYS   5   1.254 -11.289  -3.827
   43    HD2  LYS   5           2HD      LYS   5   2.767 -11.553  -6.460
   44    HD3  LYS   5           3HD      LYS   5   2.892 -12.658  -5.083
   45    HE2  LYS   5           2HE      LYS   5   0.458 -13.168  -5.273
   46    HE3  LYS   5           3HE      LYS   5   0.350 -12.102  -6.680
   47    HZ1  LYS   5           HZ1      LYS   5   1.935 -13.559  -7.824
   48    HZ2  LYS   5           HZ2      LYS   5   2.030 -14.548  -6.525
   49    HZ3  LYS   5           HZ3      LYS   5   0.631 -14.415  -7.349
   50    H    ILE   6           H        ILE   6   1.577  -8.650  -2.031
   51    HA   ILE   6           HA       ILE   6  -1.031  -9.434  -0.765
   52    HB   ILE   6           HB       ILE   6   1.787  -9.714   0.342
   53   HG12  ILE   6          2HG1      ILE   6  -0.128 -11.850  -0.715
   54   HG13  ILE   6          3HG1      ILE   6   1.337 -11.298  -1.525
   55   HG21  ILE   6          1HG2      ILE   6  -0.902 -10.684   1.426
   56   HG22  ILE   6          2HG2      ILE   6   0.685 -10.927   2.190
   57   HG23  ILE   6          3HG2      ILE   6   0.013  -9.310   2.067
   58   HD11  ILE   6          3HD1      ILE   6   2.696 -12.095   0.420
   59   HD12  ILE   6          1HD1      ILE   6   1.218 -12.841   1.081
   60   HD13  ILE   6          2HD1      ILE   6   1.854 -13.365  -0.485
   61    H    LEU   7           H        LEU   7   1.817  -7.292  -0.362
   62    HA   LEU   7           HA       LEU   7   0.932  -5.806   1.838
   63    HB2  LEU   7           2HB      LEU   7   3.207  -5.959   0.834
   64    HB3  LEU   7           3HB      LEU   7   2.700  -4.970  -0.511
   65    HG   LEU   7           HG       LEU   7   4.122  -3.928   1.307
   66   HD11  LEU   7          1HD1      LEU   7   1.544  -2.431   0.757
   67   HD12  LEU   7          2HD1      LEU   7   3.122  -1.760   1.183
   68   HD13  LEU   7          3HD1      LEU   7   2.911  -2.580  -0.370
   69   HD21  LEU   7          3HD2      LEU   7   1.527  -3.765   2.884
   70   HD22  LEU   7          1HD2      LEU   7   2.900  -4.833   3.270
   71   HD23  LEU   7          2HD2      LEU   7   3.101  -3.075   3.316
   72    H    CYS   8           H        CYS   8   0.107  -5.384  -1.585
   73    HA   CYS   8           HA       CYS   8  -1.185  -2.845  -1.449
   74    HB2  CYS   8           2HB      CYS   8  -0.613  -3.873  -3.541
   75    HB3  CYS   8           3HB      CYS   8  -1.575  -5.302  -3.190
   76    H    ALA   9           H        ALA   9  -2.465  -6.129  -0.651
   77    HA   ALA   9           HA       ALA   9  -5.209  -5.202  -0.390
   78    HB1  ALA   9           3HB      ALA   9  -5.586  -7.425   0.568
   79    HB2  ALA   9           1HB      ALA   9  -4.619  -7.546  -0.919
   80    HB3  ALA   9           2HB      ALA   9  -3.835  -7.710   0.671
   81    H    ILE  10           H        ILE  10  -2.462  -5.631   1.826
   82    HA   ILE  10           HA       ILE  10  -3.840  -4.963   4.266
   83    HB   ILE  10           HB       ILE  10  -0.912  -4.484   3.581
   84   HG12  ILE  10          2HG1      ILE  10  -1.383  -6.813   3.074
   85   HG13  ILE  10          3HG1      ILE  10  -0.372  -6.662   4.478
   86   HG21  ILE  10          1HG2      ILE  10  -2.324  -4.836   6.253
   87   HG22  ILE  10          2HG2      ILE  10  -0.564  -4.762   6.024
   88   HG23  ILE  10          3HG2      ILE  10  -1.563  -3.359   5.632
   89   HD11  ILE  10          3HD1      ILE  10  -2.312  -7.163   5.956
   90   HD12  ILE  10          1HD1      ILE  10  -3.366  -7.270   4.522
   91   HD13  ILE  10          2HD1      ILE  10  -2.053  -8.435   4.752
   92    H    ALA  11           H        ALA  11  -1.974  -2.964   1.936
   93    HA   ALA  11           HA       ALA  11  -1.959  -0.605   3.375
   94    HB1  ALA  11           3HB      ALA  11  -1.349   0.448   1.256
   95    HB2  ALA  11           1HB      ALA  11  -0.600  -1.153   1.382
   96    HB3  ALA  11           2HB      ALA  11  -2.023  -0.921   0.340
   97    H    LYS  12           H        LYS  12  -4.490  -1.496   0.937
   98    HA   LYS  12           HA       LYS  12  -5.975   0.953   1.637
   99    HB2  LYS  12           2HB      LYS  12  -7.454   0.383  -0.182
  100    HB3  LYS  12           3HB      LYS  12  -5.761   0.536  -0.622
  101    HG2  LYS  12           2HG      LYS  12  -5.640  -2.007  -0.637
  102    HG3  LYS  12           3HG      LYS  12  -7.401  -2.023  -0.465
  103    HD2  LYS  12           2HD      LYS  12  -7.652  -0.774  -2.563
  104    HD3  LYS  12           3HD      LYS  12  -5.902  -0.520  -2.666
  105    HE2  LYS  12           2HE      LYS  12  -5.556  -2.976  -2.851
  106    HE3  LYS  12           3HE      LYS  12  -7.313  -3.204  -2.866
  107    HZ1  LYS  12           HZ1      LYS  12  -5.750  -1.666  -4.899
  108    HZ2  LYS  12           HZ2      LYS  12  -6.450  -3.122  -5.127
  109    HZ3  LYS  12           HZ3      LYS  12  -7.379  -1.803  -4.889
  110    H    LYS  13           H        LYS  13  -6.128  -2.305   2.721
  111    HA   LYS  13           HA       LYS  13  -8.762  -1.956   4.011
  112    HB2  LYS  13           2HB      LYS  13  -6.501  -3.944   4.433
  113    HB3  LYS  13           3HB      LYS  13  -7.957  -3.906   5.434
  114    HG2  LYS  13           2HG      LYS  13  -9.395  -4.238   3.478
  115    HG3  LYS  13           3HG      LYS  13  -7.991  -4.238   2.403
  116    HD2  LYS  13           2HD      LYS  13  -7.102  -6.252   3.590
  117    HD3  LYS  13           3HD      LYS  13  -8.542  -6.250   4.634
  118    HE2  LYS  13           2HE      LYS  13  -9.983  -6.475   2.604
  119    HE3  LYS  13           3HE      LYS  13  -8.533  -6.526   1.592
  120    HZ1  LYS  13           HZ1      LYS  13  -7.872  -8.565   2.771
  121    HZ2  LYS  13           HZ2      LYS  13  -9.218  -8.513   3.697
  122    HZ3  LYS  13           HZ3      LYS  13  -9.343  -8.761   2.091
  123    H    LYS  14           H        LYS  14  -5.383  -1.412   5.017
  124    HA   LYS  14           HA       LYS  14  -6.192  -0.340   7.651
  125    HB2  LYS  14           2HB      LYS  14  -3.563  -0.837   6.231
  126    HB3  LYS  14           3HB      LYS  14  -3.615   0.253   7.598
  127    HG2  LYS  14           2HG      LYS  14  -2.966  -1.978   8.291
  128    HG3  LYS  14           3HG      LYS  14  -4.435  -1.426   9.091
  129    HD2  LYS  14           2HD      LYS  14  -5.810  -2.882   7.670
  130    HD3  LYS  14           3HD      LYS  14  -4.369  -3.387   6.756
  131    HE2  LYS  14           2HE      LYS  14  -3.385  -4.342   8.805
  132    HE3  LYS  14           3HE      LYS  14  -4.753  -3.760   9.761
  133    HZ1  LYS  14           HZ1      LYS  14  -6.203  -5.244   8.496
  134    HZ2  LYS  14           HZ2      LYS  14  -4.950  -5.785   7.592
  135    HZ3  LYS  14           HZ3      LYS  14  -5.007  -6.103   9.190
  136    H    GLY  15           H        GLY  15  -5.781   1.045   4.516
  137    HA2  GLY  15           HA2      GLY  15  -6.284   3.210   3.830
  138    HA3  GLY  15           HA3      GLY  15  -6.480   3.718   5.508
  139    H    LYS  16           H        LYS  16  -3.545   2.092   4.471
  140    HA   LYS  16           HA       LYS  16  -1.955   4.574   4.962
  141    HB2  LYS  16           2HB      LYS  16  -1.745   2.341   6.357
  142    HB3  LYS  16           3HB      LYS  16  -0.827   1.777   4.966
  143    HG2  LYS  16           2HG      LYS  16   0.412   4.199   5.393
  144    HG3  LYS  16           3HG      LYS  16  -0.233   3.935   6.995
  145    HD2  LYS  16           2HD      LYS  16   2.050   3.122   6.885
  146    HD3  LYS  16           3HD      LYS  16   0.955   1.769   7.146
  147    HE2  LYS  16           2HE      LYS  16   2.750   1.212   5.552
  148    HE3  LYS  16           3HE      LYS  16   1.157   1.068   4.814
  149    HZ1  LYS  16           HZ1      LYS  16   2.944   3.420   4.471
  150    HZ2  LYS  16           HZ2      LYS  16   2.775   2.221   3.378
  151    HZ3  LYS  16           HZ3      LYS  16   1.502   3.191   3.714
  152    H    CYS  17           H        CYS  17  -3.220   3.509   2.334
  153    HA   CYS  17           HA       CYS  17  -0.892   3.015   0.616
  154    HB2  CYS  17           2HB      CYS  17  -3.129   1.862   0.474
  155    HB3  CYS  17           3HB      CYS  17  -3.789   3.385  -0.141
  156    H    LYS  18           H        LYS  18   0.336   4.743   0.216
  157    HA   LYS  18           HA       LYS  18  -0.783   7.213  -1.016
  158    HB2  LYS  18           2HB      LYS  18   0.997   7.186   1.486
  159    HB3  LYS  18           3HB      LYS  18   0.550   8.627   0.578
  160    HG2  LYS  18           2HG      LYS  18  -1.853   8.236   1.159
  161    HG3  LYS  18           3HG      LYS  18  -1.366   6.837   2.121
  162    HD2  LYS  18           2HD      LYS  18  -1.689   8.664   3.629
  163    HD3  LYS  18           3HD      LYS  18   0.019   8.259   3.570
  164    HE2  LYS  18           2HE      LYS  18  -0.151  10.638   3.632
  165    HE3  LYS  18           3HE      LYS  18   0.409  10.199   2.022
  166    HZ1  LYS  18           HZ1      LYS  18  -1.353  11.880   1.952
  167    HZ2  LYS  18           HZ2      LYS  18  -1.888  10.523   1.224
  168    HZ3  LYS  18           HZ3      LYS  18  -2.397  10.902   2.732
  169    H    GLY  19           H        GLY  19   0.955   8.749  -1.680
  170    HA2  GLY  19           HA2      GLY  19   2.756   9.203  -3.050
  171    HA3  GLY  19           HA3      GLY  19   3.650   8.085  -2.032
  172    HA   PRO  20           HA       PRO  20   3.757   5.982  -6.110
  173    HB2  PRO  20           2HB      PRO  20   5.602   4.044  -5.533
  174    HB3  PRO  20           3HB      PRO  20   6.038   5.747  -5.864
  175    HG2  PRO  20           2HG      PRO  20   5.681   4.410  -3.164
  176    HG3  PRO  20           3HG      PRO  20   7.036   5.445  -3.716
  177    HD2  PRO  20           2HD      PRO  20   4.978   6.427  -2.236
  178    HD3  PRO  20           3HD      PRO  20   5.735   7.408  -3.531
  179    H    LEU  21           H        LEU  21   3.213   4.400  -2.919
  180    HA   LEU  21           HA       LEU  21   2.359   1.905  -3.995
  181    HB2  LEU  21           2HB      LEU  21   3.128   2.292  -1.672
  182    HB3  LEU  21           3HB      LEU  21   1.647   3.194  -1.343
  183    HG   LEU  21           HG       LEU  21   0.289   1.176  -1.682
  184   HD11  LEU  21          1HD1      LEU  21   1.602  -0.084  -3.324
  185   HD12  LEU  21          2HD1      LEU  21   2.938  -0.255  -2.160
  186   HD13  LEU  21          3HD1      LEU  21   1.374  -1.052  -1.870
  187   HD21  LEU  21          3HD2      LEU  21   1.086  -0.061   0.286
  188   HD22  LEU  21          1HD2      LEU  21   2.659   0.748   0.178
  189   HD23  LEU  21          2HD2      LEU  21   1.191   1.688   0.546
  190    H    LYS  22           H        LYS  22   0.562   4.865  -3.314
  191    HA   LYS  22           HA       LYS  22  -2.112   3.928  -3.829
  192    HB2  LYS  22           2HB      LYS  22  -1.698   6.036  -2.750
  193    HB3  LYS  22           3HB      LYS  22  -0.821   6.659  -4.156
  194    HG2  LYS  22           2HG      LYS  22  -2.882   6.671  -5.489
  195    HG3  LYS  22           3HG      LYS  22  -3.786   5.929  -4.157
  196    HD2  LYS  22           2HD      LYS  22  -3.316   7.899  -2.736
  197    HD3  LYS  22           3HD      LYS  22  -2.349   8.603  -4.043
  198    HE2  LYS  22           2HE      LYS  22  -4.331   9.742  -4.319
  199    HE3  LYS  22           3HE      LYS  22  -4.511   8.428  -5.484
  200    HZ1  LYS  22           HZ1      LYS  22  -5.872   7.247  -3.781
  201    HZ2  LYS  22           HZ2      LYS  22  -5.697   8.505  -2.754
  202    HZ3  LYS  22           HZ3      LYS  22  -6.515   8.700  -4.151
  203    H    LEU  23           H        LEU  23   0.434   4.928  -6.034
  204    HA   LEU  23           HA       LEU  23  -1.256   4.563  -8.408
  205    HB2  LEU  23           2HB      LEU  23   0.597   6.180  -8.364
  206    HB3  LEU  23           3HB      LEU  23   1.755   4.877  -8.119
  207    HG   LEU  23           HG       LEU  23   1.200   3.935 -10.346
  208   HD11  LEU  23          1HD1      LEU  23  -0.100   5.326 -11.954
  209   HD12  LEU  23          2HD1      LEU  23  -1.113   4.710 -10.648
  210   HD13  LEU  23          3HD1      LEU  23  -0.573   6.406 -10.623
  211   HD21  LEU  23          3HD2      LEU  23   1.919   6.895 -10.388
  212   HD22  LEU  23          1HD2      LEU  23   3.042   5.552 -10.080
  213   HD23  LEU  23          2HD2      LEU  23   2.269   5.708 -11.665
  214    H    VAL  24           H        VAL  24   1.305   2.618  -6.822
  215    HA   VAL  24           HA       VAL  24   1.381   0.454  -8.679
  216    HB   VAL  24           HB       VAL  24   2.047   0.628  -5.723
  217   HG11  VAL  24          1HG1      VAL  24   1.760  -1.757  -6.175
  218   HG12  VAL  24          2HG1      VAL  24   2.782  -1.627  -7.628
  219   HG13  VAL  24          3HG1      VAL  24   3.467  -1.370  -6.004
  220   HG21  VAL  24          3HG2      VAL  24   4.347   0.832  -6.448
  221   HG22  VAL  24          1HG2      VAL  24   3.889   0.559  -8.149
  222   HG23  VAL  24          2HG2      VAL  24   3.403   2.041  -7.315
  223    H    CYS  25           H        CYS  25  -0.656   0.931  -5.823
  224    HA   CYS  25           HA       CYS  25  -1.913  -1.752  -6.101
  225    HB2  CYS  25           2HB      CYS  25  -0.849  -1.037  -4.005
  226    HB3  CYS  25           3HB      CYS  25  -1.897   0.366  -3.927
  227    H    LYS  26           H        LYS  26  -2.474   1.372  -7.033
  228    HA   LYS  26           HA       LYS  26  -4.136   2.758  -7.520
  229    HB2  LYS  26           2HB      LYS  26  -4.448   0.601  -9.095
  230    HB3  LYS  26           3HB      LYS  26  -6.054   0.644  -8.389
  231    HG2  LYS  26           2HG      LYS  26  -4.542   2.875  -9.799
  232    HG3  LYS  26           3HG      LYS  26  -5.919   1.984 -10.456
  233    HD2  LYS  26           2HD      LYS  26  -5.969   3.991  -8.152
  234    HD3  LYS  26           3HD      LYS  26  -6.590   4.240  -9.777
  235    HE2  LYS  26           2HE      LYS  26  -8.359   2.632  -9.467
  236    HE3  LYS  26           3HE      LYS  26  -7.668   2.059  -7.947
  237    HZ1  LYS  26           HZ1      LYS  26  -8.122   4.216  -6.944
  238    HZ2  LYS  26           HZ2      LYS  26  -8.728   4.800  -8.354
  239    HZ3  LYS  26           HZ3      LYS  26  -9.502   3.601  -7.560
  240    H    CYS  27           H        CYS  27  -4.324   3.488  -5.447
  241    HA   CYS  27           HA       CYS  27  -6.717   2.600  -3.888
  242    HB2  CYS  27           2HB      CYS  27  -4.260   4.148  -3.026
  243    HB3  CYS  27           3HB      CYS  27  -5.570   3.626  -1.983
  Start of MODEL   24
    1    H1   GLY   1           1H       GLY   1  11.330  -8.531   2.588
    2    H2   GLY   1           2H       GLY   1  11.593  -8.127   4.155
    3    H3   GLY   1           3H       GLY   1  10.854  -9.543   3.783
    4    HA2  GLY   1           HA2      GLY   1   9.232  -7.955   4.578
    5    HA3  GLY   1           HA3      GLY   1   9.752  -6.851   3.293
    6    H    LEU   2           H        LEU   2   7.126  -7.459   3.428
    7    HA   LEU   2           HA       LEU   2   6.381  -9.715   1.749
    8    HB2  LEU   2           2HB      LEU   2   4.863  -7.300   2.788
    9    HB3  LEU   2           3HB      LEU   2   4.105  -8.556   1.824
   10    HG   LEU   2           HG       LEU   2   5.440  -9.040   4.525
   11   HD11  LEU   2          1HD1      LEU   2   2.494  -8.802   3.790
   12   HD12  LEU   2          2HD1      LEU   2   3.144  -9.232   5.386
   13   HD13  LEU   2          3HD1      LEU   2   3.437  -7.618   4.720
   14   HD21  LEU   2          3HD2      LEU   2   5.401 -11.087   3.163
   15   HD22  LEU   2          1HD2      LEU   2   4.187 -11.195   4.438
   16   HD23  LEU   2          2HD2      LEU   2   3.686 -10.826   2.774
   17    HA   PRO   3           HA       PRO   3   6.659  -7.638  -2.212
   18    HB2  PRO   3           2HB      PRO   3   5.103  -9.201  -3.785
   19    HB3  PRO   3           3HB      PRO   3   6.611  -9.819  -3.046
   20    HG2  PRO   3           2HG      PRO   3   3.774 -10.142  -2.004
   21    HG3  PRO   3           3HG      PRO   3   5.005 -11.421  -2.255
   22    HD2  PRO   3           2HD      PRO   3   4.597 -10.218   0.175
   23    HD3  PRO   3           3HD      PRO   3   6.222 -10.748  -0.355
   24    H    ARG   4           H        ARG   4   5.437  -6.376  -3.709
   25    HA   ARG   4           HA       ARG   4   3.465  -4.662  -2.641
   26    HB2  ARG   4           2HB      ARG   4   4.292  -5.277  -5.502
   27    HB3  ARG   4           3HB      ARG   4   3.077  -4.056  -5.109
   28    HG2  ARG   4           2HG      ARG   4   4.653  -2.811  -3.732
   29    HG3  ARG   4           3HG      ARG   4   5.916  -4.031  -4.000
   30    HD2  ARG   4           2HD      ARG   4   5.925  -3.544  -6.402
   31    HD3  ARG   4           3HD      ARG   4   4.588  -2.395  -6.199
   32    HE   ARG   4           HE       ARG   4   6.747  -1.639  -4.481
   33   HH11  ARG   4          1HH1      ARG   4   6.006  -1.623  -7.907
   34   HH12  ARG   4          2HH1      ARG   4   7.032  -0.248  -8.214
   35   HH21  ARG   4          1HH2      ARG   4   8.049   0.099  -4.948
   36   HH22  ARG   4          2HH2      ARG   4   8.163   0.689  -6.580
   37    H    LYS   5           H        LYS   5   2.917  -7.640  -4.474
   38    HA   LYS   5           HA       LYS   5   0.094  -7.243  -4.876
   39    HB2  LYS   5           2HB      LYS   5   0.022  -9.524  -5.589
   40    HB3  LYS   5           3HB      LYS   5   1.480  -8.760  -6.235
   41    HG2  LYS   5           2HG      LYS   5   2.768  -9.824  -4.311
   42    HG3  LYS   5           3HG      LYS   5   1.303 -10.718  -3.902
   43    HD2  LYS   5           2HD      LYS   5   2.819 -10.908  -6.549
   44    HD3  LYS   5           3HD      LYS   5   2.947 -12.018  -5.195
   45    HE2  LYS   5           2HE      LYS   5   1.498 -13.197  -6.486
   46    HE3  LYS   5           3HE      LYS   5   0.361 -12.337  -5.452
   47    HZ1  LYS   5           HZ1      LYS   5   0.049 -10.737  -7.298
   48    HZ2  LYS   5           HZ2      LYS   5   1.137 -11.540  -8.220
   49    HZ3  LYS   5           HZ3      LYS   5  -0.268 -12.250  -7.807
   50    H    ILE   6           H        ILE   6   1.818  -8.240  -2.047
   51    HA   ILE   6           HA       ILE   6  -0.713  -9.060  -0.678
   52    HB   ILE   6           HB       ILE   6   2.188  -9.309   0.192
   53   HG12  ILE   6          2HG1      ILE   6   0.081 -11.387  -0.593
   54   HG13  ILE   6          3HG1      ILE   6   1.451 -10.899  -1.585
   55   HG21  ILE   6          1HG2      ILE   6   0.712  -8.848   2.139
   56   HG22  ILE   6          2HG2      ILE   6  -0.377 -10.152   1.627
   57   HG23  ILE   6          3HG2      ILE   6   1.277 -10.508   2.171
   58   HD11  ILE   6          3HD1      ILE   6   1.593 -12.433   1.026
   59   HD12  ILE   6          1HD1      ILE   6   1.994 -12.991  -0.605
   60   HD13  ILE   6          2HD1      ILE   6   3.007 -11.765   0.173
   61    H    LEU   7           H        LEU   7   1.996  -6.690  -0.407
   62    HA   LEU   7           HA       LEU   7   0.961  -5.210   1.778
   63    HB2  LEU   7           2HB      LEU   7   2.598  -4.339  -0.636
   64    HB3  LEU   7           3HB      LEU   7   2.266  -3.286   0.729
   65    HG   LEU   7           HG       LEU   7   3.796  -5.913   0.936
   66   HD11  LEU   7          1HD1      LEU   7   5.016  -4.202  -0.350
   67   HD12  LEU   7          2HD1      LEU   7   4.744  -3.012   0.944
   68   HD13  LEU   7          3HD1      LEU   7   5.759  -4.442   1.236
   69   HD21  LEU   7          3HD2      LEU   7   3.267  -3.679   2.950
   70   HD22  LEU   7          1HD2      LEU   7   2.739  -5.374   3.074
   71   HD23  LEU   7          2HD2      LEU   7   4.455  -4.975   3.177
   72    H    CYS   8           H        CYS   8  -0.029  -5.077  -1.618
   73    HA   CYS   8           HA       CYS   8  -1.608  -2.710  -1.572
   74    HB2  CYS   8           2HB      CYS   8  -0.994  -3.861  -3.588
   75    HB3  CYS   8           3HB      CYS   8  -1.823  -5.331  -3.093
   76    H    ALA   9           H        ALA   9  -2.456  -6.024  -0.419
   77    HA   ALA   9           HA       ALA   9  -5.256  -5.376   0.006
   78    HB1  ALA   9           3HB      ALA   9  -4.427  -7.677  -0.367
   79    HB2  ALA   9           1HB      ALA   9  -3.500  -7.598   1.147
   80    HB3  ALA   9           2HB      ALA   9  -5.276  -7.538   1.187
   81    H    ILE  10           H        ILE  10  -2.360  -5.484   2.084
   82    HA   ILE  10           HA       ILE  10  -3.608  -4.724   4.543
   83    HB   ILE  10           HB       ILE  10  -0.751  -4.154   3.658
   84   HG12  ILE  10          2HG1      ILE  10  -1.147  -6.517   3.253
   85   HG13  ILE  10          3HG1      ILE  10  -0.071  -6.285   4.597
   86   HG21  ILE  10          1HG2      ILE  10  -0.249  -4.358   6.092
   87   HG22  ILE  10          2HG2      ILE  10  -1.313  -2.999   5.721
   88   HG23  ILE  10          3HG2      ILE  10  -1.990  -4.481   6.423
   89   HD11  ILE  10          3HD1      ILE  10  -1.917  -6.810   6.189
   90   HD12  ILE  10          1HD1      ILE  10  -3.034  -7.003   4.815
   91   HD13  ILE  10          2HD1      ILE  10  -1.665  -8.109   5.013
   92    H    ALA  11           H        ALA  11  -1.937  -2.741   2.061
   93    HA   ALA  11           HA       ALA  11  -2.226  -0.232   3.289
   94    HB1  ALA  11           3HB      ALA  11  -0.735  -0.864   1.352
   95    HB2  ALA  11           1HB      ALA  11  -2.177  -0.856   0.300
   96    HB3  ALA  11           2HB      ALA  11  -1.627   0.627   1.101
   97    H    LYS  12           H        LYS  12  -4.446  -1.886   1.004
   98    HA   LYS  12           HA       LYS  12  -6.337   0.276   0.849
   99    HB2  LYS  12           2HB      LYS  12  -5.913  -1.842  -0.706
  100    HB3  LYS  12           3HB      LYS  12  -7.059  -2.632   0.364
  101    HG2  LYS  12           2HG      LYS  12  -8.386  -1.831  -1.417
  102    HG3  LYS  12           3HG      LYS  12  -8.636  -0.631  -0.150
  103    HD2  LYS  12           2HD      LYS  12  -8.281   0.645  -2.134
  104    HD3  LYS  12           3HD      LYS  12  -6.759   0.734  -1.251
  105    HE2  LYS  12           2HE      LYS  12  -5.992   0.303  -3.377
  106    HE3  LYS  12           3HE      LYS  12  -6.024  -1.315  -2.689
  107    HZ1  LYS  12           HZ1      LYS  12  -8.129  -1.676  -3.890
  108    HZ2  LYS  12           HZ2      LYS  12  -8.111  -0.131  -4.453
  109    HZ3  LYS  12           HZ3      LYS  12  -6.959  -1.170  -4.932
  110    H    LYS  13           H        LYS  13  -6.203  -2.597   2.948
  111    HA   LYS  13           HA       LYS  13  -8.781  -2.050   4.216
  112    HB2  LYS  13           2HB      LYS  13  -6.567  -4.055   4.611
  113    HB3  LYS  13           3HB      LYS  13  -7.627  -3.728   5.969
  114    HG2  LYS  13           2HG      LYS  13  -8.488  -5.608   4.780
  115    HG3  LYS  13           3HG      LYS  13  -9.618  -4.259   4.665
  116    HD2  LYS  13           2HD      LYS  13  -8.771  -3.790   2.346
  117    HD3  LYS  13           3HD      LYS  13  -7.732  -5.215   2.460
  118    HE2  LYS  13           2HE      LYS  13 -10.775  -5.216   2.708
  119    HE3  LYS  13           3HE      LYS  13  -9.889  -5.566   1.223
  120    HZ1  LYS  13           HZ1      LYS  13  -9.718  -7.172   3.717
  121    HZ2  LYS  13           HZ2      LYS  13 -10.487  -7.609   2.349
  122    HZ3  LYS  13           HZ3      LYS  13  -8.863  -7.471   2.353
  123    H    LYS  14           H        LYS  14  -5.422  -1.319   5.197
  124    HA   LYS  14           HA       LYS  14  -6.333  -0.091   7.722
  125    HB2  LYS  14           2HB      LYS  14  -3.632  -0.480   6.398
  126    HB3  LYS  14           3HB      LYS  14  -3.825   0.632   7.739
  127    HG2  LYS  14           2HG      LYS  14  -3.044  -1.477   8.562
  128    HG3  LYS  14           3HG      LYS  14  -4.640  -1.099   9.211
  129    HD2  LYS  14           2HD      LYS  14  -5.682  -2.751   7.704
  130    HD3  LYS  14           3HD      LYS  14  -4.129  -3.018   6.900
  131    HE2  LYS  14           2HE      LYS  14  -4.488  -4.850   8.388
  132    HE3  LYS  14           3HE      LYS  14  -3.170  -3.868   9.031
  133    HZ1  LYS  14           HZ1      LYS  14  -5.988  -3.780   9.991
  134    HZ2  LYS  14           HZ2      LYS  14  -4.757  -4.520  10.761
  135    HZ3  LYS  14           HZ3      LYS  14  -4.758  -2.898  10.614
  136    H    GLY  15           H        GLY  15  -5.608   1.139   4.509
  137    HA2  GLY  15           HA2      GLY  15  -6.306   3.253   3.679
  138    HA3  GLY  15           HA3      GLY  15  -6.465   3.878   5.323
  139    H    LYS  16           H        LYS  16  -3.641   2.132   5.042
  140    HA   LYS  16           HA       LYS  16  -1.830   4.368   5.284
  141    HB2  LYS  16           2HB      LYS  16  -1.573   1.340   5.025
  142    HB3  LYS  16           3HB      LYS  16  -0.162   2.347   5.180
  143    HG2  LYS  16           2HG      LYS  16  -2.346   2.620   7.259
  144    HG3  LYS  16           3HG      LYS  16  -1.309   1.200   7.273
  145    HD2  LYS  16           2HD      LYS  16  -0.446   2.840   8.807
  146    HD3  LYS  16           3HD      LYS  16   0.700   2.580   7.487
  147    HE2  LYS  16           2HE      LYS  16  -0.030   4.675   6.408
  148    HE3  LYS  16           3HE      LYS  16  -1.256   4.917   7.666
  149    HZ1  LYS  16           HZ1      LYS  16   0.553   5.089   9.292
  150    HZ2  LYS  16           HZ2      LYS  16   1.682   4.862   8.132
  151    HZ3  LYS  16           HZ3      LYS  16   0.756   6.204   8.120
  152    H    CYS  17           H        CYS  17  -3.201   3.083   2.504
  153    HA   CYS  17           HA       CYS  17  -0.964   2.909   0.758
  154    HB2  CYS  17           2HB      CYS  17  -3.350   1.909   0.600
  155    HB3  CYS  17           3HB      CYS  17  -3.826   3.486  -0.020
  156    H    LYS  18           H        LYS  18   0.260   4.504   0.118
  157    HA   LYS  18           HA       LYS  18  -0.786   7.016  -1.046
  158    HB2  LYS  18           2HB      LYS  18   1.321   6.953   1.184
  159    HB3  LYS  18           3HB      LYS  18   0.878   8.386   0.267
  160    HG2  LYS  18           2HG      LYS  18  -0.953   6.885   2.175
  161    HG3  LYS  18           3HG      LYS  18  -0.077   8.358   2.538
  162    HD2  LYS  18           2HD      LYS  18  -1.324   9.660   0.963
  163    HD3  LYS  18           3HD      LYS  18  -2.097   8.249   0.256
  164    HE2  LYS  18           2HE      LYS  18  -2.524   9.235   3.112
  165    HE3  LYS  18           3HE      LYS  18  -3.595   9.529   1.738
  166    HZ1  LYS  18           HZ1      LYS  18  -4.501   7.664   2.818
  167    HZ2  LYS  18           HZ2      LYS  18  -3.692   6.998   1.548
  168    HZ3  LYS  18           HZ3      LYS  18  -3.071   6.933   3.053
  169    H    GLY  19           H        GLY  19   0.956   8.253  -2.133
  170    HA2  GLY  19           HA2      GLY  19   2.667   8.401  -3.686
  171    HA3  GLY  19           HA3      GLY  19   3.557   7.451  -2.503
  172    HA   PRO  20           HA       PRO  20   3.853   4.803  -6.220
  173    HB2  PRO  20           2HB      PRO  20   5.476   3.206  -4.229
  174    HB3  PRO  20           3HB      PRO  20   5.819   3.542  -5.955
  175    HG2  PRO  20           2HG      PRO  20   7.093   4.955  -4.035
  176    HG3  PRO  20           3HG      PRO  20   6.421   5.813  -5.462
  177    HD2  PRO  20           2HD      PRO  20   5.207   5.533  -2.696
  178    HD3  PRO  20           3HD      PRO  20   5.362   6.993  -3.720
  179    H    LEU  21           H        LEU  21   3.083   3.600  -2.897
  180    HA   LEU  21           HA       LEU  21   2.010   1.091  -3.765
  181    HB2  LEU  21           2HB      LEU  21   2.622   2.199  -1.333
  182    HB3  LEU  21           3HB      LEU  21   0.886   2.393  -1.306
  183    HG   LEU  21           HG       LEU  21   1.433   0.390  -0.161
  184   HD11  LEU  21          1HD1      LEU  21   0.282  -1.376  -1.315
  185   HD12  LEU  21          2HD1      LEU  21  -0.548   0.148  -1.657
  186   HD13  LEU  21          3HD1      LEU  21   0.505  -0.588  -2.887
  187   HD21  LEU  21          3HD2      LEU  21   2.970  -0.581  -2.603
  188   HD22  LEU  21          1HD2      LEU  21   3.686   0.033  -1.095
  189   HD23  LEU  21          2HD2      LEU  21   2.724  -1.454  -1.076
  190    H    LYS  22           H        LYS  22   0.533   4.266  -3.375
  191    HA   LYS  22           HA       LYS  22  -2.229   3.501  -3.936
  192    HB2  LYS  22           2HB      LYS  22  -1.766   5.514  -2.714
  193    HB3  LYS  22           3HB      LYS  22  -0.751   6.154  -4.011
  194    HG2  LYS  22           2HG      LYS  22  -2.685   6.401  -5.484
  195    HG3  LYS  22           3HG      LYS  22  -3.743   5.653  -4.274
  196    HD2  LYS  22           2HD      LYS  22  -3.305   7.504  -2.708
  197    HD3  LYS  22           3HD      LYS  22  -2.111   8.183  -3.822
  198    HE2  LYS  22           2HE      LYS  22  -3.977   9.525  -4.183
  199    HE3  LYS  22           3HE      LYS  22  -3.990   8.402  -5.543
  200    HZ1  LYS  22           HZ1      LYS  22  -5.700   7.095  -4.326
  201    HZ2  LYS  22           HZ2      LYS  22  -5.670   8.174  -3.098
  202    HZ3  LYS  22           HZ3      LYS  22  -6.196   8.630  -4.572
  203    H    LEU  23           H        LEU  23   0.415   4.699  -5.974
  204    HA   LEU  23           HA       LEU  23  -1.069   4.642  -8.429
  205    HB2  LEU  23           2HB      LEU  23   1.043   5.876  -8.077
  206    HB3  LEU  23           3HB      LEU  23   1.917   4.357  -7.897
  207    HG   LEU  23           HG       LEU  23   1.419   3.769 -10.256
  208   HD11  LEU  23          1HD1      LEU  23   0.153   6.545 -10.373
  209   HD12  LEU  23          2HD1      LEU  23   0.545   5.532 -11.781
  210   HD13  LEU  23          3HD1      LEU  23  -0.681   4.994 -10.632
  211   HD21  LEU  23          3HD2      LEU  23   2.657   6.528  -9.895
  212   HD22  LEU  23          1HD2      LEU  23   3.486   4.972  -9.663
  213   HD23  LEU  23          2HD2      LEU  23   2.909   5.432 -11.273
  214    H    VAL  24           H        VAL  24   0.885   2.118  -6.836
  215    HA   VAL  24           HA       VAL  24   0.631   0.118  -8.903
  216    HB   VAL  24           HB       VAL  24   1.336   0.000  -5.949
  217   HG11  VAL  24          1HG1      VAL  24   2.307  -2.233  -6.374
  218   HG12  VAL  24          2HG1      VAL  24   0.555  -2.246  -6.515
  219   HG13  VAL  24          3HG1      VAL  24   1.559  -2.252  -7.986
  220   HG21  VAL  24          3HG2      VAL  24   2.909   1.184  -7.576
  221   HG22  VAL  24          1HG2      VAL  24   3.604  -0.152  -6.666
  222   HG23  VAL  24          2HG2      VAL  24   3.136  -0.375  -8.376
  223    H    CYS  25           H        CYS  25  -1.155   0.670  -5.878
  224    HA   CYS  25           HA       CYS  25  -2.800  -1.739  -6.283
  225    HB2  CYS  25           2HB      CYS  25  -1.479  -1.205  -4.251
  226    HB3  CYS  25           3HB      CYS  25  -2.480   0.207  -3.986
  227    H    LYS  26           H        LYS  26  -3.175   1.552  -6.920
  228    HA   LYS  26           HA       LYS  26  -4.880   2.979  -7.390
  229    HB2  LYS  26           2HB      LYS  26  -6.226   0.405  -8.253
  230    HB3  LYS  26           3HB      LYS  26  -6.861   2.010  -8.607
  231    HG2  LYS  26           2HG      LYS  26  -4.030   1.160  -9.325
  232    HG3  LYS  26           3HG      LYS  26  -5.396   0.881 -10.407
  233    HD2  LYS  26           2HD      LYS  26  -4.410   3.614  -9.460
  234    HD3  LYS  26           3HD      LYS  26  -4.069   2.864 -11.021
  235    HE2  LYS  26           2HE      LYS  26  -6.514   2.806 -11.525
  236    HE3  LYS  26           3HE      LYS  26  -6.839   3.630  -9.996
  237    HZ1  LYS  26           HZ1      LYS  26  -6.739   5.201 -11.840
  238    HZ2  LYS  26           HZ2      LYS  26  -5.516   5.513 -10.809
  239    HZ3  LYS  26           HZ3      LYS  26  -5.221   4.749 -12.224
  240    H    CYS  27           H        CYS  27  -4.636   3.194  -5.173
  241    HA   CYS  27           HA       CYS  27  -6.896   2.494  -3.393
  242    HB2  CYS  27           2HB      CYS  27  -4.361   4.078  -2.841
  243    HB3  CYS  27           3HB      CYS  27  -5.529   3.550  -1.654
  Start of MODEL   25
    1    H1   GLY   1           1H       GLY   1  10.388 -10.135   4.425
    2    H2   GLY   1           2H       GLY   1  11.060  -9.056   3.394
    3    H3   GLY   1           3H       GLY   1  11.228  -8.856   5.013
    4    HA2  GLY   1           HA2      GLY   1   8.869  -8.478   5.281
    5    HA3  GLY   1           HA3      GLY   1   9.602  -7.304   4.173
    6    H    LEU   2           H        LEU   2   6.954  -7.568   3.998
    7    HA   LEU   2           HA       LEU   2   6.086  -9.565   2.066
    8    HB2  LEU   2           2HB      LEU   2   4.776  -7.018   3.099
    9    HB3  LEU   2           3HB      LEU   2   3.988  -8.184   2.051
   10    HG   LEU   2           HG       LEU   2   4.965  -8.742   4.886
   11   HD11  LEU   2          1HD1      LEU   2   2.565  -8.853   5.415
   12   HD12  LEU   2          2HD1      LEU   2   2.994  -7.262   4.767
   13   HD13  LEU   2          3HD1      LEU   2   2.162  -8.442   3.732
   14   HD21  LEU   2          3HD2      LEU   2   3.451 -10.512   2.914
   15   HD22  LEU   2          1HD2      LEU   2   5.067 -10.814   3.594
   16   HD23  LEU   2          2HD2      LEU   2   3.651 -10.860   4.646
   17    HA   PRO   3           HA       PRO   3   6.916  -7.015  -1.583
   18    HB2  PRO   3           2HB      PRO   3   5.832  -8.504  -3.527
   19    HB3  PRO   3           3HB      PRO   3   7.173  -9.162  -2.538
   20    HG2  PRO   3           2HG      PRO   3   4.208  -9.662  -2.244
   21    HG3  PRO   3           3HG      PRO   3   5.537 -10.859  -2.206
   22    HD2  PRO   3           2HD      PRO   3   4.364  -9.630   0.058
   23    HD3  PRO   3           3HD      PRO   3   5.930 -10.447   0.030
   24    H    ARG   4           H        ARG   4   5.673  -5.864  -3.299
   25    HA   ARG   4           HA       ARG   4   3.446  -4.367  -2.402
   26    HB2  ARG   4           2HB      ARG   4   4.438  -4.964  -5.220
   27    HB3  ARG   4           3HB      ARG   4   3.164  -3.794  -4.859
   28    HG2  ARG   4           2HG      ARG   4   4.657  -2.475  -3.461
   29    HG3  ARG   4           3HG      ARG   4   5.980  -3.626  -3.689
   30    HD2  ARG   4           2HD      ARG   4   4.661  -1.993  -5.893
   31    HD3  ARG   4           3HD      ARG   4   6.184  -1.588  -5.090
   32    HE   ARG   4           HE       ARG   4   6.518  -4.193  -6.073
   33   HH11  ARG   4          2HH1      ARG   4   6.023  -1.028  -7.494
   34   HH12  ARG   4          1HH1      ARG   4   6.820  -1.472  -8.978
   35   HH21  ARG   4          1HH2      ARG   4   7.519  -4.690  -7.996
   36   HH22  ARG   4          2HH2      ARG   4   7.650  -3.487  -9.242
   37    H    LYS   5           H        LYS   5   3.395  -7.386  -4.282
   38    HA   LYS   5           HA       LYS   5   0.702  -7.575  -4.930
   39    HB2  LYS   5           2HB      LYS   5   2.671  -9.009  -5.637
   40    HB3  LYS   5           3HB      LYS   5   2.618  -9.797  -4.063
   41    HG2  LYS   5           2HG      LYS   5   1.576 -11.166  -5.753
   42    HG3  LYS   5           3HG      LYS   5   0.362 -10.678  -4.568
   43    HD2  LYS   5           2HD      LYS   5  -0.571  -9.022  -6.100
   44    HD3  LYS   5           3HD      LYS   5   0.787  -9.244  -7.238
   45    HE2  LYS   5           2HE      LYS   5   0.164 -11.590  -7.542
   46    HE3  LYS   5           3HE      LYS   5  -1.172 -11.406  -6.394
   47    HZ1  LYS   5           HZ1      LYS   5  -0.947  -9.966  -8.991
   48    HZ2  LYS   5           HZ2      LYS   5  -1.952 -11.216  -8.699
   49    HZ3  LYS   5           HZ3      LYS   5  -2.181  -9.795  -7.932
   50    H    ILE   6           H        ILE   6   2.185  -8.285  -1.780
   51    HA   ILE   6           HA       ILE   6  -0.436  -9.180  -0.666
   52    HB   ILE   6           HB       ILE   6   2.184  -8.905   0.820
   53   HG12  ILE   6          2HG1      ILE   6   2.623 -10.494  -0.964
   54   HG13  ILE   6          3HG1      ILE   6   2.607 -11.264   0.608
   55   HG21  ILE   6          1HG2      ILE   6   1.076 -10.518   2.380
   56   HG22  ILE   6          2HG2      ILE   6   0.222  -8.976   2.244
   57   HG23  ILE   6          3HG2      ILE   6  -0.403 -10.402   1.400
   58   HD11  ILE   6          3HD1      ILE   6   1.635 -12.639  -1.124
   59   HD12  ILE   6          1HD1      ILE   6   0.407 -12.250   0.099
   60   HD13  ILE   6          2HD1      ILE   6   0.401 -11.409  -1.480
   61    H    LEU   7           H        LEU   7   2.033  -6.609  -0.231
   62    HA   LEU   7           HA       LEU   7   0.782  -5.266   1.896
   63    HB2  LEU   7           2HB      LEU   7   3.130  -5.032   1.162
   64    HB3  LEU   7           3HB      LEU   7   2.599  -4.202  -0.299
   65    HG   LEU   7           HG       LEU   7   1.785  -2.299   1.022
   66   HD11  LEU   7          1HD1      LEU   7   2.330  -2.152   3.457
   67   HD12  LEU   7          2HD1      LEU   7   1.100  -3.369   3.118
   68   HD13  LEU   7          3HD1      LEU   7   2.775  -3.873   3.444
   69   HD21  LEU   7          3HD2      LEU   7   4.596  -3.136   1.849
   70   HD22  LEU   7          1HD2      LEU   7   4.164  -2.402   0.293
   71   HD23  LEU   7          2HD2      LEU   7   3.955  -1.478   1.790
   72    H    CYS   8           H        CYS   8   0.006  -5.100  -1.527
   73    HA   CYS   8           HA       CYS   8  -1.566  -2.725  -1.554
   74    HB2  CYS   8           2HB      CYS   8  -0.801  -3.819  -3.547
   75    HB3  CYS   8           3HB      CYS   8  -1.656  -5.304  -3.157
   76    H    ALA   9           H        ALA   9  -2.448  -6.028  -0.460
   77    HA   ALA   9           HA       ALA   9  -5.287  -5.531  -0.176
   78    HB1  ALA   9           3HB      ALA   9  -4.222  -7.803  -0.206
   79    HB2  ALA   9           1HB      ALA   9  -3.437  -7.444   1.353
   80    HB3  ALA   9           2HB      ALA   9  -5.204  -7.539   1.249
   81    H    ILE  10           H        ILE  10  -2.492  -5.263   1.955
   82    HA   ILE  10           HA       ILE  10  -3.939  -4.594   4.344
   83    HB   ILE  10           HB       ILE  10  -0.985  -4.397   3.643
   84   HG12  ILE  10          2HG1      ILE  10  -2.499  -6.651   5.049
   85   HG13  ILE  10          3HG1      ILE  10  -2.077  -6.695   3.352
   86   HG21  ILE  10          1HG2      ILE  10  -1.563  -3.078   5.682
   87   HG22  ILE  10          2HG2      ILE  10  -2.329  -4.522   6.383
   88   HG23  ILE  10          3HG2      ILE  10  -0.581  -4.485   6.074
   89   HD11  ILE  10          3HD1      ILE  10  -0.497  -7.993   4.488
   90   HD12  ILE  10          1HD1      ILE  10   0.312  -6.544   3.872
   91   HD13  ILE  10          2HD1      ILE  10  -0.080  -6.680   5.611
   92    H    ALA  11           H        ALA  11  -2.088  -2.643   1.989
   93    HA   ALA  11           HA       ALA  11  -2.227  -0.126   3.210
   94    HB1  ALA  11           3HB      ALA  11  -1.743   0.705   0.975
   95    HB2  ALA  11           1HB      ALA  11  -0.892  -0.819   1.182
   96    HB3  ALA  11           2HB      ALA  11  -2.396  -0.767   0.222
   97    H    LYS  12           H        LYS  12  -4.703  -1.762   1.220
   98    HA   LYS  12           HA       LYS  12  -6.547   0.537   1.383
   99    HB2  LYS  12           2HB      LYS  12  -6.794  -2.193   0.051
  100    HB3  LYS  12           3HB      LYS  12  -8.013  -0.906  -0.016
  101    HG2  LYS  12           2HG      LYS  12  -6.226   0.647  -0.905
  102    HG3  LYS  12           3HG      LYS  12  -5.148  -0.741  -1.049
  103    HD2  LYS  12           2HD      LYS  12  -7.780  -0.327  -2.524
  104    HD3  LYS  12           3HD      LYS  12  -6.145  -0.128  -3.168
  105    HE2  LYS  12           2HE      LYS  12  -5.748  -2.593  -2.592
  106    HE3  LYS  12           3HE      LYS  12  -7.492  -2.719  -2.338
  107    HZ1  LYS  12           HZ1      LYS  12  -6.212  -1.784  -4.871
  108    HZ2  LYS  12           HZ2      LYS  12  -6.841  -3.280  -4.638
  109    HZ3  LYS  12           HZ3      LYS  12  -7.819  -1.975  -4.634
  110    H    LYS  13           H        LYS  13  -6.266  -2.630   2.965
  111    HA   LYS  13           HA       LYS  13  -8.784  -2.459   4.399
  112    HB2  LYS  13           2HB      LYS  13  -6.208  -4.008   4.848
  113    HB3  LYS  13           3HB      LYS  13  -7.574  -4.116   5.963
  114    HG2  LYS  13           2HG      LYS  13  -9.057  -4.936   4.252
  115    HG3  LYS  13           3HG      LYS  13  -7.855  -4.679   2.982
  116    HD2  LYS  13           2HD      LYS  13  -6.344  -6.329   4.092
  117    HD3  LYS  13           3HD      LYS  13  -7.586  -6.649   5.307
  118    HE2  LYS  13           2HE      LYS  13  -7.919  -7.054   2.295
  119    HE3  LYS  13           3HE      LYS  13  -7.458  -8.327   3.427
  120    HZ1  LYS  13           HZ1      LYS  13  -9.587  -7.998   4.574
  121    HZ2  LYS  13           HZ2      LYS  13 -10.033  -6.846   3.502
  122    HZ3  LYS  13           HZ3      LYS  13  -9.832  -8.386   3.011
  123    H    LYS  14           H        LYS  14  -5.512  -1.318   5.230
  124    HA   LYS  14           HA       LYS  14  -6.465  -0.122   7.778
  125    HB2  LYS  14           2HB      LYS  14  -3.752  -0.426   6.447
  126    HB3  LYS  14           3HB      LYS  14  -3.986   0.688   7.777
  127    HG2  LYS  14           2HG      LYS  14  -3.106  -1.383   8.605
  128    HG3  LYS  14           3HG      LYS  14  -4.707  -1.066   9.273
  129    HD2  LYS  14           2HD      LYS  14  -5.707  -2.776   7.833
  130    HD3  LYS  14           3HD      LYS  14  -4.187  -2.962   6.948
  131    HE2  LYS  14           2HE      LYS  14  -4.387  -4.816   8.448
  132    HE3  LYS  14           3HE      LYS  14  -3.082  -3.777   9.025
  133    HZ1  LYS  14           HZ1      LYS  14  -5.848  -3.814  10.130
  134    HZ2  LYS  14           HZ2      LYS  14  -4.547  -4.498  10.833
  135    HZ3  LYS  14           HZ3      LYS  14  -4.626  -2.878  10.689
  136    H    GLY  15           H        GLY  15  -6.306   0.947   4.533
  137    HA2  GLY  15           HA2      GLY  15  -6.800   2.991   3.586
  138    HA3  GLY  15           HA3      GLY  15  -7.157   3.641   5.190
  139    H    LYS  16           H        LYS  16  -4.038   2.193   4.542
  140    HA   LYS  16           HA       LYS  16  -2.669   4.748   5.152
  141    HB2  LYS  16           2HB      LYS  16  -2.314   2.572   6.394
  142    HB3  LYS  16           3HB      LYS  16  -1.535   1.930   4.943
  143    HG2  LYS  16           2HG      LYS  16   0.259   3.594   5.131
  144    HG3  LYS  16           3HG      LYS  16  -0.626   4.457   6.396
  145    HD2  LYS  16           2HD      LYS  16   1.175   3.196   7.387
  146    HD3  LYS  16           3HD      LYS  16  -0.369   2.508   7.908
  147    HE2  LYS  16           2HE      LYS  16  -0.136   0.693   6.232
  148    HE3  LYS  16           3HE      LYS  16   1.368   1.414   5.643
  149    HZ1  LYS  16           HZ1      LYS  16   0.955   0.357   8.392
  150    HZ2  LYS  16           HZ2      LYS  16   1.805  -0.388   7.215
  151    HZ3  LYS  16           HZ3      LYS  16   2.343   1.018   7.841
  152    H    CYS  17           H        CYS  17  -3.550   3.188   2.319
  153    HA   CYS  17           HA       CYS  17  -1.204   3.177   0.783
  154    HB2  CYS  17           2HB      CYS  17  -3.444   1.988   0.421
  155    HB3  CYS  17           3HB      CYS  17  -4.043   3.522  -0.201
  156    H    LYS  18           H        LYS  18  -0.029   4.763   0.030
  157    HA   LYS  18           HA       LYS  18  -1.181   7.200  -1.223
  158    HB2  LYS  18           2HB      LYS  18   0.923   7.249   1.010
  159    HB3  LYS  18           3HB      LYS  18   0.510   8.632  -0.002
  160    HG2  LYS  18           2HG      LYS  18  -1.836   8.548   0.853
  161    HG3  LYS  18           3HG      LYS  18  -1.354   7.245   1.962
  162    HD2  LYS  18           2HD      LYS  18   0.329   8.737   2.998
  163    HD3  LYS  18           3HD      LYS  18  -0.168  10.052   1.908
  164    HE2  LYS  18           2HE      LYS  18  -2.478   9.924   2.825
  165    HE3  LYS  18           3HE      LYS  18  -1.979   8.622   3.912
  166    HZ1  LYS  18           HZ1      LYS  18  -0.890  11.390   3.956
  167    HZ2  LYS  18           HZ2      LYS  18  -1.947  10.775   5.036
  168    HZ3  LYS  18           HZ3      LYS  18  -0.426  10.187   4.961
  169    H    GLY  19           H        GLY  19   0.421   8.473  -2.375
  170    HA2  GLY  19           HA2      GLY  19   2.012   8.700  -4.025
  171    HA3  GLY  19           HA3      GLY  19   3.057   8.023  -2.797
  172    HA   PRO  20           HA       PRO  20   3.735   5.112  -6.200
  173    HB2  PRO  20           2HB      PRO  20   5.520   3.399  -5.011
  174    HB3  PRO  20           3HB      PRO  20   5.950   5.035  -5.592
  175    HG2  PRO  20           2HG      PRO  20   5.227   4.197  -2.766
  176    HG3  PRO  20           3HG      PRO  20   6.620   5.190  -3.305
  177    HD2  PRO  20           2HD      PRO  20   4.345   6.321  -2.351
  178    HD3  PRO  20           3HD      PRO  20   5.241   7.070  -3.709
  179    H    LEU  21           H        LEU  21   2.844   3.964  -2.887
  180    HA   LEU  21           HA       LEU  21   1.994   1.360  -3.776
  181    HB2  LEU  21           2HB      LEU  21   2.428   2.501  -1.326
  182    HB3  LEU  21           3HB      LEU  21   0.686   2.628  -1.388
  183    HG   LEU  21           HG       LEU  21   1.264   0.643  -0.207
  184   HD11  LEU  21          1HD1      LEU  21   0.495  -0.371  -2.969
  185   HD12  LEU  21          2HD1      LEU  21   0.232  -1.168  -1.408
  186   HD13  LEU  21          3HD1      LEU  21  -0.641   0.323  -1.790
  187   HD21  LEU  21          3HD2      LEU  21   2.655  -1.154  -1.107
  188   HD22  LEU  21          1HD2      LEU  21   2.960  -0.224  -2.583
  189   HD23  LEU  21          2HD2      LEU  21   3.559   0.367  -1.018
  190    H    LYS  22           H        LYS  22   0.350   4.463  -3.483
  191    HA   LYS  22           HA       LYS  22  -2.330   3.549  -4.187
  192    HB2  LYS  22           2HB      LYS  22  -2.032   5.597  -2.968
  193    HB3  LYS  22           3HB      LYS  22  -1.031   6.301  -4.247
  194    HG2  LYS  22           2HG      LYS  22  -2.896   6.438  -5.764
  195    HG3  LYS  22           3HG      LYS  22  -3.923   5.466  -4.698
  196    HD2  LYS  22           2HD      LYS  22  -3.878   7.234  -2.990
  197    HD3  LYS  22           3HD      LYS  22  -2.786   8.211  -4.003
  198    HE2  LYS  22           2HE      LYS  22  -4.517   8.296  -5.782
  199    HE3  LYS  22           3HE      LYS  22  -5.596   7.312  -4.788
  200    HZ1  LYS  22           HZ1      LYS  22  -5.609   9.101  -3.135
  201    HZ2  LYS  22           HZ2      LYS  22  -4.611  10.018  -4.052
  202    HZ3  LYS  22           HZ3      LYS  22  -6.115   9.669  -4.578
  203    H    LEU  23           H        LEU  23   0.323   4.917  -6.105
  204    HA   LEU  23           HA       LEU  23  -0.949   4.736  -8.653
  205    HB2  LEU  23           2HB      LEU  23   1.067   6.004  -8.137
  206    HB3  LEU  23           3HB      LEU  23   2.001   4.538  -7.894
  207    HG   LEU  23           HG       LEU  23   0.647   5.051 -10.564
  208   HD11  LEU  23          1HD1      LEU  23   2.699   6.198 -11.323
  209   HD12  LEU  23          2HD1      LEU  23   1.898   7.103 -10.032
  210   HD13  LEU  23          3HD1      LEU  23   3.350   6.142  -9.667
  211   HD21  LEU  23          3HD2      LEU  23   3.241   3.629  -9.772
  212   HD22  LEU  23          1HD2      LEU  23   1.742   2.833 -10.290
  213   HD23  LEU  23          2HD2      LEU  23   2.638   3.824 -11.432
  214    H    VAL  24           H        VAL  24   0.967   2.274  -6.905
  215    HA   VAL  24           HA       VAL  24   0.829   0.232  -8.935
  216    HB   VAL  24           HB       VAL  24   1.411   0.194  -5.954
  217   HG11  VAL  24          1HG1      VAL  24   2.452  -2.021  -6.268
  218   HG12  VAL  24          2HG1      VAL  24   0.711  -2.086  -6.499
  219   HG13  VAL  24          3HG1      VAL  24   1.787  -2.103  -7.916
  220   HG21  VAL  24          3HG2      VAL  24   3.328  -0.201  -8.284
  221   HG22  VAL  24          1HG2      VAL  24   3.007   1.382  -7.567
  222   HG23  VAL  24          2HG2      VAL  24   3.703   0.115  -6.564
  223    H    CYS  25           H        CYS  25  -1.115   0.820  -6.029
  224    HA   CYS  25           HA       CYS  25  -2.653  -1.667  -6.429
  225    HB2  CYS  25           2HB      CYS  25  -1.323  -1.126  -4.418
  226    HB3  CYS  25           3HB      CYS  25  -2.348   0.261  -4.119
  227    H    LYS  26           H        LYS  26  -3.138   1.567  -7.100
  228    HA   LYS  26           HA       LYS  26  -4.881   2.895  -7.696
  229    HB2  LYS  26           2HB      LYS  26  -6.206   0.262  -8.404
  230    HB3  LYS  26           3HB      LYS  26  -6.689   1.847  -9.007
  231    HG2  LYS  26           2HG      LYS  26  -3.945   0.587  -9.386
  232    HG3  LYS  26           3HG      LYS  26  -5.235   0.517 -10.580
  233    HD2  LYS  26           2HD      LYS  26  -3.750   3.001  -9.618
  234    HD3  LYS  26           3HD      LYS  26  -3.560   2.212 -11.169
  235    HE2  LYS  26           2HE      LYS  26  -6.115   3.578 -10.201
  236    HE3  LYS  26           3HE      LYS  26  -4.908   4.308 -11.258
  237    HZ1  LYS  26           HZ1      LYS  26  -6.726   3.393 -12.553
  238    HZ2  LYS  26           HZ2      LYS  26  -5.366   2.565 -12.899
  239    HZ3  LYS  26           HZ3      LYS  26  -6.510   1.898 -11.939
  240    H    CYS  27           H        CYS  27  -4.628   2.789  -5.289
  241    HA   CYS  27           HA       CYS  27  -6.888   2.184  -3.606
  242    HB2  CYS  27           2HB      CYS  27  -4.558   4.072  -3.090
  243    HB3  CYS  27           3HB      CYS  27  -5.642   3.409  -1.896
  Start of MODEL   26
    1    H1   GLY   1           1H       GLY   1  10.378  -7.306   4.763
    2    H2   GLY   1           2H       GLY   1   9.716  -8.776   4.470
    3    H3   GLY   1           3H       GLY   1  10.323  -7.893   3.233
    4    HA2  GLY   1           HA2      GLY   1   7.980  -7.159   4.865
    5    HA3  GLY   1           HA3      GLY   1   8.643  -6.192   3.536
    6    H    LEU   2           H        LEU   2   6.021  -6.885   3.432
    7    HA   LEU   2           HA       LEU   2   5.539  -9.331   1.945
    8    HB2  LEU   2           2HB      LEU   2   3.854  -6.857   2.481
    9    HB3  LEU   2           3HB      LEU   2   3.252  -8.254   1.601
   10    HG   LEU   2           HG       LEU   2   4.244  -8.348   4.486
   11   HD11  LEU   2          1HD1      LEU   2   1.864  -8.521   5.073
   12   HD12  LEU   2          2HD1      LEU   2   2.198  -6.993   4.245
   13   HD13  LEU   2          3HD1      LEU   2   1.413  -8.324   3.366
   14   HD21  LEU   2          3HD2      LEU   2   3.060 -10.544   4.519
   15   HD22  LEU   2          1HD2      LEU   2   2.768 -10.401   2.772
   16   HD23  LEU   2          2HD2      LEU   2   4.425 -10.548   3.402
   17    HA   PRO   3           HA       PRO   3   6.302  -7.713  -2.174
   18    HB2  PRO   3           2HB      PRO   3   4.926  -9.469  -3.725
   19    HB3  PRO   3           3HB      PRO   3   6.380  -9.960  -2.800
   20    HG2  PRO   3           2HG      PRO   3   3.468 -10.295  -2.004
   21    HG3  PRO   3           3HG      PRO   3   4.763 -11.533  -1.987
   22    HD2  PRO   3           2HD      PRO   3   4.048 -10.102   0.239
   23    HD3  PRO   3           3HD      PRO   3   5.738 -10.619  -0.043
   24    H    ARG   4           H        ARG   4   5.230  -6.529  -3.818
   25    HA   ARG   4           HA       ARG   4   3.226  -4.774  -2.940
   26    HB2  ARG   4           2HB      ARG   4   4.111  -5.439  -5.779
   27    HB3  ARG   4           3HB      ARG   4   3.059  -4.083  -5.360
   28    HG2  ARG   4           2HG      ARG   4   4.804  -3.153  -3.870
   29    HG3  ARG   4           3HG      ARG   4   5.906  -4.460  -4.318
   30    HD2  ARG   4           2HD      ARG   4   4.710  -2.420  -6.239
   31    HD3  ARG   4           3HD      ARG   4   6.334  -2.338  -5.537
   32    HE   ARG   4           HE       ARG   4   6.163  -4.848  -6.788
   33   HH11  ARG   4          1HH2      ARG   4   6.115  -1.507  -7.843
   34   HH12  ARG   4          2HH2      ARG   4   6.731  -1.903  -9.424
   35   HH21  ARG   4          1HH1      ARG   4   6.944  -5.281  -8.825
   36   HH22  ARG   4          2HH1      ARG   4   7.192  -3.983  -9.954
   37    H    LYS   5           H        LYS   5   2.715  -7.735  -4.798
   38    HA   LYS   5           HA       LYS   5  -0.059  -7.285  -5.406
   39    HB2  LYS   5           2HB      LYS   5  -0.115  -9.590  -6.089
   40    HB3  LYS   5           3HB      LYS   5   1.381  -8.843  -6.643
   41    HG2  LYS   5           2HG      LYS   5   2.587  -9.923  -4.702
   42    HG3  LYS   5           3HG      LYS   5   1.067 -10.726  -4.262
   43    HD2  LYS   5           2HD      LYS   5   1.009 -11.842  -6.472
   44    HD3  LYS   5           3HD      LYS   5   2.537 -11.048  -6.912
   45    HE2  LYS   5           2HE      LYS   5   3.662 -12.154  -4.991
   46    HE3  LYS   5           3HE      LYS   5   2.141 -12.938  -4.546
   47    HZ1  LYS   5           HZ1      LYS   5   3.546 -14.420  -5.861
   48    HZ2  LYS   5           HZ2      LYS   5   2.184 -14.093  -6.694
   49    HZ3  LYS   5           HZ3      LYS   5   3.589 -13.368  -7.107
   50    H    ILE   6           H        ILE   6   1.421  -8.291  -2.446
   51    HA   ILE   6           HA       ILE   6  -1.235  -8.991  -1.245
   52    HB   ILE   6           HB       ILE   6   1.573  -9.328  -0.125
   53   HG12  ILE   6          2HG1      ILE   6  -0.433 -11.399  -1.146
   54   HG13  ILE   6          3HG1      ILE   6   1.039 -10.903  -1.978
   55   HG21  ILE   6          1HG2      ILE   6  -1.135 -10.179   1.008
   56   HG22  ILE   6          2HG2      ILE   6   0.451 -10.517   1.738
   57   HG23  ILE   6          3HG2      ILE   6  -0.127  -8.864   1.640
   58   HD11  ILE   6          3HD1      ILE   6   2.392 -11.749  -0.046
   59   HD12  ILE   6          1HD1      ILE   6   0.896 -12.441   0.629
   60   HD13  ILE   6          2HD1      ILE   6   1.496 -12.987  -0.944
   61    H    LEU   7           H        LEU   7   1.604  -6.830  -0.803
   62    HA   LEU   7           HA       LEU   7   0.596  -5.424   1.407
   63    HB2  LEU   7           2HB      LEU   7   2.952  -5.530   0.565
   64    HB3  LEU   7           3HB      LEU   7   2.502  -4.460  -0.758
   65    HG   LEU   7           HG       LEU   7   2.004  -2.648   0.855
   66   HD11  LEU   7          1HD1      LEU   7   1.339  -3.898   2.854
   67   HD12  LEU   7          2HD1      LEU   7   2.956  -4.631   2.972
   68   HD13  LEU   7          3HD1      LEU   7   2.731  -2.888   3.227
   69   HD21  LEU   7          3HD2      LEU   7   4.731  -3.938   1.295
   70   HD22  LEU   7          1HD2      LEU   7   4.284  -2.925  -0.092
   71   HD23  LEU   7          2HD2      LEU   7   4.322  -2.223   1.534
   72    H    CYS   8           H        CYS   8  -0.151  -4.938  -2.007
   73    HA   CYS   8           HA       CYS   8  -1.509  -2.417  -1.823
   74    HB2  CYS   8           2HB      CYS   8  -0.864  -3.341  -3.920
   75    HB3  CYS   8           3HB      CYS   8  -1.733  -4.837  -3.634
   76    H    ALA   9           H        ALA   9  -2.640  -5.752  -1.073
   77    HA   ALA   9           HA       ALA   9  -5.417  -4.922  -0.683
   78    HB1  ALA   9           3HB      ALA   9  -5.709  -7.182   0.201
   79    HB2  ALA   9           1HB      ALA   9  -4.801  -7.236  -1.322
   80    HB3  ALA   9           2HB      ALA   9  -3.955  -7.441   0.230
   81    H    ILE  10           H        ILE  10  -2.596  -5.547   1.424
   82    HA   ILE  10           HA       ILE  10  -3.796  -4.954   3.939
   83    HB   ILE  10           HB       ILE  10  -0.946  -4.462   3.004
   84   HG12  ILE  10          2HG1      ILE  10  -1.561  -6.807   2.682
   85   HG13  ILE  10          3HG1      ILE  10  -0.359  -6.608   3.924
   86   HG21  ILE  10          1HG2      ILE  10  -1.323  -3.216   5.055
   87   HG22  ILE  10          2HG2      ILE  10  -2.056  -4.632   5.829
   88   HG23  ILE  10          3HG2      ILE  10  -0.331  -4.634   5.408
   89   HD11  ILE  10          3HD1      ILE  10  -2.098  -6.966   5.677
   90   HD12  ILE  10          1HD1      ILE  10  -3.330  -7.137   4.400
   91   HD13  ILE  10          2HD1      ILE  10  -2.014  -8.314   4.534
   92    H    ALA  11           H        ALA  11  -2.109  -2.724   1.665
   93    HA   ALA  11           HA       ALA  11  -2.248  -0.381   3.148
   94    HB1  ALA  11           3HB      ALA  11  -1.017  -0.772   0.997
   95    HB2  ALA  11           1HB      ALA  11  -2.565  -0.666   0.115
   96    HB3  ALA  11           2HB      ALA  11  -1.927   0.732   1.002
   97    H    LYS  12           H        LYS  12  -4.704  -1.573   0.841
   98    HA   LYS  12           HA       LYS  12  -6.624   0.529   1.380
   99    HB2  LYS  12           2HB      LYS  12  -6.891  -2.171   0.007
  100    HB3  LYS  12           3HB      LYS  12  -8.131  -0.904  -0.002
  101    HG2  LYS  12           2HG      LYS  12  -6.547   0.676  -1.063
  102    HG3  LYS  12           3HG      LYS  12  -5.296  -0.564  -1.100
  103    HD2  LYS  12           2HD      LYS  12  -7.937  -0.640  -2.599
  104    HD3  LYS  12           3HD      LYS  12  -6.328  -0.308  -3.266
  105    HE2  LYS  12           2HE      LYS  12  -5.594  -2.596  -2.530
  106    HE3  LYS  12           3HE      LYS  12  -7.247  -2.933  -2.006
  107    HZ1  LYS  12           HZ1      LYS  12  -6.832  -3.771  -4.252
  108    HZ2  LYS  12           HZ2      LYS  12  -7.981  -2.615  -4.301
  109    HZ3  LYS  12           HZ3      LYS  12  -6.455  -2.277  -4.794
  110    H    LYS  13           H        LYS  13  -6.311  -2.794   2.677
  111    HA   LYS  13           HA       LYS  13  -8.796  -2.734   4.169
  112    HB2  LYS  13           2HB      LYS  13  -6.288  -4.442   4.361
  113    HB3  LYS  13           3HB      LYS  13  -7.678  -4.663   5.429
  114    HG2  LYS  13           2HG      LYS  13  -9.159  -5.148   3.570
  115    HG3  LYS  13           3HG      LYS  13  -7.926  -4.724   2.393
  116    HD2  LYS  13           2HD      LYS  13  -8.074  -7.133   2.508
  117    HD3  LYS  13           3HD      LYS  13  -6.515  -6.607   3.128
  118    HE2  LYS  13           2HE      LYS  13  -7.296  -8.371   4.539
  119    HE3  LYS  13           3HE      LYS  13  -7.364  -6.876   5.470
  120    HZ1  LYS  13           HZ1      LYS  13  -9.383  -8.216   5.736
  121    HZ2  LYS  13           HZ2      LYS  13  -9.772  -6.802   5.025
  122    HZ3  LYS  13           HZ3      LYS  13  -9.690  -8.172   4.136
  123    H    LYS  14           H        LYS  14  -5.483  -1.832   5.092
  124    HA   LYS  14           HA       LYS  14  -6.304  -1.021   7.821
  125    HB2  LYS  14           2HB      LYS  14  -3.691  -1.035   6.280
  126    HB3  LYS  14           3HB      LYS  14  -3.854  -0.086   7.742
  127    HG2  LYS  14           2HG      LYS  14  -2.848  -2.238   8.217
  128    HG3  LYS  14           3HG      LYS  14  -4.361  -1.999   9.093
  129    HD2  LYS  14           2HD      LYS  14  -5.535  -3.552   7.608
  130    HD3  LYS  14           3HD      LYS  14  -4.130  -3.643   6.541
  131    HE2  LYS  14           2HE      LYS  14  -4.173  -5.641   7.859
  132    HE3  LYS  14           3HE      LYS  14  -2.800  -4.664   8.383
  133    HZ1  LYS  14           HZ1      LYS  14  -4.130  -3.941  10.297
  134    HZ2  LYS  14           HZ2      LYS  14  -5.418  -4.816   9.793
  135    HZ3  LYS  14           HZ3      LYS  14  -4.052  -5.567  10.267
  136    H    GLY  15           H        GLY  15  -6.437   0.462   4.758
  137    HA2  GLY  15           HA2      GLY  15  -7.302   2.514   4.178
  138    HA3  GLY  15           HA3      GLY  15  -7.476   2.929   5.887
  139    H    LYS  16           H        LYS  16  -4.342   1.958   4.588
  140    HA   LYS  16           HA       LYS  16  -3.384   4.794   4.523
  141    HB2  LYS  16           2HB      LYS  16  -2.848   3.738   6.733
  142    HB3  LYS  16           3HB      LYS  16  -1.911   2.503   5.879
  143    HG2  LYS  16           2HG      LYS  16  -0.507   4.373   4.882
  144    HG3  LYS  16           3HG      LYS  16  -1.416   5.517   5.885
  145    HD2  LYS  16           2HD      LYS  16  -0.610   4.308   7.935
  146    HD3  LYS  16           3HD      LYS  16   0.254   3.170   6.891
  147    HE2  LYS  16           2HE      LYS  16   1.926   4.681   7.521
  148    HE3  LYS  16           3HE      LYS  16   1.472   5.180   5.886
  149    HZ1  LYS  16           HZ1      LYS  16   1.649   7.080   7.400
  150    HZ2  LYS  16           HZ2      LYS  16   0.103   6.944   6.899
  151    HZ3  LYS  16           HZ3      LYS  16   0.525   6.461   8.402
  152    H    CYS  17           H        CYS  17  -3.118   5.002   2.403
  153    HA   CYS  17           HA       CYS  17  -1.061   3.387   1.025
  154    HB2  CYS  17           2HB      CYS  17  -3.332   2.331   0.628
  155    HB3  CYS  17           3HB      CYS  17  -3.841   3.840  -0.104
  156    H    LYS  18           H        LYS  18   0.318   4.878   0.301
  157    HA   LYS  18           HA       LYS  18  -0.569   7.382  -1.036
  158    HB2  LYS  18           2HB      LYS  18   1.230   7.298   1.438
  159    HB3  LYS  18           3HB      LYS  18   1.081   8.691   0.365
  160    HG2  LYS  18           2HG      LYS  18  -1.393   8.743   0.841
  161    HG3  LYS  18           3HG      LYS  18  -1.128   7.494   2.077
  162    HD2  LYS  18           2HD      LYS  18   0.438   8.994   3.270
  163    HD3  LYS  18           3HD      LYS  18   0.202  10.239   2.022
  164    HE2  LYS  18           2HE      LYS  18  -2.240  10.277   2.550
  165    HE3  LYS  18           3HE      LYS  18  -1.972   9.089   3.832
  166    HZ1  LYS  18           HZ1      LYS  18  -0.517  10.721   4.933
  167    HZ2  LYS  18           HZ2      LYS  18  -0.779  11.813   3.747
  168    HZ3  LYS  18           HZ3      LYS  18  -2.006  11.351   4.716
  169    H    GLY  19           H        GLY  19   1.276   8.556  -2.000
  170    HA2  GLY  19           HA2      GLY  19   3.108   8.651  -3.412
  171    HA3  GLY  19           HA3      GLY  19   3.886   7.705  -2.149
  172    HA   PRO  20           HA       PRO  20   4.419   4.986  -5.784
  173    HB2  PRO  20           2HB      PRO  20   5.803   3.368  -3.637
  174    HB3  PRO  20           3HB      PRO  20   6.309   3.667  -5.330
  175    HG2  PRO  20           2HG      PRO  20   7.452   5.069  -3.324
  176    HG3  PRO  20           3HG      PRO  20   6.936   5.927  -4.816
  177    HD2  PRO  20           2HD      PRO  20   5.474   5.722  -2.164
  178    HD3  PRO  20           3HD      PRO  20   5.766   7.162  -3.186
  179    H    LEU  21           H        LEU  21   3.306   3.850  -2.533
  180    HA   LEU  21           HA       LEU  21   2.252   1.363  -3.491
  181    HB2  LEU  21           2HB      LEU  21   2.650   2.476  -1.006
  182    HB3  LEU  21           3HB      LEU  21   0.920   2.680  -1.148
  183    HG   LEU  21           HG       LEU  21   1.344   0.657   0.027
  184   HD11  LEU  21          1HD1      LEU  21   0.673  -0.278  -2.791
  185   HD12  LEU  21          2HD1      LEU  21   0.301  -1.086  -1.258
  186   HD13  LEU  21          3HD1      LEU  21  -0.488   0.447  -1.655
  187   HD21  LEU  21          3HD2      LEU  21   2.707  -1.181  -0.831
  188   HD22  LEU  21          1HD2      LEU  21   3.128  -0.245  -2.272
  189   HD23  LEU  21          2HD2      LEU  21   3.666   0.298  -0.667
  190    H    LYS  22           H        LYS  22   0.796   4.547  -3.151
  191    HA   LYS  22           HA       LYS  22  -1.887   3.847  -4.061
  192    HB2  LYS  22           2HB      LYS  22  -1.650   5.771  -2.714
  193    HB3  LYS  22           3HB      LYS  22  -0.379   6.462  -3.731
  194    HG2  LYS  22           2HG      LYS  22  -1.882   7.032  -5.465
  195    HG3  LYS  22           3HG      LYS  22  -3.177   6.011  -4.806
  196    HD2  LYS  22           2HD      LYS  22  -3.559   7.480  -2.970
  197    HD3  LYS  22           3HD      LYS  22  -2.055   8.366  -3.249
  198    HE2  LYS  22           2HE      LYS  22  -4.067   9.639  -3.923
  199    HE3  LYS  22           3HE      LYS  22  -2.907   9.418  -5.235
  200    HZ1  LYS  22           HZ1      LYS  22  -5.259   7.632  -4.900
  201    HZ2  LYS  22           HZ2      LYS  22  -5.315   9.000  -5.814
  202    HZ3  LYS  22           HZ3      LYS  22  -4.308   7.778  -6.211
  203    H    LEU  23           H        LEU  23   1.027   4.984  -5.741
  204    HA   LEU  23           HA       LEU  23  -0.185   5.181  -8.339
  205    HB2  LEU  23           2HB      LEU  23   1.949   6.247  -7.684
  206    HB3  LEU  23           3HB      LEU  23   2.702   4.663  -7.526
  207    HG   LEU  23           HG       LEU  23   2.411   4.260  -9.956
  208   HD11  LEU  23          1HD1      LEU  23   0.448   5.657 -10.452
  209   HD12  LEU  23          2HD1      LEU  23   1.351   7.124 -10.004
  210   HD13  LEU  23          3HD1      LEU  23   1.819   6.176 -11.434
  211   HD21  LEU  23          3HD2      LEU  23   3.784   6.893  -9.281
  212   HD22  LEU  23          1HD2      LEU  23   4.481   5.270  -9.080
  213   HD23  LEU  23          2HD2      LEU  23   4.105   5.873 -10.701
  214    H    VAL  24           H        VAL  24   1.404   2.458  -6.675
  215    HA   VAL  24           HA       VAL  24   1.188   0.541  -8.837
  216    HB   VAL  24           HB       VAL  24   1.573   0.260  -5.832
  217   HG11  VAL  24          1HG1      VAL  24   2.413  -2.019  -6.267
  218   HG12  VAL  24          2HG1      VAL  24   0.694  -1.887  -6.617
  219   HG13  VAL  24          3HG1      VAL  24   1.866  -1.902  -7.956
  220   HG21  VAL  24          3HG2      VAL  24   3.887  -0.041  -6.304
  221   HG22  VAL  24          1HG2      VAL  24   3.599  -0.128  -8.067
  222   HG23  VAL  24          2HG2      VAL  24   3.398   1.395  -7.195
  223    H    CYS  25           H        CYS  25  -0.792   1.200  -5.970
  224    HA   CYS  25           HA       CYS  25  -2.636  -1.007  -6.585
  225    HB2  CYS  25           2HB      CYS  25  -1.325  -0.630  -4.473
  226    HB3  CYS  25           3HB      CYS  25  -2.318   0.776  -4.162
  227    H    LYS  26           H        LYS  26  -2.636   2.164  -7.352
  228    HA   LYS  26           HA       LYS  26  -4.031   3.823  -7.856
  229    HB2  LYS  26           2HB      LYS  26  -5.940   3.325  -9.282
  230    HB3  LYS  26           3HB      LYS  26  -4.465   2.481  -9.698
  231    HG2  LYS  26           2HG      LYS  26  -6.240   0.978 -10.059
  232    HG3  LYS  26           3HG      LYS  26  -5.353   0.397  -8.662
  233    HD2  LYS  26           2HD      LYS  26  -7.162   1.434  -7.190
  234    HD3  LYS  26           3HD      LYS  26  -8.035   1.857  -8.682
  235    HE2  LYS  26           2HE      LYS  26  -7.891  -0.630  -9.276
  236    HE3  LYS  26           3HE      LYS  26  -7.229  -0.888  -7.650
  237    HZ1  LYS  26           HZ1      LYS  26  -9.911   0.260  -8.257
  238    HZ2  LYS  26           HZ2      LYS  26  -9.645  -1.248  -7.704
  239    HZ3  LYS  26           HZ3      LYS  26  -9.317   0.041  -6.752
  240    H    CYS  27           H        CYS  27  -4.165   3.032  -5.179
  241    HA   CYS  27           HA       CYS  27  -6.539   2.955  -3.837
  242    HB2  CYS  27           2HB      CYS  27  -4.022   4.484  -3.064
  243    HB3  CYS  27           3HB      CYS  27  -5.315   4.085  -1.966
  Start of MODEL   27
    1    H1   GLY   1           1H       GLY   1   8.098  -5.211   1.558
    2    H2   GLY   1           2H       GLY   1   7.476  -3.871   2.266
    3    H3   GLY   1           3H       GLY   1   8.606  -4.760   3.054
    4    HA2  GLY   1           HA2      GLY   1   6.391  -5.194   3.977
    5    HA3  GLY   1           HA3      GLY   1   5.911  -5.753   2.363
    6    H    LEU   2           H        LEU   2   6.922  -8.918   3.238
    7    HA   LEU   2           HA       LEU   2   5.524  -9.312   1.614
    8    HB2  LEU   2           2HB      LEU   2   4.189  -6.730   2.462
    9    HB3  LEU   2           3HB      LEU   2   3.473  -7.937   1.413
   10    HG   LEU   2           HG       LEU   2   4.277  -8.403   4.317
   11   HD11  LEU   2          1HD1      LEU   2   1.843  -8.408   4.719
   12   HD12  LEU   2          2HD1      LEU   2   2.383  -6.851   4.076
   13   HD13  LEU   2          3HD1      LEU   2   1.550  -8.006   3.013
   14   HD21  LEU   2          3HD2      LEU   2   2.899 -10.475   4.075
   15   HD22  LEU   2          1HD2      LEU   2   2.780 -10.168   2.329
   16   HD23  LEU   2          2HD2      LEU   2   4.355 -10.514   3.079
   17    HA   PRO   3           HA       PRO   3   6.497  -7.138  -2.235
   18    HB2  PRO   3           2HB      PRO   3   5.010  -8.564  -3.993
   19    HB3  PRO   3           3HB      PRO   3   6.460  -9.269  -3.213
   20    HG2  PRO   3           2HG      PRO   3   3.558  -9.598  -2.387
   21    HG3  PRO   3           3HG      PRO   3   4.789 -10.879  -2.618
   22    HD2  PRO   3           2HD      PRO   3   4.194  -9.802  -0.163
   23    HD3  PRO   3           3HD      PRO   3   5.839 -10.367  -0.581
   24    H    ARG   4           H        ARG   4   5.336  -5.673  -3.640
   25    HA   ARG   4           HA       ARG   4   3.432  -4.068  -2.335
   26    HB2  ARG   4           2HB      ARG   4   4.070  -4.233  -5.310
   27    HB3  ARG   4           3HB      ARG   4   3.120  -2.946  -4.548
   28    HG2  ARG   4           2HG      ARG   4   4.988  -2.337  -3.105
   29    HG3  ARG   4           3HG      ARG   4   5.999  -3.612  -3.802
   30    HD2  ARG   4           2HD      ARG   4   4.951  -1.139  -5.206
   31    HD3  ARG   4           3HD      ARG   4   6.603  -1.432  -4.659
   32    HE   ARG   4           HE       ARG   4   5.796  -3.532  -6.449
   33   HH11  ARG   4          1HH1      ARG   4   6.892  -0.204  -6.544
   34   HH12  ARG   4          2HH1      ARG   4   7.470  -0.350  -8.180
   35   HH21  ARG   4          1HH2      ARG   4   6.550  -3.642  -8.536
   36   HH22  ARG   4          2HH2      ARG   4   7.285  -2.247  -9.266
   37    H    LYS   5           H        LYS   5   2.737  -6.674  -4.647
   38    HA   LYS   5           HA       LYS   5  -0.018  -6.293  -5.077
   39    HB2  LYS   5           2HB      LYS   5   1.516  -7.752  -6.324
   40    HB3  LYS   5           3HB      LYS   5   1.759  -8.772  -4.898
   41    HG2  LYS   5           2HG      LYS   5  -0.594  -9.466  -4.959
   42    HG3  LYS   5           3HG      LYS   5  -0.895  -8.387  -6.342
   43    HD2  LYS   5           2HD      LYS   5   0.684  -9.663  -7.727
   44    HD3  LYS   5           3HD      LYS   5   1.134 -10.681  -6.330
   45    HE2  LYS   5           2HE      LYS   5  -1.184 -11.415  -6.094
   46    HE3  LYS   5           3HE      LYS   5  -1.670 -10.390  -7.454
   47    HZ1  LYS   5           HZ1      LYS   5  -0.239 -11.750  -8.900
   48    HZ2  LYS   5           HZ2      LYS   5   0.207 -12.697  -7.644
   49    HZ3  LYS   5           HZ3      LYS   5  -1.338 -12.705  -8.165
   50    H    ILE   6           H        ILE   6   1.635  -7.871  -2.350
   51    HA   ILE   6           HA       ILE   6  -0.968  -8.696  -1.152
   52    HB   ILE   6           HB       ILE   6   1.872  -9.388  -0.331
   53   HG12  ILE   6          2HG1      ILE   6  -0.241 -11.039  -1.809
   54   HG13  ILE   6          3HG1      ILE   6   1.202 -10.350  -2.547
   55   HG21  ILE   6          1HG2      ILE   6   0.271  -9.436   1.571
   56   HG22  ILE   6          2HG2      ILE   6  -0.823 -10.464   0.630
   57   HG23  ILE   6          3HG2      ILE   6   0.769 -11.063   1.145
   58   HD11  ILE   6          3HD1      ILE   6   1.645 -12.648  -2.182
   59   HD12  ILE   6          1HD1      ILE   6   2.619 -11.745  -1.005
   60   HD13  ILE   6          2HD1      ILE   6   1.130 -12.578  -0.492
   61    H    LEU   7           H        LEU   7   1.871  -6.634  -0.449
   62    HA   LEU   7           HA       LEU   7   1.086  -5.585   2.053
   63    HB2  LEU   7           2HB      LEU   7   3.274  -5.230   0.884
   64    HB3  LEU   7           3HB      LEU   7   2.456  -4.231  -0.312
   65    HG   LEU   7           HG       LEU   7   1.893  -2.563   1.439
   66   HD11  LEU   7          1HD1      LEU   7   3.544  -4.362   3.270
   67   HD12  LEU   7          2HD1      LEU   7   3.027  -2.704   3.648
   68   HD13  LEU   7          3HD1      LEU   7   1.816  -3.971   3.449
   69   HD21  LEU   7          3HD2      LEU   7   4.183  -1.730   1.759
   70   HD22  LEU   7          1HD2      LEU   7   4.838  -3.322   1.309
   71   HD23  LEU   7          2HD2      LEU   7   3.952  -2.347   0.116
   72    H    CYS   8           H        CYS   8  -0.072  -4.795  -1.213
   73    HA   CYS   8           HA       CYS   8  -1.566  -2.457  -0.609
   74    HB2  CYS   8           2HB      CYS   8  -1.021  -3.197  -2.861
   75    HB3  CYS   8           3HB      CYS   8  -2.064  -4.614  -2.682
   76    H    ALA   9           H        ALA   9  -2.416  -5.876  -0.019
   77    HA   ALA   9           HA       ALA   9  -5.257  -5.327   0.387
   78    HB1  ALA   9           3HB      ALA   9  -4.407  -7.520  -0.377
   79    HB2  ALA   9           1HB      ALA   9  -3.560  -7.725   1.179
   80    HB3  ALA   9           2HB      ALA   9  -5.335  -7.641   1.137
   81    H    ILE  10           H        ILE  10  -2.383  -5.289   2.393
   82    HA   ILE  10           HA       ILE  10  -3.824  -4.844   4.918
   83    HB   ILE  10           HB       ILE  10  -0.951  -4.101   4.221
   84   HG12  ILE  10          2HG1      ILE  10  -1.146  -6.454   3.672
   85   HG13  ILE  10          3HG1      ILE  10  -0.168  -6.209   5.084
   86   HG21  ILE  10          1HG2      ILE  10  -2.345  -4.615   6.875
   87   HG22  ILE  10          2HG2      ILE  10  -0.603  -4.326   6.664
   88   HG23  ILE  10          3HG2      ILE  10  -1.764  -3.057   6.251
   89   HD11  ILE  10          3HD1      ILE  10  -2.045  -6.950   6.545
   90   HD12  ILE  10          1HD1      ILE  10  -3.072  -7.157   5.102
   91   HD13  ILE  10          2HD1      ILE  10  -1.634  -8.168   5.324
   92    H    ALA  11           H        ALA  11  -2.075  -2.865   2.503
   93    HA   ALA  11           HA       ALA  11  -2.314  -0.418   3.777
   94    HB1  ALA  11           3HB      ALA  11  -0.827  -1.071   1.855
   95    HB2  ALA  11           1HB      ALA  11  -2.223  -0.865   0.763
   96    HB3  ALA  11           2HB      ALA  11  -1.581   0.508   1.687
   97    H    LYS  12           H        LYS  12  -4.576  -1.624   1.182
   98    HA   LYS  12           HA       LYS  12  -6.291   0.707   1.549
   99    HB2  LYS  12           2HB      LYS  12  -7.666  -0.215  -0.153
  100    HB3  LYS  12           3HB      LYS  12  -5.972  -0.385  -0.590
  101    HG2  LYS  12           2HG      LYS  12  -6.241  -2.831   0.391
  102    HG3  LYS  12           3HG      LYS  12  -7.963  -2.534   0.223
  103    HD2  LYS  12           2HD      LYS  12  -7.795  -2.225  -2.145
  104    HD3  LYS  12           3HD      LYS  12  -6.030  -2.041  -2.082
  105    HE2  LYS  12           2HE      LYS  12  -5.695  -4.340  -1.492
  106    HE3  LYS  12           3HE      LYS  12  -7.440  -4.618  -1.309
  107    HZ1  LYS  12           HZ1      LYS  12  -7.697  -4.200  -3.691
  108    HZ2  LYS  12           HZ2      LYS  12  -6.097  -3.924  -3.873
  109    HZ3  LYS  12           HZ3      LYS  12  -6.634  -5.413  -3.465
  110    H    LYS  13           H        LYS  13  -6.206  -2.399   3.123
  111    HA   LYS  13           HA       LYS  13  -8.824  -2.147   4.396
  112    HB2  LYS  13           2HB      LYS  13  -7.675  -4.276   4.089
  113    HB3  LYS  13           3HB      LYS  13  -6.349  -3.752   5.139
  114    HG2  LYS  13           2HG      LYS  13  -7.803  -3.743   7.079
  115    HG3  LYS  13           3HG      LYS  13  -9.240  -3.952   6.068
  116    HD2  LYS  13           2HD      LYS  13  -8.640  -6.049   7.169
  117    HD3  LYS  13           3HD      LYS  13  -8.519  -6.194   5.411
  118    HE2  LYS  13           2HE      LYS  13  -6.064  -5.938   5.535
  119    HE3  LYS  13           3HE      LYS  13  -6.162  -5.726   7.291
  120    HZ1  LYS  13           HZ1      LYS  13  -5.610  -8.022   6.709
  121    HZ2  LYS  13           HZ2      LYS  13  -7.068  -7.990   7.439
  122    HZ3  LYS  13           HZ3      LYS  13  -6.969  -8.182   5.821
  123    H    LYS  14           H        LYS  14  -5.543  -1.099   5.295
  124    HA   LYS  14           HA       LYS  14  -6.468   0.161   7.813
  125    HB2  LYS  14           2HB      LYS  14  -3.801  -0.345   6.478
  126    HB3  LYS  14           3HB      LYS  14  -3.918   0.944   7.657
  127    HG2  LYS  14           2HG      LYS  14  -3.148  -1.060   8.729
  128    HG3  LYS  14           3HG      LYS  14  -4.703  -0.548   9.384
  129    HD2  LYS  14           2HD      LYS  14  -5.854  -2.348   8.142
  130    HD3  LYS  14           3HD      LYS  14  -4.337  -2.778   7.341
  131    HE2  LYS  14           2HE      LYS  14  -4.701  -4.371   9.090
  132    HE3  LYS  14           3HE      LYS  14  -3.334  -3.353   9.544
  133    HZ1  LYS  14           HZ1      LYS  14  -6.113  -3.025  10.567
  134    HZ2  LYS  14           HZ2      LYS  14  -4.881  -3.695  11.397
  135    HZ3  LYS  14           HZ3      LYS  14  -4.832  -2.113  11.018
  136    H    GLY  15           H        GLY  15  -6.222   1.240   4.567
  137    HA2  GLY  15           HA2      GLY  15  -6.755   3.344   3.678
  138    HA3  GLY  15           HA3      GLY  15  -6.776   4.053   5.294
  139    H    LYS  16           H        LYS  16  -4.027   2.119   4.378
  140    HA   LYS  16           HA       LYS  16  -2.252   4.506   4.414
  141    HB2  LYS  16           2HB      LYS  16  -2.189   2.573   6.127
  142    HB3  LYS  16           3HB      LYS  16  -1.449   1.616   4.841
  143    HG2  LYS  16           2HG      LYS  16   0.444   3.234   4.746
  144    HG3  LYS  16           3HG      LYS  16  -0.390   4.284   5.898
  145    HD2  LYS  16           2HD      LYS  16   1.353   3.059   7.030
  146    HD3  LYS  16           3HD      LYS  16  -0.219   2.512   7.630
  147    HE2  LYS  16           2HE      LYS  16  -0.094   0.511   6.172
  148    HE3  LYS  16           3HE      LYS  16   1.436   1.085   5.494
  149    HZ1  LYS  16           HZ1      LYS  16   2.420   0.890   7.717
  150    HZ2  LYS  16           HZ2      LYS  16   1.009   0.364   8.348
  151    HZ3  LYS  16           HZ3      LYS  16   1.808  -0.549   7.256
  152    H    CYS  17           H        CYS  17  -3.655   2.857   1.959
  153    HA   CYS  17           HA       CYS  17  -1.326   2.316   0.285
  154    HB2  CYS  17           2HB      CYS  17  -3.617   1.235   0.096
  155    HB3  CYS  17           3HB      CYS  17  -4.156   2.743  -0.661
  156    H    LYS  18           H        LYS  18  -0.041   3.969  -0.017
  157    HA   LYS  18           HA       LYS  18  -0.987   6.600  -1.085
  158    HB2  LYS  18           2HB      LYS  18   0.558   6.162   1.519
  159    HB3  LYS  18           3HB      LYS  18   0.391   7.727   0.719
  160    HG2  LYS  18           2HG      LYS  18  -2.078   7.599   0.954
  161    HG3  LYS  18           3HG      LYS  18  -1.911   6.063   1.821
  162    HD2  LYS  18           2HD      LYS  18  -0.569   7.174   3.574
  163    HD3  LYS  18           3HD      LYS  18  -0.753   8.727   2.724
  164    HE2  LYS  18           2HE      LYS  18  -3.226   8.540   2.941
  165    HE3  LYS  18           3HE      LYS  18  -3.041   7.002   3.789
  166    HZ1  LYS  18           HZ1      LYS  18  -1.837   8.198   5.548
  167    HZ2  LYS  18           HZ2      LYS  18  -2.020   9.620   4.761
  168    HZ3  LYS  18           HZ3      LYS  18  -3.324   8.837   5.347
  169    H    GLY  19           H        GLY  19   0.785   8.023  -1.717
  170    HA2  GLY  19           HA2      GLY  19   2.661   8.429  -3.020
  171    HA3  GLY  19           HA3      GLY  19   3.478   7.330  -1.910
  172    HA   PRO  20           HA       PRO  20   4.035   5.195  -5.920
  173    HB2  PRO  20           2HB      PRO  20   5.585   3.374  -4.072
  174    HB3  PRO  20           3HB      PRO  20   6.013   3.946  -5.715
  175    HG2  PRO  20           2HG      PRO  20   7.149   5.103  -3.552
  176    HG3  PRO  20           3HG      PRO  20   6.539   6.138  -4.887
  177    HD2  PRO  20           2HD      PRO  20   5.177   5.462  -2.261
  178    HD3  PRO  20           3HD      PRO  20   5.361   7.052  -3.060
  179    H    LEU  21           H        LEU  21   3.106   3.543  -2.830
  180    HA   LEU  21           HA       LEU  21   2.282   1.122  -4.089
  181    HB2  LEU  21           2HB      LEU  21   2.808   1.404  -1.667
  182    HB3  LEU  21           3HB      LEU  21   1.315   2.329  -1.474
  183    HG   LEU  21           HG       LEU  21  -0.029   0.346  -2.079
  184   HD11  LEU  21          1HD1      LEU  21   1.056  -1.887  -2.180
  185   HD12  LEU  21          2HD1      LEU  21   1.463  -0.878  -3.570
  186   HD13  LEU  21          3HD1      LEU  21   2.646  -1.091  -2.252
  187   HD21  LEU  21          3HD2      LEU  21   0.575   0.736   0.268
  188   HD22  LEU  21          1HD2      LEU  21   0.459  -0.997  -0.100
  189   HD23  LEU  21          2HD2      LEU  21   2.054  -0.227   0.056
  190    H    LYS  22           H        LYS  22   0.497   4.086  -3.439
  191    HA   LYS  22           HA       LYS  22  -2.147   3.192  -4.196
  192    HB2  LYS  22           2HB      LYS  22  -1.494   5.303  -2.916
  193    HB3  LYS  22           3HB      LYS  22  -0.987   5.994  -4.460
  194    HG2  LYS  22           2HG      LYS  22  -3.462   5.402  -5.212
  195    HG3  LYS  22           3HG      LYS  22  -3.756   5.276  -3.462
  196    HD2  LYS  22           2HD      LYS  22  -2.714   7.583  -3.241
  197    HD3  LYS  22           3HD      LYS  22  -2.757   7.684  -5.010
  198    HE2  LYS  22           2HE      LYS  22  -5.164   7.309  -3.165
  199    HE3  LYS  22           3HE      LYS  22  -4.661   8.837  -3.892
  200    HZ1  LYS  22           HZ1      LYS  22  -6.394   7.884  -5.217
  201    HZ2  LYS  22           HZ2      LYS  22  -5.026   7.762  -6.101
  202    HZ3  LYS  22           HZ3      LYS  22  -5.658   6.442  -5.340
  203    H    LEU  23           H        LEU  23   0.529   4.611  -6.036
  204    HA   LEU  23           HA       LEU  23  -0.864   4.619  -8.574
  205    HB2  LEU  23           2HB      LEU  23   0.985   6.152  -8.010
  206    HB3  LEU  23           3HB      LEU  23   2.088   4.791  -7.837
  207    HG   LEU  23           HG       LEU  23   1.878   4.288 -10.257
  208   HD11  LEU  23          1HD1      LEU  23  -0.359   5.187 -10.729
  209   HD12  LEU  23          2HD1      LEU  23   0.192   6.833 -10.334
  210   HD13  LEU  23          3HD1      LEU  23   0.840   5.980 -11.754
  211   HD21  LEU  23          3HD2      LEU  23   3.666   5.765  -9.423
  212   HD22  LEU  23          1HD2      LEU  23   3.144   6.236 -11.048
  213   HD23  LEU  23          2HD2      LEU  23   2.609   7.178  -9.637
  214    H    VAL  24           H        VAL  24   1.353   2.330  -7.011
  215    HA   VAL  24           HA       VAL  24   1.633   0.484  -9.195
  216    HB   VAL  24           HB       VAL  24   2.038   0.288  -6.197
  217   HG11  VAL  24          1HG1      VAL  24   3.326  -1.787  -6.555
  218   HG12  VAL  24          2HG1      VAL  24   1.616  -2.018  -6.881
  219   HG13  VAL  24          3HG1      VAL  24   2.756  -1.852  -8.239
  220   HG21  VAL  24          3HG2      VAL  24   4.086   0.229  -8.451
  221   HG22  VAL  24          1HG2      VAL  24   3.571   1.725  -7.663
  222   HG23  VAL  24          2HG2      VAL  24   4.362   0.480  -6.705
  223    H    CYS  25           H        CYS  25  -0.553   0.448  -6.331
  224    HA   CYS  25           HA       CYS  25  -1.894  -1.959  -7.386
  225    HB2  CYS  25           2HB      CYS  25  -1.108  -1.567  -5.012
  226    HB3  CYS  25           3HB      CYS  25  -2.437  -0.427  -4.843
  227    H    LYS  26           H        LYS  26  -2.434   1.379  -7.655
  228    HA   LYS  26           HA       LYS  26  -4.141   2.756  -8.212
  229    HB2  LYS  26           2HB      LYS  26  -5.099   0.274  -9.654
  230    HB3  LYS  26           3HB      LYS  26  -5.948   1.818  -9.769
  231    HG2  LYS  26           2HG      LYS  26  -2.962   1.686 -10.234
  232    HG3  LYS  26           3HG      LYS  26  -4.084   1.244 -11.528
  233    HD2  LYS  26           2HD      LYS  26  -5.033   3.420 -11.631
  234    HD3  LYS  26           3HD      LYS  26  -4.334   3.912 -10.075
  235    HE2  LYS  26           2HE      LYS  26  -2.087   3.796 -10.955
  236    HE3  LYS  26           3HE      LYS  26  -2.668   3.171 -12.507
  237    HZ1  LYS  26           HZ1      LYS  26  -2.260   5.563 -12.643
  238    HZ2  LYS  26           HZ2      LYS  26  -3.851   5.279 -12.844
  239    HZ3  LYS  26           HZ3      LYS  26  -3.304   5.870 -11.424
  240    H    CYS  27           H        CYS  27  -4.238   2.771  -5.975
  241    HA   CYS  27           HA       CYS  27  -6.702   1.689  -4.681
  242    HB2  CYS  27           2HB      CYS  27  -4.372   3.256  -3.543
  243    HB3  CYS  27           3HB      CYS  27  -5.782   2.775  -2.630
  Start of MODEL   28
    1    H1   GLY   1           1H       GLY   1  10.122 -10.642   3.771
    2    H2   GLY   1           2H       GLY   1  10.759  -9.515   2.771
    3    H3   GLY   1           3H       GLY   1  10.901  -9.342   4.394
    4    HA2  GLY   1           HA2      GLY   1   8.525  -9.070   4.642
    5    HA3  GLY   1           HA3      GLY   1   9.220  -7.841   3.569
    6    H    LEU   2           H        LEU   2   6.545  -8.337   3.435
    7    HA   LEU   2           HA       LEU   2   5.866 -10.266   1.364
    8    HB2  LEU   2           2HB      LEU   2   4.326  -7.982   2.644
    9    HB3  LEU   2           3HB      LEU   2   3.620  -9.084   1.474
   10    HG   LEU   2           HG       LEU   2   4.760  -9.941   4.173
   11   HD11  LEU   2          1HD1      LEU   2   2.419 -10.202   4.853
   12   HD12  LEU   2          2HD1      LEU   2   2.757  -8.521   4.410
   13   HD13  LEU   2          3HD1      LEU   2   1.872  -9.572   3.284
   14   HD21  LEU   2          3HD2      LEU   2   4.802 -11.792   2.556
   15   HD22  LEU   2          1HD2      LEU   2   3.504 -12.046   3.722
   16   HD23  LEU   2          2HD2      LEU   2   3.118 -11.456   2.091
   17    HA   PRO   3           HA       PRO   3   6.562  -7.606  -2.158
   18    HB2  PRO   3           2HB      PRO   3   5.079  -8.794  -4.094
   19    HB3  PRO   3           3HB      PRO   3   6.501  -9.595  -3.360
   20    HG2  PRO   3           2HG      PRO   3   3.581  -9.961  -2.610
   21    HG3  PRO   3           3HG      PRO   3   4.792 -11.234  -2.968
   22    HD2  PRO   3           2HD      PRO   3   4.195 -10.429  -0.420
   23    HD3  PRO   3           3HD      PRO   3   5.849 -10.934  -0.887
   24    H    ARG   4           H        ARG   4   5.573  -6.032  -3.490
   25    HA   ARG   4           HA       ARG   4   3.864  -4.326  -2.133
   26    HB2  ARG   4           2HB      ARG   4   3.901  -2.888  -3.974
   27    HB3  ARG   4           3HB      ARG   4   5.481  -3.613  -3.696
   28    HG2  ARG   4           2HG      ARG   4   5.030  -5.210  -5.627
   29    HG3  ARG   4           3HG      ARG   4   3.506  -4.339  -5.906
   30    HD2  ARG   4           2HD      ARG   4   4.980  -3.228  -7.354
   31    HD3  ARG   4           3HD      ARG   4   4.928  -2.207  -5.911
   32    HE   ARG   4           HE       ARG   4   7.154  -2.671  -5.456
   33   HH11  ARG   4          1HH1      ARG   4   6.177  -4.857  -8.022
   34   HH12  ARG   4          2HH1      ARG   4   7.814  -5.368  -8.323
   35   HH21  ARG   4          1HH2      ARG   4   9.206  -3.373  -5.895
   36   HH22  ARG   4          2HH2      ARG   4   9.477  -4.546  -7.150
   37    H    LYS   5           H        LYS   5   2.773  -6.614  -4.622
   38    HA   LYS   5           HA       LYS   5   0.066  -5.572  -4.628
   39    HB2  LYS   5           2HB      LYS   5  -0.521  -7.191  -6.134
   40    HB3  LYS   5           3HB      LYS   5   1.135  -6.803  -6.545
   41    HG2  LYS   5           2HG      LYS   5   0.204  -9.286  -5.015
   42    HG3  LYS   5           3HG      LYS   5   0.547  -9.196  -6.737
   43    HD2  LYS   5           2HD      LYS   5   2.938  -8.607  -6.215
   44    HD3  LYS   5           3HD      LYS   5   2.564  -8.802  -4.496
   45    HE2  LYS   5           2HE      LYS   5   3.589 -10.832  -5.209
   46    HE3  LYS   5           3HE      LYS   5   1.880 -11.171  -4.926
   47    HZ1  LYS   5           HZ1      LYS   5   2.683 -12.161  -7.003
   48    HZ2  LYS   5           HZ2      LYS   5   1.535 -11.059  -7.344
   49    HZ3  LYS   5           HZ3      LYS   5   3.112 -10.706  -7.598
   50    H    ILE   6           H        ILE   6   1.642  -7.741  -2.454
   51    HA   ILE   6           HA       ILE   6  -0.941  -8.622  -1.254
   52    HB   ILE   6           HB       ILE   6   1.922  -9.355  -0.545
   53   HG12  ILE   6          2HG1      ILE   6  -0.322 -10.885  -1.958
   54   HG13  ILE   6          3HG1      ILE   6   1.156 -10.291  -2.706
   55   HG21  ILE   6          1HG2      ILE   6   0.900 -11.003   0.993
   56   HG22  ILE   6          2HG2      ILE   6   0.417  -9.380   1.447
   57   HG23  ILE   6          3HG2      ILE   6  -0.722 -10.413   0.565
   58   HD11  ILE   6          3HD1      ILE   6   0.925 -12.547  -0.691
   59   HD12  ILE   6          1HD1      ILE   6   1.430 -12.628  -2.383
   60   HD13  ILE   6          2HD1      ILE   6   2.475 -11.830  -1.192
   61    H    LEU   7           H        LEU   7   1.914  -6.557  -0.512
   62    HA   LEU   7           HA       LEU   7   0.974  -5.510   1.971
   63    HB2  LEU   7           2HB      LEU   7   2.576  -4.224  -0.277
   64    HB3  LEU   7           3HB      LEU   7   2.291  -3.445   1.270
   65    HG   LEU   7           HG       LEU   7   3.774  -6.087   0.941
   66   HD11  LEU   7          1HD1      LEU   7   4.786  -3.258   1.476
   67   HD12  LEU   7          2HD1      LEU   7   5.775  -4.735   1.473
   68   HD13  LEU   7          3HD1      LEU   7   5.013  -4.188  -0.024
   69   HD21  LEU   7          3HD2      LEU   7   3.360  -4.261   3.355
   70   HD22  LEU   7          1HD2      LEU   7   2.764  -5.927   3.171
   71   HD23  LEU   7          2HD2      LEU   7   4.498  -5.622   3.294
   72    H    CYS   8           H        CYS   8  -0.118  -4.774  -1.326
   73    HA   CYS   8           HA       CYS   8  -1.648  -2.465  -0.688
   74    HB2  CYS   8           2HB      CYS   8  -1.071  -3.221  -2.968
   75    HB3  CYS   8           3HB      CYS   8  -2.206  -4.567  -2.806
   76    H    ALA   9           H        ALA   9  -2.406  -5.889  -0.085
   77    HA   ALA   9           HA       ALA   9  -5.252  -5.463   0.374
   78    HB1  ALA   9           3HB      ALA   9  -5.182  -7.721   1.302
   79    HB2  ALA   9           1HB      ALA   9  -4.269  -7.668  -0.221
   80    HB3  ALA   9           2HB      ALA   9  -3.408  -7.694   1.337
   81    H    ILE  10           H        ILE  10  -2.322  -5.301   2.344
   82    HA   ILE  10           HA       ILE  10  -3.656  -4.743   4.875
   83    HB   ILE  10           HB       ILE  10  -0.828  -3.975   4.062
   84   HG12  ILE  10          2HG1      ILE  10  -1.002  -6.333   3.539
   85   HG13  ILE  10          3HG1      ILE  10   0.004  -6.073   4.931
   86   HG21  ILE  10          1HG2      ILE  10  -2.108  -4.504   6.768
   87   HG22  ILE  10          2HG2      ILE  10  -0.383  -4.182   6.487
   88   HG23  ILE  10          3HG2      ILE  10  -1.584  -2.936   6.121
   89   HD11  ILE  10          3HD1      ILE  10  -1.829  -6.832   6.432
   90   HD12  ILE  10          1HD1      ILE  10  -2.890  -7.048   5.017
   91   HD13  ILE  10          2HD1      ILE  10  -1.439  -8.046   5.203
   92    H    ALA  11           H        ALA  11  -2.051  -2.760   2.358
   93    HA   ALA  11           HA       ALA  11  -2.322  -0.261   3.521
   94    HB1  ALA  11           3HB      ALA  11  -1.783   0.596   1.352
   95    HB2  ALA  11           1HB      ALA  11  -0.983  -0.967   1.456
   96    HB3  ALA  11           2HB      ALA  11  -2.499  -0.800   0.522
   97    H    LYS  12           H        LYS  12  -4.702  -1.877   1.368
   98    HA   LYS  12           HA       LYS  12  -6.585   0.361   1.487
   99    HB2  LYS  12           2HB      LYS  12  -6.851  -2.484   0.450
  100    HB3  LYS  12           3HB      LYS  12  -8.071  -1.213   0.246
  101    HG2  LYS  12           2HG      LYS  12  -6.402   0.214  -0.926
  102    HG3  LYS  12           3HG      LYS  12  -5.202  -1.066  -0.799
  103    HD2  LYS  12           2HD      LYS  12  -7.783  -1.122  -2.388
  104    HD3  LYS  12           3HD      LYS  12  -6.118  -1.068  -2.995
  105    HE2  LYS  12           2HE      LYS  12  -5.707  -3.320  -1.966
  106    HE3  LYS  12           3HE      LYS  12  -7.405  -3.385  -1.483
  107    HZ1  LYS  12           HZ1      LYS  12  -8.023  -3.252  -3.833
  108    HZ2  LYS  12           HZ2      LYS  12  -6.457  -3.186  -4.295
  109    HZ3  LYS  12           HZ3      LYS  12  -7.049  -4.536  -3.592
  110    H    LYS  13           H        LYS  13  -6.210  -2.610   3.359
  111    HA   LYS  13           HA       LYS  13  -8.756  -2.396   4.753
  112    HB2  LYS  13           2HB      LYS  13  -7.467  -4.481   4.446
  113    HB3  LYS  13           3HB      LYS  13  -6.197  -3.870   5.517
  114    HG2  LYS  13           2HG      LYS  13  -7.820  -3.774   7.387
  115    HG3  LYS  13           3HG      LYS  13  -9.113  -4.321   6.319
  116    HD2  LYS  13           2HD      LYS  13  -6.596  -5.883   7.052
  117    HD3  LYS  13           3HD      LYS  13  -8.185  -6.136   7.762
  118    HE2  LYS  13           2HE      LYS  13  -7.483  -6.565   4.818
  119    HE3  LYS  13           3HE      LYS  13  -7.559  -7.830   6.042
  120    HZ1  LYS  13           HZ1      LYS  13  -9.869  -6.164   5.196
  121    HZ2  LYS  13           HZ2      LYS  13  -9.626  -7.728   4.809
  122    HZ3  LYS  13           HZ3      LYS  13  -9.920  -7.315   6.358
  123    H    LYS  14           H        LYS  14  -5.465  -1.266   5.494
  124    HA   LYS  14           HA       LYS  14  -6.269   0.054   8.008
  125    HB2  LYS  14           2HB      LYS  14  -3.701  -0.284   6.438
  126    HB3  LYS  14           3HB      LYS  14  -3.813   1.005   7.616
  127    HG2  LYS  14           2HG      LYS  14  -2.784  -0.941   8.595
  128    HG3  LYS  14           3HG      LYS  14  -4.277  -0.503   9.423
  129    HD2  LYS  14           2HD      LYS  14  -5.466  -2.374   8.366
  130    HD3  LYS  14           3HD      LYS  14  -4.016  -2.787   7.416
  131    HE2  LYS  14           2HE      LYS  14  -2.753  -3.208   9.490
  132    HE3  LYS  14           3HE      LYS  14  -4.134  -2.697  10.467
  133    HZ1  LYS  14           HZ1      LYS  14  -4.116  -5.076   8.682
  134    HZ2  LYS  14           HZ2      LYS  14  -4.005  -5.111  10.308
  135    HZ3  LYS  14           HZ3      LYS  14  -5.381  -4.595   9.609
  136    H    GLY  15           H        GLY  15  -6.399   1.022   4.711
  137    HA2  GLY  15           HA2      GLY  15  -6.981   3.050   3.741
  138    HA3  GLY  15           HA3      GLY  15  -7.154   3.781   5.341
  139    H    LYS  16           H        LYS  16  -4.214   2.120   4.449
  140    HA   LYS  16           HA       LYS  16  -2.624   4.583   4.823
  141    HB2  LYS  16           2HB      LYS  16  -2.304   2.561   6.237
  142    HB3  LYS  16           3HB      LYS  16  -1.926   1.622   4.807
  143    HG2  LYS  16           2HG      LYS  16   0.054   2.009   5.988
  144    HG3  LYS  16           3HG      LYS  16   0.184   2.920   4.511
  145    HD2  LYS  16           2HD      LYS  16  -0.611   4.105   7.218
  146    HD3  LYS  16           3HD      LYS  16   1.050   3.980   6.672
  147    HE2  LYS  16           2HE      LYS  16  -1.121   5.692   5.400
  148    HE3  LYS  16           3HE      LYS  16   0.222   6.238   6.397
  149    HZ1  LYS  16           HZ1      LYS  16   0.817   6.555   4.121
  150    HZ2  LYS  16           HZ2      LYS  16   1.732   5.311   4.652
  151    HZ3  LYS  16           HZ3      LYS  16   0.416   5.026   3.700
  152    H    CYS  17           H        CYS  17  -3.798   2.902   2.133
  153    HA   CYS  17           HA       CYS  17  -1.437   2.833   0.512
  154    HB2  CYS  17           2HB      CYS  17  -3.573   1.479   0.222
  155    HB3  CYS  17           3HB      CYS  17  -4.289   2.932  -0.481
  156    H    LYS  18           H        LYS  18  -0.333   4.567   0.046
  157    HA   LYS  18           HA       LYS  18  -1.527   6.885  -1.381
  158    HB2  LYS  18           2HB      LYS  18   0.194   7.121   1.138
  159    HB3  LYS  18           3HB      LYS  18  -0.187   8.457   0.049
  160    HG2  LYS  18           2HG      LYS  18  -2.635   8.075   0.495
  161    HG3  LYS  18           3HG      LYS  18  -2.175   6.887   1.733
  162    HD2  LYS  18           2HD      LYS  18  -0.916   8.640   2.953
  163    HD3  LYS  18           3HD      LYS  18  -1.376   9.829   1.714
  164    HE2  LYS  18           2HE      LYS  18  -3.780   9.407   2.221
  165    HE3  LYS  18           3HE      LYS  18  -3.312   8.254   3.475
  166    HZ1  LYS  18           HZ1      LYS  18  -2.200  10.091   4.646
  167    HZ2  LYS  18           HZ2      LYS  18  -2.637  11.152   3.481
  168    HZ3  LYS  18           HZ3      LYS  18  -3.775  10.447   4.413
  169    H    GLY  19           H        GLY  19   0.174   8.278  -2.321
  170    HA2  GLY  19           HA2      GLY  19   1.948   8.535  -3.773
  171    HA3  GLY  19           HA3      GLY  19   2.879   7.870  -2.447
  172    HA   PRO  20           HA       PRO  20   3.932   4.974  -5.749
  173    HB2  PRO  20           2HB      PRO  20   5.493   3.188  -4.357
  174    HB3  PRO  20           3HB      PRO  20   6.037   4.815  -4.866
  175    HG2  PRO  20           2HG      PRO  20   4.938   3.985  -2.163
  176    HG3  PRO  20           3HG      PRO  20   6.410   4.946  -2.514
  177    HD2  PRO  20           2HD      PRO  20   4.071   6.135  -1.846
  178    HD3  PRO  20           3HD      PRO  20   5.133   6.857  -3.093
  179    H    LEU  21           H        LEU  21   2.655   3.663  -2.611
  180    HA   LEU  21           HA       LEU  21   1.928   1.122  -3.726
  181    HB2  LEU  21           2HB      LEU  21   2.027   2.214  -1.186
  182    HB3  LEU  21           3HB      LEU  21   0.306   2.207  -1.456
  183    HG   LEU  21           HG       LEU  21   0.849   0.222  -0.296
  184   HD11  LEU  21          1HD1      LEU  21  -0.752  -0.236  -2.127
  185   HD12  LEU  21          2HD1      LEU  21   0.597  -0.683  -3.196
  186   HD13  LEU  21          3HD1      LEU  21   0.267  -1.636  -1.747
  187   HD21  LEU  21          3HD2      LEU  21   2.540  -1.390  -0.967
  188   HD22  LEU  21          1HD2      LEU  21   2.970  -0.407  -2.384
  189   HD23  LEU  21          2HD2      LEU  21   3.265   0.210  -0.743
  190    H    LYS  22           H        LYS  22   0.226   4.172  -3.472
  191    HA   LYS  22           HA       LYS  22  -2.369   3.278  -4.466
  192    HB2  LYS  22           2HB      LYS  22  -2.154   5.215  -3.027
  193    HB3  LYS  22           3HB      LYS  22  -1.118   6.039  -4.203
  194    HG2  LYS  22           2HG      LYS  22  -2.970   6.202  -5.794
  195    HG3  LYS  22           3HG      LYS  22  -4.018   5.248  -4.727
  196    HD2  LYS  22           2HD      LYS  22  -3.887   7.000  -2.996
  197    HD3  LYS  22           3HD      LYS  22  -2.725   7.902  -3.981
  198    HE2  LYS  22           2HE      LYS  22  -4.704   9.046  -4.380
  199    HE3  LYS  22           3HE      LYS  22  -4.542   8.009  -5.798
  200    HZ1  LYS  22           HZ1      LYS  22  -6.274   7.459  -3.441
  201    HZ2  LYS  22           HZ2      LYS  22  -6.796   7.945  -4.907
  202    HZ3  LYS  22           HZ3      LYS  22  -6.147   6.460  -4.729
  203    H    LEU  23           H        LEU  23   0.520   4.757  -6.051
  204    HA   LEU  23           HA       LEU  23  -0.599   4.858  -8.675
  205    HB2  LEU  23           2HB      LEU  23   2.147   4.845  -7.373
  206    HB3  LEU  23           3HB      LEU  23   1.986   4.798  -9.093
  207    HG   LEU  23           HG       LEU  23   0.759   6.992  -7.368
  208   HD11  LEU  23          1HD1      LEU  23   3.370   7.001  -8.941
  209   HD12  LEU  23          2HD1      LEU  23   2.650   8.393  -8.098
  210   HD13  LEU  23          3HD1      LEU  23   3.216   6.996  -7.170
  211   HD21  LEU  23          3HD2      LEU  23   0.688   8.268  -9.497
  212   HD22  LEU  23          1HD2      LEU  23   1.276   6.838 -10.371
  213   HD23  LEU  23          2HD2      LEU  23  -0.316   6.820  -9.579
  214    H    VAL  24           H        VAL  24   1.276   2.343  -6.956
  215    HA   VAL  24           HA       VAL  24   1.499   0.479  -9.132
  216    HB   VAL  24           HB       VAL  24   1.598   0.208  -6.109
  217   HG11  VAL  24          1HG1      VAL  24   2.238  -1.981  -8.125
  218   HG12  VAL  24          2HG1      VAL  24   2.613  -2.011  -6.385
  219   HG13  VAL  24          3HG1      VAL  24   0.938  -2.015  -6.910
  220   HG21  VAL  24          3HG2      VAL  24   3.445   1.442  -7.361
  221   HG22  VAL  24          1HG2      VAL  24   3.963   0.066  -6.388
  222   HG23  VAL  24          2HG2      VAL  24   3.826  -0.087  -8.162
  223    H    CYS  25           H        CYS  25  -0.898   0.787  -6.522
  224    HA   CYS  25           HA       CYS  25  -2.330  -1.600  -7.561
  225    HB2  CYS  25           2HB      CYS  25  -1.268  -1.355  -5.251
  226    HB3  CYS  25           3HB      CYS  25  -2.593  -0.270  -4.868
  227    H    LYS  26           H        LYS  26  -2.795   1.733  -7.623
  228    HA   LYS  26           HA       LYS  26  -4.509   3.163  -8.023
  229    HB2  LYS  26           2HB      LYS  26  -5.685   0.760  -9.444
  230    HB3  LYS  26           3HB      LYS  26  -6.257   2.416  -9.633
  231    HG2  LYS  26           2HG      LYS  26  -3.381   1.556 -10.128
  232    HG3  LYS  26           3HG      LYS  26  -4.608   1.565 -11.394
  233    HD2  LYS  26           2HD      LYS  26  -3.603   4.009  -9.861
  234    HD3  LYS  26           3HD      LYS  26  -3.137   3.530 -11.493
  235    HE2  LYS  26           2HE      LYS  26  -5.517   3.740 -12.229
  236    HE3  LYS  26           3HE      LYS  26  -5.955   4.304 -10.612
  237    HZ1  LYS  26           HZ1      LYS  26  -4.050   5.673 -12.437
  238    HZ2  LYS  26           HZ2      LYS  26  -5.573   6.162 -12.123
  239    HZ3  LYS  26           HZ3      LYS  26  -4.450   6.197 -10.940
  240    H    CYS  27           H        CYS  27  -4.428   2.649  -5.693
  241    HA   CYS  27           HA       CYS  27  -6.774   1.658  -4.309
  242    HB2  CYS  27           2HB      CYS  27  -4.564   3.536  -3.368
  243    HB3  CYS  27           3HB      CYS  27  -5.785   2.835  -2.350
  Start of MODEL   29
    1    H1   GLY   1           1H       GLY   1  10.940  -9.681   2.950
    2    H2   GLY   1           2H       GLY   1  11.208  -8.880   4.355
    3    H3   GLY   1           3H       GLY   1  10.137 -10.122   4.306
    4    HA2  GLY   1           HA2      GLY   1   8.970  -8.012   4.378
    5    HA3  GLY   1           HA3      GLY   1   9.832  -7.548   2.899
    6    H    LEU   2           H        LEU   2   7.602  -7.230   2.110
    7    HA   LEU   2           HA       LEU   2   6.514  -9.683   0.832
    8    HB2  LEU   2           2HB      LEU   2   4.963  -7.538   2.332
    9    HB3  LEU   2           3HB      LEU   2   4.194  -8.635   1.198
   10    HG   LEU   2           HG       LEU   2   5.656  -9.531   3.720
   11   HD11  LEU   2          1HD1      LEU   2   3.634  -8.225   4.233
   12   HD12  LEU   2          2HD1      LEU   2   2.678  -9.259   3.150
   13   HD13  LEU   2          3HD1      LEU   2   3.408  -9.937   4.621
   14   HD21  LEU   2          3HD2      LEU   2   3.867 -11.042   1.757
   15   HD22  LEU   2          1HD2      LEU   2   5.604 -11.311   2.022
   16   HD23  LEU   2          2HD2      LEU   2   4.456 -11.677   3.309
   17    HA   PRO   3           HA       PRO   3   6.491  -6.995  -2.743
   18    HB2  PRO   3           2HB      PRO   3   4.854  -8.311  -4.459
   19    HB3  PRO   3           3HB      PRO   3   6.422  -9.000  -3.935
   20    HG2  PRO   3           2HG      PRO   3   3.670  -9.576  -2.787
   21    HG3  PRO   3           3HG      PRO   3   4.906 -10.758  -3.323
   22    HD2  PRO   3           2HD      PRO   3   4.634  -9.994  -0.706
   23    HD3  PRO   3           3HD      PRO   3   6.232 -10.375  -1.416
   24    H    ARG   4           H        ARG   4   5.170  -5.522  -3.915
   25    HA   ARG   4           HA       ARG   4   3.284  -4.078  -2.376
   26    HB2  ARG   4           2HB      ARG   4   3.919  -4.017  -5.352
   27    HB3  ARG   4           3HB      ARG   4   2.817  -2.873  -4.566
   28    HG2  ARG   4           2HG      ARG   4   4.553  -2.133  -3.041
   29    HG3  ARG   4           3HG      ARG   4   5.712  -3.288  -3.716
   30    HD2  ARG   4           2HD      ARG   4   4.448  -0.963  -5.199
   31    HD3  ARG   4           3HD      ARG   4   6.042  -0.937  -4.475
   32    HE   ARG   4           HE       ARG   4   5.261  -2.279  -6.972
   33   HH11  ARG   4          2HH1      ARG   4   7.804  -2.081  -4.563
   34   HH12  ARG   4          1HH1      ARG   4   8.991  -2.760  -5.642
   35   HH21  ARG   4          2HH2      ARG   4   6.823  -3.139  -8.281
   36   HH22  ARG   4          1HH2      ARG   4   8.443  -3.338  -7.684
   37    H    LYS   5           H        LYS   5   2.611  -6.601  -4.751
   38    HA   LYS   5           HA       LYS   5  -0.236  -6.156  -4.864
   39    HB2  LYS   5           2HB      LYS   5  -0.365  -8.212  -6.063
   40    HB3  LYS   5           3HB      LYS   5   1.062  -7.332  -6.601
   41    HG2  LYS   5           2HG      LYS   5   2.455  -8.827  -5.072
   42    HG3  LYS   5           3HG      LYS   5   0.978  -9.756  -4.751
   43    HD2  LYS   5           2HD      LYS   5   0.766 -10.205  -7.216
   44    HD3  LYS   5           3HD      LYS   5   2.253  -9.292  -7.480
   45    HE2  LYS   5           2HE      LYS   5   2.916 -11.548  -7.519
   46    HE3  LYS   5           3HE      LYS   5   3.457 -10.925  -5.960
   47    HZ1  LYS   5           HZ1      LYS   5   1.002 -12.550  -6.414
   48    HZ2  LYS   5           HZ2      LYS   5   2.382 -13.102  -5.752
   49    HZ3  LYS   5           HZ3      LYS   5   1.485 -11.998  -4.953
   50    H    ILE   6           H        ILE   6   1.686  -7.671  -2.422
   51    HA   ILE   6           HA       ILE   6  -0.736  -8.816  -1.093
   52    HB   ILE   6           HB       ILE   6   2.217  -9.164  -0.470
   53   HG12  ILE   6          2HG1      ILE   6   0.088 -11.083  -1.547
   54   HG13  ILE   6          3HG1      ILE   6   1.397 -10.377  -2.488
   55   HG21  ILE   6          1HG2      ILE   6   1.448 -10.763   1.272
   56   HG22  ILE   6          2HG2      ILE   6   0.854  -9.146   1.611
   57   HG23  ILE   6          3HG2      ILE   6  -0.242 -10.350   0.907
   58   HD11  ILE   6          3HD1      ILE   6   1.685 -12.413  -0.258
   59   HD12  ILE   6          1HD1      ILE   6   2.014 -12.615  -1.985
   60   HD13  ILE   6          2HD1      ILE   6   3.052 -11.557  -1.013
   61    H    LEU   7           H        LEU   7   1.924  -6.439  -0.534
   62    HA   LEU   7           HA       LEU   7   0.997  -5.435   1.959
   63    HB2  LEU   7           2HB      LEU   7   2.381  -4.038  -0.367
   64    HB3  LEU   7           3HB      LEU   7   2.134  -3.288   1.200
   65    HG   LEU   7           HG       LEU   7   3.770  -5.826   0.774
   66   HD11  LEU   7          1HD1      LEU   7   4.811  -3.862  -0.284
   67   HD12  LEU   7          2HD1      LEU   7   4.632  -2.935   1.225
   68   HD13  LEU   7          3HD1      LEU   7   5.709  -4.347   1.159
   69   HD21  LEU   7          3HD2      LEU   7   3.382  -4.015   3.200
   70   HD22  LEU   7          1HD2      LEU   7   2.900  -5.722   3.058
   71   HD23  LEU   7          2HD2      LEU   7   4.611  -5.288   3.077
   72    H    CYS   8           H        CYS   8  -0.207  -4.738  -1.310
   73    HA   CYS   8           HA       CYS   8  -1.828  -2.512  -0.654
   74    HB2  CYS   8           2HB      CYS   8  -1.240  -3.252  -2.932
   75    HB3  CYS   8           3HB      CYS   8  -2.340  -4.624  -2.767
   76    H    ALA   9           H        ALA   9  -2.476  -5.971  -0.053
   77    HA   ALA   9           HA       ALA   9  -5.314  -5.835   0.341
   78    HB1  ALA   9           3HB      ALA   9  -4.958  -7.888   1.643
   79    HB2  ALA   9           1HB      ALA   9  -3.940  -7.940   0.187
   80    HB3  ALA   9           2HB      ALA   9  -3.221  -7.559   1.777
   81    H    ILE  10           H        ILE  10  -2.557  -5.287   2.439
   82    HA   ILE  10           HA       ILE  10  -4.047  -4.776   4.879
   83    HB   ILE  10           HB       ILE  10  -1.114  -4.315   4.178
   84   HG12  ILE  10          2HG1      ILE  10  -2.397  -6.780   5.450
   85   HG13  ILE  10          3HG1      ILE  10  -1.902  -6.698   3.773
   86   HG21  ILE  10          1HG2      ILE  10  -2.492  -4.642   6.882
   87   HG22  ILE  10          2HG2      ILE  10  -0.749  -4.422   6.617
   88   HG23  ILE  10          3HG2      ILE  10  -1.865  -3.115   6.219
   89   HD11  ILE  10          3HD1      ILE  10   0.425  -6.293   4.400
   90   HD12  ILE  10          1HD1      ILE  10  -0.013  -6.576   6.111
   91   HD13  ILE  10          2HD1      ILE  10  -0.234  -7.859   4.895
   92    H    ALA  11           H        ALA  11  -2.229  -2.807   2.501
   93    HA   ALA  11           HA       ALA  11  -2.634  -0.285   3.668
   94    HB1  ALA  11           3HB      ALA  11  -1.963   0.565   1.522
   95    HB2  ALA  11           1HB      ALA  11  -1.071  -0.933   1.789
   96    HB3  ALA  11           2HB      ALA  11  -2.479  -0.908   0.691
   97    H    LYS  12           H        LYS  12  -4.780  -2.048   1.374
   98    HA   LYS  12           HA       LYS  12  -6.723   0.066   1.164
   99    HB2  LYS  12           2HB      LYS  12  -6.291  -2.178  -0.264
  100    HB3  LYS  12           3HB      LYS  12  -7.481  -2.843   0.839
  101    HG2  LYS  12           2HG      LYS  12  -8.786  -2.099  -0.959
  102    HG3  LYS  12           3HG      LYS  12  -8.934  -0.769   0.179
  103    HD2  LYS  12           2HD      LYS  12  -8.529   0.236  -1.956
  104    HD3  LYS  12           3HD      LYS  12  -7.024   0.393  -1.054
  105    HE2  LYS  12           2HE      LYS  12  -6.475  -0.224  -3.298
  106    HE3  LYS  12           3HE      LYS  12  -6.099  -1.593  -2.253
  107    HZ1  LYS  12           HZ1      LYS  12  -8.551  -1.337  -3.927
  108    HZ2  LYS  12           HZ2      LYS  12  -7.263  -2.268  -4.292
  109    HZ3  LYS  12           HZ3      LYS  12  -8.186  -2.632  -2.999
  110    H    LYS  13           H        LYS  13  -6.487  -2.720   3.358
  111    HA   LYS  13           HA       LYS  13  -9.031  -2.236   4.681
  112    HB2  LYS  13           2HB      LYS  13  -6.611  -3.946   5.365
  113    HB3  LYS  13           3HB      LYS  13  -8.044  -3.850   6.399
  114    HG2  LYS  13           2HG      LYS  13  -9.491  -4.661   4.609
  115    HG3  LYS  13           3HG      LYS  13  -8.162  -4.630   3.454
  116    HD2  LYS  13           2HD      LYS  13  -8.524  -6.902   4.124
  117    HD3  LYS  13           3HD      LYS  13  -6.969  -6.374   4.782
  118    HE2  LYS  13           2HE      LYS  13  -8.022  -6.005   6.999
  119    HE3  LYS  13           3HE      LYS  13  -9.601  -6.447   6.334
  120    HZ1  LYS  13           HZ1      LYS  13  -8.566  -8.320   7.480
  121    HZ2  LYS  13           HZ2      LYS  13  -8.721  -8.675   5.897
  122    HZ3  LYS  13           HZ3      LYS  13  -7.259  -8.271   6.505
  123    H    LYS  14           H        LYS  14  -5.697  -1.291   5.535
  124    HA   LYS  14           HA       LYS  14  -6.636   0.122   7.967
  125    HB2  LYS  14           2HB      LYS  14  -3.901  -0.431   6.777
  126    HB3  LYS  14           3HB      LYS  14  -4.134   0.733   8.072
  127    HG2  LYS  14           2HG      LYS  14  -3.430  -1.330   9.017
  128    HG3  LYS  14           3HG      LYS  14  -5.057  -0.923   9.559
  129    HD2  LYS  14           2HD      LYS  14  -6.024  -2.646   8.104
  130    HD3  LYS  14           3HD      LYS  14  -4.448  -2.928   7.350
  131    HE2  LYS  14           2HE      LYS  14  -4.849  -4.707   8.902
  132    HE3  LYS  14           3HE      LYS  14  -3.539  -3.703   9.525
  133    HZ1  LYS  14           HZ1      LYS  14  -6.370  -3.565  10.440
  134    HZ2  LYS  14           HZ2      LYS  14  -5.155  -4.281  11.255
  135    HZ3  LYS  14           HZ3      LYS  14  -5.143  -2.667  11.043
  136    H    GLY  15           H        GLY  15  -6.048   1.031   4.677
  137    HA2  GLY  15           HA2      GLY  15  -6.892   3.006   3.709
  138    HA3  GLY  15           HA3      GLY  15  -6.959   3.792   5.291
  139    H    LYS  16           H        LYS  16  -4.120   2.039   4.287
  140    HA   LYS  16           HA       LYS  16  -2.454   4.491   4.498
  141    HB2  LYS  16           2HB      LYS  16  -1.851   1.519   4.771
  142    HB3  LYS  16           3HB      LYS  16  -0.712   2.804   5.045
  143    HG2  LYS  16           2HG      LYS  16  -3.198   2.282   6.705
  144    HG3  LYS  16           3HG      LYS  16  -1.549   1.850   7.115
  145    HD2  LYS  16           2HD      LYS  16  -1.785   3.729   8.373
  146    HD3  LYS  16           3HD      LYS  16  -1.073   4.438   6.919
  147    HE2  LYS  16           2HE      LYS  16  -3.353   5.113   6.158
  148    HE3  LYS  16           3HE      LYS  16  -4.064   4.314   7.564
  149    HZ1  LYS  16           HZ1      LYS  16  -3.816   6.704   7.922
  150    HZ2  LYS  16           HZ2      LYS  16  -2.878   5.897   8.983
  151    HZ3  LYS  16           HZ3      LYS  16  -2.203   6.631   7.688
  152    H    CYS  17           H        CYS  17  -3.721   2.992   1.872
  153    HA   CYS  17           HA       CYS  17  -1.335   2.506   0.309
  154    HB2  CYS  17           2HB      CYS  17  -3.630   1.450  -0.023
  155    HB3  CYS  17           3HB      CYS  17  -4.127   2.999  -0.726
  156    H    LYS  18           H        LYS  18  -0.008   4.029  -0.320
  157    HA   LYS  18           HA       LYS  18  -0.928   6.676  -1.349
  158    HB2  LYS  18           2HB      LYS  18   0.959   6.259   1.028
  159    HB3  LYS  18           3HB      LYS  18   0.779   7.787   0.166
  160    HG2  LYS  18           2HG      LYS  18  -1.635   7.859   0.790
  161    HG3  LYS  18           3HG      LYS  18  -1.428   6.360   1.702
  162    HD2  LYS  18           2HD      LYS  18  -1.374   8.172   3.252
  163    HD3  LYS  18           3HD      LYS  18   0.249   7.470   3.162
  164    HE2  LYS  18           2HE      LYS  18   0.964   9.314   1.655
  165    HE3  LYS  18           3HE      LYS  18  -0.673   9.984   1.686
  166    HZ1  LYS  18           HZ1      LYS  18   1.106   9.723   4.055
  167    HZ2  LYS  18           HZ2      LYS  18   0.783  11.114   3.267
  168    HZ3  LYS  18           HZ3      LYS  18  -0.405  10.350   4.081
  169    H    GLY  19           H        GLY  19   0.782   7.970  -2.250
  170    HA2  GLY  19           HA2      GLY  19   2.448   8.283  -3.812
  171    HA3  GLY  19           HA3      GLY  19   3.417   7.453  -2.615
  172    HA   PRO  20           HA       PRO  20   4.116   4.789  -6.205
  173    HB2  PRO  20           2HB      PRO  20   5.687   2.849  -5.057
  174    HB3  PRO  20           3HB      PRO  20   6.274   4.485  -5.480
  175    HG2  PRO  20           2HG      PRO  20   5.323   3.493  -2.776
  176    HG3  PRO  20           3HG      PRO  20   6.807   4.423  -3.157
  177    HD2  PRO  20           2HD      PRO  20   4.557   5.633  -2.240
  178    HD3  PRO  20           3HD      PRO  20   5.583   6.421  -3.477
  179    H    LEU  21           H        LEU  21   3.031   3.320  -3.055
  180    HA   LEU  21           HA       LEU  21   2.088   0.908  -4.285
  181    HB2  LEU  21           2HB      LEU  21   2.631   1.200  -1.861
  182    HB3  LEU  21           3HB      LEU  21   1.203   2.225  -1.693
  183    HG   LEU  21           HG       LEU  21  -0.254   0.301  -2.312
  184   HD11  LEU  21          1HD1      LEU  21   0.708  -1.980  -2.280
  185   HD12  LEU  21          2HD1      LEU  21   1.232  -1.049  -3.687
  186   HD13  LEU  21          3HD1      LEU  21   2.339  -1.274  -2.305
  187   HD21  LEU  21          3HD2      LEU  21   0.081  -0.988  -0.266
  188   HD22  LEU  21          1HD2      LEU  21   1.705  -0.291  -0.067
  189   HD23  LEU  21          2HD2      LEU  21   0.267   0.750   0.043
  190    H    LYS  22           H        LYS  22   0.533   4.002  -3.650
  191    HA   LYS  22           HA       LYS  22  -2.156   3.265  -4.460
  192    HB2  LYS  22           2HB      LYS  22  -1.779   5.184  -3.061
  193    HB3  LYS  22           3HB      LYS  22  -0.764   5.971  -4.280
  194    HG2  LYS  22           2HG      LYS  22  -2.632   6.355  -5.731
  195    HG3  LYS  22           3HG      LYS  22  -3.672   5.257  -4.815
  196    HD2  LYS  22           2HD      LYS  22  -3.573   6.785  -2.858
  197    HD3  LYS  22           3HD      LYS  22  -2.562   7.908  -3.799
  198    HE2  LYS  22           2HE      LYS  22  -4.380   8.138  -5.472
  199    HE3  LYS  22           3HE      LYS  22  -5.374   6.987  -4.568
  200    HZ1  LYS  22           HZ1      LYS  22  -4.463   9.627  -3.542
  201    HZ2  LYS  22           HZ2      LYS  22  -5.976   9.278  -4.041
  202    HZ3  LYS  22           HZ3      LYS  22  -5.378   8.561  -2.704
  203    H    LEU  23           H        LEU  23   0.613   4.544  -6.267
  204    HA   LEU  23           HA       LEU  23  -0.776   4.574  -8.813
  205    HB2  LEU  23           2HB      LEU  23   1.189   5.916  -8.278
  206    HB3  LEU  23           3HB      LEU  23   2.197   4.488  -8.123
  207    HG   LEU  23           HG       LEU  23   0.761   5.072 -10.739
  208   HD11  LEU  23          1HD1      LEU  23   3.442   6.215  -9.844
  209   HD12  LEU  23          2HD1      LEU  23   2.750   6.333 -11.479
  210   HD13  LEU  23          3HD1      LEU  23   1.949   7.139 -10.125
  211   HD21  LEU  23          3HD2      LEU  23   1.936   2.888 -10.612
  212   HD22  LEU  23          1HD2      LEU  23   2.782   3.971 -11.708
  213   HD23  LEU  23          2HD2      LEU  23   3.417   3.704 -10.071
  214    H    VAL  24           H        VAL  24   1.292   2.153  -7.226
  215    HA   VAL  24           HA       VAL  24   1.406   0.281  -9.381
  216    HB   VAL  24           HB       VAL  24   1.921   0.132  -6.401
  217   HG11  VAL  24          1HG1      VAL  24   3.138  -1.979  -6.724
  218   HG12  VAL  24          2HG1      VAL  24   1.416  -2.181  -6.988
  219   HG13  VAL  24          3HG1      VAL  24   2.514  -2.092  -8.389
  220   HG21  VAL  24          3HG2      VAL  24   4.218   0.287  -7.018
  221   HG22  VAL  24          1HG2      VAL  24   3.866  -0.044  -8.738
  222   HG23  VAL  24          2HG2      VAL  24   3.398   1.491  -7.995
  223    H    CYS  25           H        CYS  25  -0.758   0.415  -6.542
  224    HA   CYS  25           HA       CYS  25  -2.190  -2.018  -7.490
  225    HB2  CYS  25           2HB      CYS  25  -1.301  -1.684  -5.147
  226    HB3  CYS  25           3HB      CYS  25  -2.536  -0.452  -4.927
  227    H    LYS  26           H        LYS  26  -2.474   1.291  -7.828
  228    HA   LYS  26           HA       LYS  26  -4.019   2.810  -8.264
  229    HB2  LYS  26           2HB      LYS  26  -4.333   0.855 -10.149
  230    HB3  LYS  26           3HB      LYS  26  -5.997   1.106  -9.641
  231    HG2  LYS  26           2HG      LYS  26  -3.993   3.233 -10.508
  232    HG3  LYS  26           3HG      LYS  26  -5.302   2.585 -11.502
  233    HD2  LYS  26           2HD      LYS  26  -6.546   4.332 -10.810
  234    HD3  LYS  26           3HD      LYS  26  -6.689   3.505  -9.264
  235    HE2  LYS  26           2HE      LYS  26  -4.435   4.718  -8.658
  236    HE3  LYS  26           3HE      LYS  26  -4.737   5.687 -10.101
  237    HZ1  LYS  26           HZ1      LYS  26  -5.670   6.843  -8.267
  238    HZ2  LYS  26           HZ2      LYS  26  -6.969   6.207  -9.028
  239    HZ3  LYS  26           HZ3      LYS  26  -6.389   5.527  -7.638
  240    H    CYS  27           H        CYS  27  -4.149   2.818  -5.986
  241    HA   CYS  27           HA       CYS  27  -6.713   2.076  -4.718
  242    HB2  CYS  27           2HB      CYS  27  -4.339   3.613  -3.603
  243    HB3  CYS  27           3HB      CYS  27  -5.731   3.069  -2.701
  Start of MODEL   30
    1    H1   GLY   1           1H       GLY   1  10.007  -5.173   4.756
    2    H2   GLY   1           2H       GLY   1   9.443  -4.954   3.232
    3    H3   GLY   1           3H       GLY   1   8.506  -4.556   4.515
    4    HA2  GLY   1           HA2      GLY   1   9.362  -7.286   3.804
    5    HA3  GLY   1           HA3      GLY   1   8.363  -6.862   5.206
    6    H    LEU   2           H        LEU   2   7.634  -8.662   3.184
    7    HA   LEU   2           HA       LEU   2   6.068  -9.358   1.809
    8    HB2  LEU   2           2HB      LEU   2   4.490  -6.967   2.771
    9    HB3  LEU   2           3HB      LEU   2   3.812  -8.251   1.793
   10    HG   LEU   2           HG       LEU   2   5.015  -8.656   4.568
   11   HD11  LEU   2          1HD1      LEU   2   2.685  -8.886   5.311
   12   HD12  LEU   2          2HD1      LEU   2   2.972  -7.280   4.625
   13   HD13  LEU   2          3HD1      LEU   2   2.108  -8.507   3.675
   14   HD21  LEU   2          3HD2      LEU   2   5.097 -10.728   3.246
   15   HD22  LEU   2          1HD2      LEU   2   3.821 -10.842   4.459
   16   HD23  LEU   2          2HD2      LEU   2   3.398 -10.516   2.764
   17    HA   PRO   3           HA       PRO   3   6.522  -7.365  -2.147
   18    HB2  PRO   3           2HB      PRO   3   5.031  -8.946  -3.753
   19    HB3  PRO   3           3HB      PRO   3   6.488  -9.571  -2.921
   20    HG2  PRO   3           2HG      PRO   3   3.594  -9.820  -2.027
   21    HG3  PRO   3           3HG      PRO   3   4.813 -11.125  -2.180
   22    HD2  PRO   3           2HD      PRO   3   4.299  -9.854   0.197
   23    HD3  PRO   3           3HD      PRO   3   5.934 -10.435  -0.234
   24    H    ARG   4           H        ARG   4   5.377  -6.119  -3.717
   25    HA   ARG   4           HA       ARG   4   3.395  -4.354  -2.768
   26    HB2  ARG   4           2HB      ARG   4   4.242  -5.076  -5.600
   27    HB3  ARG   4           3HB      ARG   4   3.110  -3.770  -5.233
   28    HG2  ARG   4           2HG      ARG   4   4.764  -2.616  -3.863
   29    HG3  ARG   4           3HG      ARG   4   5.943  -3.910  -4.112
   30    HD2  ARG   4           2HD      ARG   4   4.763  -2.142  -6.297
   31    HD3  ARG   4           3HD      ARG   4   6.336  -1.902  -5.554
   32    HE   ARG   4           HE       ARG   4   5.591  -3.903  -7.567
   33   HH11  ARG   4          1HH1      ARG   4   8.072  -3.077  -5.227
   34   HH12  ARG   4          2HH1      ARG   4   9.265  -4.071  -6.015
   35   HH21  ARG   4          1HH2      ARG   4   7.161  -5.150  -8.508
   36   HH22  ARG   4          2HH2      ARG   4   8.758  -5.208  -7.821
   37    H    LYS   5           H        LYS   5   2.865  -7.353  -4.579
   38    HA   LYS   5           HA       LYS   5   0.061  -6.919  -5.075
   39    HB2  LYS   5           2HB      LYS   5  -0.010  -9.201  -5.798
   40    HB3  LYS   5           3HB      LYS   5   1.456  -8.437  -6.407
   41    HG2  LYS   5           2HG      LYS   5   2.742  -9.528  -4.519
   42    HG3  LYS   5           3HG      LYS   5   1.266 -10.385  -4.063
   43    HD2  LYS   5           2HD      LYS   5   2.672 -10.603  -6.758
   44    HD3  LYS   5           3HD      LYS   5   2.825 -11.752  -5.422
   45    HE2  LYS   5           2HE      LYS   5   0.375 -12.203  -5.528
   46    HE3  LYS   5           3HE      LYS   5   0.235 -11.091  -6.897
   47    HZ1  LYS   5           HZ1      LYS   5   1.865 -13.577  -6.886
   48    HZ2  LYS   5           HZ2      LYS   5   0.436 -13.389  -7.647
   49    HZ3  LYS   5           HZ3      LYS   5   1.739 -12.546  -8.148
   50    H    ILE   6           H        ILE   6   1.691  -7.998  -2.207
   51    HA   ILE   6           HA       ILE   6  -0.887  -8.814  -0.934
   52    HB   ILE   6           HB       ILE   6   1.981  -9.056   0.035
   53   HG12  ILE   6          2HG1      ILE   6  -0.107 -11.135  -0.797
   54   HG13  ILE   6          3HG1      ILE   6   1.283 -10.649  -1.761
   55   HG21  ILE   6          1HG2      ILE   6   1.011 -10.249   1.989
   56   HG22  ILE   6          2HG2      ILE   6   0.453  -8.586   1.936
   57   HG23  ILE   6          3HG2      ILE   6  -0.625  -9.888   1.397
   58   HD11  ILE   6          3HD1      ILE   6   1.372 -12.174   0.858
   59   HD12  ILE   6          1HD1      ILE   6   1.803 -12.739  -0.764
   60   HD13  ILE   6          2HD1      ILE   6   2.803 -11.511   0.030
   61    H    LEU   7           H        LEU   7   1.790  -6.423  -0.550
   62    HA   LEU   7           HA       LEU   7   0.674  -4.942   1.585
   63    HB2  LEU   7           2HB      LEU   7   2.345  -4.077  -0.807
   64    HB3  LEU   7           3HB      LEU   7   1.962  -3.000   0.524
   65    HG   LEU   7           HG       LEU   7   3.514  -5.605   0.847
   66   HD11  LEU   7          1HD1      LEU   7   5.466  -4.125   1.118
   67   HD12  LEU   7          2HD1      LEU   7   4.751  -3.945  -0.488
   68   HD13  LEU   7          3HD1      LEU   7   4.459  -2.706   0.756
   69   HD21  LEU   7          3HD2      LEU   7   4.124  -4.589   3.058
   70   HD22  LEU   7          1HD2      LEU   7   2.950  -3.292   2.760
   71   HD23  LEU   7          2HD2      LEU   7   2.407  -4.978   2.939
   72    H    CYS   8           H        CYS   8  -0.185  -4.821  -1.853
   73    HA   CYS   8           HA       CYS   8  -1.864  -2.528  -1.803
   74    HB2  CYS   8           2HB      CYS   8  -1.087  -3.561  -3.831
   75    HB3  CYS   8           3HB      CYS   8  -1.865  -5.088  -3.441
   76    H    ALA   9           H        ALA   9  -2.588  -5.916  -0.825
   77    HA   ALA   9           HA       ALA   9  -5.443  -5.404  -0.443
   78    HB1  ALA   9           3HB      ALA   9  -3.657  -7.690   0.504
   79    HB2  ALA   9           1HB      ALA   9  -5.432  -7.664   0.515
   80    HB3  ALA   9           2HB      ALA   9  -4.555  -7.638  -1.029
   81    H    ILE  10           H        ILE  10  -2.553  -5.620   1.653
   82    HA   ILE  10           HA       ILE  10  -3.803  -5.119   4.169
   83    HB   ILE  10           HB       ILE  10  -1.029  -4.320   3.199
   84   HG12  ILE  10          2HG1      ILE  10  -1.368  -6.733   2.933
   85   HG13  ILE  10          3HG1      ILE  10  -0.181  -6.365   4.152
   86   HG21  ILE  10          1HG2      ILE  10  -1.515  -3.099   5.230
   87   HG22  ILE  10          2HG2      ILE  10  -2.104  -4.568   6.032
   88   HG23  ILE  10          3HG2      ILE  10  -0.387  -4.403   5.607
   89   HD11  ILE  10          3HD1      ILE  10  -1.839  -6.894   5.933
   90   HD12  ILE  10          1HD1      ILE  10  -3.065  -7.223   4.679
   91   HD13  ILE  10          2HD1      ILE  10  -1.621  -8.241   4.806
   92    H    ALA  11           H        ALA  11  -2.524  -2.812   1.741
   93    HA   ALA  11           HA       ALA  11  -2.788  -0.505   3.287
   94    HB1  ALA  11           3HB      ALA  11  -1.438  -0.790   1.249
   95    HB2  ALA  11           1HB      ALA  11  -2.914  -0.766   0.251
   96    HB3  ALA  11           2HB      ALA  11  -2.417   0.659   1.199
   97    H    LYS  12           H        LYS  12  -5.235  -1.749   0.902
   98    HA   LYS  12           HA       LYS  12  -7.224   0.235   1.586
   99    HB2  LYS  12           2HB      LYS  12  -7.466  -2.544   0.359
  100    HB3  LYS  12           3HB      LYS  12  -8.860  -1.562   0.762
  101    HG2  LYS  12           2HG      LYS  12  -8.693  -0.873  -1.368
  102    HG3  LYS  12           3HG      LYS  12  -7.647   0.328  -0.637
  103    HD2  LYS  12           2HD      LYS  12  -6.561  -0.462  -2.622
  104    HD3  LYS  12           3HD      LYS  12  -5.665  -1.095  -1.249
  105    HE2  LYS  12           2HE      LYS  12  -5.823  -2.901  -2.777
  106    HE3  LYS  12           3HE      LYS  12  -6.986  -3.277  -1.516
  107    HZ1  LYS  12           HZ1      LYS  12  -7.644  -2.067  -4.158
  108    HZ2  LYS  12           HZ2      LYS  12  -7.918  -3.619  -3.740
  109    HZ3  LYS  12           HZ3      LYS  12  -8.747  -2.425  -3.003
  110    H    LYS  13           H        LYS  13  -6.586  -2.991   3.013
  111    HA   LYS  13           HA       LYS  13  -8.878  -2.969   4.757
  112    HB2  LYS  13           2HB      LYS  13  -6.249  -4.499   4.834
  113    HB3  LYS  13           3HB      LYS  13  -7.551  -4.750   6.005
  114    HG2  LYS  13           2HG      LYS  13  -9.118  -5.390   4.243
  115    HG3  LYS  13           3HG      LYS  13  -7.949  -4.998   2.992
  116    HD2  LYS  13           2HD      LYS  13  -7.977  -7.389   3.241
  117    HD3  LYS  13           3HD      LYS  13  -6.431  -6.775   3.810
  118    HE2  LYS  13           2HE      LYS  13  -7.125  -8.487   5.325
  119    HE3  LYS  13           3HE      LYS  13  -7.255  -6.950   6.177
  120    HZ1  LYS  13           HZ1      LYS  13  -9.529  -8.413   4.930
  121    HZ2  LYS  13           HZ2      LYS  13  -9.212  -8.362   6.528
  122    HZ3  LYS  13           HZ3      LYS  13  -9.667  -7.004   5.748
  123    H    LYS  14           H        LYS  14  -5.611  -1.712   5.268
  124    HA   LYS  14           HA       LYS  14  -6.233  -0.765   8.011
  125    HB2  LYS  14           2HB      LYS  14  -3.797  -0.818   6.218
  126    HB3  LYS  14           3HB      LYS  14  -3.857   0.345   7.525
  127    HG2  LYS  14           2HG      LYS  14  -2.678  -1.671   8.189
  128    HG3  LYS  14           3HG      LYS  14  -4.077  -1.334   9.206
  129    HD2  LYS  14           2HD      LYS  14  -5.360  -3.120   8.127
  130    HD3  LYS  14           3HD      LYS  14  -4.035  -3.416   6.978
  131    HE2  LYS  14           2HE      LYS  14  -2.535  -4.026   8.838
  132    HE3  LYS  14           3HE      LYS  14  -3.792  -3.631  10.014
  133    HZ1  LYS  14           HZ1      LYS  14  -3.985  -5.817   8.008
  134    HZ2  LYS  14           HZ2      LYS  14  -3.691  -6.016   9.599
  135    HZ3  LYS  14           HZ3      LYS  14  -5.136  -5.444   9.113
  136    H    GLY  15           H        GLY  15  -6.826   0.497   4.902
  137    HA2  GLY  15           HA2      GLY  15  -7.526   2.564   4.164
  138    HA3  GLY  15           HA3      GLY  15  -7.664   3.106   5.842
  139    H    LYS  16           H        LYS  16  -4.716   1.842   4.357
  140    HA   LYS  16           HA       LYS  16  -3.318   4.465   4.686
  141    HB2  LYS  16           2HB      LYS  16  -3.211   2.965   6.730
  142    HB3  LYS  16           3HB      LYS  16  -2.388   1.767   5.742
  143    HG2  LYS  16           2HG      LYS  16  -0.763   2.937   7.042
  144    HG3  LYS  16           3HG      LYS  16  -0.522   3.424   5.365
  145    HD2  LYS  16           2HD      LYS  16  -1.730   5.545   5.788
  146    HD3  LYS  16           3HD      LYS  16  -2.044   5.061   7.458
  147    HE2  LYS  16           2HE      LYS  16   0.730   5.414   6.226
  148    HE3  LYS  16           3HE      LYS  16  -0.129   6.676   7.115
  149    HZ1  LYS  16           HZ1      LYS  16   1.396   5.507   8.574
  150    HZ2  LYS  16           HZ2      LYS  16  -0.129   5.220   9.072
  151    HZ3  LYS  16           HZ3      LYS  16   0.704   4.066   8.265
  152    H    CYS  17           H        CYS  17  -3.722   4.352   2.337
  153    HA   CYS  17           HA       CYS  17  -1.464   3.009   0.905
  154    HB2  CYS  17           2HB      CYS  17  -3.840   2.069   0.490
  155    HB3  CYS  17           3HB      CYS  17  -4.191   3.608  -0.261
  156    H    LYS  18           H        LYS  18  -0.152   4.416  -0.209
  157    HA   LYS  18           HA       LYS  18  -1.083   7.034  -1.149
  158    HB2  LYS  18           2HB      LYS  18   0.442   8.370   0.247
  159    HB3  LYS  18           3HB      LYS  18  -0.785   7.566   1.212
  160    HG2  LYS  18           2HG      LYS  18   0.803   5.930   2.038
  161    HG3  LYS  18           3HG      LYS  18   2.032   6.445   0.878
  162    HD2  LYS  18           2HD      LYS  18   2.562   7.304   3.084
  163    HD3  LYS  18           3HD      LYS  18   2.221   8.631   1.966
  164    HE2  LYS  18           2HE      LYS  18  -0.086   8.814   2.906
  165    HE3  LYS  18           3HE      LYS  18   0.275   7.496   4.029
  166    HZ1  LYS  18           HZ1      LYS  18   0.593   9.673   5.071
  167    HZ2  LYS  18           HZ2      LYS  18   2.032   8.906   4.989
  168    HZ3  LYS  18           HZ3      LYS  18   1.687  10.115   3.948
  169    H    GLY  19           H        GLY  19   0.679   8.350  -2.083
  170    HA2  GLY  19           HA2      GLY  19   2.421   8.621  -3.583
  171    HA3  GLY  19           HA3      GLY  19   3.294   7.642  -2.411
  172    HA   PRO  20           HA       PRO  20   3.817   5.149  -6.208
  173    HB2  PRO  20           2HB      PRO  20   5.389   3.520  -4.205
  174    HB3  PRO  20           3HB      PRO  20   5.801   3.930  -5.900
  175    HG2  PRO  20           2HG      PRO  20   6.953   5.296  -3.872
  176    HG3  PRO  20           3HG      PRO  20   6.328   6.193  -5.296
  177    HD2  PRO  20           2HD      PRO  20   4.991   5.779  -2.604
  178    HD3  PRO  20           3HD      PRO  20   5.164   7.282  -3.561
  179    H    LEU  21           H        LEU  21   2.963   3.789  -2.950
  180    HA   LEU  21           HA       LEU  21   1.995   1.322  -4.040
  181    HB2  LEU  21           2HB      LEU  21   2.684   1.677  -1.659
  182    HB3  LEU  21           3HB      LEU  21   1.233   2.638  -1.402
  183    HG   LEU  21           HG       LEU  21  -0.199   0.684  -1.859
  184   HD11  LEU  21          1HD1      LEU  21   1.114  -0.592  -3.469
  185   HD12  LEU  21          2HD1      LEU  21   2.409  -0.833  -2.268
  186   HD13  LEU  21          3HD1      LEU  21   0.814  -1.590  -2.050
  187   HD21  LEU  21          3HD2      LEU  21   2.047   0.107   0.108
  188   HD22  LEU  21          1HD2      LEU  21   0.562   1.038   0.426
  189   HD23  LEU  21          2HD2      LEU  21   0.467  -0.699   0.076
  190    H    LYS  22           H        LYS  22   0.382   4.390  -3.401
  191    HA   LYS  22           HA       LYS  22  -2.324   3.554  -4.067
  192    HB2  LYS  22           2HB      LYS  22  -1.990   5.547  -2.795
  193    HB3  LYS  22           3HB      LYS  22  -0.950   6.270  -4.034
  194    HG2  LYS  22           2HG      LYS  22  -2.800   6.550  -5.554
  195    HG3  LYS  22           3HG      LYS  22  -3.874   5.593  -4.523
  196    HD2  LYS  22           2HD      LYS  22  -3.710   7.299  -2.740
  197    HD3  LYS  22           3HD      LYS  22  -2.609   8.261  -3.756
  198    HE2  LYS  22           2HE      LYS  22  -4.382   8.450  -5.488
  199    HE3  LYS  22           3HE      LYS  22  -5.472   7.487  -4.484
  200    HZ1  LYS  22           HZ1      LYS  22  -5.890   9.858  -4.208
  201    HZ2  LYS  22           HZ2      LYS  22  -5.365   9.241  -2.794
  202    HZ3  LYS  22           HZ3      LYS  22  -4.359  10.137  -3.723
  203    H    LEU  23           H        LEU  23   0.341   4.857  -6.038
  204    HA   LEU  23           HA       LEU  23  -1.138   4.828  -8.505
  205    HB2  LEU  23           2HB      LEU  23   0.889   6.174  -8.114
  206    HB3  LEU  23           3HB      LEU  23   1.854   4.712  -7.939
  207    HG   LEU  23           HG       LEU  23   1.447   4.129 -10.311
  208   HD11  LEU  23          1HD1      LEU  23   0.476   5.843 -11.833
  209   HD12  LEU  23          2HD1      LEU  23  -0.725   5.204 -10.708
  210   HD13  LEU  23          3HD1      LEU  23  -0.010   6.810 -10.421
  211   HD21  LEU  23          3HD2      LEU  23   2.476   6.964  -9.896
  212   HD22  LEU  23          1HD2      LEU  23   3.411   5.470  -9.665
  213   HD23  LEU  23          2HD2      LEU  23   2.832   5.907 -11.281
  214    H    VAL  24           H        VAL  24   0.939   2.371  -6.970
  215    HA   VAL  24           HA       VAL  24   0.796   0.403  -9.071
  216    HB   VAL  24           HB       VAL  24   1.410   0.236  -6.099
  217   HG11  VAL  24          1HG1      VAL  24   0.728  -2.019  -6.750
  218   HG12  VAL  24          2HG1      VAL  24   1.777  -1.951  -8.186
  219   HG13  VAL  24          3HG1      VAL  24   2.475  -1.951  -6.550
  220   HG21  VAL  24          3HG2      VAL  24   2.998   1.517  -7.623
  221   HG22  VAL  24          1HG2      VAL  24   3.709   0.165  -6.748
  222   HG23  VAL  24          2HG2      VAL  24   3.296  -0.001  -8.476
  223    H    CYS  25           H        CYS  25  -1.060   0.782  -6.045
  224    HA   CYS  25           HA       CYS  25  -2.664  -1.604  -6.577
  225    HB2  CYS  25           2HB      CYS  25  -1.570  -0.979  -4.429
  226    HB3  CYS  25           3HB      CYS  25  -2.630   0.414  -4.319
  227    H    LYS  26           H        LYS  26  -3.066   1.728  -7.222
  228    HA   LYS  26           HA       LYS  26  -4.747   3.127  -7.762
  229    HB2  LYS  26           2HB      LYS  26  -5.925   0.570  -8.882
  230    HB3  LYS  26           3HB      LYS  26  -6.672   2.153  -9.132
  231    HG2  LYS  26           2HG      LYS  26  -3.734   1.721  -9.730
  232    HG3  LYS  26           3HG      LYS  26  -4.968   1.269 -10.911
  233    HD2  LYS  26           2HD      LYS  26  -5.701   3.492 -11.215
  234    HD3  LYS  26           3HD      LYS  26  -4.937   4.072  -9.723
  235    HE2  LYS  26           2HE      LYS  26  -2.722   3.713 -10.613
  236    HE3  LYS  26           3HE      LYS  26  -3.371   2.978 -12.087
  237    HZ1  LYS  26           HZ1      LYS  26  -3.796   5.810 -11.274
  238    HZ2  LYS  26           HZ2      LYS  26  -2.799   5.308 -12.468
  239    HZ3  LYS  26           HZ3      LYS  26  -4.410   5.122 -12.622
  240    H    CYS  27           H        CYS  27  -4.598   3.102  -5.460
  241    HA   CYS  27           HA       CYS  27  -6.948   2.330  -3.874
  242    HB2  CYS  27           2HB      CYS  27  -4.527   4.025  -3.158
  243    HB3  CYS  27           3HB      CYS  27  -5.791   3.556  -2.051
  Start of MODEL   31
    1    H1   GLY   1           1H       GLY   1  11.385  -6.424   4.624
    2    H2   GLY   1           2H       GLY   1  10.521  -7.749   5.057
    3    H3   GLY   1           3H       GLY   1  11.206  -7.669   3.573
    4    HA2  GLY   1           HA2      GLY   1   9.042  -5.914   4.544
    5    HA3  GLY   1           HA3      GLY   1   9.777  -5.844   2.933
    6    H    LEU   2           H        LEU   2   7.516  -6.115   2.243
    7    HA   LEU   2           HA       LEU   2   6.769  -8.975   1.937
    8    HB2  LEU   2           2HB      LEU   2   4.920  -6.665   2.638
    9    HB3  LEU   2           3HB      LEU   2   4.346  -8.228   2.082
   10    HG   LEU   2           HG       LEU   2   5.967  -7.820   4.634
   11   HD11  LEU   2          1HD1      LEU   2   3.756  -6.720   4.750
   12   HD12  LEU   2          2HD1      LEU   2   2.975  -8.250   4.296
   13   HD13  LEU   2          3HD1      LEU   2   3.865  -8.121   5.826
   14   HD21  LEU   2          3HD2      LEU   2   6.163 -10.117   3.754
   15   HD22  LEU   2          1HD2      LEU   2   5.142 -10.096   5.193
   16   HD23  LEU   2          2HD2      LEU   2   4.396 -10.221   3.585
   17    HA   PRO   3           HA       PRO   3   6.452  -7.918  -2.359
   18    HB2  PRO   3           2HB      PRO   3   3.974  -9.604  -2.538
   19    HB3  PRO   3           3HB      PRO   3   5.471  -9.690  -3.512
   20    HG2  PRO   3           2HG      PRO   3   4.987 -11.517  -1.561
   21    HG3  PRO   3           3HG      PRO   3   6.632 -10.834  -1.777
   22    HD2  PRO   3           2HD      PRO   3   4.514 -10.019   0.232
   23    HD3  PRO   3           3HD      PRO   3   6.255 -10.339   0.480
   24    H    ARG   4           H        ARG   4   5.288  -6.633  -3.885
   25    HA   ARG   4           HA       ARG   4   3.663  -4.554  -2.844
   26    HB2  ARG   4           2HB      ARG   4   4.067  -5.502  -5.713
   27    HB3  ARG   4           3HB      ARG   4   3.205  -4.024  -5.274
   28    HG2  ARG   4           2HG      ARG   4   5.212  -3.160  -4.115
   29    HG3  ARG   4           3HG      ARG   4   6.125  -4.598  -4.590
   30    HD2  ARG   4           2HD      ARG   4   4.860  -2.584  -6.494
   31    HD3  ARG   4           3HD      ARG   4   6.567  -2.628  -6.033
   32    HE   ARG   4           HE       ARG   4   6.018  -5.181  -7.033
   33   HH11  ARG   4          1HH2      ARG   4   6.003  -1.940  -8.367
   34   HH12  ARG   4          2HH2      ARG   4   6.324  -2.507  -9.983
   35   HH21  ARG   4          1HH1      ARG   4   6.420  -5.834  -9.120
   36   HH22  ARG   4          2HH1      ARG   4   6.559  -4.653 -10.389
   37    H    LYS   5           H        LYS   5   2.595  -7.534  -4.439
   38    HA   LYS   5           HA       LYS   5  -0.206  -6.924  -4.586
   39    HB2  LYS   5           2HB      LYS   5   0.965  -8.755  -5.792
   40    HB3  LYS   5           3HB      LYS   5   1.179  -9.626  -4.267
   41    HG2  LYS   5           2HG      LYS   5  -1.297  -9.753  -4.005
   42    HG3  LYS   5           3HG      LYS   5  -1.507  -8.891  -5.529
   43    HD2  LYS   5           2HD      LYS   5  -0.151 -11.600  -5.149
   44    HD3  LYS   5           3HD      LYS   5  -1.799 -11.371  -5.716
   45    HE2  LYS   5           2HE      LYS   5   0.703 -10.395  -7.174
   46    HE3  LYS   5           3HE      LYS   5  -0.154 -11.893  -7.523
   47    HZ1  LYS   5           HZ1      LYS   5  -2.126 -10.577  -8.083
   48    HZ2  LYS   5           HZ2      LYS   5  -1.330  -9.178  -7.795
   49    HZ3  LYS   5           HZ3      LYS   5  -0.867 -10.146  -9.021
   50    H    ILE   6           H        ILE   6   1.733  -8.296  -1.949
   51    HA   ILE   6           HA       ILE   6  -0.560  -8.795  -0.198
   52    HB   ILE   6           HB       ILE   6   2.446  -8.962   0.101
   53   HG12  ILE   6          2HG1      ILE   6   1.975 -11.300   0.695
   54   HG13  ILE   6          3HG1      ILE   6   0.239 -11.022   0.572
   55   HG21  ILE   6          1HG2      ILE   6   1.734  -8.042   2.239
   56   HG22  ILE   6          2HG2      ILE   6   0.409  -9.226   2.347
   57   HG23  ILE   6          3HG2      ILE   6   2.103  -9.753   2.442
   58   HD11  ILE   6          3HD1      ILE   6   0.402 -10.778  -1.849
   59   HD12  ILE   6          1HD1      ILE   6   2.184 -10.829  -1.765
   60   HD13  ILE   6          2HD1      ILE   6   1.224 -12.259  -1.353
   61    H    LEU   7           H        LEU   7   2.036  -6.291  -0.340
   62    HA   LEU   7           HA       LEU   7   1.071  -4.655   1.780
   63    HB2  LEU   7           2HB      LEU   7   2.497  -3.943  -0.820
   64    HB3  LEU   7           3HB      LEU   7   2.219  -2.792   0.479
   65    HG   LEU   7           HG       LEU   7   3.859  -5.344   0.785
   66   HD11  LEU   7          1HD1      LEU   7   4.920  -3.729  -0.741
   67   HD12  LEU   7          2HD1      LEU   7   4.723  -2.437   0.468
   68   HD13  LEU   7          3HD1      LEU   7   5.795  -3.820   0.791
   69   HD21  LEU   7          3HD2      LEU   7   3.444  -2.952   2.633
   70   HD22  LEU   7          1HD2      LEU   7   2.945  -4.633   2.942
   71   HD23  LEU   7          2HD2      LEU   7   4.661  -4.222   2.873
   72    H    CYS   8           H        CYS   8   0.082  -4.723  -1.645
   73    HA   CYS   8           HA       CYS   8  -1.723  -2.540  -1.586
   74    HB2  CYS   8           2HB      CYS   8  -0.882  -3.524  -3.617
   75    HB3  CYS   8           3HB      CYS   8  -1.603  -5.084  -3.242
   76    H    ALA   9           H        ALA   9  -2.326  -5.993  -0.677
   77    HA   ALA   9           HA       ALA   9  -5.181  -5.746  -0.441
   78    HB1  ALA   9           3HB      ALA   9  -3.895  -7.900  -0.625
   79    HB2  ALA   9           1HB      ALA   9  -3.206  -7.610   0.994
   80    HB3  ALA   9           2HB      ALA   9  -4.951  -7.867   0.804
   81    H    ILE  10           H        ILE  10  -2.484  -5.289   1.760
   82    HA   ILE  10           HA       ILE  10  -4.059  -4.896   4.158
   83    HB   ILE  10           HB       ILE  10  -1.110  -4.501   3.515
   84   HG12  ILE  10          2HG1      ILE  10  -2.554  -6.834   4.867
   85   HG13  ILE  10          3HG1      ILE  10  -2.093  -6.846   3.197
   86   HG21  ILE  10          1HG2      ILE  10  -0.732  -4.601   5.953
   87   HG22  ILE  10          2HG2      ILE  10  -1.760  -3.231   5.554
   88   HG23  ILE  10          3HG2      ILE  10  -2.482  -4.707   6.237
   89   HD11  ILE  10          3HD1      ILE  10  -0.152  -6.776   5.505
   90   HD12  ILE  10          1HD1      ILE  10  -0.477  -8.085   4.346
   91   HD13  ILE  10          2HD1      ILE  10   0.286  -6.587   3.783
   92    H    ALA  11           H        ALA  11  -2.413  -2.720   1.854
   93    HA   ALA  11           HA       ALA  11  -2.815  -0.302   3.250
   94    HB1  ALA  11           3HB      ALA  11  -1.292  -0.704   1.331
   95    HB2  ALA  11           1HB      ALA  11  -2.701  -0.745   0.235
   96    HB3  ALA  11           2HB      ALA  11  -2.281   0.731   1.138
   97    H    LYS  12           H        LYS  12  -4.974  -1.831   0.780
   98    HA   LYS  12           HA       LYS  12  -7.156   0.013   0.938
   99    HB2  LYS  12           2HB      LYS  12  -7.205  -3.043   0.620
  100    HB3  LYS  12           3HB      LYS  12  -8.575  -1.985   0.308
  101    HG2  LYS  12           2HG      LYS  12  -5.947  -1.882  -1.189
  102    HG3  LYS  12           3HG      LYS  12  -7.369  -2.774  -1.731
  103    HD2  LYS  12           2HD      LYS  12  -8.628  -0.756  -2.116
  104    HD3  LYS  12           3HD      LYS  12  -7.484   0.213  -1.163
  105    HE2  LYS  12           2HE      LYS  12  -6.815   0.721  -3.294
  106    HE3  LYS  12           3HE      LYS  12  -5.681  -0.517  -2.714
  107    HZ1  LYS  12           HZ1      LYS  12  -6.943  -2.154  -4.045
  108    HZ2  LYS  12           HZ2      LYS  12  -7.969  -0.990  -4.572
  109    HZ3  LYS  12           HZ3      LYS  12  -6.393  -0.949  -5.008
  110    H    LYS  13           H        LYS  13  -6.505  -2.863   2.781
  111    HA   LYS  13           HA       LYS  13  -8.873  -2.861   4.374
  112    HB2  LYS  13           2HB      LYS  13  -7.388  -4.799   3.891
  113    HB3  LYS  13           3HB      LYS  13  -6.205  -4.169   5.047
  114    HG2  LYS  13           2HG      LYS  13  -7.908  -4.353   6.860
  115    HG3  LYS  13           3HG      LYS  13  -9.084  -4.965   5.694
  116    HD2  LYS  13           2HD      LYS  13  -6.441  -6.318   6.408
  117    HD3  LYS  13           3HD      LYS  13  -8.023  -6.740   7.079
  118    HE2  LYS  13           2HE      LYS  13  -8.844  -7.256   4.769
  119    HE3  LYS  13           3HE      LYS  13  -7.225  -6.930   4.138
  120    HZ1  LYS  13           HZ1      LYS  13  -7.891  -9.053   6.109
  121    HZ2  LYS  13           HZ2      LYS  13  -7.559  -9.300   4.533
  122    HZ3  LYS  13           HZ3      LYS  13  -6.390  -8.754   5.533
  123    H    LYS  14           H        LYS  14  -5.662  -1.561   5.206
  124    HA   LYS  14           HA       LYS  14  -6.694  -0.457   7.764
  125    HB2  LYS  14           2HB      LYS  14  -3.919  -0.764   6.579
  126    HB3  LYS  14           3HB      LYS  14  -4.226   0.265   7.970
  127    HG2  LYS  14           2HG      LYS  14  -3.410  -1.841   8.717
  128    HG3  LYS  14           3HG      LYS  14  -5.049  -1.553   9.302
  129    HD2  LYS  14           2HD      LYS  14  -5.962  -3.184   7.743
  130    HD3  LYS  14           3HD      LYS  14  -4.409  -3.312   6.902
  131    HE2  LYS  14           2HE      LYS  14  -4.667  -5.255   8.292
  132    HE3  LYS  14           3HE      LYS  14  -3.373  -4.254   8.952
  133    HZ1  LYS  14           HZ1      LYS  14  -4.879  -5.065  10.686
  134    HZ2  LYS  14           HZ2      LYS  14  -4.943  -3.440  10.629
  135    HZ3  LYS  14           HZ3      LYS  14  -6.161  -4.331   9.997
  136    H    GLY  15           H        GLY  15  -6.301   0.745   4.579
  137    HA2  GLY  15           HA2      GLY  15  -7.096   2.787   3.775
  138    HA3  GLY  15           HA3      GLY  15  -7.280   3.399   5.425
  139    H    LYS  16           H        LYS  16  -4.359   1.909   4.217
  140    HA   LYS  16           HA       LYS  16  -2.762   4.348   4.864
  141    HB2  LYS  16           2HB      LYS  16  -2.229   1.352   5.017
  142    HB3  LYS  16           3HB      LYS  16  -1.029   2.563   5.359
  143    HG2  LYS  16           2HG      LYS  16  -3.587   2.154   6.924
  144    HG3  LYS  16           3HG      LYS  16  -1.982   1.619   7.381
  145    HD2  LYS  16           2HD      LYS  16  -2.058   3.497   8.655
  146    HD3  LYS  16           3HD      LYS  16  -1.382   4.198   7.196
  147    HE2  LYS  16           2HE      LYS  16  -3.071   5.685   7.965
  148    HE3  LYS  16           3HE      LYS  16  -3.733   4.907   6.533
  149    HZ1  LYS  16           HZ1      LYS  16  -5.334   4.999   8.370
  150    HZ2  LYS  16           HZ2      LYS  16  -5.030   3.439   8.009
  151    HZ3  LYS  16           HZ3      LYS  16  -4.356   4.127   9.337
  152    H    CYS  17           H        CYS  17  -3.860   3.507   2.093
  153    HA   CYS  17           HA       CYS  17  -1.436   2.878   0.580
  154    HB2  CYS  17           2HB      CYS  17  -3.808   1.950   0.180
  155    HB3  CYS  17           3HB      CYS  17  -4.180   3.535  -0.481
  156    H    LYS  18           H        LYS  18  -0.087   4.359  -0.123
  157    HA   LYS  18           HA       LYS  18  -0.868   6.973  -1.204
  158    HB2  LYS  18           2HB      LYS  18   0.434   8.283   0.477
  159    HB3  LYS  18           3HB      LYS  18  -0.977   7.505   1.175
  160    HG2  LYS  18           2HG      LYS  18   0.417   5.729   2.152
  161    HG3  LYS  18           3HG      LYS  18   1.867   6.417   1.392
  162    HD2  LYS  18           2HD      LYS  18   1.565   8.500   2.703
  163    HD3  LYS  18           3HD      LYS  18   0.103   7.817   3.452
  164    HE2  LYS  18           2HE      LYS  18   1.451   5.956   4.389
  165    HE3  LYS  18           3HE      LYS  18   2.906   6.618   3.633
  166    HZ1  LYS  18           HZ1      LYS  18   2.639   8.611   5.011
  167    HZ2  LYS  18           HZ2      LYS  18   1.292   8.005   5.711
  168    HZ3  LYS  18           HZ3      LYS  18   2.736   7.290   5.961
  169    H    GLY  19           H        GLY  19   1.091   8.322  -1.751
  170    HA2  GLY  19           HA2      GLY  19   3.029   8.548  -3.005
  171    HA3  GLY  19           HA3      GLY  19   3.695   7.307  -1.942
  172    HA   PRO  20           HA       PRO  20   3.941   5.275  -6.063
  173    HB2  PRO  20           2HB      PRO  20   5.500   3.373  -4.305
  174    HB3  PRO  20           3HB      PRO  20   5.855   3.916  -5.975
  175    HG2  PRO  20           2HG      PRO  20   7.193   5.008  -3.895
  176    HG3  PRO  20           3HG      PRO  20   6.561   6.074  -5.195
  177    HD2  PRO  20           2HD      PRO  20   5.336   5.492  -2.482
  178    HD3  PRO  20           3HD      PRO  20   5.557   7.066  -3.307
  179    H    LEU  21           H        LEU  21   3.072   3.761  -2.898
  180    HA   LEU  21           HA       LEU  21   2.031   1.376  -4.052
  181    HB2  LEU  21           2HB      LEU  21   2.740   1.684  -1.674
  182    HB3  LEU  21           3HB      LEU  21   1.293   2.642  -1.386
  183    HG   LEU  21           HG       LEU  21  -0.146   0.704  -1.818
  184   HD11  LEU  21          1HD1      LEU  21   0.845  -1.571  -2.098
  185   HD12  LEU  21          2HD1      LEU  21   1.105  -0.544  -3.504
  186   HD13  LEU  21          3HD1      LEU  21   2.437  -0.822  -2.355
  187   HD21  LEU  21          3HD2      LEU  21   0.726   1.012   0.452
  188   HD22  LEU  21          1HD2      LEU  21   0.585  -0.716   0.076
  189   HD23  LEU  21          2HD2      LEU  21   2.177   0.063   0.048
  190    H    LYS  22           H        LYS  22   0.485   4.490  -3.441
  191    HA   LYS  22           HA       LYS  22  -2.229   3.747  -4.111
  192    HB2  LYS  22           2HB      LYS  22  -1.827   5.770  -2.929
  193    HB3  LYS  22           3HB      LYS  22  -0.725   6.388  -4.168
  194    HG2  LYS  22           2HG      LYS  22  -2.523   6.721  -5.736
  195    HG3  LYS  22           3HG      LYS  22  -3.671   5.857  -4.702
  196    HD2  LYS  22           2HD      LYS  22  -3.457   7.605  -2.971
  197    HD3  LYS  22           3HD      LYS  22  -2.279   8.473  -3.986
  198    HE2  LYS  22           2HE      LYS  22  -3.999   8.703  -5.768
  199    HE3  LYS  22           3HE      LYS  22  -5.164   7.838  -4.761
  200    HZ1  LYS  22           HZ1      LYS  22  -4.993   9.639  -3.126
  201    HZ2  LYS  22           HZ2      LYS  22  -3.917  10.444  -4.059
  202    HZ3  LYS  22           HZ3      LYS  22  -5.451  10.237  -4.572
  203    H    LEU  23           H        LEU  23   0.480   4.753  -6.140
  204    HA   LEU  23           HA       LEU  23  -1.053   4.660  -8.604
  205    HB2  LEU  23           2HB      LEU  23   0.981   6.017  -8.332
  206    HB3  LEU  23           3HB      LEU  23   1.944   4.563  -8.087
  207    HG   LEU  23           HG       LEU  23   1.479   3.831 -10.406
  208   HD11  LEU  23          1HD1      LEU  23  -0.698   4.894 -10.823
  209   HD12  LEU  23          2HD1      LEU  23   0.034   6.509 -10.658
  210   HD13  LEU  23          3HD1      LEU  23   0.482   5.449 -12.013
  211   HD21  LEU  23          3HD2      LEU  23   2.850   5.535 -11.520
  212   HD22  LEU  23          1HD2      LEU  23   2.531   6.682 -10.199
  213   HD23  LEU  23          2HD2      LEU  23   3.465   5.199  -9.893
  214    H    VAL  24           H        VAL  24   1.050   2.300  -6.944
  215    HA   VAL  24           HA       VAL  24   0.918   0.227  -8.936
  216    HB   VAL  24           HB       VAL  24   1.520   0.181  -5.957
  217   HG11  VAL  24          1HG1      VAL  24   2.633  -1.990  -6.321
  218   HG12  VAL  24          2HG1      VAL  24   0.895  -2.110  -6.564
  219   HG13  VAL  24          3HG1      VAL  24   1.979  -2.053  -7.975
  220   HG21  VAL  24          3HG2      VAL  24   3.844   0.082  -6.625
  221   HG22  VAL  24          1HG2      VAL  24   3.399  -0.023  -8.348
  222   HG23  VAL  24          2HG2      VAL  24   3.109   1.463  -7.433
  223    H    CYS  25           H        CYS  25  -0.976   0.758  -5.974
  224    HA   CYS  25           HA       CYS  25  -2.597  -1.659  -6.406
  225    HB2  CYS  25           2HB      CYS  25  -1.398  -1.024  -4.310
  226    HB3  CYS  25           3HB      CYS  25  -2.452   0.361  -4.153
  227    H    LYS  26           H        LYS  26  -2.895   1.529  -7.299
  228    HA   LYS  26           HA       LYS  26  -4.530   2.968  -7.939
  229    HB2  LYS  26           2HB      LYS  26  -5.773   0.329  -8.749
  230    HB3  LYS  26           3HB      LYS  26  -6.503   1.884  -9.172
  231    HG2  LYS  26           2HG      LYS  26  -3.575   1.348  -9.741
  232    HG3  LYS  26           3HG      LYS  26  -4.828   0.782 -10.854
  233    HD2  LYS  26           2HD      LYS  26  -5.558   2.986 -11.363
  234    HD3  LYS  26           3HD      LYS  26  -4.694   3.703  -9.990
  235    HE2  LYS  26           2HE      LYS  26  -2.543   3.157 -10.953
  236    HE3  LYS  26           3HE      LYS  26  -3.306   2.296 -12.299
  237    HZ1  LYS  26           HZ1      LYS  26  -3.587   5.212 -11.775
  238    HZ2  LYS  26           HZ2      LYS  26  -2.670   4.550 -12.953
  239    HZ3  LYS  26           HZ3      LYS  26  -4.292   4.410 -13.010
  240    H    CYS  27           H        CYS  27  -4.497   3.491  -5.808
  241    HA   CYS  27           HA       CYS  27  -6.925   2.911  -4.177
  242    HB2  CYS  27           2HB      CYS  27  -4.351   4.296  -3.369
  243    HB3  CYS  27           3HB      CYS  27  -5.673   3.847  -2.314
  Start of MODEL   32
    1    H1   GLY   1           1H       GLY   1  11.508  -7.266   4.698
    2    H2   GLY   1           2H       GLY   1  10.800  -8.661   4.205
    3    H3   GLY   1           3H       GLY   1  11.239  -7.534   3.103
    4    HA2  GLY   1           HA2      GLY   1   9.148  -7.191   5.153
    5    HA3  GLY   1           HA3      GLY   1   9.628  -5.964   3.969
    6    H    LEU   2           H        LEU   2   7.013  -6.669   4.083
    7    HA   LEU   2           HA       LEU   2   6.259  -8.802   2.291
    8    HB2  LEU   2           2HB      LEU   2   4.820  -6.451   3.546
    9    HB3  LEU   2           3HB      LEU   2   4.042  -7.433   2.315
   10    HG   LEU   2           HG       LEU   2   4.192  -9.434   3.658
   11   HD11  LEU   2          1HD1      LEU   2   6.220  -9.117   4.978
   12   HD12  LEU   2          2HD1      LEU   2   5.503  -7.705   5.801
   13   HD13  LEU   2          3HD1      LEU   2   4.846  -9.336   6.060
   14   HD21  LEU   2          3HD2      LEU   2   2.604  -8.782   5.408
   15   HD22  LEU   2          1HD2      LEU   2   3.110  -7.083   5.271
   16   HD23  LEU   2          2HD2      LEU   2   2.270  -7.876   3.927
   17    HA   PRO   3           HA       PRO   3   6.851  -6.486  -1.518
   18    HB2  PRO   3           2HB      PRO   3   5.782  -8.166  -3.348
   19    HB3  PRO   3           3HB      PRO   3   7.235  -8.617  -2.399
   20    HG2  PRO   3           2HG      PRO   3   4.346  -9.327  -1.822
   21    HG3  PRO   3           3HG      PRO   3   5.744 -10.445  -1.912
   22    HD2  PRO   3           2HD      PRO   3   4.817  -9.418   0.458
   23    HD3  PRO   3           3HD      PRO   3   6.555  -9.733   0.175
   24    H    ARG   4           H        ARG   4   5.672  -5.347  -3.172
   25    HA   ARG   4           HA       ARG   4   3.450  -3.917  -2.243
   26    HB2  ARG   4           2HB      ARG   4   3.385  -2.813  -4.295
   27    HB3  ARG   4           3HB      ARG   4   5.049  -3.051  -3.774
   28    HG2  ARG   4           2HG      ARG   4   5.249  -4.966  -5.431
   29    HG3  ARG   4           3HG      ARG   4   3.583  -4.620  -5.947
   30    HD2  ARG   4           2HD      ARG   4   4.866  -3.415  -7.481
   31    HD3  ARG   4           3HD      ARG   4   4.342  -2.213  -6.272
   32    HE   ARG   4           HE       ARG   4   6.880  -3.217  -5.480
   33   HH11  ARG   4          1HH2      ARG   4   5.631  -1.244  -8.091
   34   HH12  ARG   4          2HH2      ARG   4   7.129  -0.372  -8.268
   35   HH21  ARG   4          1HH1      ARG   4   8.761  -2.067  -5.762
   36   HH22  ARG   4          2HH1      ARG   4   8.851  -0.836  -6.986
   37    H    LYS   5           H        LYS   5   3.349  -6.834  -4.220
   38    HA   LYS   5           HA       LYS   5   0.572  -6.618  -4.964
   39    HB2  LYS   5           2HB      LYS   5   2.671  -8.183  -5.759
   40    HB3  LYS   5           3HB      LYS   5   1.814  -9.342  -4.765
   41    HG2  LYS   5           2HG      LYS   5   0.768  -7.782  -7.168
   42    HG3  LYS   5           3HG      LYS   5   1.176  -9.491  -7.127
   43    HD2  LYS   5           2HD      LYS   5  -1.175  -8.162  -5.718
   44    HD3  LYS   5           3HD      LYS   5  -1.234  -9.160  -7.165
   45    HE2  LYS   5           2HE      LYS   5  -0.441 -11.125  -5.922
   46    HE3  LYS   5           3HE      LYS   5  -0.271 -10.160  -4.450
   47    HZ1  LYS   5           HZ1      LYS   5  -2.667  -9.775  -4.483
   48    HZ2  LYS   5           HZ2      LYS   5  -2.841 -10.652  -5.853
   49    HZ3  LYS   5           HZ3      LYS   5  -2.372 -11.381  -4.473
   50    H    ILE   6           H        ILE   6   2.161  -8.153  -2.173
   51    HA   ILE   6           HA       ILE   6  -0.340  -9.192  -1.038
   52    HB   ILE   6           HB       ILE   6   2.559  -9.087  -0.197
   53   HG12  ILE   6          2HG1      ILE   6   2.278 -11.513   0.026
   54   HG13  ILE   6          3HG1      ILE   6   0.553 -11.376  -0.314
   55   HG21  ILE   6          1HG2      ILE   6   1.970 -10.193   1.951
   56   HG22  ILE   6          2HG2      ILE   6   1.431  -8.521   1.881
   57   HG23  ILE   6          3HG2      ILE   6   0.256  -9.836   1.649
   58   HD11  ILE   6          3HD1      ILE   6   0.998 -10.813  -2.640
   59   HD12  ILE   6          1HD1      ILE   6   2.752 -10.761  -2.322
   60   HD13  ILE   6          2HD1      ILE   6   1.867 -12.287  -2.200
   61    H    LEU   7           H        LEU   7   1.812  -6.378  -0.434
   62    HA   LEU   7           HA       LEU   7   0.235  -5.188   1.631
   63    HB2  LEU   7           2HB      LEU   7   2.036  -3.961  -0.489
   64    HB3  LEU   7           3HB      LEU   7   1.336  -3.046   0.838
   65    HG   LEU   7           HG       LEU   7   3.236  -5.401   1.209
   66   HD11  LEU   7          1HD1      LEU   7   4.874  -3.672   1.834
   67   HD12  LEU   7          2HD1      LEU   7   4.332  -3.458   0.165
   68   HD13  LEU   7          3HD1      LEU   7   3.696  -2.397   1.443
   69   HD21  LEU   7          3HD2      LEU   7   3.405  -4.498   3.543
   70   HD22  LEU   7          1HD2      LEU   7   2.069  -3.387   3.181
   71   HD23  LEU   7          2HD2      LEU   7   1.808  -5.148   3.173
   72    H    CYS   8           H        CYS   8  -0.345  -5.289  -1.833
   73    HA   CYS   8           HA       CYS   8  -2.091  -3.138  -2.122
   74    HB2  CYS   8           2HB      CYS   8  -1.033  -5.040  -3.731
   75    HB3  CYS   8           3HB      CYS   8  -2.625  -5.743  -3.562
   76    H    ALA   9           H        ALA   9  -2.785  -6.300  -0.699
   77    HA   ALA   9           HA       ALA   9  -5.685  -5.907  -0.553
   78    HB1  ALA   9           3HB      ALA   9  -5.546  -7.948   0.850
   79    HB2  ALA   9           1HB      ALA   9  -4.632  -8.154  -0.659
   80    HB3  ALA   9           2HB      ALA   9  -3.772  -7.834   0.867
   81    H    ILE  10           H        ILE  10  -2.899  -5.625   1.589
   82    HA   ILE  10           HA       ILE  10  -4.345  -5.173   4.024
   83    HB   ILE  10           HB       ILE  10  -1.424  -4.812   3.249
   84   HG12  ILE  10          2HG1      ILE  10  -2.725  -7.117   4.775
   85   HG13  ILE  10          3HG1      ILE  10  -2.529  -7.154   3.036
   86   HG21  ILE  10          1HG2      ILE  10  -0.916  -4.922   5.668
   87   HG22  ILE  10          2HG2      ILE  10  -1.913  -3.517   5.307
   88   HG23  ILE  10          3HG2      ILE  10  -2.652  -4.961   6.034
   89   HD11  ILE  10          3HD1      ILE  10  -0.095  -6.919   3.241
   90   HD12  ILE  10          1HD1      ILE  10  -0.247  -7.020   5.018
   91   HD13  ILE  10          2HD1      ILE  10  -0.746  -8.383   3.991
   92    H    ALA  11           H        ALA  11  -2.699  -2.985   1.747
   93    HA   ALA  11           HA       ALA  11  -2.662  -0.640   3.271
   94    HB1  ALA  11           3HB      ALA  11  -2.977  -1.006   0.245
   95    HB2  ALA  11           1HB      ALA  11  -2.284   0.406   1.084
   96    HB3  ALA  11           2HB      ALA  11  -1.456  -1.137   1.168
   97    H    LYS  12           H        LYS  12  -5.141  -1.714   0.956
   98    HA   LYS  12           HA       LYS  12  -7.027   0.433   1.372
   99    HB2  LYS  12           2HB      LYS  12  -7.438  -2.416   0.355
  100    HB3  LYS  12           3HB      LYS  12  -8.574  -1.073   0.149
  101    HG2  LYS  12           2HG      LYS  12  -6.996   0.140  -1.255
  102    HG3  LYS  12           3HG      LYS  12  -5.715  -1.042  -0.934
  103    HD2  LYS  12           2HD      LYS  12  -7.129  -2.827  -1.966
  104    HD3  LYS  12           3HD      LYS  12  -8.290  -1.553  -2.457
  105    HE2  LYS  12           2HE      LYS  12  -6.311  -0.355  -3.506
  106    HE3  LYS  12           3HE      LYS  12  -5.336  -1.789  -3.133
  107    HZ1  LYS  12           HZ1      LYS  12  -6.269  -1.713  -5.448
  108    HZ2  LYS  12           HZ2      LYS  12  -6.720  -3.074  -4.635
  109    HZ3  LYS  12           HZ3      LYS  12  -7.775  -1.839  -4.847
  110    H    LYS  13           H        LYS  13  -6.782  -2.840   2.682
  111    HA   LYS  13           HA       LYS  13  -9.125  -2.854   4.305
  112    HB2  LYS  13           2HB      LYS  13  -7.765  -4.820   3.657
  113    HB3  LYS  13           3HB      LYS  13  -6.493  -4.318   4.780
  114    HG2  LYS  13           2HG      LYS  13  -8.100  -4.548   6.674
  115    HG3  LYS  13           3HG      LYS  13  -9.356  -5.061   5.546
  116    HD2  LYS  13           2HD      LYS  13  -6.707  -6.482   6.083
  117    HD3  LYS  13           3HD      LYS  13  -8.263  -6.959   6.748
  118    HE2  LYS  13           2HE      LYS  13  -7.554  -6.947   3.774
  119    HE3  LYS  13           3HE      LYS  13  -7.504  -8.359   4.827
  120    HZ1  LYS  13           HZ1      LYS  13  -9.898  -8.101   5.205
  121    HZ2  LYS  13           HZ2      LYS  13  -9.962  -6.813   4.200
  122    HZ3  LYS  13           HZ3      LYS  13  -9.586  -8.287   3.617
  123    H    LYS  14           H        LYS  14  -5.835  -1.783   5.190
  124    HA   LYS  14           HA       LYS  14  -6.747  -0.840   7.847
  125    HB2  LYS  14           2HB      LYS  14  -4.063  -1.166   6.491
  126    HB3  LYS  14           3HB      LYS  14  -4.213  -0.057   7.838
  127    HG2  LYS  14           2HG      LYS  14  -3.454  -2.143   8.675
  128    HG3  LYS  14           3HG      LYS  14  -5.069  -1.814   9.303
  129    HD2  LYS  14           2HD      LYS  14  -6.037  -3.407   7.665
  130    HD3  LYS  14           3HD      LYS  14  -4.427  -3.746   7.024
  131    HE2  LYS  14           2HE      LYS  14  -5.392  -4.241   9.885
  132    HE3  LYS  14           3HE      LYS  14  -5.294  -5.469   8.623
  133    HZ1  LYS  14           HZ1      LYS  14  -2.968  -4.005   9.756
  134    HZ2  LYS  14           HZ2      LYS  14  -3.356  -5.556  10.057
  135    HZ3  LYS  14           HZ3      LYS  14  -2.874  -5.122   8.563
  136    H    GLY  15           H        GLY  15  -6.742   0.554   4.777
  137    HA2  GLY  15           HA2      GLY  15  -7.388   2.664   4.124
  138    HA3  GLY  15           HA3      GLY  15  -7.502   3.160   5.814
  139    H    LYS  16           H        LYS  16  -4.492   1.828   4.535
  140    HA   LYS  16           HA       LYS  16  -3.248   4.545   4.348
  141    HB2  LYS  16           2HB      LYS  16  -2.836   3.579   6.604
  142    HB3  LYS  16           3HB      LYS  16  -2.055   2.183   5.846
  143    HG2  LYS  16           2HG      LYS  16  -0.351   3.699   4.833
  144    HG3  LYS  16           3HG      LYS  16  -1.163   5.095   5.568
  145    HD2  LYS  16           2HD      LYS  16  -0.708   4.172   7.826
  146    HD3  LYS  16           3HD      LYS  16   0.086   2.760   7.090
  147    HE2  LYS  16           2HE      LYS  16   1.739   4.264   6.002
  148    HE3  LYS  16           3HE      LYS  16   0.950   5.667   6.731
  149    HZ1  LYS  16           HZ1      LYS  16   2.251   3.465   8.251
  150    HZ2  LYS  16           HZ2      LYS  16   2.874   4.956   8.036
  151    HZ3  LYS  16           HZ3      LYS  16   1.522   4.763   8.926
  152    H    CYS  17           H        CYS  17  -3.124   4.543   2.196
  153    HA   CYS  17           HA       CYS  17  -1.154   2.728   0.885
  154    HB2  CYS  17           2HB      CYS  17  -3.542   1.980   0.446
  155    HB3  CYS  17           3HB      CYS  17  -3.836   3.534  -0.294
  156    H    LYS  18           H        LYS  18   0.402   3.988  -0.006
  157    HA   LYS  18           HA       LYS  18  -0.131   6.742  -1.005
  158    HB2  LYS  18           2HB      LYS  18   1.475   6.077   1.510
  159    HB3  LYS  18           3HB      LYS  18   1.793   7.531   0.568
  160    HG2  LYS  18           2HG      LYS  18  -0.585   8.234   0.845
  161    HG3  LYS  18           3HG      LYS  18  -0.833   6.854   1.938
  162    HD2  LYS  18           2HD      LYS  18   0.812   7.722   3.513
  163    HD3  LYS  18           3HD      LYS  18   1.307   8.975   2.374
  164    HE2  LYS  18           2HE      LYS  18  -0.065  10.013   4.033
  165    HE3  LYS  18           3HE      LYS  18  -0.929  10.022   2.496
  166    HZ1  LYS  18           HZ1      LYS  18  -2.247   8.136   3.297
  167    HZ2  LYS  18           HZ2      LYS  18  -1.418   8.101   4.714
  168    HZ3  LYS  18           HZ3      LYS  18  -2.365   9.376   4.348
  169    H    GLY  19           H        GLY  19   1.817   7.817  -1.805
  170    HA2  GLY  19           HA2      GLY  19   3.696   7.925  -3.150
  171    HA3  GLY  19           HA3      GLY  19   4.315   6.633  -2.125
  172    HA   PRO  20           HA       PRO  20   4.323   4.597  -6.237
  173    HB2  PRO  20           2HB      PRO  20   5.613   2.492  -4.492
  174    HB3  PRO  20           3HB      PRO  20   6.053   3.009  -6.150
  175    HG2  PRO  20           2HG      PRO  20   7.490   3.899  -4.040
  176    HG3  PRO  20           3HG      PRO  20   7.011   5.052  -5.332
  177    HD2  PRO  20           2HD      PRO  20   5.690   4.594  -2.639
  178    HD3  PRO  20           3HD      PRO  20   6.114   6.137  -3.443
  179    H    LEU  21           H        LEU  21   3.275   3.124  -3.105
  180    HA   LEU  21           HA       LEU  21   1.969   0.893  -4.295
  181    HB2  LEU  21           2HB      LEU  21   2.727   1.174  -1.883
  182    HB3  LEU  21           3HB      LEU  21   1.319   2.207  -1.630
  183    HG   LEU  21           HG       LEU  21  -0.168   0.270  -2.262
  184   HD11  LEU  21          1HD1      LEU  21   0.833  -2.000  -2.212
  185   HD12  LEU  21          2HD1      LEU  21   1.389  -1.075  -3.606
  186   HD13  LEU  21          3HD1      LEU  21   2.458  -1.272  -2.193
  187   HD21  LEU  21          3HD2      LEU  21   0.266  -1.010  -0.181
  188   HD22  LEU  21          1HD2      LEU  21   1.820  -0.176   0.005
  189   HD23  LEU  21          2HD2      LEU  21   0.297   0.744   0.086
  190    H    LYS  22           H        LYS  22   0.730   4.061  -3.383
  191    HA   LYS  22           HA       LYS  22  -2.078   3.801  -3.907
  192    HB2  LYS  22           2HB      LYS  22  -1.170   5.708  -2.768
  193    HB3  LYS  22           3HB      LYS  22  -0.077   6.081  -4.091
  194    HG2  LYS  22           2HG      LYS  22  -1.732   7.731  -4.073
  195    HG3  LYS  22           3HG      LYS  22  -2.017   6.751  -5.507
  196    HD2  LYS  22           2HD      LYS  22  -3.898   5.619  -4.385
  197    HD3  LYS  22           3HD      LYS  22  -3.533   6.486  -2.868
  198    HE2  LYS  22           2HE      LYS  22  -3.880   8.659  -4.113
  199    HE3  LYS  22           3HE      LYS  22  -4.378   7.723  -5.530
  200    HZ1  LYS  22           HZ1      LYS  22  -6.181   6.777  -4.153
  201    HZ2  LYS  22           HZ2      LYS  22  -5.752   7.734  -2.897
  202    HZ3  LYS  22           HZ3      LYS  22  -6.313   8.406  -4.276
  203    H    LEU  23           H        LEU  23   0.593   4.547  -6.070
  204    HA   LEU  23           HA       LEU  23  -1.002   4.781  -8.477
  205    HB2  LEU  23           2HB      LEU  23   1.078   5.993  -7.961
  206    HB3  LEU  23           3HB      LEU  23   1.998   4.512  -7.994
  207    HG   LEU  23           HG       LEU  23   2.187   6.111  -9.929
  208   HD11  LEU  23          1HD1      LEU  23   1.473   3.287 -10.770
  209   HD12  LEU  23          2HD1      LEU  23   2.509   4.448 -11.607
  210   HD13  LEU  23          3HD1      LEU  23   3.014   3.788 -10.044
  211   HD21  LEU  23          3HD2      LEU  23  -0.452   4.932 -10.849
  212   HD22  LEU  23          1HD2      LEU  23  -0.222   6.588 -10.232
  213   HD23  LEU  23          2HD2      LEU  23   0.587   6.072 -11.722
  214    H    VAL  24           H        VAL  24   0.318   1.981  -6.808
  215    HA   VAL  24           HA       VAL  24   0.508   0.303  -9.267
  216    HB   VAL  24           HB       VAL  24   1.198  -0.083  -6.332
  217   HG11  VAL  24          1HG1      VAL  24   0.365  -2.267  -7.057
  218   HG12  VAL  24          2HG1      VAL  24   1.398  -2.207  -8.503
  219   HG13  VAL  24          3HG1      VAL  24   2.111  -2.305  -6.876
  220   HG21  VAL  24          3HG2      VAL  24   2.753   1.186  -7.930
  221   HG22  VAL  24          1HG2      VAL  24   3.453  -0.173  -7.054
  222   HG23  VAL  24          2HG2      VAL  24   2.992  -0.346  -8.774
  223    H    CYS  25           H        CYS  25  -1.275   0.647  -6.244
  224    HA   CYS  25           HA       CYS  25  -3.076  -1.563  -6.832
  225    HB2  CYS  25           2HB      CYS  25  -2.248   0.190  -4.497
  226    HB3  CYS  25           3HB      CYS  25  -3.554  -0.918  -4.373
  227    H    LYS  26           H        LYS  26  -3.236   1.766  -7.399
  228    HA   LYS  26           HA       LYS  26  -4.883   3.319  -7.661
  229    HB2  LYS  26           2HB      LYS  26  -6.243   0.857  -8.810
  230    HB3  LYS  26           3HB      LYS  26  -6.857   2.501  -9.038
  231    HG2  LYS  26           2HG      LYS  26  -3.988   1.775  -9.715
  232    HG3  LYS  26           3HG      LYS  26  -5.297   1.514 -10.869
  233    HD2  LYS  26           2HD      LYS  26  -5.729   3.802 -11.139
  234    HD3  LYS  26           3HD      LYS  26  -4.947   4.260  -9.616
  235    HE2  LYS  26           2HE      LYS  26  -2.759   3.689 -10.459
  236    HE3  LYS  26           3HE      LYS  26  -3.442   3.064 -11.969
  237    HZ1  LYS  26           HZ1      LYS  26  -3.586   5.904 -11.088
  238    HZ2  LYS  26           HZ2      LYS  26  -2.617   5.328 -12.271
  239    HZ3  LYS  26           HZ3      LYS  26  -4.234   5.319 -12.469
  240    H    CYS  27           H        CYS  27  -4.617   2.907  -5.320
  241    HA   CYS  27           HA       CYS  27  -6.804   2.030  -3.662
  242    HB2  CYS  27           2HB      CYS  27  -4.404   3.816  -3.133
  243    HB3  CYS  27           3HB      CYS  27  -5.528   3.322  -1.891
  Start of MODEL   33
    1    H1   GLY   1           1H       GLY   1  10.334  -9.060   4.311
    2    H2   GLY   1           2H       GLY   1  10.703  -7.786   3.352
    3    H3   GLY   1           3H       GLY   1  10.774  -7.631   4.982
    4    HA2  GLY   1           HA2      GLY   1   8.398  -7.928   5.185
    5    HA3  GLY   1           HA3      GLY   1   8.799  -6.545   4.151
    6    H    LEU   2           H        LEU   2   6.345  -7.432   3.816
    7    HA   LEU   2           HA       LEU   2   6.037  -9.553   1.875
    8    HB2  LEU   2           2HB      LEU   2   4.203  -7.367   2.936
    9    HB3  LEU   2           3HB      LEU   2   3.700  -8.452   1.669
   10    HG   LEU   2           HG       LEU   2   2.777  -9.183   3.719
   11   HD11  LEU   2          1HD1      LEU   2   3.439 -11.497   3.781
   12   HD12  LEU   2          2HD1      LEU   2   3.515 -10.938   2.103
   13   HD13  LEU   2          3HD1      LEU   2   5.010 -11.138   3.045
   14   HD21  LEU   2          3HD2      LEU   2   3.986  -9.915   5.655
   15   HD22  LEU   2          1HD2      LEU   2   5.550  -9.599   4.887
   16   HD23  LEU   2          2HD2      LEU   2   4.457  -8.248   5.295
   17    HA   PRO   3           HA       PRO   3   6.693  -7.195  -1.871
   18    HB2  PRO   3           2HB      PRO   3   5.326  -8.639  -3.723
   19    HB3  PRO   3           3HB      PRO   3   6.774  -9.288  -2.893
   20    HG2  PRO   3           2HG      PRO   3   3.858  -9.759  -2.178
   21    HG3  PRO   3           3HG      PRO   3   5.152 -10.982  -2.392
   22    HD2  PRO   3           2HD      PRO   3   4.449  -9.991   0.060
   23    HD3  PRO   3           3HD      PRO   3   6.140 -10.433  -0.319
   24    H    ARG   4           H        ARG   4   5.617  -5.816  -3.382
   25    HA   ARG   4           HA       ARG   4   3.596  -4.202  -2.305
   26    HB2  ARG   4           2HB      ARG   4   3.653  -2.908  -4.194
   27    HB3  ARG   4           3HB      ARG   4   5.292  -3.474  -3.871
   28    HG2  ARG   4           2HG      ARG   4   5.033  -5.206  -5.666
   29    HG3  ARG   4           3HG      ARG   4   3.377  -4.626  -5.937
   30    HD2  ARG   4           2HD      ARG   4   4.609  -2.269  -6.182
   31    HD3  ARG   4           3HD      ARG   4   5.994  -3.306  -6.595
   32    HE   ARG   4           HE       ARG   4   3.532  -4.088  -7.896
   33   HH11  ARG   4          1HH2      ARG   4   6.131  -1.768  -8.256
   34   HH12  ARG   4          2HH2      ARG   4   5.871  -1.578  -9.969
   35   HH21  ARG   4          1HH1      ARG   4   3.273  -3.829 -10.120
   36   HH22  ARG   4          2HH1      ARG   4   4.284  -2.713 -10.989
   37    H    LYS   5           H        LYS   5   3.091  -6.960  -4.395
   38    HA   LYS   5           HA       LYS   5   0.299  -6.425  -4.952
   39    HB2  LYS   5           2HB      LYS   5   0.230  -8.653  -5.866
   40    HB3  LYS   5           3HB      LYS   5   1.688  -7.820  -6.400
   41    HG2  LYS   5           2HG      LYS   5   3.008  -9.081  -4.669
   42    HG3  LYS   5           3HG      LYS   5   1.527  -9.942  -4.211
   43    HD2  LYS   5           2HD      LYS   5   1.331 -10.843  -6.511
   44    HD3  LYS   5           3HD      LYS   5   2.820  -9.988  -6.970
   45    HE2  LYS   5           2HE      LYS   5   4.079 -11.258  -5.244
   46    HE3  LYS   5           3HE      LYS   5   2.597 -12.103  -4.778
   47    HZ1  LYS   5           HZ1      LYS   5   2.504 -13.043  -7.027
   48    HZ2  LYS   5           HZ2      LYS   5   3.874 -12.264  -7.459
   49    HZ3  LYS   5           HZ3      LYS   5   3.922 -13.430  -6.320
   50    H    ILE   6           H        ILE   6   1.872  -7.829  -2.179
   51    HA   ILE   6           HA       ILE   6  -0.732  -8.718  -1.019
   52    HB   ILE   6           HB       ILE   6   2.133  -9.084  -0.088
   53   HG12  ILE   6          2HG1      ILE   6  -0.028 -11.037  -1.021
   54   HG13  ILE   6          3HG1      ILE   6   1.353 -10.514  -1.978
   55   HG21  ILE   6          1HG2      ILE   6  -0.469  -9.916   1.285
   56   HG22  ILE   6          2HG2      ILE   6   1.156 -10.419   1.790
   57   HG23  ILE   6          3HG2      ILE   6   0.706  -8.730   1.898
   58   HD11  ILE   6          3HD1      ILE   6   2.890 -11.568  -0.313
   59   HD12  ILE   6          1HD1      ILE   6   1.463 -12.239   0.516
   60   HD13  ILE   6          2HD1      ILE   6   1.818 -12.699  -1.153
   61    H    LEU   7           H        LEU   7   1.898  -6.321  -0.457
   62    HA   LEU   7           HA       LEU   7   0.678  -4.998   1.755
   63    HB2  LEU   7           2HB      LEU   7   2.411  -3.898  -0.489
   64    HB3  LEU   7           3HB      LEU   7   1.986  -2.998   0.957
   65    HG   LEU   7           HG       LEU   7   3.604  -5.582   0.959
   66   HD11  LEU   7          1HD1      LEU   7   5.492  -4.090   1.515
   67   HD12  LEU   7          2HD1      LEU   7   4.812  -3.694  -0.068
   68   HD13  LEU   7          3HD1      LEU   7   4.437  -2.671   1.339
   69   HD21  LEU   7          3HD2      LEU   7   2.920  -3.611   3.186
   70   HD22  LEU   7          1HD2      LEU   7   2.420  -5.317   3.085
   71   HD23  LEU   7          2HD2      LEU   7   4.123  -4.912   3.312
   72    H    CYS   8           H        CYS   8  -0.130  -4.787  -1.683
   73    HA   CYS   8           HA       CYS   8  -1.832  -2.524  -1.630
   74    HB2  CYS   8           2HB      CYS   8  -1.087  -3.576  -3.661
   75    HB3  CYS   8           3HB      CYS   8  -1.853  -5.103  -3.238
   76    H    ALA   9           H        ALA   9  -2.515  -5.886  -0.571
   77    HA   ALA   9           HA       ALA   9  -5.371  -5.426  -0.213
   78    HB1  ALA   9           3HB      ALA   9  -4.400  -7.668  -0.629
   79    HB2  ALA   9           1HB      ALA   9  -3.524  -7.580   0.915
   80    HB3  ALA   9           2HB      ALA   9  -5.300  -7.612   0.901
   81    H    ILE  10           H        ILE  10  -2.492  -5.406   1.904
   82    HA   ILE  10           HA       ILE  10  -3.800  -4.770   4.360
   83    HB   ILE  10           HB       ILE  10  -1.002  -3.974   3.462
   84   HG12  ILE  10          2HG1      ILE  10  -1.242  -6.375   3.148
   85   HG13  ILE  10          3HG1      ILE  10  -0.162  -6.011   4.462
   86   HG21  ILE  10          1HG2      ILE  10  -0.469  -4.032   5.889
   87   HG22  ILE  10          2HG2      ILE  10  -1.642  -2.777   5.478
   88   HG23  ILE  10          3HG2      ILE  10  -2.191  -4.278   6.247
   89   HD11  ILE  10          3HD1      ILE  10  -1.607  -7.927   4.985
   90   HD12  ILE  10          1HD1      ILE  10  -1.940  -6.600   6.108
   91   HD13  ILE  10          2HD1      ILE  10  -3.059  -6.937   4.762
   92    H    ALA  11           H        ALA  11  -2.320  -2.597   1.915
   93    HA   ALA  11           HA       ALA  11  -2.639  -0.183   3.239
   94    HB1  ALA  11           3HB      ALA  11  -1.291  -0.664   1.179
   95    HB2  ALA  11           1HB      ALA  11  -2.795  -0.669   0.221
   96    HB3  ALA  11           2HB      ALA  11  -2.245   0.803   1.051
   97    H    LYS  12           H        LYS  12  -4.944  -1.580   0.866
   98    HA   LYS  12           HA       LYS  12  -6.953   0.457   1.337
   99    HB2  LYS  12           2HB      LYS  12  -7.116  -2.191  -0.160
  100    HB3  LYS  12           3HB      LYS  12  -8.351  -0.916  -0.172
  101    HG2  LYS  12           2HG      LYS  12  -6.553   0.700  -0.951
  102    HG3  LYS  12           3HG      LYS  12  -5.483  -0.684  -1.175
  103    HD2  LYS  12           2HD      LYS  12  -8.086  -0.124  -2.647
  104    HD3  LYS  12           3HD      LYS  12  -6.434   0.029  -3.262
  105    HE2  LYS  12           2HE      LYS  12  -6.165  -2.480  -2.801
  106    HE3  LYS  12           3HE      LYS  12  -7.915  -2.532  -2.564
  107    HZ1  LYS  12           HZ1      LYS  12  -6.561  -1.558  -5.043
  108    HZ2  LYS  12           HZ2      LYS  12  -7.281  -3.022  -4.881
  109    HZ3  LYS  12           HZ3      LYS  12  -8.180  -1.661  -4.827
  110    H    LYS  13           H        LYS  13  -6.473  -2.728   2.831
  111    HA   LYS  13           HA       LYS  13  -9.085  -2.710   4.161
  112    HB2  LYS  13           2HB      LYS  13  -6.552  -4.334   4.585
  113    HB3  LYS  13           3HB      LYS  13  -7.986  -4.501   5.603
  114    HG2  LYS  13           2HG      LYS  13  -9.378  -5.118   3.701
  115    HG3  LYS  13           3HG      LYS  13  -8.063  -4.816   2.572
  116    HD2  LYS  13           2HD      LYS  13  -8.264  -7.186   2.883
  117    HD3  LYS  13           3HD      LYS  13  -6.744  -6.660   3.620
  118    HE2  LYS  13           2HE      LYS  13  -7.805  -6.706   5.863
  119    HE3  LYS  13           3HE      LYS  13  -9.354  -7.147   5.134
  120    HZ1  LYS  13           HZ1      LYS  13  -6.895  -8.815   5.035
  121    HZ2  LYS  13           HZ2      LYS  13  -8.191  -9.098   5.985
  122    HZ3  LYS  13           HZ3      LYS  13  -8.331  -9.219   4.366
  123    H    LYS  14           H        LYS  14  -5.837  -1.628   5.142
  124    HA   LYS  14           HA       LYS  14  -6.798  -0.664   7.771
  125    HB2  LYS  14           2HB      LYS  14  -4.131  -0.668   6.325
  126    HB3  LYS  14           3HB      LYS  14  -4.387   0.382   7.702
  127    HG2  LYS  14           2HG      LYS  14  -3.315  -1.663   8.399
  128    HG3  LYS  14           3HG      LYS  14  -4.885  -1.453   9.173
  129    HD2  LYS  14           2HD      LYS  14  -5.882  -3.173   7.727
  130    HD3  LYS  14           3HD      LYS  14  -4.396  -3.264   6.775
  131    HE2  LYS  14           2HE      LYS  14  -4.434  -5.156   8.238
  132    HE3  LYS  14           3HE      LYS  14  -3.159  -4.063   8.783
  133    HZ1  LYS  14           HZ1      LYS  14  -4.504  -4.899  10.635
  134    HZ2  LYS  14           HZ2      LYS  14  -4.670  -3.282  10.532
  135    HZ3  LYS  14           HZ3      LYS  14  -5.868  -4.265  10.005
  136    H    GLY  15           H        GLY  15  -6.826   0.626   4.607
  137    HA2  GLY  15           HA2      GLY  15  -7.704   2.618   3.843
  138    HA3  GLY  15           HA3      GLY  15  -8.015   3.124   5.507
  139    H    LYS  16           H        LYS  16  -4.790   2.166   4.433
  140    HA   LYS  16           HA       LYS  16  -3.853   5.009   4.371
  141    HB2  LYS  16           2HB      LYS  16  -3.508   4.061   6.631
  142    HB3  LYS  16           3HB      LYS  16  -2.523   2.765   5.937
  143    HG2  LYS  16           2HG      LYS  16  -0.912   4.437   5.066
  144    HG3  LYS  16           3HG      LYS  16  -1.909   5.753   5.697
  145    HD2  LYS  16           2HD      LYS  16  -0.579   3.591   7.394
  146    HD3  LYS  16           3HD      LYS  16   0.080   5.209   7.106
  147    HE2  LYS  16           2HE      LYS  16  -1.962   6.217   8.122
  148    HE3  LYS  16           3HE      LYS  16  -2.581   4.598   8.470
  149    HZ1  LYS  16           HZ1      LYS  16  -0.630   4.229   9.888
  150    HZ2  LYS  16           HZ2      LYS  16  -0.062   5.728   9.572
  151    HZ3  LYS  16           HZ3      LYS  16  -1.454   5.540  10.400
  152    H    CYS  17           H        CYS  17  -3.444   5.158   2.286
  153    HA   CYS  17           HA       CYS  17  -1.326   3.493   1.043
  154    HB2  CYS  17           2HB      CYS  17  -3.553   2.396   0.628
  155    HB3  CYS  17           3HB      CYS  17  -4.119   3.868  -0.109
  156    H    LYS  18           H        LYS  18   0.051   4.845   0.001
  157    HA   LYS  18           HA       LYS  18  -0.863   7.340  -1.307
  158    HB2  LYS  18           2HB      LYS  18   0.653   8.757  -0.028
  159    HB3  LYS  18           3HB      LYS  18  -0.527   7.994   1.033
  160    HG2  LYS  18           2HG      LYS  18   1.177   6.330   1.755
  161    HG3  LYS  18           3HG      LYS  18   2.367   7.079   0.673
  162    HD2  LYS  18           2HD      LYS  18   2.159   9.215   1.921
  163    HD3  LYS  18           3HD      LYS  18   0.975   8.458   3.011
  164    HE2  LYS  18           2HE      LYS  18   2.677   6.786   3.699
  165    HE3  LYS  18           3HE      LYS  18   3.853   7.519   2.600
  166    HZ1  LYS  18           HZ1      LYS  18   3.704   9.569   3.911
  167    HZ2  LYS  18           HZ2      LYS  18   2.616   8.896   4.927
  168    HZ3  LYS  18           HZ3      LYS  18   4.143   8.327   4.872
  169    H    GLY  19           H        GLY  19   0.756   8.425  -2.535
  170    HA2  GLY  19           HA2      GLY  19   2.475   8.570  -4.055
  171    HA3  GLY  19           HA3      GLY  19   3.436   7.811  -2.805
  172    HA   PRO  20           HA       PRO  20   3.916   4.736  -6.105
  173    HB2  PRO  20           2HB      PRO  20   5.378   2.830  -4.773
  174    HB3  PRO  20           3HB      PRO  20   6.064   4.372  -5.368
  175    HG2  PRO  20           2HG      PRO  20   5.095   3.725  -2.566
  176    HG3  PRO  20           3HG      PRO  20   6.627   4.515  -3.057
  177    HD2  PRO  20           2HD      PRO  20   4.464   5.949  -2.244
  178    HD3  PRO  20           3HD      PRO  20   5.530   6.546  -3.553
  179    H    LEU  21           H        LEU  21   2.828   3.711  -2.801
  180    HA   LEU  21           HA       LEU  21   1.689   1.238  -3.677
  181    HB2  LEU  21           2HB      LEU  21   2.196   2.441  -1.236
  182    HB3  LEU  21           3HB      LEU  21   0.463   2.621  -1.321
  183    HG   LEU  21           HG       LEU  21   0.940   0.652  -0.094
  184   HD11  LEU  21          1HD1      LEU  21  -0.101  -1.154  -1.289
  185   HD12  LEU  21          2HD1      LEU  21  -0.932   0.353  -1.710
  186   HD13  LEU  21          3HD1      LEU  21   0.208  -0.388  -2.858
  187   HD21  LEU  21          3HD2      LEU  21   3.253   0.302  -0.852
  188   HD22  LEU  21          1HD2      LEU  21   2.314  -1.197  -0.880
  189   HD23  LEU  21          2HD2      LEU  21   2.662  -0.344  -2.398
  190    H    LYS  22           H        LYS  22   0.350   4.465  -3.367
  191    HA   LYS  22           HA       LYS  22  -2.410   4.022  -4.007
  192    HB2  LYS  22           2HB      LYS  22  -1.637   6.047  -2.973
  193    HB3  LYS  22           3HB      LYS  22  -0.493   6.367  -4.264
  194    HG2  LYS  22           2HG      LYS  22  -2.249   7.935  -4.480
  195    HG3  LYS  22           3HG      LYS  22  -2.335   6.825  -5.835
  196    HD2  LYS  22           2HD      LYS  22  -4.571   7.207  -5.079
  197    HD3  LYS  22           3HD      LYS  22  -4.117   5.560  -4.660
  198    HE2  LYS  22           2HE      LYS  22  -5.336   6.449  -2.805
  199    HE3  LYS  22           3HE      LYS  22  -3.652   6.334  -2.297
  200    HZ1  LYS  22           HZ1      LYS  22  -3.459   8.749  -2.748
  201    HZ2  LYS  22           HZ2      LYS  22  -5.031   8.812  -3.194
  202    HZ3  LYS  22           HZ3      LYS  22  -4.630   8.451  -1.655
  203    H    LEU  23           H        LEU  23   0.363   4.819  -6.098
  204    HA   LEU  23           HA       LEU  23  -1.095   4.710  -8.567
  205    HB2  LEU  23           2HB      LEU  23   1.024   5.924  -8.229
  206    HB3  LEU  23           3HB      LEU  23   1.873   4.406  -7.953
  207    HG   LEU  23           HG       LEU  23   1.430   3.711 -10.293
  208   HD11  LEU  23          1HD1      LEU  23   0.194   6.488 -10.580
  209   HD12  LEU  23          2HD1      LEU  23   0.608   5.401 -11.925
  210   HD13  LEU  23          3HD1      LEU  23  -0.649   4.934 -10.780
  211   HD21  LEU  23          3HD2      LEU  23   2.684   6.474 -10.039
  212   HD22  LEU  23          1HD2      LEU  23   3.493   4.926  -9.711
  213   HD23  LEU  23          2HD2      LEU  23   2.959   5.309 -11.354
  214    H    VAL  24           H        VAL  24   0.824   2.224  -6.855
  215    HA   VAL  24           HA       VAL  24   0.631   0.164  -8.855
  216    HB   VAL  24           HB       VAL  24   1.160   0.117  -5.860
  217   HG11  VAL  24          1HG1      VAL  24   0.382  -2.135  -6.413
  218   HG12  VAL  24          2HG1      VAL  24   1.464  -2.190  -7.825
  219   HG13  VAL  24          3HG1      VAL  24   2.124  -2.144  -6.173
  220   HG21  VAL  24          3HG2      VAL  24   3.092  -0.340  -8.169
  221   HG22  VAL  24          1HG2      VAL  24   2.841   1.238  -7.417
  222   HG23  VAL  24          2HG2      VAL  24   3.464  -0.087  -6.439
  223    H    CYS  25           H        CYS  25  -1.301   0.825  -5.951
  224    HA   CYS  25           HA       CYS  25  -2.929  -1.592  -6.368
  225    HB2  CYS  25           2HB      CYS  25  -1.641  -1.011  -4.314
  226    HB3  CYS  25           3HB      CYS  25  -2.682   0.381  -4.084
  227    H    LYS  26           H        LYS  26  -3.294   1.690  -7.047
  228    HA   LYS  26           HA       LYS  26  -4.988   3.127  -7.497
  229    HB2  LYS  26           2HB      LYS  26  -6.242   0.557  -8.510
  230    HB3  LYS  26           3HB      LYS  26  -6.914   2.161  -8.838
  231    HG2  LYS  26           2HG      LYS  26  -4.012   1.514  -9.441
  232    HG3  LYS  26           3HG      LYS  26  -5.299   1.127 -10.590
  233    HD2  LYS  26           2HD      LYS  26  -5.835   3.411 -10.963
  234    HD3  LYS  26           3HD      LYS  26  -5.036   3.946  -9.489
  235    HE2  LYS  26           2HE      LYS  26  -3.667   4.605 -11.330
  236    HE3  LYS  26           3HE      LYS  26  -2.838   3.360 -10.393
  237    HZ1  LYS  26           HZ1      LYS  26  -3.486   1.738 -12.092
  238    HZ2  LYS  26           HZ2      LYS  26  -4.295   2.878 -12.944
  239    HZ3  LYS  26           HZ3      LYS  26  -2.673   2.961 -12.795
  240    H    CYS  27           H        CYS  27  -4.762   3.014  -5.174
  241    HA   CYS  27           HA       CYS  27  -6.977   2.268  -3.463
  242    HB2  CYS  27           2HB      CYS  27  -4.652   4.171  -3.028
  243    HB3  CYS  27           3HB      CYS  27  -5.749   3.632  -1.781
  Start of MODEL   34
    1    H1   GLY   1           1H       GLY   1  10.659  -9.516   3.490
    2    H2   GLY   1           2H       GLY   1  11.191  -8.538   2.292
    3    H3   GLY   1           3H       GLY   1  11.559  -8.195   3.851
    4    HA2  GLY   1           HA2      GLY   1   9.249  -7.783   4.377
    5    HA3  GLY   1           HA3      GLY   1   9.832  -6.714   3.088
    6    H    LEU   2           H        LEU   2   7.148  -7.087   3.360
    7    HA   LEU   2           HA       LEU   2   6.061  -9.218   1.747
    8    HB2  LEU   2           2HB      LEU   2   4.976  -6.618   2.875
    9    HB3  LEU   2           3HB      LEU   2   4.034  -7.579   1.746
   10    HG   LEU   2           HG       LEU   2   3.982  -9.482   3.225
   11   HD11  LEU   2          1HD1      LEU   2   6.090  -9.350   4.449
   12   HD12  LEU   2          2HD1      LEU   2   5.598  -7.805   5.193
   13   HD13  LEU   2          3HD1      LEU   2   4.747  -9.314   5.589
   14   HD21  LEU   2          3HD2      LEU   2   3.292  -6.915   4.719
   15   HD22  LEU   2          1HD2      LEU   2   2.304  -7.644   3.441
   16   HD23  LEU   2          2HD2      LEU   2   2.559  -8.517   4.960
   17    HA   PRO   3           HA       PRO   3   6.622  -7.149  -2.258
   18    HB2  PRO   3           2HB      PRO   3   5.228  -8.796  -3.889
   19    HB3  PRO   3           3HB      PRO   3   6.748  -9.330  -3.102
   20    HG2  PRO   3           2HG      PRO   3   3.906  -9.808  -2.173
   21    HG3  PRO   3           3HG      PRO   3   5.204 -11.028  -2.374
   22    HD2  PRO   3           2HD      PRO   3   4.617  -9.861   0.041
   23    HD3  PRO   3           3HD      PRO   3   6.281 -10.322  -0.412
   24    H    ARG   4           H        ARG   4   5.343  -5.894  -3.712
   25    HA   ARG   4           HA       ARG   4   3.411  -4.284  -2.494
   26    HB2  ARG   4           2HB      ARG   4   4.078  -4.733  -5.431
   27    HB3  ARG   4           3HB      ARG   4   2.953  -3.483  -4.881
   28    HG2  ARG   4           2HG      ARG   4   4.622  -2.344  -3.625
   29    HG3  ARG   4           3HG      ARG   4   5.795  -3.661  -3.809
   30    HD2  ARG   4           2HD      ARG   4   5.937  -3.225  -6.223
   31    HD3  ARG   4           3HD      ARG   4   4.725  -1.938  -6.069
   32    HE   ARG   4           HE       ARG   4   6.884  -1.420  -4.269
   33   HH11  ARG   4          1HH1      ARG   4   6.276  -1.311  -7.718
   34   HH12  ARG   4          2HH1      ARG   4   7.439  -0.042  -7.975
   35   HH21  ARG   4          1HH2      ARG   4   8.370   0.180  -4.673
   36   HH22  ARG   4          2HH2      ARG   4   8.601   0.765  -6.293
   37    H    LYS   5           H        LYS   5   2.721  -7.069  -4.586
   38    HA   LYS   5           HA       LYS   5  -0.120  -6.539  -4.698
   39    HB2  LYS   5           2HB      LYS   5  -0.316  -8.609  -5.896
   40    HB3  LYS   5           3HB      LYS   5   1.040  -7.659  -6.491
   41    HG2  LYS   5           2HG      LYS   5   2.586  -9.151  -5.115
   42    HG3  LYS   5           3HG      LYS   5   1.167 -10.150  -4.749
   43    HD2  LYS   5           2HD      LYS   5   0.814 -10.507  -7.208
   44    HD3  LYS   5           3HD      LYS   5   2.232  -9.507  -7.531
   45    HE2  LYS   5           2HE      LYS   5   3.005 -11.715  -7.728
   46    HE3  LYS   5           3HE      LYS   5   3.620 -11.142  -6.178
   47    HZ1  LYS   5           HZ1      LYS   5   2.676 -13.381  -6.017
   48    HZ2  LYS   5           HZ2      LYS   5   1.784 -12.369  -5.100
   49    HZ3  LYS   5           HZ3      LYS   5   1.224 -12.873  -6.553
   50    H    ILE   6           H        ILE   6   1.762  -8.463  -2.394
   51    HA   ILE   6           HA       ILE   6  -0.650  -9.372  -0.958
   52    HB   ILE   6           HB       ILE   6   2.332  -9.489  -0.447
   53   HG12  ILE   6          2HG1      ILE   6   1.939 -11.891  -0.251
   54   HG13  ILE   6          3HG1      ILE   6   0.196 -11.657  -0.415
   55   HG21  ILE   6          1HG2      ILE   6   1.436  -8.938   1.757
   56   HG22  ILE   6          2HG2      ILE   6   0.162 -10.164   1.586
   57   HG23  ILE   6          3HG2      ILE   6   1.870 -10.640   1.717
   58   HD11  ILE   6          3HD1      ILE   6   1.283 -12.602  -2.424
   59   HD12  ILE   6          1HD1      ILE   6   0.433 -11.087  -2.751
   60   HD13  ILE   6          2HD1      ILE   6   2.216 -11.112  -2.615
   61    H    LEU   7           H        LEU   7   1.866  -6.836  -0.562
   62    HA   LEU   7           HA       LEU   7   0.919  -5.784   1.863
   63    HB2  LEU   7           2HB      LEU   7   3.146  -5.411   0.833
   64    HB3  LEU   7           3HB      LEU   7   2.403  -4.415  -0.416
   65    HG   LEU   7           HG       LEU   7   1.760  -2.728   1.268
   66   HD11  LEU   7          1HD1      LEU   7   3.181  -4.564   3.254
   67   HD12  LEU   7          2HD1      LEU   7   2.689  -2.886   3.580
   68   HD13  LEU   7          3HD1      LEU   7   1.459  -4.112   3.275
   69   HD21  LEU   7          3HD2      LEU   7   4.685  -3.558   1.468
   70   HD22  LEU   7          1HD2      LEU   7   3.967  -2.607   0.152
   71   HD23  LEU   7          2HD2      LEU   7   4.021  -1.940   1.790
   72    H    CYS   8           H        CYS   8  -0.236  -5.080  -1.422
   73    HA   CYS   8           HA       CYS   8  -1.778  -2.787  -0.903
   74    HB2  CYS   8           2HB      CYS   8  -1.293  -3.703  -3.124
   75    HB3  CYS   8           3HB      CYS   8  -2.365  -5.073  -2.812
   76    H    ALA   9           H        ALA   9  -2.568  -6.168  -0.063
   77    HA   ALA   9           HA       ALA   9  -5.349  -5.832   0.487
   78    HB1  ALA   9           3HB      ALA   9  -5.025  -7.821   1.907
   79    HB2  ALA   9           1HB      ALA   9  -4.088  -8.015   0.408
   80    HB3  ALA   9           2HB      ALA   9  -3.268  -7.567   1.929
   81    H    ILE  10           H        ILE  10  -2.454  -5.134   2.351
   82    HA   ILE  10           HA       ILE  10  -3.856  -4.479   4.836
   83    HB   ILE  10           HB       ILE  10  -0.913  -4.252   4.080
   84   HG12  ILE  10          2HG1      ILE  10  -2.360  -6.585   5.431
   85   HG13  ILE  10          3HG1      ILE  10  -1.810  -6.591   3.760
   86   HG21  ILE  10          1HG2      ILE  10  -1.594  -2.961   6.112
   87   HG22  ILE  10          2HG2      ILE  10  -2.230  -4.464   6.821
   88   HG23  ILE  10          3HG2      ILE  10  -0.496  -4.284   6.490
   89   HD11  ILE  10          3HD1      ILE  10   0.519  -6.275   4.491
   90   HD12  ILE  10          1HD1      ILE  10  -0.019  -6.542   6.174
   91   HD13  ILE  10          2HD1      ILE  10  -0.246  -7.810   4.945
   92    H    ALA  11           H        ALA  11  -1.984  -2.786   2.325
   93    HA   ALA  11           HA       ALA  11  -2.053  -0.132   3.077
   94    HB1  ALA  11           3HB      ALA  11  -1.838   0.311   0.698
   95    HB2  ALA  11           1HB      ALA  11  -1.079  -1.259   0.953
   96    HB3  ALA  11           2HB      ALA  11  -2.725  -1.153   0.256
   97    H    LYS  12           H        LYS  12  -4.542  -1.867   1.303
   98    HA   LYS  12           HA       LYS  12  -6.267   0.436   0.969
   99    HB2  LYS  12           2HB      LYS  12  -5.565  -1.286  -0.662
  100    HB3  LYS  12           3HB      LYS  12  -6.475  -2.509   0.233
  101    HG2  LYS  12           2HG      LYS  12  -8.566  -1.532  -0.376
  102    HG3  LYS  12           3HG      LYS  12  -7.788  -0.073  -1.042
  103    HD2  LYS  12           2HD      LYS  12  -6.978  -2.824  -2.035
  104    HD3  LYS  12           3HD      LYS  12  -8.470  -2.052  -2.665
  105    HE2  LYS  12           2HE      LYS  12  -6.955  -0.020  -3.161
  106    HE3  LYS  12           3HE      LYS  12  -5.594  -1.096  -2.807
  107    HZ1  LYS  12           HZ1      LYS  12  -7.637  -1.518  -4.938
  108    HZ2  LYS  12           HZ2      LYS  12  -6.087  -1.088  -5.203
  109    HZ3  LYS  12           HZ3      LYS  12  -6.431  -2.569  -4.604
  110    H    LYS  13           H        LYS  13  -6.351  -2.434   2.995
  111    HA   LYS  13           HA       LYS  13  -9.071  -1.909   4.012
  112    HB2  LYS  13           2HB      LYS  13  -6.912  -3.863   4.880
  113    HB3  LYS  13           3HB      LYS  13  -8.475  -3.698   5.690
  114    HG2  LYS  13           2HG      LYS  13  -9.676  -4.236   3.608
  115    HG3  LYS  13           3HG      LYS  13  -8.156  -4.344   2.726
  116    HD2  LYS  13           2HD      LYS  13  -8.898  -6.568   3.207
  117    HD3  LYS  13           3HD      LYS  13  -7.459  -6.253   4.188
  118    HE2  LYS  13           2HE      LYS  13  -8.895  -5.802   6.162
  119    HE3  LYS  13           3HE      LYS  13 -10.343  -6.038   5.175
  120    HZ1  LYS  13           HZ1      LYS  13  -9.648  -8.348   4.825
  121    HZ2  LYS  13           HZ2      LYS  13  -8.305  -8.132   5.731
  122    HZ3  LYS  13           HZ3      LYS  13  -9.780  -8.045   6.421
  123    H    LYS  14           H        LYS  14  -5.788  -1.154   5.203
  124    HA   LYS  14           HA       LYS  14  -6.959   0.119   7.625
  125    HB2  LYS  14           2HB      LYS  14  -4.088  -0.455   6.813
  126    HB3  LYS  14           3HB      LYS  14  -4.527   0.559   8.176
  127    HG2  LYS  14           2HG      LYS  14  -4.137  -1.462   9.164
  128    HG3  LYS  14           3HG      LYS  14  -5.894  -1.349   9.115
  129    HD2  LYS  14           2HD      LYS  14  -5.895  -2.879   7.122
  130    HD3  LYS  14           3HD      LYS  14  -4.139  -3.001   7.234
  131    HE2  LYS  14           2HE      LYS  14  -6.156  -3.837   9.373
  132    HE3  LYS  14           3HE      LYS  14  -5.370  -4.932   8.236
  133    HZ1  LYS  14           HZ1      LYS  14  -3.969  -3.346  10.323
  134    HZ2  LYS  14           HZ2      LYS  14  -4.228  -4.953  10.355
  135    HZ3  LYS  14           HZ3      LYS  14  -3.220  -4.320   9.240
  136    H    GLY  15           H        GLY  15  -6.053   1.208   4.499
  137    HA2  GLY  15           HA2      GLY  15  -6.604   3.328   3.630
  138    HA3  GLY  15           HA3      GLY  15  -6.806   3.975   5.263
  139    H    LYS  16           H        LYS  16  -4.031   2.110   4.329
  140    HA   LYS  16           HA       LYS  16  -2.131   4.337   4.869
  141    HB2  LYS  16           2HB      LYS  16  -1.884   1.296   4.922
  142    HB3  LYS  16           3HB      LYS  16  -0.623   2.416   5.359
  143    HG2  LYS  16           2HG      LYS  16  -3.234   2.012   6.857
  144    HG3  LYS  16           3HG      LYS  16  -1.654   1.398   7.299
  145    HD2  LYS  16           2HD      LYS  16  -1.801   3.180   8.708
  146    HD3  LYS  16           3HD      LYS  16  -0.935   3.931   7.364
  147    HE2  LYS  16           2HE      LYS  16  -3.080   4.894   6.541
  148    HE3  LYS  16           3HE      LYS  16  -3.961   4.045   7.816
  149    HZ1  LYS  16           HZ1      LYS  16  -1.911   6.149   8.282
  150    HZ2  LYS  16           HZ2      LYS  16  -3.523   6.359   8.415
  151    HZ3  LYS  16           HZ3      LYS  16  -2.745   5.372   9.453
  152    H    CYS  17           H        CYS  17  -3.493   3.313   2.152
  153    HA   CYS  17           HA       CYS  17  -1.176   2.566   0.558
  154    HB2  CYS  17           2HB      CYS  17  -3.566   1.760   0.259
  155    HB3  CYS  17           3HB      CYS  17  -3.934   3.348  -0.409
  156    H    LYS  18           H        LYS  18   0.303   3.983   0.044
  157    HA   LYS  18           HA       LYS  18  -0.267   6.533  -1.298
  158    HB2  LYS  18           2HB      LYS  18   1.045   7.892   0.306
  159    HB3  LYS  18           3HB      LYS  18  -0.434   7.258   1.012
  160    HG2  LYS  18           2HG      LYS  18   0.783   5.566   2.260
  161    HG3  LYS  18           3HG      LYS  18   2.287   5.942   1.411
  162    HD2  LYS  18           2HD      LYS  18   2.355   6.897   3.627
  163    HD3  LYS  18           3HD      LYS  18   2.320   8.194   2.427
  164    HE2  LYS  18           2HE      LYS  18  -0.121   8.492   2.828
  165    HE3  LYS  18           3HE      LYS  18  -0.087   7.176   4.011
  166    HZ1  LYS  18           HZ1      LYS  18   1.452   8.520   5.349
  167    HZ2  LYS  18           HZ2      LYS  18   1.420   9.730   4.252
  168    HZ3  LYS  18           HZ3      LYS  18   0.072   9.352   5.088
  169    H    GLY  19           H        GLY  19   1.894   7.688  -1.776
  170    HA2  GLY  19           HA2      GLY  19   3.879   7.618  -2.985
  171    HA3  GLY  19           HA3      GLY  19   4.327   6.242  -1.973
  172    HA   PRO  20           HA       PRO  20   4.138   4.421  -6.195
  173    HB2  PRO  20           2HB      PRO  20   5.400   2.182  -4.601
  174    HB3  PRO  20           3HB      PRO  20   5.798   2.759  -6.249
  175    HG2  PRO  20           2HG      PRO  20   7.346   3.495  -4.159
  176    HG3  PRO  20           3HG      PRO  20   6.866   4.724  -5.377
  177    HD2  PRO  20           2HD      PRO  20   5.630   4.190  -2.657
  178    HD3  PRO  20           3HD      PRO  20   6.082   5.753  -3.406
  179    H    LEU  21           H        LEU  21   3.152   2.813  -3.124
  180    HA   LEU  21           HA       LEU  21   1.803   0.626  -4.238
  181    HB2  LEU  21           2HB      LEU  21   2.356   1.520  -1.696
  182    HB3  LEU  21           3HB      LEU  21   0.644   1.857  -1.754
  183    HG   LEU  21           HG       LEU  21   0.921  -0.256  -0.733
  184   HD11  LEU  21          1HD1      LEU  21  -0.937  -0.294  -2.372
  185   HD12  LEU  21          2HD1      LEU  21   0.173  -0.937  -3.606
  186   HD13  LEU  21          3HD1      LEU  21  -0.177  -1.879  -2.159
  187   HD21  LEU  21          3HD2      LEU  21   2.602  -1.161  -3.099
  188   HD22  LEU  21          1HD2      LEU  21   3.218  -0.710  -1.490
  189   HD23  LEU  21          2HD2      LEU  21   2.162  -2.122  -1.670
  190    H    LYS  22           H        LYS  22   0.564   3.871  -3.603
  191    HA   LYS  22           HA       LYS  22  -2.207   3.425  -4.203
  192    HB2  LYS  22           2HB      LYS  22  -1.068   5.390  -2.995
  193    HB3  LYS  22           3HB      LYS  22  -0.679   6.021  -4.601
  194    HG2  LYS  22           2HG      LYS  22  -3.303   5.748  -4.992
  195    HG3  LYS  22           3HG      LYS  22  -3.350   5.689  -3.216
  196    HD2  LYS  22           2HD      LYS  22  -2.030   7.852  -3.215
  197    HD3  LYS  22           3HD      LYS  22  -2.293   7.930  -4.966
  198    HE2  LYS  22           2HE      LYS  22  -4.461   7.869  -2.812
  199    HE3  LYS  22           3HE      LYS  22  -3.900   9.312  -3.662
  200    HZ1  LYS  22           HZ1      LYS  22  -5.894   8.515  -4.700
  201    HZ2  LYS  22           HZ2      LYS  22  -4.678   8.238  -5.755
  202    HZ3  LYS  22           HZ3      LYS  22  -5.328   7.003  -4.880
  203    H    LEU  23           H        LEU  23   0.519   4.203  -6.291
  204    HA   LEU  23           HA       LEU  23  -1.147   4.433  -8.704
  205    HB2  LEU  23           2HB      LEU  23   0.878   5.802  -8.362
  206    HB3  LEU  23           3HB      LEU  23   1.867   4.346  -8.278
  207    HG   LEU  23           HG       LEU  23   1.331   3.828 -10.648
  208   HD11  LEU  23          1HD1      LEU  23  -0.141   6.503 -10.595
  209   HD12  LEU  23          2HD1      LEU  23   0.274   5.586 -12.060
  210   HD13  LEU  23          3HD1      LEU  23  -0.866   4.907 -10.898
  211   HD21  LEU  23          3HD2      LEU  23   2.654   5.643 -11.635
  212   HD22  LEU  23          1HD2      LEU  23   2.372   6.655 -10.200
  213   HD23  LEU  23          2HD2      LEU  23   3.323   5.158 -10.068
  214    H    VAL  24           H        VAL  24   0.998   1.999  -7.253
  215    HA   VAL  24           HA       VAL  24   1.074   0.123  -9.419
  216    HB   VAL  24           HB       VAL  24   1.560  -0.052  -6.429
  217   HG11  VAL  24          1HG1      VAL  24   2.092  -2.271  -8.439
  218   HG12  VAL  24          2HG1      VAL  24   2.717  -2.200  -6.776
  219   HG13  VAL  24          3HG1      VAL  24   0.988  -2.342  -7.044
  220   HG21  VAL  24          3HG2      VAL  24   3.872  -0.008  -7.001
  221   HG22  VAL  24          1HG2      VAL  24   3.535  -0.282  -8.734
  222   HG23  VAL  24          2HG2      VAL  24   3.129   1.260  -7.972
  223    H    CYS  25           H        CYS  25  -1.129   0.480  -6.681
  224    HA   CYS  25           HA       CYS  25  -2.741  -1.860  -7.624
  225    HB2  CYS  25           2HB      CYS  25  -1.351  -1.902  -5.451
  226    HB3  CYS  25           3HB      CYS  25  -2.583  -0.835  -4.796
  227    H    LYS  26           H        LYS  26  -2.848   1.290  -7.808
  228    HA   LYS  26           HA       LYS  26  -4.375   2.961  -7.971
  229    HB2  LYS  26           2HB      LYS  26  -4.835   1.027  -9.765
  230    HB3  LYS  26           3HB      LYS  26  -6.435   1.061  -9.039
  231    HG2  LYS  26           2HG      LYS  26  -4.874   3.454 -10.118
  232    HG3  LYS  26           3HG      LYS  26  -6.118   2.575 -11.014
  233    HD2  LYS  26           2HD      LYS  26  -7.831   3.245  -9.357
  234    HD3  LYS  26           3HD      LYS  26  -6.604   4.144  -8.435
  235    HE2  LYS  26           2HE      LYS  26  -6.151   5.589 -10.356
  236    HE3  LYS  26           3HE      LYS  26  -7.315   4.690 -11.343
  237    HZ1  LYS  26           HZ1      LYS  26  -8.305   6.712 -10.431
  238    HZ2  LYS  26           HZ2      LYS  26  -9.072   5.412  -9.816
  239    HZ3  LYS  26           HZ3      LYS  26  -8.001   6.241  -8.899
  240    H    CYS  27           H        CYS  27  -4.380   3.232  -5.691
  241    HA   CYS  27           HA       CYS  27  -6.800   2.351  -4.196
  242    HB2  CYS  27           2HB      CYS  27  -4.316   3.823  -3.296
  243    HB3  CYS  27           3HB      CYS  27  -5.637   3.346  -2.254
  Start of MODEL   35
    1    H1   GLY   1           1H       GLY   1  10.825  -8.292   3.015
    2    H2   GLY   1           2H       GLY   1  10.997  -7.645   4.511
    3    H3   GLY   1           3H       GLY   1  10.223  -9.077   4.317
    4    HA2  GLY   1           HA2      GLY   1   8.622  -7.328   4.721
    5    HA3  GLY   1           HA3      GLY   1   9.280  -6.467   3.317
    6    H    LEU   2           H        LEU   2   6.630  -6.944   3.330
    7    HA   LEU   2           HA       LEU   2   5.877  -9.425   2.031
    8    HB2  LEU   2           2HB      LEU   2   4.445  -6.771   2.426
    9    HB3  LEU   2           3HB      LEU   2   3.690  -8.168   1.669
   10    HG   LEU   2           HG       LEU   2   4.741  -8.119   4.533
   11   HD11  LEU   2          1HD1      LEU   2   2.813  -6.627   4.220
   12   HD12  LEU   2          2HD1      LEU   2   1.906  -7.937   3.434
   13   HD13  LEU   2          3HD1      LEU   2   2.353  -8.060   5.151
   14   HD21  LEU   2          3HD2      LEU   2   3.384 -10.202   4.763
   15   HD22  LEU   2          1HD2      LEU   2   3.084 -10.182   3.011
   16   HD23  LEU   2          2HD2      LEU   2   4.731 -10.407   3.643
   17    HA   PRO   3           HA       PRO   3   6.577  -8.104  -2.234
   18    HB2  PRO   3           2HB      PRO   3   5.040  -9.882  -3.596
   19    HB3  PRO   3           3HB      PRO   3   6.525 -10.385  -2.730
   20    HG2  PRO   3           2HG      PRO   3   3.656 -10.550  -1.758
   21    HG3  PRO   3           3HG      PRO   3   4.903 -11.836  -1.733
   22    HD2  PRO   3           2HD      PRO   3   4.357 -10.244   0.434
   23    HD3  PRO   3           3HD      PRO   3   6.005 -10.858   0.106
   24    H    ARG   4           H        ARG   4   5.443  -6.969  -3.886
   25    HA   ARG   4           HA       ARG   4   3.630  -5.049  -2.983
   26    HB2  ARG   4           2HB      ARG   4   4.158  -5.961  -5.842
   27    HB3  ARG   4           3HB      ARG   4   3.286  -4.487  -5.405
   28    HG2  ARG   4           2HG      ARG   4   5.266  -3.644  -4.183
   29    HG3  ARG   4           3HG      ARG   4   6.189  -5.075  -4.656
   30    HD2  ARG   4           2HD      ARG   4   4.943  -3.080  -6.591
   31    HD3  ARG   4           3HD      ARG   4   6.634  -3.062  -6.063
   32    HE   ARG   4           HE       ARG   4   6.173  -5.639  -7.081
   33   HH11  ARG   4          1HH1      ARG   4   6.223  -2.393  -8.397
   34   HH12  ARG   4          2HH1      ARG   4   6.656  -2.949  -9.991
   35   HH21  ARG   4          1HH2      ARG   4   6.718  -6.280  -9.140
   36   HH22  ARG   4          2HH2      ARG   4   6.932  -5.091 -10.390
   37    H    LYS   5           H        LYS   5   2.749  -8.084  -4.615
   38    HA   LYS   5           HA       LYS   5  -0.012  -7.585  -5.073
   39    HB2  LYS   5           2HB      LYS   5   1.280  -9.320  -6.152
   40    HB3  LYS   5           3HB      LYS   5   1.691 -10.064  -4.601
   41    HG2  LYS   5           2HG      LYS   5  -0.618 -10.747  -4.252
   42    HG3  LYS   5           3HG      LYS   5  -1.126  -9.940  -5.755
   43    HD2  LYS   5           2HD      LYS   5   0.086 -11.497  -7.119
   44    HD3  LYS   5           3HD      LYS   5   1.094 -12.020  -5.762
   45    HE2  LYS   5           2HE      LYS   5  -0.404 -13.784  -6.123
   46    HE3  LYS   5           3HE      LYS   5  -0.885 -12.958  -4.634
   47    HZ1  LYS   5           HZ1      LYS   5  -2.192 -12.598  -7.291
   48    HZ2  LYS   5           HZ2      LYS   5  -2.810 -13.469  -6.060
   49    HZ3  LYS   5           HZ3      LYS   5  -2.660 -11.853  -5.912
   50    H    ILE   6           H        ILE   6   1.670  -8.695  -2.152
   51    HA   ILE   6           HA       ILE   6  -0.904  -9.148  -0.722
   52    HB   ILE   6           HB       ILE   6   1.962  -9.638   0.168
   53   HG12  ILE   6          2HG1      ILE   6  -0.210 -11.579  -0.775
   54   HG13  ILE   6          3HG1      ILE   6   1.227 -11.134  -1.691
   55   HG21  ILE   6          1HG2      ILE   6   0.421  -9.156   2.062
   56   HG22  ILE   6          2HG2      ILE   6  -0.705 -10.387   1.463
   57   HG23  ILE   6          3HG2      ILE   6   0.904 -10.844   2.069
   58   HD11  ILE   6          3HD1      ILE   6   1.646 -13.269  -0.744
   59   HD12  ILE   6          1HD1      ILE   6   2.654 -12.108   0.145
   60   HD13  ILE   6          2HD1      ILE   6   1.161 -12.750   0.875
   61    H    LEU   7           H        LEU   7   2.015  -7.081  -0.532
   62    HA   LEU   7           HA       LEU   7   1.322  -5.518   1.704
   63    HB2  LEU   7           2HB      LEU   7   3.499  -5.673   0.515
   64    HB3  LEU   7           3HB      LEU   7   2.847  -4.787  -0.841
   65    HG   LEU   7           HG       LEU   7   4.395  -3.588   0.748
   66   HD11  LEU   7          1HD1      LEU   7   2.940  -2.392  -0.875
   67   HD12  LEU   7          2HD1      LEU   7   1.731  -2.180   0.412
   68   HD13  LEU   7          3HD1      LEU   7   3.339  -1.464   0.577
   69   HD21  LEU   7          3HD2      LEU   7   3.419  -4.402   2.878
   70   HD22  LEU   7          1HD2      LEU   7   3.555  -2.637   2.800
   71   HD23  LEU   7          2HD2      LEU   7   1.974  -3.406   2.578
   72    H    CYS   8           H        CYS   8   0.226  -5.237  -1.657
   73    HA   CYS   8           HA       CYS   8  -1.181  -2.758  -1.474
   74    HB2  CYS   8           2HB      CYS   8  -0.634  -3.816  -3.566
   75    HB3  CYS   8           3HB      CYS   8  -1.580  -5.246  -3.172
   76    H    ALA   9           H        ALA   9  -2.203  -6.064  -0.479
   77    HA   ALA   9           HA       ALA   9  -4.986  -5.294  -0.082
   78    HB1  ALA   9           3HB      ALA   9  -4.259  -7.625  -0.548
   79    HB2  ALA   9           1HB      ALA   9  -3.409  -7.668   1.013
   80    HB3  ALA   9           2HB      ALA   9  -5.177  -7.495   0.965
   81    H    ILE  10           H        ILE  10  -2.074  -5.465   1.960
   82    HA   ILE  10           HA       ILE  10  -3.344  -4.712   4.441
   83    HB   ILE  10           HB       ILE  10  -0.469  -4.207   3.571
   84   HG12  ILE  10          2HG1      ILE  10  -0.913  -6.569   3.219
   85   HG13  ILE  10          3HG1      ILE  10   0.158  -6.324   4.561
   86   HG21  ILE  10          1HG2      ILE  10  -1.028  -2.994   5.603
   87   HG22  ILE  10          2HG2      ILE  10  -1.723  -4.453   6.336
   88   HG23  ILE  10          3HG2      ILE  10   0.019  -4.358   6.004
   89   HD11  ILE  10          3HD1      ILE  10  -1.698  -6.781   6.156
   90   HD12  ILE  10          1HD1      ILE  10  -2.815  -6.981   4.783
   91   HD13  ILE  10          2HD1      ILE  10  -1.470  -8.109   5.010
   92    H    ALA  11           H        ALA  11  -1.684  -2.774   1.891
   93    HA   ALA  11           HA       ALA  11  -2.039  -0.224   3.026
   94    HB1  ALA  11           3HB      ALA  11  -2.102  -0.970   0.065
   95    HB2  ALA  11           1HB      ALA  11  -1.657   0.593   0.763
   96    HB3  ALA  11           2HB      ALA  11  -0.621  -0.818   1.043
   97    H    LYS  12           H        LYS  12  -4.239  -2.021   0.860
   98    HA   LYS  12           HA       LYS  12  -6.325  -0.095   0.687
   99    HB2  LYS  12           2HB      LYS  12  -5.799  -2.436  -0.566
  100    HB3  LYS  12           3HB      LYS  12  -6.906  -3.064   0.633
  101    HG2  LYS  12           2HG      LYS  12  -8.299  -2.589  -1.177
  102    HG3  LYS  12           3HG      LYS  12  -8.518  -1.167  -0.160
  103    HD2  LYS  12           2HD      LYS  12  -8.282  -0.418  -2.423
  104    HD3  LYS  12           3HD      LYS  12  -6.776   0.024  -1.594
  105    HE2  LYS  12           2HE      LYS  12  -5.570  -1.792  -2.611
  106    HE3  LYS  12           3HE      LYS  12  -7.052  -2.558  -3.189
  107    HZ1  LYS  12           HZ1      LYS  12  -5.798  -1.268  -4.932
  108    HZ2  LYS  12           HZ2      LYS  12  -7.358  -0.805  -4.774
  109    HZ3  LYS  12           HZ3      LYS  12  -6.161   0.103  -4.152
  110    H    LYS  13           H        LYS  13  -5.898  -2.788   2.990
  111    HA   LYS  13           HA       LYS  13  -8.418  -2.315   4.370
  112    HB2  LYS  13           2HB      LYS  13  -6.001  -4.068   4.945
  113    HB3  LYS  13           3HB      LYS  13  -7.403  -3.987   6.021
  114    HG2  LYS  13           2HG      LYS  13  -8.911  -4.667   4.215
  115    HG3  LYS  13           3HG      LYS  13  -7.570  -4.772   3.076
  116    HD2  LYS  13           2HD      LYS  13  -7.796  -6.420   5.635
  117    HD3  LYS  13           3HD      LYS  13  -8.332  -6.965   4.037
  118    HE2  LYS  13           2HE      LYS  13  -6.018  -6.702   3.173
  119    HE3  LYS  13           3HE      LYS  13  -5.471  -6.215   4.782
  120    HZ1  LYS  13           HZ1      LYS  13  -5.098  -8.596   4.400
  121    HZ2  LYS  13           HZ2      LYS  13  -6.180  -8.406   5.607
  122    HZ3  LYS  13           HZ3      LYS  13  -6.684  -8.851   4.121
  123    H    LYS  14           H        LYS  14  -5.055  -1.452   5.185
  124    HA   LYS  14           HA       LYS  14  -5.926  -0.220   7.742
  125    HB2  LYS  14           2HB      LYS  14  -3.208  -0.796   6.516
  126    HB3  LYS  14           3HB      LYS  14  -3.404   0.212   7.937
  127    HG2  LYS  14           2HG      LYS  14  -2.806  -1.980   8.625
  128    HG3  LYS  14           3HG      LYS  14  -4.415  -1.560   9.211
  129    HD2  LYS  14           2HD      LYS  14  -5.463  -3.056   7.595
  130    HD3  LYS  14           3HD      LYS  14  -3.919  -3.302   6.765
  131    HE2  LYS  14           2HE      LYS  14  -4.359  -5.250   8.093
  132    HE3  LYS  14           3HE      LYS  14  -2.996  -4.384   8.805
  133    HZ1  LYS  14           HZ1      LYS  14  -4.530  -3.483  10.477
  134    HZ2  LYS  14           HZ2      LYS  14  -5.802  -4.255   9.797
  135    HZ3  LYS  14           HZ3      LYS  14  -4.600  -5.110  10.490
  136    H    GLY  15           H        GLY  15  -5.695   0.948   4.581
  137    HA2  GLY  15           HA2      GLY  15  -6.249   3.089   3.847
  138    HA3  GLY  15           HA3      GLY  15  -6.213   3.689   5.511
  139    H    LYS  16           H        LYS  16  -3.566   1.905   4.120
  140    HA   LYS  16           HA       LYS  16  -1.681   4.189   4.501
  141    HB2  LYS  16           2HB      LYS  16  -1.600   1.227   4.821
  142    HB3  LYS  16           3HB      LYS  16  -0.209   1.878   4.014
  143    HG2  LYS  16           2HG      LYS  16   0.304   1.762   6.308
  144    HG3  LYS  16           3HG      LYS  16   0.158   3.474   5.927
  145    HD2  LYS  16           2HD      LYS  16  -2.183   1.915   7.074
  146    HD3  LYS  16           3HD      LYS  16  -0.884   2.477   8.126
  147    HE2  LYS  16           2HE      LYS  16  -1.282   4.799   7.510
  148    HE3  LYS  16           3HE      LYS  16  -2.513   4.320   6.339
  149    HZ1  LYS  16           HZ1      LYS  16  -3.521   5.012   8.433
  150    HZ2  LYS  16           HZ2      LYS  16  -3.848   3.433   8.157
  151    HZ3  LYS  16           HZ3      LYS  16  -2.715   3.860   9.263
  152    H    CYS  17           H        CYS  17  -3.415   3.135   1.938
  153    HA   CYS  17           HA       CYS  17  -1.312   3.026  -0.062
  154    HB2  CYS  17           2HB      CYS  17  -3.554   1.811   0.017
  155    HB3  CYS  17           3HB      CYS  17  -4.255   3.321  -0.567
  156    H    LYS  18           H        LYS  18  -0.278   4.948   0.298
  157    HA   LYS  18           HA       LYS  18  -1.275   7.272  -1.255
  158    HB2  LYS  18           2HB      LYS  18  -0.723   8.885   0.499
  159    HB3  LYS  18           3HB      LYS  18  -1.970   7.766   1.035
  160    HG2  LYS  18           2HG      LYS  18  -0.287   6.495   2.357
  161    HG3  LYS  18           3HG      LYS  18   0.991   7.561   1.763
  162    HD2  LYS  18           2HD      LYS  18   0.389   8.229   3.995
  163    HD3  LYS  18           3HD      LYS  18  -0.112   9.496   2.867
  164    HE2  LYS  18           2HE      LYS  18  -2.450   8.633   2.947
  165    HE3  LYS  18           3HE      LYS  18  -1.940   7.346   4.046
  166    HZ1  LYS  18           HZ1      LYS  18  -2.894   9.225   5.255
  167    HZ2  LYS  18           HZ2      LYS  18  -1.319   9.075   5.659
  168    HZ3  LYS  18           HZ3      LYS  18  -1.793  10.258   4.636
  169    H    GLY  19           H        GLY  19   0.478   8.975  -1.506
  170    HA2  GLY  19           HA2      GLY  19   2.496   9.449  -2.568
  171    HA3  GLY  19           HA3      GLY  19   3.240   8.222  -1.538
  172    HA   PRO  20           HA       PRO  20   3.626   6.369  -5.754
  173    HB2  PRO  20           2HB      PRO  20   5.403   4.577  -4.091
  174    HB3  PRO  20           3HB      PRO  20   5.672   5.214  -5.743
  175    HG2  PRO  20           2HG      PRO  20   6.930   6.353  -3.639
  176    HG3  PRO  20           3HG      PRO  20   6.180   7.398  -4.893
  177    HD2  PRO  20           2HD      PRO  20   5.062   6.613  -2.185
  178    HD3  PRO  20           3HD      PRO  20   5.115   8.226  -2.962
  179    H    LEU  21           H        LEU  21   2.908   4.763  -2.637
  180    HA   LEU  21           HA       LEU  21   2.191   2.222  -3.639
  181    HB2  LEU  21           2HB      LEU  21   2.474   3.343  -1.174
  182    HB3  LEU  21           3HB      LEU  21   0.722   3.297  -1.259
  183    HG   LEU  21           HG       LEU  21   2.679   0.964  -1.461
  184   HD11  LEU  21          1HD1      LEU  21   0.535   1.688   0.574
  185   HD12  LEU  21          2HD1      LEU  21   1.602   0.273   0.643
  186   HD13  LEU  21          3HD1      LEU  21   2.284   1.900   0.790
  187   HD21  LEU  21          3HD2      LEU  21   0.825   0.373  -2.913
  188   HD22  LEU  21          1HD2      LEU  21   0.686  -0.533  -1.409
  189   HD23  LEU  21          2HD2      LEU  21  -0.358   0.878  -1.680
  190    H    LYS  22           H        LYS  22   0.230   5.150  -3.333
  191    HA   LYS  22           HA       LYS  22  -2.348   4.094  -4.066
  192    HB2  LYS  22           2HB      LYS  22  -2.102   6.195  -2.976
  193    HB3  LYS  22           3HB      LYS  22  -1.108   6.857  -4.283
  194    HG2  LYS  22           2HG      LYS  22  -3.016   6.868  -5.799
  195    HG3  LYS  22           3HG      LYS  22  -4.025   6.045  -4.589
  196    HD2  LYS  22           2HD      LYS  22  -3.925   7.960  -3.103
  197    HD3  LYS  22           3HD      LYS  22  -2.693   8.733  -4.107
  198    HE2  LYS  22           2HE      LYS  22  -4.731   9.870  -4.539
  199    HE3  LYS  22           3HE      LYS  22  -4.330   8.928  -5.976
  200    HZ1  LYS  22           HZ1      LYS  22  -6.301   8.082  -3.914
  201    HZ2  LYS  22           HZ2      LYS  22  -6.688   8.749  -5.351
  202    HZ3  LYS  22           HZ3      LYS  22  -5.984   7.281  -5.304
  203    H    LEU  23           H        LEU  23   0.411   4.944  -6.034
  204    HA   LEU  23           HA       LEU  23  -1.064   4.547  -8.565
  205    HB2  LEU  23           2HB      LEU  23   0.778   6.178  -8.285
  206    HB3  LEU  23           3HB      LEU  23   1.927   4.868  -8.068
  207    HG   LEU  23           HG       LEU  23   0.227   5.143 -10.583
  208   HD11  LEU  23          1HD1      LEU  23   2.158   6.289 -11.605
  209   HD12  LEU  23          2HD1      LEU  23   1.511   7.222 -10.249
  210   HD13  LEU  23          3HD1      LEU  23   3.004   6.279 -10.039
  211   HD21  LEU  23          3HD2      LEU  23   2.169   3.932 -11.626
  212   HD22  LEU  23          1HD2      LEU  23   2.879   3.730 -10.012
  213   HD23  LEU  23          2HD2      LEU  23   1.336   2.953 -10.431
  214    H    VAL  24           H        VAL  24   1.441   2.766  -6.708
  215    HA   VAL  24           HA       VAL  24   1.683   0.528  -8.427
  216    HB   VAL  24           HB       VAL  24   2.145   0.769  -5.429
  217   HG11  VAL  24          1HG1      VAL  24   3.721  -1.138  -5.677
  218   HG12  VAL  24          2HG1      VAL  24   2.050  -1.621  -5.945
  219   HG13  VAL  24          3HG1      VAL  24   3.133  -1.391  -7.338
  220   HG21  VAL  24          3HG2      VAL  24   3.515   2.308  -6.853
  221   HG22  VAL  24          1HG2      VAL  24   4.492   1.095  -6.033
  222   HG23  VAL  24          2HG2      VAL  24   4.108   0.910  -7.762
  223    H    CYS  25           H        CYS  25  -0.510   0.974  -5.672
  224    HA   CYS  25           HA       CYS  25  -1.733  -1.714  -6.042
  225    HB2  CYS  25           2HB      CYS  25  -0.793  -1.074  -3.905
  226    HB3  CYS  25           3HB      CYS  25  -1.770   0.377  -3.855
  227    H    LYS  26           H        LYS  26  -2.257   1.420  -6.977
  228    HA   LYS  26           HA       LYS  26  -3.901   2.678  -7.830
  229    HB2  LYS  26           2HB      LYS  26  -3.917   0.323  -9.142
  230    HB3  LYS  26           3HB      LYS  26  -5.606   0.373  -8.656
  231    HG2  LYS  26           2HG      LYS  26  -4.049   2.558 -10.103
  232    HG3  LYS  26           3HG      LYS  26  -5.147   1.402 -10.875
  233    HD2  LYS  26           2HD      LYS  26  -7.029   2.315  -9.463
  234    HD3  LYS  26           3HD      LYS  26  -5.946   3.583  -8.879
  235    HE2  LYS  26           2HE      LYS  26  -6.684   3.093 -11.798
  236    HE3  LYS  26           3HE      LYS  26  -7.447   4.287 -10.746
  237    HZ1  LYS  26           HZ1      LYS  26  -5.282   5.388 -10.521
  238    HZ2  LYS  26           HZ2      LYS  26  -4.580   4.302 -11.528
  239    HZ3  LYS  26           HZ3      LYS  26  -5.728   5.314 -12.086
  240    H    CYS  27           H        CYS  27  -4.476   3.716  -6.016
  241    HA   CYS  27           HA       CYS  27  -7.025   2.911  -4.659
  242    HB2  CYS  27           2HB      CYS  27  -4.565   4.166  -3.389
  243    HB3  CYS  27           3HB      CYS  27  -6.043   3.724  -2.570
  Start of MODEL   36
    1    H1   GLY   1           1H       GLY   1   9.362  -9.540   4.575
    2    H2   GLY   1           2H       GLY   1  10.105  -8.564   3.490
    3    H3   GLY   1           3H       GLY   1  10.103  -8.168   5.081
    4    HA2  GLY   1           HA2      GLY   1   7.719  -7.856   5.070
    5    HA3  GLY   1           HA3      GLY   1   8.528  -6.790   3.906
    6    H    LEU   2           H        LEU   2   5.860  -7.308   3.606
    7    HA   LEU   2           HA       LEU   2   5.327  -9.510   1.793
    8    HB2  LEU   2           2HB      LEU   2   3.759  -7.009   2.520
    9    HB3  LEU   2           3HB      LEU   2   3.134  -8.274   1.470
   10    HG   LEU   2           HG       LEU   2   3.913  -8.672   4.392
   11   HD11  LEU   2          1HD1      LEU   2   1.187  -8.405   3.055
   12   HD12  LEU   2          2HD1      LEU   2   1.476  -8.792   4.766
   13   HD13  LEU   2          3HD1      LEU   2   1.954  -7.213   4.125
   14   HD21  LEU   2          3HD2      LEU   2   2.519 -10.513   2.397
   15   HD22  LEU   2          1HD2      LEU   2   4.108 -10.778   3.153
   16   HD23  LEU   2          2HD2      LEU   2   2.648 -10.811   4.145
   17    HA   PRO   3           HA       PRO   3   6.310  -7.318  -2.059
   18    HB2  PRO   3           2HB      PRO   3   5.048  -8.889  -3.877
   19    HB3  PRO   3           3HB      PRO   3   6.494  -9.458  -2.984
   20    HG2  PRO   3           2HG      PRO   3   3.577  -9.999  -2.341
   21    HG3  PRO   3           3HG      PRO   3   4.918 -11.182  -2.448
   22    HD2  PRO   3           2HD      PRO   3   4.072 -10.093  -0.074
   23    HD3  PRO   3           3HD      PRO   3   5.785 -10.525  -0.358
   24    H    ARG   4           H        ARG   4   5.205  -5.946  -3.541
   25    HA   ARG   4           HA       ARG   4   3.166  -4.365  -2.503
   26    HB2  ARG   4           2HB      ARG   4   4.103  -4.784  -5.366
   27    HB3  ARG   4           3HB      ARG   4   2.903  -3.559  -4.934
   28    HG2  ARG   4           2HG      ARG   4   4.413  -2.392  -3.502
   29    HG3  ARG   4           3HG      ARG   4   5.632  -3.680  -3.593
   30    HD2  ARG   4           2HD      ARG   4   5.983  -3.234  -5.974
   31    HD3  ARG   4           3HD      ARG   4   4.708  -2.002  -5.953
   32    HE   ARG   4           HE       ARG   4   6.659  -1.359  -3.967
   33   HH11  ARG   4          1HH1      ARG   4   6.397  -1.350  -7.462
   34   HH12  ARG   4          2HH1      ARG   4   7.545  -0.051  -7.634
   35   HH21  ARG   4          1HH2      ARG   4   8.125   0.284  -4.261
   36   HH22  ARG   4          2HH2      ARG   4   8.500   0.838  -5.867
   37    H    LYS   5           H        LYS   5   2.659  -7.084  -4.720
   38    HA   LYS   5           HA       LYS   5  -0.146  -6.618  -5.141
   39    HB2  LYS   5           2HB      LYS   5  -0.168  -8.749  -6.247
   40    HB3  LYS   5           3HB      LYS   5   1.293  -7.869  -6.692
   41    HG2  LYS   5           2HG      LYS   5   2.580  -9.262  -5.014
   42    HG3  LYS   5           3HG      LYS   5   1.091 -10.178  -4.707
   43    HD2  LYS   5           2HD      LYS   5   1.002 -10.850  -7.089
   44    HD3  LYS   5           3HD      LYS   5   2.500  -9.943  -7.399
   45    HE2  LYS   5           2HE      LYS   5   3.699 -11.366  -5.749
   46    HE3  LYS   5           3HE      LYS   5   2.208 -12.263  -5.433
   47    HZ1  LYS   5           HZ1      LYS   5   3.617 -13.422  -7.037
   48    HZ2  LYS   5           HZ2      LYS   5   2.227 -12.980  -7.766
   49    HZ3  LYS   5           HZ3      LYS   5   3.605 -12.150  -8.057
   50    H    ILE   6           H        ILE   6   1.446  -8.056  -2.438
   51    HA   ILE   6           HA       ILE   6  -1.159  -9.075  -1.352
   52    HB   ILE   6           HB       ILE   6   1.658  -9.569  -0.321
   53   HG12  ILE   6          2HG1      ILE   6  -0.226 -11.421  -1.861
   54   HG13  ILE   6          3HG1      ILE   6   1.255 -10.703  -2.493
   55   HG21  ILE   6          1HG2      ILE   6  -0.098  -9.592   1.449
   56   HG22  ILE   6          2HG2      ILE   6  -1.042 -10.750   0.494
   57   HG23  ILE   6          3HG2      ILE   6   0.534 -11.206   1.177
   58   HD11  ILE   6          3HD1      ILE   6   1.767 -12.947  -1.945
   59   HD12  ILE   6          1HD1      ILE   6   2.568 -11.925  -0.738
   60   HD13  ILE   6          2HD1      ILE   6   1.076 -12.808  -0.323
   61    H    LEU   7           H        LEU   7   1.618  -6.936  -0.613
   62    HA   LEU   7           HA       LEU   7   0.756  -5.897   1.842
   63    HB2  LEU   7           2HB      LEU   7   2.996  -5.630   0.787
   64    HB3  LEU   7           3HB      LEU   7   2.297  -4.562  -0.422
   65    HG   LEU   7           HG       LEU   7   1.797  -2.870   1.284
   66   HD11  LEU   7          1HD1      LEU   7   2.679  -3.108   3.592
   67   HD12  LEU   7          2HD1      LEU   7   1.395  -4.272   3.272
   68   HD13  LEU   7          3HD1      LEU   7   3.093  -4.802   3.261
   69   HD21  LEU   7          3HD2      LEU   7   4.652  -3.915   1.482
   70   HD22  LEU   7          1HD2      LEU   7   4.012  -2.900   0.175
   71   HD23  LEU   7          2HD2      LEU   7   4.109  -2.256   1.822
   72    H    CYS   8           H        CYS   8  -0.369  -5.036  -1.418
   73    HA   CYS   8           HA       CYS   8  -1.720  -2.628  -0.727
   74    HB2  CYS   8           2HB      CYS   8  -1.221  -3.373  -3.019
   75    HB3  CYS   8           3HB      CYS   8  -2.436  -4.646  -2.877
   76    H    ALA   9           H        ALA   9  -2.693  -5.993  -0.132
   77    HA   ALA   9           HA       ALA   9  -5.506  -5.412   0.345
   78    HB1  ALA   9           3HB      ALA   9  -4.639  -7.675  -0.214
   79    HB2  ALA   9           1HB      ALA   9  -3.773  -7.718   1.339
   80    HB3  ALA   9           2HB      ALA   9  -5.545  -7.657   1.312
   81    H    ILE  10           H        ILE  10  -2.569  -5.362   2.303
   82    HA   ILE  10           HA       ILE  10  -3.872  -4.736   4.840
   83    HB   ILE  10           HB       ILE  10  -0.991  -4.196   4.029
   84   HG12  ILE  10          2HG1      ILE  10  -1.347  -6.531   3.495
   85   HG13  ILE  10          3HG1      ILE  10  -0.337  -6.360   4.898
   86   HG21  ILE  10          1HG2      ILE  10  -2.317  -4.634   6.728
   87   HG22  ILE  10          2HG2      ILE  10  -0.565  -4.472   6.455
   88   HG23  ILE  10          3HG2      ILE  10  -1.641  -3.116   6.093
   89   HD11  ILE  10          3HD1      ILE  10  -3.301  -7.098   4.954
   90   HD12  ILE  10          1HD1      ILE  10  -1.935  -8.209   5.154
   91   HD13  ILE  10          2HD1      ILE  10  -2.241  -6.969   6.380
   92    H    ALA  11           H        ALA  11  -2.142  -2.891   2.313
   93    HA   ALA  11           HA       ALA  11  -2.244  -0.350   3.429
   94    HB1  ALA  11           3HB      ALA  11  -0.986  -1.201   1.354
   95    HB2  ALA  11           1HB      ALA  11  -2.502  -0.931   0.447
   96    HB3  ALA  11           2HB      ALA  11  -1.667   0.418   1.241
   97    H    LYS  12           H        LYS  12  -4.739  -1.888   1.354
   98    HA   LYS  12           HA       LYS  12  -6.513   0.439   1.455
   99    HB2  LYS  12           2HB      LYS  12  -6.915  -2.411   0.480
  100    HB3  LYS  12           3HB      LYS  12  -8.097  -1.102   0.280
  101    HG2  LYS  12           2HG      LYS  12  -6.430   0.247  -0.961
  102    HG3  LYS  12           3HG      LYS  12  -5.245  -1.045  -0.821
  103    HD2  LYS  12           2HD      LYS  12  -7.852  -1.109  -2.367
  104    HD3  LYS  12           3HD      LYS  12  -6.196  -1.091  -3.002
  105    HE2  LYS  12           2HE      LYS  12  -5.795  -3.322  -1.926
  106    HE3  LYS  12           3HE      LYS  12  -7.485  -3.353  -1.411
  107    HZ1  LYS  12           HZ1      LYS  12  -8.142  -3.268  -3.754
  108    HZ2  LYS  12           HZ2      LYS  12  -6.583  -3.237  -4.243
  109    HZ3  LYS  12           HZ3      LYS  12  -7.183  -4.560  -3.497
  110    H    LYS  13           H        LYS  13  -6.247  -2.510   3.377
  111    HA   LYS  13           HA       LYS  13  -8.754  -2.209   4.798
  112    HB2  LYS  13           2HB      LYS  13  -7.486  -4.312   4.598
  113    HB3  LYS  13           3HB      LYS  13  -6.183  -3.646   5.594
  114    HG2  LYS  13           2HG      LYS  13  -7.770  -3.418   7.498
  115    HG3  LYS  13           3HG      LYS  13  -9.073  -4.068   6.495
  116    HD2  LYS  13           2HD      LYS  13  -6.516  -5.551   7.264
  117    HD3  LYS  13           3HD      LYS  13  -8.089  -5.734   8.054
  118    HE2  LYS  13           2HE      LYS  13  -9.074  -6.481   5.875
  119    HE3  LYS  13           3HE      LYS  13  -7.469  -6.390   5.137
  120    HZ1  LYS  13           HZ1      LYS  13  -8.202  -8.158   7.412
  121    HZ2  LYS  13           HZ2      LYS  13  -7.976  -8.645   5.872
  122    HZ3  LYS  13           HZ3      LYS  13  -6.716  -8.074   6.737
  123    H    LYS  14           H        LYS  14  -5.446  -1.078   5.483
  124    HA   LYS  14           HA       LYS  14  -6.289   0.340   7.940
  125    HB2  LYS  14           2HB      LYS  14  -3.648  -0.182   6.544
  126    HB3  LYS  14           3HB      LYS  14  -3.772   1.102   7.730
  127    HG2  LYS  14           2HG      LYS  14  -2.963  -0.785   8.863
  128    HG3  LYS  14           3HG      LYS  14  -4.600  -0.475   9.437
  129    HD2  LYS  14           2HD      LYS  14  -5.441  -2.333   8.002
  130    HD3  LYS  14           3HD      LYS  14  -3.795  -2.651   7.446
  131    HE2  LYS  14           2HE      LYS  14  -4.806  -2.821  10.327
  132    HE3  LYS  14           3HE      LYS  14  -4.593  -4.196   9.244
  133    HZ1  LYS  14           HZ1      LYS  14  -2.692  -3.968  10.704
  134    HZ2  LYS  14           HZ2      LYS  14  -2.197  -3.683   9.177
  135    HZ3  LYS  14           HZ3      LYS  14  -2.403  -2.440  10.223
  136    H    GLY  15           H        GLY  15  -6.315   1.221   4.650
  137    HA2  GLY  15           HA2      GLY  15  -6.692   3.264   3.608
  138    HA3  GLY  15           HA3      GLY  15  -6.767   4.066   5.181
  139    H    LYS  16           H        LYS  16  -3.998   2.099   4.530
  140    HA   LYS  16           HA       LYS  16  -2.185   4.414   4.694
  141    HB2  LYS  16           2HB      LYS  16  -1.990   2.490   6.199
  142    HB3  LYS  16           3HB      LYS  16  -1.707   1.402   4.850
  143    HG2  LYS  16           2HG      LYS  16   0.119   3.780   5.131
  144    HG3  LYS  16           3HG      LYS  16   0.248   2.530   6.359
  145    HD2  LYS  16           2HD      LYS  16   0.935   0.864   4.865
  146    HD3  LYS  16           3HD      LYS  16   0.340   1.725   3.434
  147    HE2  LYS  16           2HE      LYS  16   2.009   3.468   3.693
  148    HE3  LYS  16           3HE      LYS  16   2.587   2.758   5.209
  149    HZ1  LYS  16           HZ1      LYS  16   4.014   2.135   3.347
  150    HZ2  LYS  16           HZ2      LYS  16   3.300   0.799   3.949
  151    HZ3  LYS  16           HZ3      LYS  16   2.769   1.452   2.543
  152    H    CYS  17           H        CYS  17  -3.571   2.708   2.120
  153    HA   CYS  17           HA       CYS  17  -1.324   2.628   0.335
  154    HB2  CYS  17           2HB      CYS  17  -3.498   1.319   0.151
  155    HB3  CYS  17           3HB      CYS  17  -4.229   2.803  -0.469
  156    H    LYS  18           H        LYS  18  -0.240   4.417   0.115
  157    HA   LYS  18           HA       LYS  18  -1.397   6.819  -1.216
  158    HB2  LYS  18           2HB      LYS  18   0.271   6.851   1.349
  159    HB3  LYS  18           3HB      LYS  18  -0.098   8.269   0.361
  160    HG2  LYS  18           2HG      LYS  18  -2.548   7.861   0.748
  161    HG3  LYS  18           3HG      LYS  18  -2.117   6.553   1.870
  162    HD2  LYS  18           2HD      LYS  18  -0.893   8.162   3.302
  163    HD3  LYS  18           3HD      LYS  18  -1.235   9.452   2.145
  164    HE2  LYS  18           2HE      LYS  18  -2.800   9.764   3.865
  165    HE3  LYS  18           3HE      LYS  18  -3.706   9.073   2.520
  166    HZ1  LYS  18           HZ1      LYS  18  -3.655   6.916   3.677
  167    HZ2  LYS  18           HZ2      LYS  18  -2.721   7.539   4.874
  168    HZ3  LYS  18           HZ3      LYS  18  -4.253   8.046   4.672
  169    H    GLY  19           H        GLY  19   0.319   8.209  -2.123
  170    HA2  GLY  19           HA2      GLY  19   2.176   8.501  -3.480
  171    HA3  GLY  19           HA3      GLY  19   3.033   7.664  -2.192
  172    HA   PRO  20           HA       PRO  20   3.953   4.996  -5.759
  173    HB2  PRO  20           2HB      PRO  20   5.271   3.372  -3.576
  174    HB3  PRO  20           3HB      PRO  20   5.885   3.780  -5.209
  175    HG2  PRO  20           2HG      PRO  20   6.775   5.154  -3.062
  176    HG3  PRO  20           3HG      PRO  20   6.324   6.046  -4.554
  177    HD2  PRO  20           2HD      PRO  20   4.672   5.632  -2.041
  178    HD3  PRO  20           3HD      PRO  20   4.956   7.131  -2.975
  179    H    LEU  21           H        LEU  21   2.735   3.591  -2.649
  180    HA   LEU  21           HA       LEU  21   1.927   1.102  -3.820
  181    HB2  LEU  21           2HB      LEU  21   2.096   2.091  -1.252
  182    HB3  LEU  21           3HB      LEU  21   0.367   2.146  -1.484
  183    HG   LEU  21           HG       LEU  21   0.873   0.107  -0.402
  184   HD11  LEU  21          1HD1      LEU  21   0.186  -1.687  -1.880
  185   HD12  LEU  21          2HD1      LEU  21  -0.777  -0.243  -2.224
  186   HD13  LEU  21          3HD1      LEU  21   0.542  -0.718  -3.316
  187   HD21  LEU  21          3HD2      LEU  21   2.492  -1.537  -1.185
  188   HD22  LEU  21          1HD2      LEU  21   2.932  -0.498  -2.558
  189   HD23  LEU  21          2HD2      LEU  21   3.273   0.025  -0.893
  190    H    LYS  22           H        LYS  22   0.257   4.164  -3.447
  191    HA   LYS  22           HA       LYS  22  -2.357   3.315  -4.445
  192    HB2  LYS  22           2HB      LYS  22  -2.128   5.205  -2.953
  193    HB3  LYS  22           3HB      LYS  22  -1.097   6.068  -4.103
  194    HG2  LYS  22           2HG      LYS  22  -2.920   6.319  -5.673
  195    HG3  LYS  22           3HG      LYS  22  -3.953   5.223  -4.738
  196    HD2  LYS  22           2HD      LYS  22  -3.996   6.809  -2.862
  197    HD3  LYS  22           3HD      LYS  22  -2.898   7.905  -3.738
  198    HE2  LYS  22           2HE      LYS  22  -4.581   8.141  -5.547
  199    HE3  LYS  22           3HE      LYS  22  -5.665   7.038  -4.692
  200    HZ1  LYS  22           HZ1      LYS  22  -5.764   8.646  -2.867
  201    HZ2  LYS  22           HZ2      LYS  22  -4.761   9.673  -3.655
  202    HZ3  LYS  22           HZ3      LYS  22  -6.243   9.351  -4.257
  203    H    LEU  23           H        LEU  23   0.529   4.807  -5.959
  204    HA   LEU  23           HA       LEU  23  -0.620   4.995  -8.587
  205    HB2  LEU  23           2HB      LEU  23   1.354   6.264  -7.807
  206    HB3  LEU  23           3HB      LEU  23   2.273   4.769  -7.658
  207    HG   LEU  23           HG       LEU  23   2.151   4.423 -10.111
  208   HD11  LEU  23          1HD1      LEU  23   1.400   6.305 -11.562
  209   HD12  LEU  23          2HD1      LEU  23   0.059   5.588 -10.667
  210   HD13  LEU  23          3HD1      LEU  23   0.753   7.138 -10.132
  211   HD21  LEU  23          3HD2      LEU  23   3.670   6.251 -10.725
  212   HD22  LEU  23          1HD2      LEU  23   3.160   7.179  -9.296
  213   HD23  LEU  23          2HD2      LEU  23   4.040   5.646  -9.103
  214    H    VAL  24           H        VAL  24   1.204   2.401  -6.975
  215    HA   VAL  24           HA       VAL  24   1.363   0.595  -9.212
  216    HB   VAL  24           HB       VAL  24   1.570   0.242  -6.204
  217   HG11  VAL  24          1HG1      VAL  24   2.618  -1.955  -6.611
  218   HG12  VAL  24          2HG1      VAL  24   0.917  -1.959  -7.049
  219   HG13  VAL  24          3HG1      VAL  24   2.153  -1.862  -8.326
  220   HG21  VAL  24          3HG2      VAL  24   3.743   0.036  -8.328
  221   HG22  VAL  24          1HG2      VAL  24   3.362   1.545  -7.487
  222   HG23  VAL  24          2HG2      VAL  24   3.924   0.162  -6.554
  223    H    CYS  25           H        CYS  25  -0.933   0.780  -6.472
  224    HA   CYS  25           HA       CYS  25  -2.422  -1.529  -7.577
  225    HB2  CYS  25           2HB      CYS  25  -1.350  -1.373  -5.275
  226    HB3  CYS  25           3HB      CYS  25  -2.632  -0.252  -4.853
  227    H    LYS  26           H        LYS  26  -2.814   1.810  -7.573
  228    HA   LYS  26           HA       LYS  26  -4.489   3.276  -8.013
  229    HB2  LYS  26           2HB      LYS  26  -5.743   0.910  -9.430
  230    HB3  LYS  26           3HB      LYS  26  -6.182   2.597  -9.676
  231    HG2  LYS  26           2HG      LYS  26  -3.392   1.456 -10.094
  232    HG3  LYS  26           3HG      LYS  26  -4.581   1.633 -11.383
  233    HD2  LYS  26           2HD      LYS  26  -3.303   3.905  -9.789
  234    HD3  LYS  26           3HD      LYS  26  -2.895   3.411 -11.432
  235    HE2  LYS  26           2HE      LYS  26  -5.230   3.931 -12.163
  236    HE3  LYS  26           3HE      LYS  26  -5.599   4.503 -10.532
  237    HZ1  LYS  26           HZ1      LYS  26  -4.989   6.340 -11.995
  238    HZ2  LYS  26           HZ2      LYS  26  -3.875   6.208 -10.811
  239    HZ3  LYS  26           HZ3      LYS  26  -3.537   5.676 -12.321
  240    H    CYS  27           H        CYS  27  -4.453   2.610  -5.667
  241    HA   CYS  27           HA       CYS  27  -6.838   1.743  -4.328
  242    HB2  CYS  27           2HB      CYS  27  -4.570   3.532  -3.342
  243    HB3  CYS  27           3HB      CYS  27  -5.809   2.846  -2.342
  Start of MODEL   37
    1    H1   GLY   1           1H       GLY   1  10.814  -6.533   5.481
    2    H2   GLY   1           2H       GLY   1   9.935  -7.904   5.660
    3    H3   GLY   1           3H       GLY   1  10.746  -7.630   4.265
    4    HA2  GLY   1           HA2      GLY   1   8.480  -6.024   5.260
    5    HA3  GLY   1           HA3      GLY   1   9.352  -5.742   3.742
    6    H    LEU   2           H        LEU   2   7.171  -5.927   2.819
    7    HA   LEU   2           HA       LEU   2   6.452  -8.738   2.125
    8    HB2  LEU   2           2HB      LEU   2   4.560  -6.448   2.795
    9    HB3  LEU   2           3HB      LEU   2   4.047  -7.970   2.081
   10    HG   LEU   2           HG       LEU   2   5.363  -7.712   4.824
   11   HD11  LEU   2          1HD1      LEU   2   2.442  -8.168   4.108
   12   HD12  LEU   2          2HD1      LEU   2   3.142  -8.110   5.738
   13   HD13  LEU   2          3HD1      LEU   2   3.130  -6.652   4.734
   14   HD21  LEU   2          3HD2      LEU   2   5.712  -9.950   3.856
   15   HD22  LEU   2          1HD2      LEU   2   4.519 -10.028   5.152
   16   HD23  LEU   2          2HD2      LEU   2   3.984 -10.071   3.459
   17    HA   PRO   3           HA       PRO   3   6.702  -7.037  -1.999
   18    HB2  PRO   3           2HB      PRO   3   5.475  -8.922  -3.504
   19    HB3  PRO   3           3HB      PRO   3   6.998  -9.274  -2.624
   20    HG2  PRO   3           2HG      PRO   3   4.160  -9.857  -1.734
   21    HG3  PRO   3           3HG      PRO   3   5.544 -10.995  -1.778
   22    HD2  PRO   3           2HD      PRO   3   4.796  -9.647   0.490
   23    HD3  PRO   3           3HD      PRO   3   6.505 -10.027   0.132
   24    H    ARG   4           H        ARG   4   5.440  -5.930  -3.546
   25    HA   ARG   4           HA       ARG   4   3.294  -4.429  -2.565
   26    HB2  ARG   4           2HB      ARG   4   4.164  -4.985  -5.434
   27    HB3  ARG   4           3HB      ARG   4   2.921  -3.801  -5.018
   28    HG2  ARG   4           2HG      ARG   4   4.454  -2.515  -3.664
   29    HG3  ARG   4           3HG      ARG   4   5.757  -3.688  -3.903
   30    HD2  ARG   4           2HD      ARG   4   4.443  -2.030  -6.090
   31    HD3  ARG   4           3HD      ARG   4   5.984  -1.656  -5.308
   32    HE   ARG   4           HE       ARG   4   6.259  -4.265  -6.294
   33   HH11  ARG   4          1HH1      ARG   4   5.790  -1.097  -7.716
   34   HH12  ARG   4          2HH1      ARG   4   6.556  -1.557  -9.212
   35   HH21  ARG   4          1HH2      ARG   4   7.220  -4.784  -8.230
   36   HH22  ARG   4          2HH2      ARG   4   7.349  -3.586  -9.483
   37    H    LYS   5           H        LYS   5   2.991  -7.423  -4.440
   38    HA   LYS   5           HA       LYS   5   0.148  -7.186  -4.845
   39    HB2  LYS   5           2HB      LYS   5   0.220  -9.439  -5.664
   40    HB3  LYS   5           3HB      LYS   5   1.572  -8.505  -6.296
   41    HG2  LYS   5           2HG      LYS   5   3.024  -9.575  -4.468
   42    HG3  LYS   5           3HG      LYS   5   1.661 -10.644  -4.137
   43    HD2  LYS   5           2HD      LYS   5   3.155 -10.374  -6.774
   44    HD3  LYS   5           3HD      LYS   5   3.344 -11.689  -5.624
   45    HE2  LYS   5           2HE      LYS   5   0.764 -11.042  -7.134
   46    HE3  LYS   5           3HE      LYS   5   1.951 -12.244  -7.632
   47    HZ1  LYS   5           HZ1      LYS   5   0.401 -12.356  -5.100
   48    HZ2  LYS   5           HZ2      LYS   5   0.164 -13.293  -6.411
   49    HZ3  LYS   5           HZ3      LYS   5   1.539 -13.444  -5.551
   50    H    ILE   6           H        ILE   6   1.941  -8.515  -2.089
   51    HA   ILE   6           HA       ILE   6  -0.542  -9.289  -0.687
   52    HB   ILE   6           HB       ILE   6   2.415  -9.270  -0.018
   53   HG12  ILE   6          2HG1      ILE   6   2.027 -11.611   0.544
   54   HG13  ILE   6          3HG1      ILE   6   0.295 -11.436   0.237
   55   HG21  ILE   6          1HG2      ILE   6   0.144  -9.641   1.981
   56   HG22  ILE   6          2HG2      ILE   6   1.837 -10.084   2.275
   57   HG23  ILE   6          3HG2      ILE   6   1.415  -8.396   2.022
   58   HD11  ILE   6          3HD1      ILE   6   2.454 -11.215  -1.883
   59   HD12  ILE   6          1HD1      ILE   6   1.520 -12.672  -1.522
   60   HD13  ILE   6          2HD1      ILE   6   0.683 -11.244  -2.139
   61    H    LEU   7           H        LEU   7   1.922  -6.671  -0.521
   62    HA   LEU   7           HA       LEU   7   0.841  -5.368   1.711
   63    HB2  LEU   7           2HB      LEU   7   3.066  -5.074   0.107
   64    HB3  LEU   7           3HB      LEU   7   2.169  -3.624  -0.317
   65    HG   LEU   7           HG       LEU   7   3.069  -4.511   2.460
   66   HD11  LEU   7          1HD1      LEU   7   4.867  -3.698   0.971
   67   HD12  LEU   7          2HD1      LEU   7   3.963  -2.192   0.697
   68   HD13  LEU   7          3HD1      LEU   7   4.586  -2.583   2.316
   69   HD21  LEU   7          3HD2      LEU   7   2.393  -2.237   3.230
   70   HD22  LEU   7          1HD2      LEU   7   1.600  -1.967   1.664
   71   HD23  LEU   7          2HD2      LEU   7   1.016  -3.234   2.767
   72    H    CYS   8           H        CYS   8  -0.067  -4.979  -1.695
   73    HA   CYS   8           HA       CYS   8  -1.652  -2.660  -1.570
   74    HB2  CYS   8           2HB      CYS   8  -1.014  -3.663  -3.641
   75    HB3  CYS   8           3HB      CYS   8  -1.775  -5.196  -3.235
   76    H    ALA   9           H        ALA   9  -2.590  -6.037  -0.684
   77    HA   ALA   9           HA       ALA   9  -5.396  -5.520  -0.369
   78    HB1  ALA   9           3HB      ALA   9  -3.558  -7.514   1.054
   79    HB2  ALA   9           1HB      ALA   9  -5.329  -7.596   0.958
   80    HB3  ALA   9           2HB      ALA   9  -4.351  -7.785  -0.521
   81    H    ILE  10           H        ILE  10  -2.636  -5.360   1.803
   82    HA   ILE  10           HA       ILE  10  -4.121  -4.873   4.229
   83    HB   ILE  10           HB       ILE  10  -1.155  -4.603   3.577
   84   HG12  ILE  10          2HG1      ILE  10  -2.634  -6.987   4.789
   85   HG13  ILE  10          3HG1      ILE  10  -2.202  -6.892   3.097
   86   HG21  ILE  10          1HG2      ILE  10  -1.775  -3.447   5.690
   87   HG22  ILE  10          2HG2      ILE  10  -2.548  -4.937   6.275
   88   HG23  ILE  10          3HG2      ILE  10  -0.794  -4.873   6.006
   89   HD11  ILE  10          3HD1      ILE  10   0.181  -6.721   3.647
   90   HD12  ILE  10          1HD1      ILE  10  -0.219  -7.011   5.365
   91   HD13  ILE  10          2HD1      ILE  10  -0.596  -8.236   4.132
   92    H    ALA  11           H        ALA  11  -2.242  -2.826   1.990
   93    HA   ALA  11           HA       ALA  11  -2.199  -0.465   3.455
   94    HB1  ALA  11           3HB      ALA  11  -2.338  -0.801   0.422
   95    HB2  ALA  11           1HB      ALA  11  -1.662   0.583   1.316
   96    HB3  ALA  11           2HB      ALA  11  -0.883  -0.995   1.432
   97    H    LYS  12           H        LYS  12  -4.744  -1.370   1.013
   98    HA   LYS  12           HA       LYS  12  -6.286   1.005   1.809
   99    HB2  LYS  12           2HB      LYS  12  -7.800   0.436   0.037
  100    HB3  LYS  12           3HB      LYS  12  -6.127   0.566  -0.475
  101    HG2  LYS  12           2HG      LYS  12  -6.038  -1.988  -0.440
  102    HG3  LYS  12           3HG      LYS  12  -7.794  -1.968  -0.213
  103    HD2  LYS  12           2HD      LYS  12  -8.078  -0.718  -2.313
  104    HD3  LYS  12           3HD      LYS  12  -6.321  -0.550  -2.486
  105    HE2  LYS  12           2HE      LYS  12  -6.087  -3.004  -2.678
  106    HE3  LYS  12           3HE      LYS  12  -7.843  -3.183  -2.552
  107    HZ1  LYS  12           HZ1      LYS  12  -6.439  -1.684  -4.725
  108    HZ2  LYS  12           HZ2      LYS  12  -7.107  -3.168  -4.877
  109    HZ3  LYS  12           HZ3      LYS  12  -8.058  -1.874  -4.599
  110    H    LYS  13           H        LYS  13  -6.356  -2.331   2.795
  111    HA   LYS  13           HA       LYS  13  -8.927  -2.071   4.183
  112    HB2  LYS  13           2HB      LYS  13  -6.572  -3.961   4.507
  113    HB3  LYS  13           3HB      LYS  13  -7.970  -3.988   5.590
  114    HG2  LYS  13           2HG      LYS  13  -9.504  -4.370   3.725
  115    HG3  LYS  13           3HG      LYS  13  -8.175  -4.289   2.564
  116    HD2  LYS  13           2HD      LYS  13  -7.121  -6.278   3.656
  117    HD3  LYS  13           3HD      LYS  13  -8.490  -6.357   4.788
  118    HE2  LYS  13           2HE      LYS  13 -10.046  -6.612   2.847
  119    HE3  LYS  13           3HE      LYS  13  -8.662  -6.585   1.748
  120    HZ1  LYS  13           HZ1      LYS  13  -7.846  -8.612   2.846
  121    HZ2  LYS  13           HZ2      LYS  13  -9.132  -8.633   3.854
  122    HZ3  LYS  13           HZ3      LYS  13  -9.346  -8.860   2.254
  123    H    LYS  14           H        LYS  14  -5.566  -1.352   5.164
  124    HA   LYS  14           HA       LYS  14  -6.483  -0.374   7.812
  125    HB2  LYS  14           2HB      LYS  14  -3.773  -0.874   6.559
  126    HB3  LYS  14           3HB      LYS  14  -3.934   0.117   7.996
  127    HG2  LYS  14           2HG      LYS  14  -3.357  -2.134   8.604
  128    HG3  LYS  14           3HG      LYS  14  -4.906  -1.642   9.285
  129    HD2  LYS  14           2HD      LYS  14  -6.115  -3.024   7.664
  130    HD3  LYS  14           3HD      LYS  14  -4.588  -3.451   6.850
  131    HE2  LYS  14           2HE      LYS  14  -3.768  -4.512   8.922
  132    HE3  LYS  14           3HE      LYS  14  -5.233  -4.021   9.779
  133    HZ1  LYS  14           HZ1      LYS  14  -5.371  -6.327   9.045
  134    HZ2  LYS  14           HZ2      LYS  14  -6.520  -5.453   8.294
  135    HZ3  LYS  14           HZ3      LYS  14  -5.172  -5.909   7.482
  136    H    GLY  15           H        GLY  15  -5.699   1.110   4.760
  137    HA2  GLY  15           HA2      GLY  15  -6.412   3.298   4.174
  138    HA3  GLY  15           HA3      GLY  15  -6.475   3.766   5.876
  139    H    LYS  16           H        LYS  16  -3.739   2.035   4.612
  140    HA   LYS  16           HA       LYS  16  -1.874   4.289   5.170
  141    HB2  LYS  16           2HB      LYS  16  -1.539   1.263   5.027
  142    HB3  LYS  16           3HB      LYS  16  -0.281   2.391   5.456
  143    HG2  LYS  16           2HG      LYS  16  -2.801   1.865   7.076
  144    HG3  LYS  16           3HG      LYS  16  -1.195   1.232   7.389
  145    HD2  LYS  16           2HD      LYS  16  -1.254   2.932   8.902
  146    HD3  LYS  16           3HD      LYS  16  -0.475   3.761   7.550
  147    HE2  LYS  16           2HE      LYS  16  -2.680   4.751   6.918
  148    HE3  LYS  16           3HE      LYS  16  -3.462   3.842   8.214
  149    HZ1  LYS  16           HZ1      LYS  16  -2.981   6.125   8.886
  150    HZ2  LYS  16           HZ2      LYS  16  -2.123   5.096   9.815
  151    HZ3  LYS  16           HZ3      LYS  16  -1.384   5.929   8.618
  152    H    CYS  17           H        CYS  17  -3.321   3.429   2.451
  153    HA   CYS  17           HA       CYS  17  -1.051   2.820   0.721
  154    HB2  CYS  17           2HB      CYS  17  -3.444   1.895   0.562
  155    HB3  CYS  17           3HB      CYS  17  -3.890   3.486  -0.063
  156    H    LYS  18           H        LYS  18   0.224   4.304  -0.120
  157    HA   LYS  18           HA       LYS  18  -0.666   6.900  -1.151
  158    HB2  LYS  18           2HB      LYS  18   0.753   8.248   0.404
  159    HB3  LYS  18           3HB      LYS  18  -0.581   7.459   1.229
  160    HG2  LYS  18           2HG      LYS  18   0.913   5.716   2.104
  161    HG3  LYS  18           3HG      LYS  18   2.283   6.402   1.206
  162    HD2  LYS  18           2HD      LYS  18   2.083   8.504   2.506
  163    HD3  LYS  18           3HD      LYS  18   0.704   7.820   3.399
  164    HE2  LYS  18           2HE      LYS  18   2.151   5.987   4.237
  165    HE3  LYS  18           3HE      LYS  18   3.521   6.643   3.332
  166    HZ1  LYS  18           HZ1      LYS  18   3.573   7.357   5.653
  167    HZ2  LYS  18           HZ2      LYS  18   3.376   8.659   4.693
  168    HZ3  LYS  18           HZ3      LYS  18   2.106   8.061   5.530
  169    H    GLY  19           H        GLY  19   1.254   8.281  -1.819
  170    HA2  GLY  19           HA2      GLY  19   3.061   8.515  -3.257
  171    HA3  GLY  19           HA3      GLY  19   3.811   7.222  -2.319
  172    HA   PRO  20           HA       PRO  20   3.511   5.349  -6.516
  173    HB2  PRO  20           2HB      PRO  20   5.277   3.386  -5.044
  174    HB3  PRO  20           3HB      PRO  20   5.415   3.988  -6.726
  175    HG2  PRO  20           2HG      PRO  20   7.016   5.000  -4.797
  176    HG3  PRO  20           3HG      PRO  20   6.233   6.112  -5.970
  177    HD2  PRO  20           2HD      PRO  20   5.364   5.445  -3.141
  178    HD3  PRO  20           3HD      PRO  20   5.485   7.045  -3.939
  179    H    LEU  21           H        LEU  21   3.033   3.755  -3.315
  180    HA   LEU  21           HA       LEU  21   1.900   1.375  -4.364
  181    HB2  LEU  21           2HB      LEU  21   2.824   1.666  -2.065
  182    HB3  LEU  21           3HB      LEU  21   1.413   2.630  -1.638
  183    HG   LEU  21           HG       LEU  21  -0.068   0.692  -1.985
  184   HD11  LEU  21          1HD1      LEU  21   0.912  -1.582  -2.297
  185   HD12  LEU  21          2HD1      LEU  21   1.082  -0.569  -3.728
  186   HD13  LEU  21          3HD1      LEU  21   2.483  -0.831  -2.657
  187   HD21  LEU  21          3HD2      LEU  21   2.351   0.055  -0.253
  188   HD22  LEU  21          1HD2      LEU  21   0.943   1.034   0.225
  189   HD23  LEU  21          2HD2      LEU  21   0.747  -0.693  -0.128
  190    H    LYS  22           H        LYS  22   0.343   4.464  -3.555
  191    HA   LYS  22           HA       LYS  22  -2.396   3.689  -3.914
  192    HB2  LYS  22           2HB      LYS  22  -1.668   5.753  -2.855
  193    HB3  LYS  22           3HB      LYS  22  -0.962   6.338  -4.371
  194    HG2  LYS  22           2HG      LYS  22  -3.159   6.530  -5.399
  195    HG3  LYS  22           3HG      LYS  22  -3.910   5.666  -4.059
  196    HD2  LYS  22           2HD      LYS  22  -4.396   7.968  -3.711
  197    HD3  LYS  22           3HD      LYS  22  -3.212   7.470  -2.505
  198    HE2  LYS  22           2HE      LYS  22  -2.555   9.635  -3.251
  199    HE3  LYS  22           3HE      LYS  22  -1.389   8.494  -3.920
  200    HZ1  LYS  22           HZ1      LYS  22  -2.134  10.125  -5.572
  201    HZ2  LYS  22           HZ2      LYS  22  -2.596   8.636  -6.049
  202    HZ3  LYS  22           HZ3      LYS  22  -3.688   9.669  -5.405
  203    H    LEU  23           H        LEU  23   0.040   4.729  -6.262
  204    HA   LEU  23           HA       LEU  23  -1.760   4.571  -8.542
  205    HB2  LEU  23           2HB      LEU  23   0.236   6.015  -8.490
  206    HB3  LEU  23           3HB      LEU  23   1.279   4.600  -8.373
  207    HG   LEU  23           HG       LEU  23   0.571   3.861 -10.629
  208   HD11  LEU  23          1HD1      LEU  23  -1.683   4.827 -10.785
  209   HD12  LEU  23          2HD1      LEU  23  -1.011   6.472 -10.678
  210   HD13  LEU  23          3HD1      LEU  23  -0.674   5.449 -12.092
  211   HD21  LEU  23          3HD2      LEU  23   1.727   5.624 -11.882
  212   HD22  LEU  23          1HD2      LEU  23   1.519   6.753 -10.523
  213   HD23  LEU  23          2HD2      LEU  23   2.545   5.311 -10.343
  214    H    VAL  24           H        VAL  24   0.620   2.306  -7.137
  215    HA   VAL  24           HA       VAL  24   0.375   0.196  -9.066
  216    HB   VAL  24           HB       VAL  24   1.154   0.224  -6.131
  217   HG11  VAL  24          1HG1      VAL  24   2.236  -1.960  -6.462
  218   HG12  VAL  24          2HG1      VAL  24   0.491  -2.084  -6.611
  219   HG13  VAL  24          3HG1      VAL  24   1.500  -2.087  -8.077
  220   HG21  VAL  24          3HG2      VAL  24   2.894  -0.086  -8.610
  221   HG22  VAL  24          1HG2      VAL  24   2.639   1.449  -7.768
  222   HG23  VAL  24          2HG2      VAL  24   3.426   0.121  -6.920
  223    H    CYS  25           H        CYS  25  -1.341   0.757  -6.006
  224    HA   CYS  25           HA       CYS  25  -2.947  -1.690  -6.315
  225    HB2  CYS  25           2HB      CYS  25  -1.575  -1.088  -4.331
  226    HB3  CYS  25           3HB      CYS  25  -2.599   0.306  -4.065
  227    H    LYS  26           H        LYS  26  -3.391   1.555  -7.040
  228    HA   LYS  26           HA       LYS  26  -5.123   2.941  -7.532
  229    HB2  LYS  26           2HB      LYS  26  -6.464   0.323  -8.266
  230    HB3  LYS  26           3HB      LYS  26  -7.054   1.914  -8.745
  231    HG2  LYS  26           2HG      LYS  26  -4.252   0.899  -9.357
  232    HG3  LYS  26           3HG      LYS  26  -5.615   0.660 -10.450
  233    HD2  LYS  26           2HD      LYS  26  -4.456   3.359  -9.608
  234    HD3  LYS  26           3HD      LYS  26  -4.167   2.526 -11.135
  235    HE2  LYS  26           2HE      LYS  26  -6.612   2.617 -11.644
  236    HE3  LYS  26           3HE      LYS  26  -6.878   3.523 -10.149
  237    HZ1  LYS  26           HZ1      LYS  26  -6.671   5.005 -12.059
  238    HZ2  LYS  26           HZ2      LYS  26  -5.431   5.276 -11.036
  239    HZ3  LYS  26           HZ3      LYS  26  -5.186   4.436 -12.417
  240    H    CYS  27           H        CYS  27  -4.796   2.925  -5.173
  241    HA   CYS  27           HA       CYS  27  -7.054   2.286  -3.432
  242    HB2  CYS  27           2HB      CYS  27  -4.580   3.974  -2.924
  243    HB3  CYS  27           3HB      CYS  27  -5.726   3.457  -1.709
  Start of MODEL   38
    1    H1   GLY   1           1H       GLY   1  11.221  -9.499   2.625
    2    H2   GLY   1           2H       GLY   1  11.468  -8.570   1.301
    3    H3   GLY   1           3H       GLY   1  11.958  -8.043   2.773
    4    HA2  GLY   1           HA2      GLY   1   9.689  -7.895   3.553
    5    HA3  GLY   1           HA3      GLY   1   9.962  -6.878   2.127
    6    H    LEU   2           H        LEU   2   7.408  -7.568   2.750
    7    HA   LEU   2           HA       LEU   2   6.514  -9.939   1.316
    8    HB2  LEU   2           2HB      LEU   2   5.010  -7.566   2.470
    9    HB3  LEU   2           3HB      LEU   2   4.234  -8.986   1.786
   10    HG   LEU   2           HG       LEU   2   6.081  -9.042   4.215
   11   HD11  LEU   2          1HD1      LEU   2   3.046  -9.212   4.078
   12   HD12  LEU   2          2HD1      LEU   2   4.052  -9.342   5.533
   13   HD13  LEU   2          3HD1      LEU   2   3.979  -7.811   4.648
   14   HD21  LEU   2          3HD2      LEU   2   5.108 -11.305   4.565
   15   HD22  LEU   2          1HD2      LEU   2   4.257 -11.173   3.012
   16   HD23  LEU   2          2HD2      LEU   2   6.035 -11.216   3.067
   17    HA   PRO   3           HA       PRO   3   6.057  -8.201  -2.754
   18    HB2  PRO   3           2HB      PRO   3   3.400  -9.590  -2.945
   19    HB3  PRO   3           3HB      PRO   3   4.795  -9.665  -4.061
   20    HG2  PRO   3           2HG      PRO   3   4.271 -11.721  -2.363
   21    HG3  PRO   3           3HG      PRO   3   5.959 -11.176  -2.636
   22    HD2  PRO   3           2HD      PRO   3   4.121 -10.491  -0.325
   23    HD3  PRO   3           3HD      PRO   3   5.834 -11.003  -0.309
   24    H    ARG   4           H        ARG   4   4.948  -6.558  -3.936
   25    HA   ARG   4           HA       ARG   4   3.605  -4.581  -2.385
   26    HB2  ARG   4           2HB      ARG   4   3.759  -4.881  -5.412
   27    HB3  ARG   4           3HB      ARG   4   3.190  -3.444  -4.546
   28    HG2  ARG   4           2HG      ARG   4   5.358  -3.200  -3.426
   29    HG3  ARG   4           3HG      ARG   4   5.991  -4.617  -4.276
   30    HD2  ARG   4           2HD      ARG   4   5.178  -1.957  -5.487
   31    HD3  ARG   4           3HD      ARG   4   6.814  -2.579  -5.274
   32    HE   ARG   4           HE       ARG   4   5.379  -4.465  -6.845
   33   HH11  ARG   4          1HH1      ARG   4   6.708  -1.245  -7.215
   34   HH12  ARG   4          2HH1      ARG   4   6.868  -1.413  -8.941
   35   HH21  ARG   4          2HH2      ARG   4   5.595  -4.604  -9.053
   36   HH22  ARG   4          1HH2      ARG   4   6.253  -3.266  -9.945
   37    H    LYS   5           H        LYS   5   2.201  -7.123  -4.381
   38    HA   LYS   5           HA       LYS   5  -0.543  -6.262  -4.281
   39    HB2  LYS   5           2HB      LYS   5   0.398  -7.992  -5.805
   40    HB3  LYS   5           3HB      LYS   5   0.609  -9.087  -4.431
   41    HG2  LYS   5           2HG      LYS   5  -1.858  -9.029  -4.030
   42    HG3  LYS   5           3HG      LYS   5  -2.057  -7.963  -5.423
   43    HD2  LYS   5           2HD      LYS   5  -0.947 -10.807  -5.454
   44    HD3  LYS   5           3HD      LYS   5  -2.587 -10.359  -5.902
   45    HE2  LYS   5           2HE      LYS   5  -0.061  -9.434  -7.354
   46    HE3  LYS   5           3HE      LYS   5  -1.068 -10.795  -7.840
   47    HZ1  LYS   5           HZ1      LYS   5  -2.929  -9.250  -8.135
   48    HZ2  LYS   5           HZ2      LYS   5  -1.994  -7.973  -7.720
   49    HZ3  LYS   5           HZ3      LYS   5  -1.672  -8.818  -9.077
   50    H    ILE   6           H        ILE   6   1.381  -8.224  -2.016
   51    HA   ILE   6           HA       ILE   6  -0.843  -8.738  -0.188
   52    HB   ILE   6           HB       ILE   6   2.141  -9.232  -0.127
   53   HG12  ILE   6          2HG1      ILE   6   1.459 -11.571   0.185
   54   HG13  ILE   6          3HG1      ILE   6  -0.240 -11.111   0.232
   55   HG21  ILE   6          1HG2      ILE   6   1.860 -10.303   2.107
   56   HG22  ILE   6          2HG2      ILE   6   1.669  -8.553   2.164
   57   HG23  ILE   6          3HG2      ILE   6   0.231  -9.602   2.217
   58   HD11  ILE   6          3HD1      ILE   6   0.482 -12.155  -1.910
   59   HD12  ILE   6          1HD1      ILE   6  -0.197 -10.541  -2.143
   60   HD13  ILE   6          2HD1      ILE   6   1.570 -10.786  -2.198
   61    H    LEU   7           H        LEU   7   1.940  -6.445  -0.213
   62    HA   LEU   7           HA       LEU   7   1.208  -5.061   2.183
   63    HB2  LEU   7           2HB      LEU   7   2.623  -4.092  -0.336
   64    HB3  LEU   7           3HB      LEU   7   2.513  -3.157   1.149
   65    HG   LEU   7           HG       LEU   7   3.884  -5.875   0.945
   66   HD11  LEU   7          1HD1      LEU   7   5.048  -3.061   1.079
   67   HD12  LEU   7          2HD1      LEU   7   5.970  -4.584   1.106
   68   HD13  LEU   7          3HD1      LEU   7   5.061  -4.133  -0.342
   69   HD21  LEU   7          3HD2      LEU   7   3.117  -5.459   3.228
   70   HD22  LEU   7          1HD2      LEU   7   4.863  -5.211   3.149
   71   HD23  LEU   7          2HD2      LEU   7   3.777  -3.808   3.184
   72    H    CYS   8           H        CYS   8  -0.028  -4.666  -1.148
   73    HA   CYS   8           HA       CYS   8  -1.674  -2.394  -0.528
   74    HB2  CYS   8           2HB      CYS   8  -0.970  -3.082  -2.802
   75    HB3  CYS   8           3HB      CYS   8  -2.048  -4.477  -2.698
   76    H    ALA   9           H        ALA   9  -2.179  -5.862   0.026
   77    HA   ALA   9           HA       ALA   9  -5.058  -5.651   0.431
   78    HB1  ALA   9           3HB      ALA   9  -4.874  -7.892   1.349
   79    HB2  ALA   9           1HB      ALA   9  -3.904  -7.791  -0.134
   80    HB3  ALA   9           2HB      ALA   9  -3.112  -7.763   1.460
   81    H    ILE  10           H        ILE  10  -2.164  -5.473   2.517
   82    HA   ILE  10           HA       ILE  10  -3.523  -4.852   4.982
   83    HB   ILE  10           HB       ILE  10  -0.785  -3.896   4.057
   84   HG12  ILE  10          2HG1      ILE  10  -0.874  -6.330   3.853
   85   HG13  ILE  10          3HG1      ILE  10   0.217  -5.803   5.088
   86   HG21  ILE  10          1HG2      ILE  10  -1.566  -2.650   5.992
   87   HG22  ILE  10          2HG2      ILE  10  -1.983  -4.151   6.839
   88   HG23  ILE  10          3HG2      ILE  10  -0.286  -3.767   6.480
   89   HD11  ILE  10          3HD1      ILE  10  -1.444  -6.442   6.840
   90   HD12  ILE  10          1HD1      ILE  10  -2.585  -6.930   5.559
   91   HD13  ILE  10          2HD1      ILE  10  -1.055  -7.797   5.769
   92    H    ALA  11           H        ALA  11  -2.062  -2.699   2.490
   93    HA   ALA  11           HA       ALA  11  -2.622  -0.259   3.630
   94    HB1  ALA  11           3HB      ALA  11  -1.231  -0.764   1.571
   95    HB2  ALA  11           1HB      ALA  11  -2.751  -0.851   0.637
   96    HB3  ALA  11           2HB      ALA  11  -2.259   0.654   1.421
   97    H    LYS  12           H        LYS  12  -4.803  -2.002   1.364
   98    HA   LYS  12           HA       LYS  12  -6.914  -0.019   1.578
   99    HB2  LYS  12           2HB      LYS  12  -6.881  -2.822   0.408
  100    HB3  LYS  12           3HB      LYS  12  -8.210  -1.661   0.230
  101    HG2  LYS  12           2HG      LYS  12  -6.636  -0.029  -0.827
  102    HG3  LYS  12           3HG      LYS  12  -5.346  -1.224  -0.751
  103    HD2  LYS  12           2HD      LYS  12  -7.914  -1.410  -2.363
  104    HD3  LYS  12           3HD      LYS  12  -6.267  -1.149  -2.967
  105    HE2  LYS  12           2HE      LYS  12  -5.623  -3.408  -2.063
  106    HE3  LYS  12           3HE      LYS  12  -7.306  -3.670  -1.593
  107    HZ1  LYS  12           HZ1      LYS  12  -7.934  -3.463  -3.937
  108    HZ2  LYS  12           HZ2      LYS  12  -6.381  -3.218  -4.383
  109    HZ3  LYS  12           HZ3      LYS  12  -6.838  -4.657  -3.762
  110    H    LYS  13           H        LYS  13  -6.351  -3.069   3.341
  111    HA   LYS  13           HA       LYS  13  -8.979  -3.030   4.638
  112    HB2  LYS  13           2HB      LYS  13  -6.410  -4.556   5.200
  113    HB3  LYS  13           3HB      LYS  13  -7.859  -4.705   6.199
  114    HG2  LYS  13           2HG      LYS  13  -9.196  -5.448   4.297
  115    HG3  LYS  13           3HG      LYS  13  -7.825  -5.246   3.198
  116    HD2  LYS  13           2HD      LYS  13  -6.550  -6.962   4.482
  117    HD3  LYS  13           3HD      LYS  13  -7.946  -7.172   5.563
  118    HE2  LYS  13           2HE      LYS  13  -9.344  -7.817   3.595
  119    HE3  LYS  13           3HE      LYS  13  -7.931  -7.645   2.546
  120    HZ1  LYS  13           HZ1      LYS  13  -8.267  -9.958   3.207
  121    HZ2  LYS  13           HZ2      LYS  13  -6.854  -9.427   3.828
  122    HZ3  LYS  13           HZ3      LYS  13  -8.167  -9.583   4.790
  123    H    LYS  14           H        LYS  14  -5.778  -1.790   5.555
  124    HA   LYS  14           HA       LYS  14  -6.754  -0.688   8.120
  125    HB2  LYS  14           2HB      LYS  14  -4.117  -0.649   6.623
  126    HB3  LYS  14           3HB      LYS  14  -4.406   0.483   7.926
  127    HG2  LYS  14           2HG      LYS  14  -3.211  -1.450   8.742
  128    HG3  LYS  14           3HG      LYS  14  -4.775  -1.262   9.536
  129    HD2  LYS  14           2HD      LYS  14  -5.712  -3.129   8.238
  130    HD3  LYS  14           3HD      LYS  14  -4.239  -3.220   7.266
  131    HE2  LYS  14           2HE      LYS  14  -4.156  -4.997   8.860
  132    HE3  LYS  14           3HE      LYS  14  -2.934  -3.804   9.305
  133    HZ1  LYS  14           HZ1      LYS  14  -4.463  -2.977  11.019
  134    HZ2  LYS  14           HZ2      LYS  14  -5.612  -4.057  10.582
  135    HZ3  LYS  14           HZ3      LYS  14  -4.209  -4.571  11.235
  136    H    GLY  15           H        GLY  15  -6.989   0.341   4.891
  137    HA2  GLY  15           HA2      GLY  15  -8.060   2.192   4.032
  138    HA3  GLY  15           HA3      GLY  15  -8.281   2.828   5.664
  139    H    LYS  16           H        LYS  16  -5.053   1.992   4.524
  140    HA   LYS  16           HA       LYS  16  -4.369   4.861   4.016
  141    HB2  LYS  16           2HB      LYS  16  -3.869   4.282   6.387
  142    HB3  LYS  16           3HB      LYS  16  -2.795   2.993   5.825
  143    HG2  LYS  16           2HG      LYS  16  -1.407   4.705   4.632
  144    HG3  LYS  16           3HG      LYS  16  -2.499   5.974   5.216
  145    HD2  LYS  16           2HD      LYS  16  -1.911   5.409   7.557
  146    HD3  LYS  16           3HD      LYS  16  -0.845   4.106   6.976
  147    HE2  LYS  16           2HE      LYS  16   0.489   5.776   5.705
  148    HE3  LYS  16           3HE      LYS  16  -0.560   7.068   6.301
  149    HZ1  LYS  16           HZ1      LYS  16   1.462   6.879   7.646
  150    HZ2  LYS  16           HZ2      LYS  16   0.166   6.522   8.569
  151    HZ3  LYS  16           HZ3      LYS  16   1.134   5.326   8.019
  152    H    CYS  17           H        CYS  17  -4.208   4.564   1.877
  153    HA   CYS  17           HA       CYS  17  -1.751   3.203   0.912
  154    HB2  CYS  17           2HB      CYS  17  -3.773   1.795   0.321
  155    HB3  CYS  17           3HB      CYS  17  -4.409   3.180  -0.552
  156    H    LYS  18           H        LYS  18  -0.483   4.718  -0.000
  157    HA   LYS  18           HA       LYS  18  -1.552   6.977  -1.559
  158    HB2  LYS  18           2HB      LYS  18  -0.479   8.696  -0.182
  159    HB3  LYS  18           3HB      LYS  18  -1.746   7.852   0.695
  160    HG2  LYS  18           2HG      LYS  18  -0.114   6.589   1.995
  161    HG3  LYS  18           3HG      LYS  18   1.216   7.181   0.992
  162    HD2  LYS  18           2HD      LYS  18   1.190   8.366   3.107
  163    HD3  LYS  18           3HD      LYS  18   0.842   9.478   1.777
  164    HE2  LYS  18           2HE      LYS  18  -1.598   9.319   2.307
  165    HE3  LYS  18           3HE      LYS  18  -1.227   8.228   3.647
  166    HZ1  LYS  18           HZ1      LYS  18  -0.297  11.046   3.416
  167    HZ2  LYS  18           HZ2      LYS  18  -1.476  10.521   4.412
  168    HZ3  LYS  18           HZ3      LYS  18   0.068  10.050   4.658
  169    H    GLY  19           H        GLY  19   0.258   8.393  -2.351
  170    HA2  GLY  19           HA2      GLY  19   2.146   8.617  -3.656
  171    HA3  GLY  19           HA3      GLY  19   2.951   7.915  -2.269
  172    HA   PRO  20           HA       PRO  20   4.123   5.015  -5.542
  173    HB2  PRO  20           2HB      PRO  20   5.666   3.260  -4.095
  174    HB3  PRO  20           3HB      PRO  20   6.209   4.890  -4.597
  175    HG2  PRO  20           2HG      PRO  20   5.045   4.061  -1.920
  176    HG3  PRO  20           3HG      PRO  20   6.516   5.037  -2.236
  177    HD2  PRO  20           2HD      PRO  20   4.137   6.196  -1.640
  178    HD3  PRO  20           3HD      PRO  20   5.239   6.934  -2.843
  179    H    LEU  21           H        LEU  21   2.773   3.762  -2.412
  180    HA   LEU  21           HA       LEU  21   2.118   1.178  -3.446
  181    HB2  LEU  21           2HB      LEU  21   2.102   2.351  -0.963
  182    HB3  LEU  21           3HB      LEU  21   0.396   2.420  -1.309
  183    HG   LEU  21           HG       LEU  21   0.742   0.468  -0.050
  184   HD11  LEU  21          1HD1      LEU  21   0.694  -0.591  -2.906
  185   HD12  LEU  21          2HD1      LEU  21   0.194  -1.436  -1.440
  186   HD13  LEU  21          3HD1      LEU  21  -0.723  -0.022  -1.989
  187   HD21  LEU  21          3HD2      LEU  21   3.179   0.336  -0.290
  188   HD22  LEU  21          1HD2      LEU  21   2.410  -1.241  -0.513
  189   HD23  LEU  21          2HD2      LEU  21   2.996  -0.336  -1.927
  190    H    LYS  22           H        LYS  22   0.313   4.194  -3.334
  191    HA   LYS  22           HA       LYS  22  -2.162   3.217  -4.511
  192    HB2  LYS  22           2HB      LYS  22  -2.125   5.178  -3.105
  193    HB3  LYS  22           3HB      LYS  22  -1.023   6.025  -4.206
  194    HG2  LYS  22           2HG      LYS  22  -2.711   6.167  -5.924
  195    HG3  LYS  22           3HG      LYS  22  -3.785   5.061  -5.053
  196    HD2  LYS  22           2HD      LYS  22  -4.035   6.705  -3.228
  197    HD3  LYS  22           3HD      LYS  22  -2.934   7.821  -4.070
  198    HE2  LYS  22           2HE      LYS  22  -4.491   7.902  -6.000
  199    HE3  LYS  22           3HE      LYS  22  -5.572   6.764  -5.187
  200    HZ1  LYS  22           HZ1      LYS  22  -4.899   9.481  -4.181
  201    HZ2  LYS  22           HZ2      LYS  22  -6.311   9.051  -4.877
  202    HZ3  LYS  22           HZ3      LYS  22  -5.897   8.422  -3.432
  203    H    LEU  23           H        LEU  23   0.772   4.744  -5.907
  204    HA   LEU  23           HA       LEU  23  -0.209   4.781  -8.601
  205    HB2  LEU  23           2HB      LEU  23   1.689   6.123  -7.758
  206    HB3  LEU  23           3HB      LEU  23   2.625   4.655  -7.491
  207    HG   LEU  23           HG       LEU  23   2.661   4.210  -9.929
  208   HD11  LEU  23          1HD1      LEU  23   0.585   5.305 -10.659
  209   HD12  LEU  23          2HD1      LEU  23   1.216   6.890 -10.148
  210   HD13  LEU  23          3HD1      LEU  23   1.965   6.013 -11.501
  211   HD21  LEU  23          3HD2      LEU  23   4.179   6.042 -10.527
  212   HD22  LEU  23          1HD2      LEU  23   3.566   7.016  -9.170
  213   HD23  LEU  23          2HD2      LEU  23   4.460   5.511  -8.861
  214    H    VAL  24           H        VAL  24   1.553   2.293  -6.766
  215    HA   VAL  24           HA       VAL  24   1.894   0.413  -8.926
  216    HB   VAL  24           HB       VAL  24   1.919   0.133  -5.899
  217   HG11  VAL  24          1HG1      VAL  24   3.132  -2.004  -6.231
  218   HG12  VAL  24          2HG1      VAL  24   1.455  -2.107  -6.754
  219   HG13  VAL  24          3HG1      VAL  24   2.752  -1.946  -7.964
  220   HG21  VAL  24          3HG2      VAL  24   3.736   1.513  -7.093
  221   HG22  VAL  24          1HG2      VAL  24   4.275   0.200  -6.054
  222   HG23  VAL  24          2HG2      VAL  24   4.261   0.000  -7.834
  223    H    CYS  25           H        CYS  25  -0.568   0.655  -6.336
  224    HA   CYS  25           HA       CYS  25  -1.931  -1.744  -7.407
  225    HB2  CYS  25           2HB      CYS  25  -1.070  -1.426  -5.041
  226    HB3  CYS  25           3HB      CYS  25  -2.380  -0.278  -4.805
  227    H    LYS  26           H        LYS  26  -2.424   1.618  -7.557
  228    HA   LYS  26           HA       LYS  26  -4.125   3.015  -8.091
  229    HB2  LYS  26           2HB      LYS  26  -5.254   0.613  -9.550
  230    HB3  LYS  26           3HB      LYS  26  -5.723   2.289  -9.817
  231    HG2  LYS  26           2HG      LYS  26  -2.893   1.208 -10.126
  232    HG3  LYS  26           3HG      LYS  26  -4.036   1.362 -11.460
  233    HD2  LYS  26           2HD      LYS  26  -2.868   3.659  -9.818
  234    HD3  LYS  26           3HD      LYS  26  -2.386   3.174 -11.443
  235    HE2  LYS  26           2HE      LYS  26  -4.701   3.645 -12.265
  236    HE3  LYS  26           3HE      LYS  26  -5.145   4.211 -10.649
  237    HZ1  LYS  26           HZ1      LYS  26  -3.445   5.949 -10.865
  238    HZ2  LYS  26           HZ2      LYS  26  -3.038   5.424 -12.361
  239    HZ3  LYS  26           HZ3      LYS  26  -4.515   6.058 -12.091
  240    H    CYS  27           H        CYS  27  -4.147   2.326  -5.742
  241    HA   CYS  27           HA       CYS  27  -6.486   1.418  -4.402
  242    HB2  CYS  27           2HB      CYS  27  -4.428   3.508  -3.578
  243    HB3  CYS  27           3HB      CYS  27  -5.666   2.886  -2.529
  Start of MODEL   39
    1    H1   GLY   1           1H       GLY   1  10.890  -8.287   4.065
    2    H2   GLY   1           2H       GLY   1   9.944  -9.617   3.911
    3    H3   GLY   1           3H       GLY   1  10.588  -8.914   2.580
    4    HA2  GLY   1           HA2      GLY   1   8.578  -7.688   4.356
    5    HA3  GLY   1           HA3      GLY   1   9.284  -6.916   2.925
    6    H    LEU   2           H        LEU   2   6.560  -7.151   3.127
    7    HA   LEU   2           HA       LEU   2   5.532  -9.514   1.786
    8    HB2  LEU   2           2HB      LEU   2   4.295  -6.793   2.310
    9    HB3  LEU   2           3HB      LEU   2   3.422  -8.181   1.672
   10    HG   LEU   2           HG       LEU   2   4.733  -8.052   4.425
   11   HD11  LEU   2          1HD1      LEU   2   2.799  -6.546   4.225
   12   HD12  LEU   2          2HD1      LEU   2   1.803  -7.883   3.613
   13   HD13  LEU   2          3HD1      LEU   2   2.433  -7.923   5.273
   14   HD21  LEU   2          3HD2      LEU   2   3.401 -10.102   4.882
   15   HD22  LEU   2          1HD2      LEU   2   2.915 -10.156   3.174
   16   HD23  LEU   2          2HD2      LEU   2   4.620 -10.373   3.634
   17    HA   PRO   3           HA       PRO   3   6.184  -8.094  -2.480
   18    HB2  PRO   3           2HB      PRO   3   3.733  -9.722  -3.075
   19    HB3  PRO   3           3HB      PRO   3   5.333  -9.760  -3.872
   20    HG2  PRO   3           2HG      PRO   3   4.587 -11.730  -2.151
   21    HG3  PRO   3           3HG      PRO   3   6.262 -11.085  -2.130
   22    HD2  PRO   3           2HD      PRO   3   3.958 -10.371  -0.290
   23    HD3  PRO   3           3HD      PRO   3   5.659 -10.760   0.108
   24    H    ARG   4           H        ARG   4   5.151  -6.598  -3.937
   25    HA   ARG   4           HA       ARG   4   3.587  -4.607  -2.719
   26    HB2  ARG   4           2HB      ARG   4   4.025  -5.233  -5.670
   27    HB3  ARG   4           3HB      ARG   4   3.242  -3.760  -5.110
   28    HG2  ARG   4           2HG      ARG   4   6.060  -4.554  -4.259
   29    HG3  ARG   4           3HG      ARG   4   5.705  -3.568  -5.675
   30    HD2  ARG   4           2HD      ARG   4   4.638  -1.844  -4.273
   31    HD3  ARG   4           3HD      ARG   4   4.850  -2.846  -2.841
   32    HE   ARG   4           HE       ARG   4   7.039  -2.210  -2.666
   33   HH11  ARG   4          1HH2      ARG   4   6.080  -1.289  -5.915
   34   HH12  ARG   4          2HH2      ARG   4   7.535  -0.367  -6.167
   35   HH21  ARG   4          1HH1      ARG   4   8.861  -1.032  -3.072
   36   HH22  ARG   4          2HH1      ARG   4   9.062  -0.235  -4.603
   37    H    LYS   5           H        LYS   5   2.360  -7.269  -4.700
   38    HA   LYS   5           HA       LYS   5  -0.376  -6.433  -4.869
   39    HB2  LYS   5           2HB      LYS   5   0.639  -8.190  -6.259
   40    HB3  LYS   5           3HB      LYS   5   0.860  -9.222  -4.841
   41    HG2  LYS   5           2HG      LYS   5  -1.616  -9.341  -4.545
   42    HG3  LYS   5           3HG      LYS   5  -1.824  -8.236  -5.911
   43    HD2  LYS   5           2HD      LYS   5  -2.247 -10.463  -6.677
   44    HD3  LYS   5           3HD      LYS   5  -0.723  -9.916  -7.397
   45    HE2  LYS   5           2HE      LYS   5   0.543 -11.212  -5.695
   46    HE3  LYS   5           3HE      LYS   5  -0.978 -11.719  -4.944
   47    HZ1  LYS   5           HZ1      LYS   5  -1.542 -12.863  -7.021
   48    HZ2  LYS   5           HZ2      LYS   5  -0.141 -12.390  -7.717
   49    HZ3  LYS   5           HZ3      LYS   5  -0.119 -13.419  -6.452
   50    H    ILE   6           H        ILE   6   1.180  -8.593  -2.499
   51    HA   ILE   6           HA       ILE   6  -1.175  -8.908  -0.835
   52    HB   ILE   6           HB       ILE   6   1.776  -9.490  -0.370
   53   HG12  ILE   6          2HG1      ILE   6   0.985 -11.862  -0.293
   54   HG13  ILE   6          3HG1      ILE   6  -0.640 -11.336  -0.720
   55   HG21  ILE   6          1HG2      ILE   6   1.045 -10.722   1.685
   56   HG22  ILE   6          2HG2      ILE   6   0.834  -8.981   1.823
   57   HG23  ILE   6          3HG2      ILE   6  -0.574 -10.015   1.501
   58   HD11  ILE   6          3HD1      ILE   6   1.813 -10.954  -2.490
   59   HD12  ILE   6          1HD1      ILE   6   0.705 -12.333  -2.590
   60   HD13  ILE   6          2HD1      ILE   6   0.103 -10.714  -2.950
   61    H    LEU   7           H        LEU   7   1.729  -6.813  -0.595
   62    HA   LEU   7           HA       LEU   7   1.059  -5.505   1.818
   63    HB2  LEU   7           2HB      LEU   7   3.265  -5.482   0.660
   64    HB3  LEU   7           3HB      LEU   7   2.581  -4.486  -0.618
   65    HG   LEU   7           HG       LEU   7   2.238  -2.625   0.951
   66   HD11  LEU   7          1HD1      LEU   7   3.221  -2.715   3.232
   67   HD12  LEU   7          2HD1      LEU   7   1.853  -3.816   3.069
   68   HD13  LEU   7          3HD1      LEU   7   3.516  -4.455   3.033
   69   HD21  LEU   7          3HD2      LEU   7   4.402  -2.879  -0.240
   70   HD22  LEU   7          1HD2      LEU   7   4.601  -2.092   1.334
   71   HD23  LEU   7          2HD2      LEU   7   5.044  -3.803   1.132
   72    H    CYS   8           H        CYS   8  -0.060  -4.841  -1.506
   73    HA   CYS   8           HA       CYS   8  -1.411  -2.387  -0.902
   74    HB2  CYS   8           2HB      CYS   8  -0.804  -3.173  -3.167
   75    HB3  CYS   8           3HB      CYS   8  -2.027  -4.438  -3.052
   76    H    ALA   9           H        ALA   9  -2.405  -5.766  -0.355
   77    HA   ALA   9           HA       ALA   9  -5.224  -5.133   0.043
   78    HB1  ALA   9           3HB      ALA   9  -5.364  -7.380   0.974
   79    HB2  ALA   9           1HB      ALA   9  -4.407  -7.415  -0.520
   80    HB3  ALA   9           2HB      ALA   9  -3.599  -7.506   1.063
   81    H    ILE  10           H        ILE  10  -2.361  -5.417   2.152
   82    HA   ILE  10           HA       ILE  10  -3.635  -4.672   4.624
   83    HB   ILE  10           HB       ILE  10  -0.763  -4.124   3.778
   84   HG12  ILE  10          2HG1      ILE  10  -1.185  -6.487   3.375
   85   HG13  ILE  10          3HG1      ILE  10  -0.098  -6.244   4.704
   86   HG21  ILE  10          1HG2      ILE  10  -2.043  -4.418   6.522
   87   HG22  ILE  10          2HG2      ILE  10  -0.299  -4.284   6.210
   88   HG23  ILE  10          3HG2      ILE  10  -1.373  -2.938   5.807
   89   HD11  ILE  10          3HD1      ILE  10  -3.061  -6.950   4.962
   90   HD12  ILE  10          1HD1      ILE  10  -1.695  -8.063   5.150
   91   HD13  ILE  10          2HD1      ILE  10  -1.925  -6.754   6.321
   92    H    ALA  11           H        ALA  11  -1.886  -2.712   2.165
   93    HA   ALA  11           HA       ALA  11  -2.110  -0.221   3.375
   94    HB1  ALA  11           3HB      ALA  11  -1.535   0.666   1.221
   95    HB2  ALA  11           1HB      ALA  11  -0.743  -0.901   1.332
   96    HB3  ALA  11           2HB      ALA  11  -2.237  -0.723   0.369
   97    H    LYS  12           H        LYS  12  -4.519  -1.783   1.224
   98    HA   LYS  12           HA       LYS  12  -6.338   0.517   1.348
   99    HB2  LYS  12           2HB      LYS  12  -6.622  -2.274   0.186
  100    HB3  LYS  12           3HB      LYS  12  -7.838  -0.993   0.030
  101    HG2  LYS  12           2HG      LYS  12  -6.169   0.492  -1.053
  102    HG3  LYS  12           3HG      LYS  12  -4.954  -0.774  -0.961
  103    HD2  LYS  12           2HD      LYS  12  -7.506  -0.805  -2.601
  104    HD3  LYS  12           3HD      LYS  12  -5.832  -0.683  -3.175
  105    HE2  LYS  12           2HE      LYS  12  -5.385  -2.970  -2.235
  106    HE3  LYS  12           3HE      LYS  12  -7.096  -3.100  -1.810
  107    HZ1  LYS  12           HZ1      LYS  12  -7.647  -2.869  -4.167
  108    HZ2  LYS  12           HZ2      LYS  12  -6.072  -2.720  -4.577
  109    HZ3  LYS  12           HZ3      LYS  12  -6.633  -4.130  -3.969
  110    H    LYS  13           H        LYS  13  -6.141  -2.572   3.104
  111    HA   LYS  13           HA       LYS  13  -8.688  -2.237   4.485
  112    HB2  LYS  13           2HB      LYS  13  -6.220  -3.935   5.012
  113    HB3  LYS  13           3HB      LYS  13  -7.616  -3.926   6.097
  114    HG2  LYS  13           2HG      LYS  13  -9.114  -4.663   4.333
  115    HG3  LYS  13           3HG      LYS  13  -7.825  -4.576   3.126
  116    HD2  LYS  13           2HD      LYS  13  -6.553  -6.328   4.358
  117    HD3  LYS  13           3HD      LYS  13  -7.861  -6.419   5.559
  118    HE2  LYS  13           2HE      LYS  13  -9.458  -7.037   3.740
  119    HE3  LYS  13           3HE      LYS  13  -8.133  -6.985   2.569
  120    HZ1  LYS  13           HZ1      LYS  13  -7.058  -8.792   3.819
  121    HZ2  LYS  13           HZ2      LYS  13  -8.290  -8.835   4.893
  122    HZ3  LYS  13           HZ3      LYS  13  -8.547  -9.251   3.338
  123    H    LYS  14           H        LYS  14  -5.368  -1.246   5.282
  124    HA   LYS  14           HA       LYS  14  -6.213   0.010   7.829
  125    HB2  LYS  14           2HB      LYS  14  -3.567  -0.377   6.397
  126    HB3  LYS  14           3HB      LYS  14  -3.710   0.790   7.694
  127    HG2  LYS  14           2HG      LYS  14  -2.850  -1.276   8.560
  128    HG3  LYS  14           3HG      LYS  14  -4.410  -0.886   9.284
  129    HD2  LYS  14           2HD      LYS  14  -5.520  -2.614   7.929
  130    HD3  LYS  14           3HD      LYS  14  -4.026  -2.892   7.026
  131    HE2  LYS  14           2HE      LYS  14  -4.253  -4.669   8.607
  132    HE3  LYS  14           3HE      LYS  14  -2.906  -3.649   9.116
  133    HZ1  LYS  14           HZ1      LYS  14  -4.391  -2.632  10.767
  134    HZ2  LYS  14           HZ2      LYS  14  -5.650  -3.551  10.270
  135    HZ3  LYS  14           HZ3      LYS  14  -4.359  -4.246  10.979
  136    H    GLY  15           H        GLY  15  -6.271   1.054   4.597
  137    HA2  GLY  15           HA2      GLY  15  -6.761   3.108   3.665
  138    HA3  GLY  15           HA3      GLY  15  -6.962   3.789   5.284
  139    H    LYS  16           H        LYS  16  -3.998   2.184   4.323
  140    HA   LYS  16           HA       LYS  16  -2.455   4.694   4.758
  141    HB2  LYS  16           2HB      LYS  16  -2.246   2.630   6.231
  142    HB3  LYS  16           3HB      LYS  16  -1.484   1.814   4.864
  143    HG2  LYS  16           2HG      LYS  16   0.384   3.410   4.918
  144    HG3  LYS  16           3HG      LYS  16  -0.478   4.429   6.078
  145    HD2  LYS  16           2HD      LYS  16   1.251   3.192   7.216
  146    HD3  LYS  16           3HD      LYS  16  -0.328   2.624   7.775
  147    HE2  LYS  16           2HE      LYS  16  -0.155   0.646   6.288
  148    HE3  LYS  16           3HE      LYS  16   1.385   1.244   5.652
  149    HZ1  LYS  16           HZ1      LYS  16   2.322   1.024   7.890
  150    HZ2  LYS  16           HZ2      LYS  16   0.902   0.480   8.486
  151    HZ3  LYS  16           HZ3      LYS  16   1.730  -0.413   7.397
  152    H    CYS  17           H        CYS  17  -3.549   3.042   2.069
  153    HA   CYS  17           HA       CYS  17  -1.149   2.895   0.503
  154    HB2  CYS  17           2HB      CYS  17  -3.319   1.630   0.123
  155    HB3  CYS  17           3HB      CYS  17  -3.986   3.134  -0.514
  156    H    LYS  18           H        LYS  18   0.034   4.569   0.012
  157    HA   LYS  18           HA       LYS  18  -1.068   7.074  -1.172
  158    HB2  LYS  18           2HB      LYS  18   0.842   6.886   1.214
  159    HB3  LYS  18           3HB      LYS  18   0.515   8.373   0.347
  160    HG2  LYS  18           2HG      LYS  18  -1.543   6.778   1.931
  161    HG3  LYS  18           3HG      LYS  18  -0.681   8.186   2.510
  162    HD2  LYS  18           2HD      LYS  18  -2.595   8.213   0.132
  163    HD3  LYS  18           3HD      LYS  18  -3.004   8.664   1.790
  164    HE2  LYS  18           2HE      LYS  18  -1.227  10.429   1.732
  165    HE3  LYS  18           3HE      LYS  18  -0.919  10.037   0.035
  166    HZ1  LYS  18           HZ1      LYS  18  -3.505  11.026   1.120
  167    HZ2  LYS  18           HZ2      LYS  18  -2.450  11.908   0.247
  168    HZ3  LYS  18           HZ3      LYS  18  -3.235  10.660  -0.449
  169    H    GLY  19           H        GLY  19   0.632   8.419  -2.106
  170    HA2  GLY  19           HA2      GLY  19   2.339   8.717  -3.630
  171    HA3  GLY  19           HA3      GLY  19   3.293   8.042  -2.329
  172    HA   PRO  20           HA       PRO  20   4.421   5.170  -5.604
  173    HB2  PRO  20           2HB      PRO  20   5.875   3.321  -4.182
  174    HB3  PRO  20           3HB      PRO  20   6.478   4.950  -4.611
  175    HG2  PRO  20           2HG      PRO  20   5.220   4.062  -1.995
  176    HG3  PRO  20           3HG      PRO  20   6.723   5.008  -2.240
  177    HD2  PRO  20           2HD      PRO  20   4.361   6.213  -1.664
  178    HD3  PRO  20           3HD      PRO  20   5.514   6.959  -2.813
  179    H    LEU  21           H        LEU  21   3.021   3.760  -2.547
  180    HA   LEU  21           HA       LEU  21   2.317   1.278  -3.799
  181    HB2  LEU  21           2HB      LEU  21   2.388   2.203  -1.215
  182    HB3  LEU  21           3HB      LEU  21   0.668   2.300  -1.502
  183    HG   LEU  21           HG       LEU  21   1.098   0.229  -0.446
  184   HD11  LEU  21          1HD1      LEU  21   0.852  -0.521  -3.388
  185   HD12  LEU  21          2HD1      LEU  21   0.431  -1.512  -1.989
  186   HD13  LEU  21          3HD1      LEU  21  -0.495  -0.040  -2.329
  187   HD21  LEU  21          3HD2      LEU  21   3.225  -0.356  -2.542
  188   HD22  LEU  21          1HD2      LEU  21   3.505   0.096  -0.845
  189   HD23  LEU  21          2HD2      LEU  21   2.704  -1.435  -1.231
  190    H    LYS  22           H        LYS  22   0.596   4.298  -3.392
  191    HA   LYS  22           HA       LYS  22  -1.987   3.562  -4.480
  192    HB2  LYS  22           2HB      LYS  22  -1.636   5.547  -3.093
  193    HB3  LYS  22           3HB      LYS  22  -0.534   6.237  -4.291
  194    HG2  LYS  22           2HG      LYS  22  -2.409   6.387  -5.922
  195    HG3  LYS  22           3HG      LYS  22  -3.504   5.716  -4.699
  196    HD2  LYS  22           2HD      LYS  22  -3.025   7.665  -3.214
  197    HD3  LYS  22           3HD      LYS  22  -1.872   8.276  -4.407
  198    HE2  LYS  22           2HE      LYS  22  -3.794   9.560  -4.774
  199    HE3  LYS  22           3HE      LYS  22  -3.781   8.380  -6.086
  200    HZ1  LYS  22           HZ1      LYS  22  -5.443   7.075  -4.817
  201    HZ2  LYS  22           HZ2      LYS  22  -5.428   8.182  -3.613
  202    HZ3  LYS  22           HZ3      LYS  22  -5.985   8.587  -5.092
  203    H    LEU  23           H        LEU  23   0.862   5.082  -5.981
  204    HA   LEU  23           HA       LEU  23  -0.125   5.078  -8.655
  205    HB2  LEU  23           2HB      LEU  23   1.749   6.447  -7.814
  206    HB3  LEU  23           3HB      LEU  23   2.724   4.998  -7.584
  207    HG   LEU  23           HG       LEU  23   2.735   4.600 -10.035
  208   HD11  LEU  23          1HD1      LEU  23   1.986   6.421 -11.558
  209   HD12  LEU  23          2HD1      LEU  23   0.628   5.679 -10.710
  210   HD13  LEU  23          3HD1      LEU  23   1.244   7.262 -10.177
  211   HD21  LEU  23          3HD2      LEU  23   3.602   7.403  -9.222
  212   HD22  LEU  23          1HD2      LEU  23   4.525   5.906  -8.960
  213   HD23  LEU  23          2HD2      LEU  23   4.213   6.472 -10.609
  214    H    VAL  24           H        VAL  24   1.741   2.580  -6.921
  215    HA   VAL  24           HA       VAL  24   2.235   0.863  -9.171
  216    HB   VAL  24           HB       VAL  24   2.298   0.470  -6.164
  217   HG11  VAL  24          1HG1      VAL  24   1.955  -1.782  -7.019
  218   HG12  VAL  24          2HG1      VAL  24   3.199  -1.538  -8.267
  219   HG13  VAL  24          3HG1      VAL  24   3.641  -1.590  -6.546
  220   HG21  VAL  24          3HG2      VAL  24   4.630   0.716  -6.352
  221   HG22  VAL  24          1HG2      VAL  24   4.622   0.467  -8.125
  222   HG23  VAL  24          2HG2      VAL  24   3.999   1.963  -7.425
  223    H    CYS  25           H        CYS  25  -0.340   0.808  -6.689
  224    HA   CYS  25           HA       CYS  25  -1.413  -1.718  -7.827
  225    HB2  CYS  25           2HB      CYS  25  -0.698  -1.518  -5.446
  226    HB3  CYS  25           3HB      CYS  25  -1.915  -0.266  -5.211
  227    H    LYS  26           H        LYS  26  -2.132   1.624  -7.677
  228    HA   LYS  26           HA       LYS  26  -3.813   3.010  -7.821
  229    HB2  LYS  26           2HB      LYS  26  -5.377   2.930  -9.357
  230    HB3  LYS  26           3HB      LYS  26  -4.355   1.632  -9.930
  231    HG2  LYS  26           2HG      LYS  26  -6.368   0.596 -10.118
  232    HG3  LYS  26           3HG      LYS  26  -6.000   0.130  -8.462
  233    HD2  LYS  26           2HD      LYS  26  -7.349   2.208  -7.717
  234    HD3  LYS  26           3HD      LYS  26  -7.836   2.374  -9.415
  235    HE2  LYS  26           2HE      LYS  26  -8.737   0.035  -9.341
  236    HE3  LYS  26           3HE      LYS  26  -8.276  -0.063  -7.635
  237    HZ1  LYS  26           HZ1      LYS  26 -10.239   1.867  -8.761
  238    HZ2  LYS  26           HZ2      LYS  26 -10.617   0.542  -7.889
  239    HZ3  LYS  26           HZ3      LYS  26  -9.816   1.776  -7.184
  240    H    CYS  27           H        CYS  27  -4.602   3.814  -6.136
  241    HA   CYS  27           HA       CYS  27  -6.500   2.310  -4.397
  242    HB2  CYS  27           2HB      CYS  27  -4.136   3.954  -3.404
  243    HB3  CYS  27           3HB      CYS  27  -5.414   3.308  -2.412
  Start of MODEL   40
    1    H1   GLY   1           1H       GLY   1  10.974  -6.396   2.116
    2    H2   GLY   1           2H       GLY   1  11.085  -5.656   3.574
    3    H3   GLY   1           3H       GLY   1  10.669  -7.239   3.485
    4    HA2  GLY   1           HA2      GLY   1   8.723  -5.906   3.956
    5    HA3  GLY   1           HA3      GLY   1   9.056  -4.982   2.480
    6    H    LEU   2           H        LEU   2   6.607  -6.098   2.735
    7    HA   LEU   2           HA       LEU   2   6.400  -8.741   1.556
    8    HB2  LEU   2           2HB      LEU   2   4.398  -6.506   2.030
    9    HB3  LEU   2           3HB      LEU   2   3.948  -8.053   1.328
   10    HG   LEU   2           HG       LEU   2   5.178  -7.739   4.100
   11   HD11  LEU   2          1HD1      LEU   2   2.286  -8.181   3.244
   12   HD12  LEU   2          2HD1      LEU   2   2.893  -8.186   4.916
   13   HD13  LEU   2          3HD1      LEU   2   2.955  -6.698   3.960
   14   HD21  LEU   2          3HD2      LEU   2   3.863 -10.119   2.708
   15   HD22  LEU   2          1HD2      LEU   2   5.575  -9.985   3.172
   16   HD23  LEU   2          2HD2      LEU   2   4.331 -10.061   4.421
   17    HA   PRO   3           HA       PRO   3   6.312  -7.661  -2.867
   18    HB2  PRO   3           2HB      PRO   3   4.127  -9.743  -2.930
   19    HB3  PRO   3           3HB      PRO   3   5.545  -9.564  -4.010
   20    HG2  PRO   3           2HG      PRO   3   5.525 -11.461  -2.071
   21    HG3  PRO   3           3HG      PRO   3   7.006 -10.488  -2.361
   22    HD2  PRO   3           2HD      PRO   3   4.891 -10.085  -0.221
   23    HD3  PRO   3           3HD      PRO   3   6.676 -10.079  -0.075
   24    H    ARG   4           H        ARG   4   5.002  -6.248  -4.089
   25    HA   ARG   4           HA       ARG   4   3.171  -4.722  -2.635
   26    HB2  ARG   4           2HB      ARG   4   2.886  -3.336  -4.500
   27    HB3  ARG   4           3HB      ARG   4   4.540  -3.917  -4.500
   28    HG2  ARG   4           2HG      ARG   4   4.093  -4.196  -6.720
   29    HG3  ARG   4           3HG      ARG   4   3.561  -5.774  -6.142
   30    HD2  ARG   4           2HD      ARG   4   1.192  -4.554  -5.934
   31    HD3  ARG   4           3HD      ARG   4   1.940  -3.364  -7.001
   32    HE   ARG   4           HE       ARG   4   2.024  -6.237  -7.748
   33   HH11  ARG   4          2HH1      ARG   4   0.652  -3.066  -8.523
   34   HH12  ARG   4          1HH1      ARG   4   0.002  -3.656 -10.027
   35   HH21  ARG   4          1HH2      ARG   4   1.187  -6.853  -9.708
   36   HH22  ARG   4          2HH2      ARG   4   0.303  -5.712 -10.676
   37    H    LYS   5           H        LYS   5   2.344  -7.377  -4.780
   38    HA   LYS   5           HA       LYS   5  -0.513  -6.891  -4.746
   39    HB2  LYS   5           2HB      LYS   5  -0.728  -9.035  -5.802
   40    HB3  LYS   5           3HB      LYS   5   0.634  -8.174  -6.512
   41    HG2  LYS   5           2HG      LYS   5   2.191  -9.556  -5.065
   42    HG3  LYS   5           3HG      LYS   5   0.775 -10.457  -4.488
   43    HD2  LYS   5           2HD      LYS   5   0.272 -11.131  -6.852
   44    HD3  LYS   5           3HD      LYS   5   1.689 -10.225  -7.388
   45    HE2  LYS   5           2HE      LYS   5   2.383 -12.476  -7.316
   46    HE3  LYS   5           3HE      LYS   5   3.127 -11.696  -5.919
   47    HZ1  LYS   5           HZ1      LYS   5   0.670 -13.380  -5.848
   48    HZ2  LYS   5           HZ2      LYS   5   2.147 -13.854  -5.352
   49    HZ3  LYS   5           HZ3      LYS   5   1.357 -12.685  -4.535
   50    H    ILE   6           H        ILE   6   1.576  -8.389  -2.407
   51    HA   ILE   6           HA       ILE   6  -0.703  -9.517  -0.864
   52    HB   ILE   6           HB       ILE   6   2.268  -9.430  -0.206
   53   HG12  ILE   6          2HG1      ILE   6   0.484 -11.670  -1.273
   54   HG13  ILE   6          3HG1      ILE   6   1.793 -10.871  -2.145
   55   HG21  ILE   6          1HG2      ILE   6   1.677 -10.967   1.636
   56   HG22  ILE   6          2HG2      ILE   6   0.793  -9.461   1.816
   57   HG23  ILE   6          3HG2      ILE   6  -0.038 -10.887   1.171
   58   HD11  ILE   6          3HD1      ILE   6   2.600 -12.995  -1.435
   59   HD12  ILE   6          1HD1      ILE   6   3.418 -11.770  -0.449
   60   HD13  ILE   6          2HD1      ILE   6   2.084 -12.731   0.236
   61    H    LEU   7           H        LEU   7   1.765  -6.917  -0.616
   62    HA   LEU   7           HA       LEU   7   0.861  -5.737   1.775
   63    HB2  LEU   7           2HB      LEU   7   2.997  -5.277   0.557
   64    HB3  LEU   7           3HB      LEU   7   2.086  -4.423  -0.685
   65    HG   LEU   7           HG       LEU   7   1.414  -2.697   0.937
   66   HD11  LEU   7          1HD1      LEU   7   2.496  -2.616   3.178
   67   HD12  LEU   7          2HD1      LEU   7   1.371  -3.967   3.040
   68   HD13  LEU   7          3HD1      LEU   7   3.124  -4.260   2.925
   69   HD21  LEU   7          3HD2      LEU   7   4.406  -3.268   0.960
   70   HD22  LEU   7          1HD2      LEU   7   3.511  -2.451  -0.339
   71   HD23  LEU   7          2HD2      LEU   7   3.634  -1.694   1.257
   72    H    CYS   8           H        CYS   8  -0.468  -5.418  -1.490
   73    HA   CYS   8           HA       CYS   8  -2.187  -3.223  -1.160
   74    HB2  CYS   8           2HB      CYS   8  -2.283  -5.766  -2.813
   75    HB3  CYS   8           3HB      CYS   8  -3.648  -4.670  -2.827
   76    H    ALA   9           H        ALA   9  -2.671  -6.543   0.041
   77    HA   ALA   9           HA       ALA   9  -5.452  -6.297   0.707
   78    HB1  ALA   9           3HB      ALA   9  -4.136  -8.433   0.563
   79    HB2  ALA   9           1HB      ALA   9  -3.257  -7.945   2.043
   80    HB3  ALA   9           2HB      ALA   9  -5.005  -8.242   2.106
   81    H    ILE  10           H        ILE  10  -2.585  -5.024   2.184
   82    HA   ILE  10           HA       ILE  10  -3.898  -4.544   4.813
   83    HB   ILE  10           HB       ILE  10  -0.967  -4.290   4.037
   84   HG12  ILE  10          2HG1      ILE  10  -2.384  -6.675   5.324
   85   HG13  ILE  10          3HG1      ILE  10  -1.748  -6.638   3.679
   86   HG21  ILE  10          1HG2      ILE  10  -0.580  -4.325   6.459
   87   HG22  ILE  10          2HG2      ILE  10  -1.704  -3.028   6.072
   88   HG23  ILE  10          3HG2      ILE  10  -2.315  -4.546   6.765
   89   HD11  ILE  10          3HD1      ILE  10   0.535  -6.276   4.550
   90   HD12  ILE  10          1HD1      ILE  10  -0.093  -6.575   6.195
   91   HD13  ILE  10          2HD1      ILE  10  -0.214  -7.836   4.947
   92    H    ALA  11           H        ALA  11  -1.983  -2.883   2.282
   93    HA   ALA  11           HA       ALA  11  -2.141  -0.261   3.223
   94    HB1  ALA  11           3HB      ALA  11  -0.708  -1.219   1.378
   95    HB2  ALA  11           1HB      ALA  11  -2.129  -1.180   0.308
   96    HB3  ALA  11           2HB      ALA  11  -1.460   0.326   0.972
   97    H    LYS  12           H        LYS  12  -4.470  -1.948   1.053
   98    HA   LYS  12           HA       LYS  12  -6.214   0.416   0.964
   99    HB2  LYS  12           2HB      LYS  12  -6.440  -2.316  -0.366
  100    HB3  LYS  12           3HB      LYS  12  -7.575  -0.976  -0.579
  101    HG2  LYS  12           2HG      LYS  12  -5.649   0.488  -1.263
  102    HG3  LYS  12           3HG      LYS  12  -4.606  -0.934  -1.274
  103    HD2  LYS  12           2HD      LYS  12  -7.079  -0.550  -3.021
  104    HD3  LYS  12           3HD      LYS  12  -5.416  -0.212  -3.501
  105    HE2  LYS  12           2HE      LYS  12  -4.896  -2.664  -2.930
  106    HE3  LYS  12           3HE      LYS  12  -6.647  -2.914  -2.906
  107    HZ1  LYS  12           HZ1      LYS  12  -5.731  -3.346  -5.125
  108    HZ2  LYS  12           HZ2      LYS  12  -6.700  -2.035  -5.207
  109    HZ3  LYS  12           HZ3      LYS  12  -5.075  -1.848  -5.219
  110    H    LYS  13           H        LYS  13  -6.294  -2.656   2.784
  111    HA   LYS  13           HA       LYS  13  -9.015  -2.087   3.744
  112    HB2  LYS  13           2HB      LYS  13  -6.927  -4.056   4.733
  113    HB3  LYS  13           3HB      LYS  13  -8.542  -3.872   5.424
  114    HG2  LYS  13           2HG      LYS  13  -9.550  -4.325   3.172
  115    HG3  LYS  13           3HG      LYS  13  -7.931  -4.670   2.547
  116    HD2  LYS  13           2HD      LYS  13  -7.706  -6.485   4.288
  117    HD3  LYS  13           3HD      LYS  13  -9.372  -6.149   4.799
  118    HE2  LYS  13           2HE      LYS  13 -10.170  -6.655   2.494
  119    HE3  LYS  13           3HE      LYS  13  -8.508  -7.002   1.998
  120    HZ1  LYS  13           HZ1      LYS  13 -10.016  -8.505   4.074
  121    HZ2  LYS  13           HZ2      LYS  13  -9.704  -9.038   2.566
  122    HZ3  LYS  13           HZ3      LYS  13  -8.479  -8.826   3.622
  123    H    LYS  14           H        LYS  14  -5.765  -1.394   5.069
  124    HA   LYS  14           HA       LYS  14  -6.975  -0.120   7.463
  125    HB2  LYS  14           2HB      LYS  14  -4.098  -0.587   6.609
  126    HB3  LYS  14           3HB      LYS  14  -4.540   0.435   7.964
  127    HG2  LYS  14           2HG      LYS  14  -3.941  -1.694   8.810
  128    HG3  LYS  14           3HG      LYS  14  -5.652  -1.394   9.112
  129    HD2  LYS  14           2HD      LYS  14  -6.288  -2.980   7.349
  130    HD3  LYS  14           3HD      LYS  14  -4.600  -3.129   6.840
  131    HE2  LYS  14           2HE      LYS  14  -5.154  -5.079   8.109
  132    HE3  LYS  14           3HE      LYS  14  -4.019  -4.107   9.048
  133    HZ1  LYS  14           HZ1      LYS  14  -6.965  -4.171   9.474
  134    HZ2  LYS  14           HZ2      LYS  14  -5.865  -4.927  10.409
  135    HZ3  LYS  14           HZ3      LYS  14  -5.907  -3.300  10.367
  136    H    GLY  15           H        GLY  15  -5.814   0.974   4.350
  137    HA2  GLY  15           HA2      GLY  15  -6.475   3.020   3.373
  138    HA3  GLY  15           HA3      GLY  15  -6.859   3.690   4.962
  139    H    LYS  16           H        LYS  16  -3.873   2.019   4.427
  140    HA   LYS  16           HA       LYS  16  -2.250   4.381   5.136
  141    HB2  LYS  16           2HB      LYS  16  -1.694   1.387   4.877
  142    HB3  LYS  16           3HB      LYS  16  -0.511   2.553   5.397
  143    HG2  LYS  16           2HG      LYS  16  -3.101   1.875   6.832
  144    HG3  LYS  16           3HG      LYS  16  -1.489   1.354   7.296
  145    HD2  LYS  16           2HD      LYS  16  -2.550   4.213   7.361
  146    HD3  LYS  16           3HD      LYS  16  -2.283   3.146   8.738
  147    HE2  LYS  16           2HE      LYS  16   0.155   3.064   8.199
  148    HE3  LYS  16           3HE      LYS  16  -0.113   4.193   6.865
  149    HZ1  LYS  16           HZ1      LYS  16   0.615   5.354   8.868
  150    HZ2  LYS  16           HZ2      LYS  16  -0.901   5.828   8.499
  151    HZ3  LYS  16           HZ3      LYS  16  -0.646   4.783   9.729
  152    H    CYS  17           H        CYS  17  -3.208   3.061   2.224
  153    HA   CYS  17           HA       CYS  17  -0.750   2.976   0.774
  154    HB2  CYS  17           2HB      CYS  17  -2.944   1.799   0.291
  155    HB3  CYS  17           3HB      CYS  17  -3.552   3.337  -0.311
  156    H    LYS  18           H        LYS  18   0.486   4.665   0.354
  157    HA   LYS  18           HA       LYS  18  -0.566   7.174  -0.850
  158    HB2  LYS  18           2HB      LYS  18   1.120   7.078   1.715
  159    HB3  LYS  18           3HB      LYS  18   0.794   8.539   0.785
  160    HG2  LYS  18           2HG      LYS  18  -1.657   8.255   1.233
  161    HG3  LYS  18           3HG      LYS  18  -1.276   6.857   2.247
  162    HD2  LYS  18           2HD      LYS  18  -1.611   8.721   3.686
  163    HD3  LYS  18           3HD      LYS  18   0.107   8.303   3.724
  164    HE2  LYS  18           2HE      LYS  18   0.596  10.168   2.153
  165    HE3  LYS  18           3HE      LYS  18  -1.129  10.546   2.054
  166    HZ1  LYS  18           HZ1      LYS  18  -1.081  11.067   4.436
  167    HZ2  LYS  18           HZ2      LYS  18   0.512  10.713   4.529
  168    HZ3  LYS  18           HZ3      LYS  18   0.008  11.986   3.644
  169    H    GLY  19           H        GLY  19   1.139   8.659  -1.535
  170    HA2  GLY  19           HA2      GLY  19   3.032   9.169  -2.747
  171    HA3  GLY  19           HA3      GLY  19   3.876   8.099  -1.643
  172    HA   PRO  20           HA       PRO  20   4.468   5.915  -5.624
  173    HB2  PRO  20           2HB      PRO  20   6.160   3.934  -4.780
  174    HB3  PRO  20           3HB      PRO  20   6.686   5.620  -5.065
  175    HG2  PRO  20           2HG      PRO  20   5.937   4.326  -2.425
  176    HG3  PRO  20           3HG      PRO  20   7.372   5.330  -2.801
  177    HD2  PRO  20           2HD      PRO  20   5.148   6.363  -1.619
  178    HD3  PRO  20           3HD      PRO  20   6.101   7.318  -2.797
  179    H    LEU  21           H        LEU  21   3.572   4.299  -2.519
  180    HA   LEU  21           HA       LEU  21   2.723   1.870  -3.740
  181    HB2  LEU  21           2HB      LEU  21   3.361   2.188  -1.353
  182    HB3  LEU  21           3HB      LEU  21   1.862   3.078  -1.086
  183    HG   LEU  21           HG       LEU  21   0.545   1.045  -1.608
  184   HD11  LEU  21          1HD1      LEU  21   2.012  -0.131  -3.170
  185   HD12  LEU  21          2HD1      LEU  21   3.250  -0.316  -1.902
  186   HD13  LEU  21          3HD1      LEU  21   1.685  -1.152  -1.770
  187   HD21  LEU  21          3HD2      LEU  21   2.754   0.599   0.437
  188   HD22  LEU  21          1HD2      LEU  21   1.243   1.493   0.709
  189   HD23  LEU  21          2HD2      LEU  21   1.197  -0.248   0.386
  190    H    LYS  22           H        LYS  22   1.014   4.861  -3.123
  191    HA   LYS  22           HA       LYS  22  -1.695   4.113  -3.743
  192    HB2  LYS  22           2HB      LYS  22  -1.324   6.153  -2.668
  193    HB3  LYS  22           3HB      LYS  22  -0.111   6.680  -3.833
  194    HG2  LYS  22           2HG      LYS  22  -2.047   8.019  -4.098
  195    HG3  LYS  22           3HG      LYS  22  -1.863   7.027  -5.542
  196    HD2  LYS  22           2HD      LYS  22  -3.617   5.494  -4.722
  197    HD3  LYS  22           3HD      LYS  22  -3.788   6.442  -3.237
  198    HE2  LYS  22           2HE      LYS  22  -4.262   7.504  -6.065
  199    HE3  LYS  22           3HE      LYS  22  -5.532   6.828  -5.044
  200    HZ1  LYS  22           HZ1      LYS  22  -3.931   9.237  -4.364
  201    HZ2  LYS  22           HZ2      LYS  22  -5.486   9.227  -4.853
  202    HZ3  LYS  22           HZ3      LYS  22  -5.090   8.576  -3.413
  203    H    LEU  23           H        LEU  23   0.958   5.033  -5.851
  204    HA   LEU  23           HA       LEU  23  -0.606   4.636  -8.300
  205    HB2  LEU  23           2HB      LEU  23   1.260   6.225  -8.123
  206    HB3  LEU  23           3HB      LEU  23   2.396   4.922  -7.854
  207    HG   LEU  23           HG       LEU  23   2.412   5.951 -10.115
  208   HD11  LEU  23          1HD1      LEU  23   2.779   3.979 -11.375
  209   HD12  LEU  23          2HD1      LEU  23   3.292   3.641  -9.716
  210   HD13  LEU  23          3HD1      LEU  23   1.749   2.999 -10.329
  211   HD21  LEU  23          3HD2      LEU  23  -0.210   4.487 -10.601
  212   HD22  LEU  23          1HD2      LEU  23  -0.034   6.248 -10.401
  213   HD23  LEU  23          2HD2      LEU  23   0.733   5.428 -11.771
  214    H    VAL  24           H        VAL  24   1.996   2.754  -6.703
  215    HA   VAL  24           HA       VAL  24   2.145   0.638  -8.568
  216    HB   VAL  24           HB       VAL  24   2.868   0.822  -5.626
  217   HG11  VAL  24          1HG1      VAL  24   4.481  -1.042  -6.038
  218   HG12  VAL  24          2HG1      VAL  24   2.793  -1.537  -6.040
  219   HG13  VAL  24          3HG1      VAL  24   3.665  -1.358  -7.588
  220   HG21  VAL  24          3HG2      VAL  24   4.031   2.364  -7.247
  221   HG22  VAL  24          1HG2      VAL  24   5.103   1.246  -6.407
  222   HG23  VAL  24          2HG2      VAL  24   4.633   0.932  -8.099
  223    H    CYS  25           H        CYS  25   0.017   0.951  -5.802
  224    HA   CYS  25           HA       CYS  25  -1.089  -1.802  -6.159
  225    HB2  CYS  25           2HB      CYS  25  -0.172  -1.059  -3.984
  226    HB3  CYS  25           3HB      CYS  25  -1.338   0.251  -3.937
  227    H    LYS  26           H        LYS  26  -1.687   1.261  -7.164
  228    HA   LYS  26           HA       LYS  26  -3.360   2.636  -7.671
  229    HB2  LYS  26           2HB      LYS  26  -3.439   0.521  -9.338
  230    HB3  LYS  26           3HB      LYS  26  -5.103   0.478  -8.784
  231    HG2  LYS  26           2HG      LYS  26  -3.571   2.790 -10.033
  232    HG3  LYS  26           3HG      LYS  26  -4.874   1.873 -10.789
  233    HD2  LYS  26           2HD      LYS  26  -5.138   3.829  -8.458
  234    HD3  LYS  26           3HD      LYS  26  -5.627   4.112 -10.122
  235    HE2  LYS  26           2HE      LYS  26  -7.399   2.494 -10.002
  236    HE3  LYS  26           3HE      LYS  26  -6.810   1.852  -8.467
  237    HZ1  LYS  26           HZ1      LYS  26  -7.882   4.595  -8.822
  238    HZ2  LYS  26           HZ2      LYS  26  -8.675   3.354  -8.117
  239    HZ3  LYS  26           HZ3      LYS  26  -7.339   3.970  -7.406
  240    H    CYS  27           H        CYS  27  -3.695   3.161  -5.549
  241    HA   CYS  27           HA       CYS  27  -6.121   2.128  -4.177
  242    HB2  CYS  27           2HB      CYS  27  -3.944   3.978  -3.165
  243    HB3  CYS  27           3HB      CYS  27  -5.199   3.211  -2.214
  Start of MODEL   41
    1    H1   GLY   1           1H       GLY   1  11.566  -7.414   3.235
    2    H2   GLY   1           2H       GLY   1  11.000  -8.944   3.073
    3    H3   GLY   1           3H       GLY   1  11.307  -8.042   1.743
    4    HA2  GLY   1           HA2      GLY   1   9.217  -7.477   3.743
    5    HA3  GLY   1           HA3      GLY   1   9.555  -6.489   2.311
    6    H    LEU   2           H        LEU   2   7.026  -7.468   2.722
    7    HA   LEU   2           HA       LEU   2   6.570  -9.947   1.263
    8    HB2  LEU   2           2HB      LEU   2   4.712  -7.760   2.258
    9    HB3  LEU   2           3HB      LEU   2   4.140  -9.216   1.465
   10    HG   LEU   2           HG       LEU   2   5.725  -9.195   4.071
   11   HD11  LEU   2          1HD1      LEU   2   3.491  -8.164   4.307
   12   HD12  LEU   2          2HD1      LEU   2   2.747  -9.602   3.575
   13   HD13  LEU   2          3HD1      LEU   2   3.582  -9.724   5.139
   14   HD21  LEU   2          3HD2      LEU   2   4.229 -11.430   2.623
   15   HD22  LEU   2          1HD2      LEU   2   5.988 -11.331   2.875
   16   HD23  LEU   2          2HD2      LEU   2   4.915 -11.544   4.258
   17    HA   PRO   3           HA       PRO   3   6.122  -8.472  -2.939
   18    HB2  PRO   3           2HB      PRO   3   3.489  -9.963  -2.920
   19    HB3  PRO   3           3HB      PRO   3   4.787  -9.987  -4.156
   20    HG2  PRO   3           2HG      PRO   3   4.556 -12.024  -2.392
   21    HG3  PRO   3           3HG      PRO   3   6.177 -11.350  -2.763
   22    HD2  PRO   3           2HD      PRO   3   4.411 -10.773  -0.366
   23    HD3  PRO   3           3HD      PRO   3   6.164 -11.114  -0.436
   24    H    ARG   4           H        ARG   4   5.106  -6.819  -4.100
   25    HA   ARG   4           HA       ARG   4   3.673  -4.819  -2.690
   26    HB2  ARG   4           2HB      ARG   4   3.972  -5.292  -5.686
   27    HB3  ARG   4           3HB      ARG   4   3.274  -3.829  -4.978
   28    HG2  ARG   4           2HG      ARG   4   5.370  -3.383  -3.750
   29    HG3  ARG   4           3HG      ARG   4   6.116  -4.819  -4.460
   30    HD2  ARG   4           2HD      ARG   4   5.071  -2.415  -6.018
   31    HD3  ARG   4           3HD      ARG   4   6.756  -2.683  -5.602
   32    HE   ARG   4           HE       ARG   4   5.195  -4.011  -7.704
   33   HH11  ARG   4          1HH2      ARG   4   8.168  -4.246  -5.854
   34   HH12  ARG   4          2HH2      ARG   4   8.917  -5.287  -7.032
   35   HH21  ARG   4          1HH1      ARG   4   6.215  -5.339  -9.154
   36   HH22  ARG   4          2HH1      ARG   4   7.837  -5.883  -8.847
   37    H    LYS   5           H        LYS   5   2.349  -7.397  -4.733
   38    HA   LYS   5           HA       LYS   5  -0.378  -6.451  -4.655
   39    HB2  LYS   5           2HB      LYS   5  -0.979  -8.550  -5.630
   40    HB3  LYS   5           3HB      LYS   5   0.502  -7.965  -6.381
   41    HG2  LYS   5           2HG      LYS   5   1.808  -9.554  -4.888
   42    HG3  LYS   5           3HG      LYS   5   0.256 -10.185  -4.303
   43    HD2  LYS   5           2HD      LYS   5  -0.351 -10.800  -6.661
   44    HD3  LYS   5           3HD      LYS   5   1.210 -10.173  -7.198
   45    HE2  LYS   5           2HE      LYS   5   1.500 -12.505  -7.081
   46    HE3  LYS   5           3HE      LYS   5   2.345 -11.851  -5.677
   47    HZ1  LYS   5           HZ1      LYS   5   0.398 -12.490  -4.321
   48    HZ2  LYS   5           HZ2      LYS   5  -0.372 -13.072  -5.642
   49    HZ3  LYS   5           HZ3      LYS   5   0.987 -13.792  -5.106
   50    H    ILE   6           H        ILE   6   1.487  -8.187  -2.295
   51    HA   ILE   6           HA       ILE   6  -0.904  -8.926  -0.695
   52    HB   ILE   6           HB       ILE   6   2.065  -9.412  -0.255
   53   HG12  ILE   6          2HG1      ILE   6  -0.288 -11.212  -1.010
   54   HG13  ILE   6          3HG1      ILE   6   1.055 -10.751  -2.053
   55   HG21  ILE   6          1HG2      ILE   6  -0.318 -10.259   1.455
   56   HG22  ILE   6          2HG2      ILE   6   1.373 -10.759   1.703
   57   HG23  ILE   6          3HG2      ILE   6   0.925  -9.077   1.916
   58   HD11  ILE   6          3HD1      ILE   6   1.414 -12.998  -1.348
   59   HD12  ILE   6          1HD1      ILE   6   2.619 -11.988  -0.532
   60   HD13  ILE   6          2HD1      ILE   6   1.197 -12.587   0.358
   61    H    LEU   7           H        LEU   7   1.934  -6.711  -0.483
   62    HA   LEU   7           HA       LEU   7   1.138  -5.330   1.884
   63    HB2  LEU   7           2HB      LEU   7   2.591  -4.361  -0.618
   64    HB3  LEU   7           3HB      LEU   7   2.432  -3.403   0.846
   65    HG   LEU   7           HG       LEU   7   3.862  -6.091   0.700
   66   HD11  LEU   7          1HD1      LEU   7   5.911  -4.740   0.918
   67   HD12  LEU   7          2HD1      LEU   7   5.030  -4.325  -0.558
   68   HD13  LEU   7          3HD1      LEU   7   4.948  -3.246   0.855
   69   HD21  LEU   7          3HD2      LEU   7   3.029  -5.683   2.968
   70   HD22  LEU   7          1HD2      LEU   7   4.770  -5.391   2.930
   71   HD23  LEU   7          2HD2      LEU   7   3.648  -4.015   2.929
   72    H    CYS   8           H        CYS   8   0.002  -4.949  -1.452
   73    HA   CYS   8           HA       CYS   8  -1.555  -2.591  -1.099
   74    HB2  CYS   8           2HB      CYS   8  -0.918  -3.495  -3.247
   75    HB3  CYS   8           3HB      CYS   8  -1.862  -4.956  -2.972
   76    H    ALA   9           H        ALA   9  -2.338  -5.968  -0.234
   77    HA   ALA   9           HA       ALA   9  -5.177  -5.444   0.161
   78    HB1  ALA   9           3HB      ALA   9  -4.273  -7.691  -0.354
   79    HB2  ALA   9           1HB      ALA   9  -3.418  -7.697   1.209
   80    HB3  ALA   9           2HB      ALA   9  -5.192  -7.662   1.167
   81    H    ILE  10           H        ILE  10  -2.293  -5.023   2.087
   82    HA   ILE  10           HA       ILE  10  -3.729  -4.435   4.590
   83    HB   ILE  10           HB       ILE  10  -0.849  -3.786   3.867
   84   HG12  ILE  10          2HG1      ILE  10  -1.100  -6.174   3.492
   85   HG13  ILE  10          3HG1      ILE  10  -0.122  -5.848   4.888
   86   HG21  ILE  10          1HG2      ILE  10  -0.519  -3.864   6.323
   87   HG22  ILE  10          2HG2      ILE  10  -1.648  -2.597   5.826
   88   HG23  ILE  10          3HG2      ILE  10  -2.267  -4.099   6.541
   89   HD11  ILE  10          3HD1      ILE  10  -3.050  -6.717   4.962
   90   HD12  ILE  10          1HD1      ILE  10  -1.641  -7.748   5.261
   91   HD13  ILE  10          2HD1      ILE  10  -2.020  -6.435   6.388
   92    H    ALA  11           H        ALA  11  -1.928  -2.602   2.093
   93    HA   ALA  11           HA       ALA  11  -2.201  -0.047   3.111
   94    HB1  ALA  11           3HB      ALA  11  -0.786  -0.931   1.167
   95    HB2  ALA  11           1HB      ALA  11  -2.226  -0.727   0.135
   96    HB3  ALA  11           2HB      ALA  11  -1.488   0.670   0.946
   97    H    LYS  12           H        LYS  12  -4.304  -1.538   0.658
   98    HA   LYS  12           HA       LYS  12  -6.214   0.562   0.465
   99    HB2  LYS  12           2HB      LYS  12  -5.510  -1.423  -1.056
  100    HB3  LYS  12           3HB      LYS  12  -6.719  -2.363  -0.204
  101    HG2  LYS  12           2HG      LYS  12  -8.438  -1.334  -1.339
  102    HG3  LYS  12           3HG      LYS  12  -7.710   0.265  -1.198
  103    HD2  LYS  12           2HD      LYS  12  -7.752  -0.351  -3.556
  104    HD3  LYS  12           3HD      LYS  12  -6.093  -0.249  -2.968
  105    HE2  LYS  12           2HE      LYS  12  -6.206  -2.142  -4.397
  106    HE3  LYS  12           3HE      LYS  12  -5.997  -2.727  -2.751
  107    HZ1  LYS  12           HZ1      LYS  12  -7.707  -3.984  -3.964
  108    HZ2  LYS  12           HZ2      LYS  12  -8.409  -3.212  -2.709
  109    HZ3  LYS  12           HZ3      LYS  12  -8.585  -2.638  -4.229
  110    H    LYS  13           H        LYS  13  -6.140  -2.265   2.590
  111    HA   LYS  13           HA       LYS  13  -8.838  -1.874   3.634
  112    HB2  LYS  13           2HB      LYS  13  -7.642  -4.034   3.516
  113    HB3  LYS  13           3HB      LYS  13  -6.505  -3.481   4.757
  114    HG2  LYS  13           2HG      LYS  13  -8.363  -3.266   6.373
  115    HG3  LYS  13           3HG      LYS  13  -9.529  -3.733   5.128
  116    HD2  LYS  13           2HD      LYS  13  -7.266  -5.495   6.174
  117    HD3  LYS  13           3HD      LYS  13  -8.959  -5.578   6.691
  118    HE2  LYS  13           2HE      LYS  13  -9.627  -6.085   4.328
  119    HE3  LYS  13           3HE      LYS  13  -7.918  -6.102   3.869
  120    HZ1  LYS  13           HZ1      LYS  13  -9.165  -7.935   5.848
  121    HZ2  LYS  13           HZ2      LYS  13  -8.731  -8.341   4.330
  122    HZ3  LYS  13           HZ3      LYS  13  -7.585  -7.952   5.424
  123    H    LYS  14           H        LYS  14  -5.598  -0.901   4.762
  124    HA   LYS  14           HA       LYS  14  -6.663   0.430   7.170
  125    HB2  LYS  14           2HB      LYS  14  -3.917  -0.037   5.998
  126    HB3  LYS  14           3HB      LYS  14  -4.150   1.228   7.188
  127    HG2  LYS  14           2HG      LYS  14  -3.385  -0.770   8.270
  128    HG3  LYS  14           3HG      LYS  14  -4.980  -0.293   8.845
  129    HD2  LYS  14           2HD      LYS  14  -6.032  -2.096   7.542
  130    HD3  LYS  14           3HD      LYS  14  -4.449  -2.547   6.857
  131    HE2  LYS  14           2HE      LYS  14  -3.591  -3.036   9.119
  132    HE3  LYS  14           3HE      LYS  14  -5.116  -2.508   9.837
  133    HZ1  LYS  14           HZ1      LYS  14  -6.227  -4.356   8.726
  134    HZ2  LYS  14           HZ2      LYS  14  -4.827  -4.847   8.024
  135    HZ3  LYS  14           HZ3      LYS  14  -5.008  -4.923   9.643
  136    H    GLY  15           H        GLY  15  -5.972   1.490   3.928
  137    HA2  GLY  15           HA2      GLY  15  -6.406   3.593   2.968
  138    HA3  GLY  15           HA3      GLY  15  -6.766   4.282   4.560
  139    H    LYS  16           H        LYS  16  -3.934   2.388   3.629
  140    HA   LYS  16           HA       LYS  16  -2.052   4.586   4.444
  141    HB2  LYS  16           2HB      LYS  16  -2.040   1.562   4.654
  142    HB3  LYS  16           3HB      LYS  16  -0.522   2.439   4.552
  143    HG2  LYS  16           2HG      LYS  16  -1.107   3.775   6.541
  144    HG3  LYS  16           3HG      LYS  16  -2.688   2.997   6.620
  145    HD2  LYS  16           2HD      LYS  16  -1.157   1.987   8.262
  146    HD3  LYS  16           3HD      LYS  16  -1.649   0.815   7.044
  147    HE2  LYS  16           2HE      LYS  16   0.668   0.460   7.422
  148    HE3  LYS  16           3HE      LYS  16   0.505   1.191   5.824
  149    HZ1  LYS  16           HZ1      LYS  16   1.269   2.649   8.308
  150    HZ2  LYS  16           HZ2      LYS  16   2.300   2.214   7.123
  151    HZ3  LYS  16           HZ3      LYS  16   1.152   3.334   6.827
  152    H    CYS  17           H        CYS  17  -3.238   2.951   1.801
  153    HA   CYS  17           HA       CYS  17  -1.036   2.977  -0.036
  154    HB2  CYS  17           2HB      CYS  17  -2.957   2.868  -1.666
  155    HB3  CYS  17           3HB      CYS  17  -2.835   1.591  -0.548
  156    H    LYS  18           H        LYS  18  -0.018   4.911   0.332
  157    HA   LYS  18           HA       LYS  18  -1.153   7.373  -0.951
  158    HB2  LYS  18           2HB      LYS  18   0.329   7.172   1.713
  159    HB3  LYS  18           3HB      LYS  18  -0.056   8.685   0.882
  160    HG2  LYS  18           2HG      LYS  18  -2.484   8.154   1.036
  161    HG3  LYS  18           3HG      LYS  18  -2.096   6.677   1.938
  162    HD2  LYS  18           2HD      LYS  18  -1.015   8.026   3.710
  163    HD3  LYS  18           3HD      LYS  18  -1.414   9.514   2.819
  164    HE2  LYS  18           2HE      LYS  18  -3.831   8.949   2.968
  165    HE3  LYS  18           3HE      LYS  18  -3.435   7.468   3.847
  166    HZ1  LYS  18           HZ1      LYS  18  -2.492   8.850   5.622
  167    HZ2  LYS  18           HZ2      LYS  18  -2.864  10.220   4.811
  168    HZ3  LYS  18           HZ3      LYS  18  -4.052   9.251   5.367
  169    H    GLY  19           H        GLY  19   0.500   8.978  -1.535
  170    HA2  GLY  19           HA2      GLY  19   2.321   9.511  -2.865
  171    HA3  GLY  19           HA3      GLY  19   3.259   8.460  -1.812
  172    HA   PRO  20           HA       PRO  20   3.494   6.288  -5.858
  173    HB2  PRO  20           2HB      PRO  20   5.452   4.473  -5.250
  174    HB3  PRO  20           3HB      PRO  20   5.784   6.195  -5.606
  175    HG2  PRO  20           2HG      PRO  20   5.497   4.880  -2.885
  176    HG3  PRO  20           3HG      PRO  20   6.796   5.981  -3.452
  177    HD2  PRO  20           2HD      PRO  20   4.687   6.876  -1.993
  178    HD3  PRO  20           3HD      PRO  20   5.382   7.871  -3.310
  179    H    LEU  21           H        LEU  21   2.991   4.753  -2.649
  180    HA   LEU  21           HA       LEU  21   2.216   2.202  -3.704
  181    HB2  LEU  21           2HB      LEU  21   3.020   2.628  -1.393
  182    HB3  LEU  21           3HB      LEU  21   1.520   3.479  -1.037
  183    HG   LEU  21           HG       LEU  21   0.221   1.409  -1.339
  184   HD11  LEU  21          1HD1      LEU  21   2.911   0.084  -1.905
  185   HD12  LEU  21          2HD1      LEU  21   1.400  -0.783  -1.548
  186   HD13  LEU  21          3HD1      LEU  21   1.520   0.188  -3.012
  187   HD21  LEU  21          3HD2      LEU  21   2.657   1.086   0.458
  188   HD22  LEU  21          1HD2      LEU  21   1.147   1.933   0.868
  189   HD23  LEU  21          2HD2      LEU  21   1.141   0.180   0.603
  190    H    LYS  22           H        LYS  22   0.429   5.180  -3.255
  191    HA   LYS  22           HA       LYS  22  -2.266   4.212  -3.606
  192    HB2  LYS  22           2HB      LYS  22  -1.493   6.550  -2.911
  193    HB3  LYS  22           3HB      LYS  22  -1.101   6.850  -4.599
  194    HG2  LYS  22           2HG      LYS  22  -3.523   6.378  -5.171
  195    HG3  LYS  22           3HG      LYS  22  -3.846   6.240  -3.425
  196    HD2  LYS  22           2HD      LYS  22  -2.875   8.541  -3.140
  197    HD3  LYS  22           3HD      LYS  22  -2.772   8.673  -4.902
  198    HE2  LYS  22           2HE      LYS  22  -5.343   8.240  -3.312
  199    HE3  LYS  22           3HE      LYS  22  -4.749   9.814  -3.846
  200    HZ1  LYS  22           HZ1      LYS  22  -6.348   9.001  -5.414
  201    HZ2  LYS  22           HZ2      LYS  22  -4.895   8.953  -6.165
  202    HZ3  LYS  22           HZ3      LYS  22  -5.597   7.573  -5.593
  203    H    LEU  23           H        LEU  23   0.231   5.208  -5.902
  204    HA   LEU  23           HA       LEU  23  -1.351   4.691  -8.277
  205    HB2  LEU  23           2HB      LEU  23   0.448   6.379  -8.150
  206    HB3  LEU  23           3HB      LEU  23   1.640   5.108  -7.889
  207    HG   LEU  23           HG       LEU  23   1.205   4.202 -10.152
  208   HD11  LEU  23          1HD1      LEU  23  -0.106   5.563 -11.775
  209   HD12  LEU  23          2HD1      LEU  23  -1.133   4.878 -10.514
  210   HD13  LEU  23          3HD1      LEU  23  -0.670   6.595 -10.442
  211   HD21  LEU  23          3HD2      LEU  23   1.785   7.192 -10.114
  212   HD22  LEU  23          1HD2      LEU  23   2.959   5.896  -9.792
  213   HD23  LEU  23          2HD2      LEU  23   2.232   6.046 -11.400
  214    H    VAL  24           H        VAL  24   1.010   2.750  -6.438
  215    HA   VAL  24           HA       VAL  24   1.081   0.522  -8.296
  216    HB   VAL  24           HB       VAL  24   1.733   0.754  -5.341
  217   HG11  VAL  24          1HG1      VAL  24   2.307  -1.597  -7.189
  218   HG12  VAL  24          2HG1      VAL  24   2.994  -1.360  -5.564
  219   HG13  VAL  24          3HG1      VAL  24   1.263  -1.615  -5.748
  220   HG21  VAL  24          3HG2      VAL  24   3.206   2.026  -6.919
  221   HG22  VAL  24          1HG2      VAL  24   4.059   0.726  -6.088
  222   HG23  VAL  24          2HG2      VAL  24   3.549   0.519  -7.780
  223    H    CYS  25           H        CYS  25  -0.921   1.214  -5.427
  224    HA   CYS  25           HA       CYS  25  -2.240  -1.413  -5.612
  225    HB2  CYS  25           2HB      CYS  25  -1.178  -0.524  -3.565
  226    HB3  CYS  25           3HB      CYS  25  -2.331   0.805  -3.543
  227    H    LYS  26           H        LYS  26  -2.916   1.730  -6.626
  228    HA   LYS  26           HA       LYS  26  -4.661   2.865  -7.467
  229    HB2  LYS  26           2HB      LYS  26  -5.627   0.066  -8.064
  230    HB3  LYS  26           3HB      LYS  26  -6.676   1.459  -8.328
  231    HG2  LYS  26           2HG      LYS  26  -5.603   1.134 -10.379
  232    HG3  LYS  26           3HG      LYS  26  -4.867   2.562  -9.643
  233    HD2  LYS  26           2HD      LYS  26  -2.960   1.030  -8.882
  234    HD3  LYS  26           3HD      LYS  26  -3.643  -0.214  -9.934
  235    HE2  LYS  26           2HE      LYS  26  -2.846   2.620 -10.734
  236    HE3  LYS  26           3HE      LYS  26  -1.789   1.219 -10.907
  237    HZ1  LYS  26           HZ1      LYS  26  -4.390   1.557 -12.316
  238    HZ2  LYS  26           HZ2      LYS  26  -2.915   1.680 -12.999
  239    HZ3  LYS  26           HZ3      LYS  26  -3.428   0.239 -12.437
  240    H    CYS  27           H        CYS  27  -4.632   3.750  -5.530
  241    HA   CYS  27           HA       CYS  27  -7.220   3.552  -4.015
  242    HB2  CYS  27           2HB      CYS  27  -4.413   4.069  -3.052
  243    HB3  CYS  27           3HB      CYS  27  -5.757   4.757  -2.184
  Start of MODEL   42
    1    H1   GLY   1           1H       GLY   1  10.440  -8.922   3.141
    2    H2   GLY   1           2H       GLY   1  10.613  -8.214   4.610
    3    H3   GLY   1           3H       GLY   1   9.684  -9.554   4.448
    4    HA2  GLY   1           HA2      GLY   1   8.285  -7.611   4.670
    5    HA3  GLY   1           HA3      GLY   1   9.110  -6.915   3.263
    6    H    LEU   2           H        LEU   2   6.387  -7.136   3.227
    7    HA   LEU   2           HA       LEU   2   5.464  -9.574   1.953
    8    HB2  LEU   2           2HB      LEU   2   4.241  -6.799   2.208
    9    HB3  LEU   2           3HB      LEU   2   3.402  -8.177   1.508
   10    HG   LEU   2           HG       LEU   2   4.373  -8.014   4.395
   11   HD11  LEU   2          1HD1      LEU   2   2.534  -6.452   3.909
   12   HD12  LEU   2          2HD1      LEU   2   1.586  -7.770   3.188
   13   HD13  LEU   2          3HD1      LEU   2   1.976  -7.791   4.923
   14   HD21  LEU   2          3HD2      LEU   2   4.277 -10.351   3.662
   15   HD22  LEU   2          1HD2      LEU   2   2.902 -10.007   4.713
   16   HD23  LEU   2          2HD2      LEU   2   2.666 -10.093   2.954
   17    HA   PRO   3           HA       PRO   3   6.296  -8.301  -2.335
   18    HB2  PRO   3           2HB      PRO   3   4.699 -10.026  -3.690
   19    HB3  PRO   3           3HB      PRO   3   6.176 -10.579  -2.841
   20    HG2  PRO   3           2HG      PRO   3   3.314 -10.663  -1.849
   21    HG3  PRO   3           3HG      PRO   3   4.523 -11.985  -1.833
   22    HD2  PRO   3           2HD      PRO   3   4.024 -10.377   0.341
   23    HD3  PRO   3           3HD      PRO   3   5.649 -11.051   0.016
   24    H    ARG   4           H        ARG   4   5.161  -7.123  -3.968
   25    HA   ARG   4           HA       ARG   4   3.492  -5.148  -2.938
   26    HB2  ARG   4           2HB      ARG   4   3.795  -6.000  -5.852
   27    HB3  ARG   4           3HB      ARG   4   3.039  -4.499  -5.330
   28    HG2  ARG   4           2HG      ARG   4   5.954  -5.254  -4.855
   29    HG3  ARG   4           3HG      ARG   4   5.336  -4.148  -6.086
   30    HD2  ARG   4           2HD      ARG   4   4.398  -2.703  -4.252
   31    HD3  ARG   4           3HD      ARG   4   5.204  -3.756  -3.069
   32    HE   ARG   4           HE       ARG   4   7.183  -2.986  -4.904
   33   HH11  ARG   4          1HH2      ARG   4   5.172  -1.308  -2.579
   34   HH12  ARG   4          2HH2      ARG   4   6.346  -0.042  -2.344
   35   HH21  ARG   4          1HH1      ARG   4   8.626  -1.337  -4.563
   36   HH22  ARG   4          2HH1      ARG   4   8.246  -0.061  -3.447
   37    H    LYS   5           H        LYS   5   2.306  -7.947  -4.840
   38    HA   LYS   5           HA       LYS   5  -0.410  -7.033  -4.907
   39    HB2  LYS   5           2HB      LYS   5  -0.966  -9.247  -5.705
   40    HB3  LYS   5           3HB      LYS   5   0.518  -8.688  -6.475
   41    HG2  LYS   5           2HG      LYS   5   1.849 -10.078  -4.851
   42    HG3  LYS   5           3HG      LYS   5   0.339 -10.694  -4.174
   43    HD2  LYS   5           2HD      LYS   5   1.204 -11.024  -7.077
   44    HD3  LYS   5           3HD      LYS   5   1.434 -12.230  -5.802
   45    HE2  LYS   5           2HE      LYS   5  -1.023 -12.328  -5.437
   46    HE3  LYS   5           3HE      LYS   5  -1.264 -11.152  -6.739
   47    HZ1  LYS   5           HZ1      LYS   5  -1.549 -13.422  -7.541
   48    HZ2  LYS   5           HZ2      LYS   5  -0.259 -12.751  -8.281
   49    HZ3  LYS   5           HZ3      LYS   5  -0.041 -13.839  -7.081
   50    H    ILE   6           H        ILE   6   1.282  -8.576  -2.302
   51    HA   ILE   6           HA       ILE   6  -1.247  -9.123  -0.823
   52    HB   ILE   6           HB       ILE   6   1.642  -9.637  -0.032
   53   HG12  ILE   6          2HG1      ILE   6  -0.569 -11.519  -1.005
   54   HG13  ILE   6          3HG1      ILE   6   0.870 -11.060  -1.913
   55   HG21  ILE   6          1HG2      ILE   6   0.169  -9.216   1.920
   56   HG22  ILE   6          2HG2      ILE   6  -0.990 -10.412   1.313
   57   HG23  ILE   6          3HG2      ILE   6   0.629 -10.911   1.853
   58   HD11  ILE   6          3HD1      ILE   6   0.783 -12.794   0.566
   59   HD12  ILE   6          1HD1      ILE   6   1.273 -13.227  -1.081
   60   HD13  ILE   6          2HD1      ILE   6   2.284 -12.128  -0.123
   61    H    LEU   7           H        LEU   7   1.684  -7.046  -0.614
   62    HA   LEU   7           HA       LEU   7   0.945  -5.511   1.639
   63    HB2  LEU   7           2HB      LEU   7   3.160  -5.496   0.503
   64    HB3  LEU   7           3HB      LEU   7   2.436  -4.712  -0.897
   65    HG   LEU   7           HG       LEU   7   1.932  -2.698   0.466
   66   HD11  LEU   7          1HD1      LEU   7   3.004  -2.455   2.696
   67   HD12  LEU   7          2HD1      LEU   7   1.733  -3.679   2.713
   68   HD13  LEU   7          3HD1      LEU   7   3.442  -4.176   2.669
   69   HD21  LEU   7          3HD2      LEU   7   4.032  -2.878  -0.803
   70   HD22  LEU   7          1HD2      LEU   7   4.251  -1.933   0.679
   71   HD23  LEU   7          2HD2      LEU   7   4.831  -3.613   0.605
   72    H    CYS   8           H        CYS   8  -0.123  -5.220  -1.732
   73    HA   CYS   8           HA       CYS   8  -1.520  -2.740  -1.531
   74    HB2  CYS   8           2HB      CYS   8  -1.897  -5.184  -3.312
   75    HB3  CYS   8           3HB      CYS   8  -2.823  -3.714  -3.510
   76    H    ALA   9           H        ALA   9  -2.512  -5.978  -0.442
   77    HA   ALA   9           HA       ALA   9  -5.329  -5.228  -0.131
   78    HB1  ALA   9           3HB      ALA   9  -5.510  -7.392   0.994
   79    HB2  ALA   9           1HB      ALA   9  -4.621  -7.569  -0.532
   80    HB3  ALA   9           2HB      ALA   9  -3.744  -7.571   1.014
   81    H    ILE  10           H        ILE  10  -2.468  -5.564   2.003
   82    HA   ILE  10           HA       ILE  10  -3.686  -4.721   4.440
   83    HB   ILE  10           HB       ILE  10  -0.809  -4.240   3.565
   84   HG12  ILE  10          2HG1      ILE  10  -1.216  -6.580   3.178
   85   HG13  ILE  10          3HG1      ILE  10  -0.219  -6.380   4.591
   86   HG21  ILE  10          1HG2      ILE  10  -2.056  -4.533   6.326
   87   HG22  ILE  10          2HG2      ILE  10  -0.315  -4.416   5.990
   88   HG23  ILE  10          3HG2      ILE  10  -1.375  -3.052   5.620
   89   HD11  ILE  10          3HD1      ILE  10  -3.201  -7.035   4.610
   90   HD12  ILE  10          1HD1      ILE  10  -1.867  -8.160   4.912
   91   HD13  ILE  10          2HD1      ILE  10  -2.179  -6.847   6.058
   92    H    ALA  11           H        ALA  11  -1.993  -2.814   1.929
   93    HA   ALA  11           HA       ALA  11  -2.112  -0.294   3.118
   94    HB1  ALA  11           3HB      ALA  11  -1.588   0.517   0.904
   95    HB2  ALA  11           1HB      ALA  11  -0.816  -1.055   1.074
   96    HB3  ALA  11           2HB      ALA  11  -2.323  -0.906   0.131
   97    H    LYS  12           H        LYS  12  -4.628  -1.923   1.202
   98    HA   LYS  12           HA       LYS  12  -6.424   0.428   1.290
   99    HB2  LYS  12           2HB      LYS  12  -6.628  -2.301  -0.046
  100    HB3  LYS  12           3HB      LYS  12  -7.893  -1.059  -0.109
  101    HG2  LYS  12           2HG      LYS  12  -6.257   0.567  -1.037
  102    HG3  LYS  12           3HG      LYS  12  -5.020  -0.689  -1.076
  103    HD2  LYS  12           2HD      LYS  12  -7.631  -0.745  -2.644
  104    HD3  LYS  12           3HD      LYS  12  -6.055  -0.233  -3.261
  105    HE2  LYS  12           2HE      LYS  12  -5.151  -2.516  -2.684
  106    HE3  LYS  12           3HE      LYS  12  -6.811  -3.026  -2.340
  107    HZ1  LYS  12           HZ1      LYS  12  -7.372  -2.396  -4.653
  108    HZ2  LYS  12           HZ2      LYS  12  -5.818  -1.966  -4.944
  109    HZ3  LYS  12           HZ3      LYS  12  -6.198  -3.531  -4.642
  110    H    LYS  13           H        LYS  13  -6.191  -2.710   2.924
  111    HA   LYS  13           HA       LYS  13  -8.738  -2.499   4.309
  112    HB2  LYS  13           2HB      LYS  13  -6.194  -4.084   4.831
  113    HB3  LYS  13           3HB      LYS  13  -7.604  -4.160   5.895
  114    HG2  LYS  13           2HG      LYS  13  -9.033  -4.971   4.109
  115    HG3  LYS  13           3HG      LYS  13  -7.772  -4.730   2.906
  116    HD2  LYS  13           2HD      LYS  13  -7.908  -7.073   3.410
  117    HD3  LYS  13           3HD      LYS  13  -6.367  -6.458   4.027
  118    HE2  LYS  13           2HE      LYS  13  -7.313  -6.350   6.316
  119    HE3  LYS  13           3HE      LYS  13  -8.889  -6.870   5.703
  120    HZ1  LYS  13           HZ1      LYS  13  -7.649  -8.731   6.643
  121    HZ2  LYS  13           HZ2      LYS  13  -7.868  -8.982   5.048
  122    HZ3  LYS  13           HZ3      LYS  13  -6.408  -8.507   5.609
  123    H    LYS  14           H        LYS  14  -5.458  -1.379   5.159
  124    HA   LYS  14           HA       LYS  14  -6.430  -0.134   7.671
  125    HB2  LYS  14           2HB      LYS  14  -3.718  -0.428   6.342
  126    HB3  LYS  14           3HB      LYS  14  -3.969   0.771   7.595
  127    HG2  LYS  14           2HG      LYS  14  -3.078  -1.122   8.652
  128    HG3  LYS  14           3HG      LYS  14  -4.755  -0.959   9.171
  129    HD2  LYS  14           2HD      LYS  14  -5.408  -2.779   7.594
  130    HD3  LYS  14           3HD      LYS  14  -3.724  -2.947   7.091
  131    HE2  LYS  14           2HE      LYS  14  -4.836  -3.368   9.908
  132    HE3  LYS  14           3HE      LYS  14  -4.473  -4.654   8.757
  133    HZ1  LYS  14           HZ1      LYS  14  -2.122  -3.966   8.838
  134    HZ2  LYS  14           HZ2      LYS  14  -2.467  -2.809   9.943
  135    HZ3  LYS  14           HZ3      LYS  14  -2.662  -4.380  10.319
  136    H    GLY  15           H        GLY  15  -6.316   0.874   4.402
  137    HA2  GLY  15           HA2      GLY  15  -6.815   2.900   3.412
  138    HA3  GLY  15           HA3      GLY  15  -7.181   3.584   5.001
  139    H    LYS  16           H        LYS  16  -4.081   2.105   4.463
  140    HA   LYS  16           HA       LYS  16  -2.606   4.543   5.116
  141    HB2  LYS  16           2HB      LYS  16  -2.023   2.396   6.092
  142    HB3  LYS  16           3HB      LYS  16  -1.853   1.656   4.497
  143    HG2  LYS  16           2HG      LYS  16   0.105   3.031   4.004
  144    HG3  LYS  16           3HG      LYS  16  -0.064   3.880   5.557
  145    HD2  LYS  16           2HD      LYS  16   0.431   1.838   6.782
  146    HD3  LYS  16           3HD      LYS  16   0.357   0.865   5.290
  147    HE2  LYS  16           2HE      LYS  16   2.234   2.120   4.336
  148    HE3  LYS  16           3HE      LYS  16   2.319   3.146   5.773
  149    HZ1  LYS  16           HZ1      LYS  16   2.882   1.164   7.083
  150    HZ2  LYS  16           HZ2      LYS  16   2.808   0.209   5.756
  151    HZ3  LYS  16           HZ3      LYS  16   3.962   1.355   5.878
  152    H    CYS  17           H        CYS  17  -3.322   2.801   2.237
  153    HA   CYS  17           HA       CYS  17  -1.165   3.266   0.618
  154    HB2  CYS  17           2HB      CYS  17  -3.250   1.785   0.324
  155    HB3  CYS  17           3HB      CYS  17  -4.025   3.213  -0.340
  156    H    LYS  18           H        LYS  18  -0.227   5.019  -0.084
  157    HA   LYS  18           HA       LYS  18  -1.677   7.311  -1.301
  158    HB2  LYS  18           2HB      LYS  18   0.207   7.506   1.105
  159    HB3  LYS  18           3HB      LYS  18  -0.203   8.891   0.096
  160    HG2  LYS  18           2HG      LYS  18  -2.594   8.642   0.652
  161    HG3  LYS  18           3HG      LYS  18  -2.216   7.292   1.728
  162    HD2  LYS  18           2HD      LYS  18  -1.135  10.115   2.071
  163    HD3  LYS  18           3HD      LYS  18  -2.539   9.442   2.916
  164    HE2  LYS  18           2HE      LYS  18  -1.094   7.639   3.866
  165    HE3  LYS  18           3HE      LYS  18   0.314   8.369   3.086
  166    HZ1  LYS  18           HZ1      LYS  18   0.115   9.095   5.392
  167    HZ2  LYS  18           HZ2      LYS  18  -0.078  10.381   4.409
  168    HZ3  LYS  18           HZ3      LYS  18  -1.376   9.704   5.135
  169    H    GLY  19           H        GLY  19  -0.222   8.858  -2.329
  170    HA2  GLY  19           HA2      GLY  19   1.469   9.395  -3.815
  171    HA3  GLY  19           HA3      GLY  19   2.492   8.718  -2.556
  172    HA   PRO  20           HA       PRO  20   3.716   6.171  -6.144
  173    HB2  PRO  20           2HB      PRO  20   5.448   4.982  -3.969
  174    HB3  PRO  20           3HB      PRO  20   5.877   5.380  -5.662
  175    HG2  PRO  20           2HG      PRO  20   6.610   7.046  -3.666
  176    HG3  PRO  20           3HG      PRO  20   5.910   7.731  -5.173
  177    HD2  PRO  20           2HD      PRO  20   4.523   7.198  -2.528
  178    HD3  PRO  20           3HD      PRO  20   4.449   8.649  -3.574
  179    H    LEU  21           H        LEU  21   2.844   4.863  -2.897
  180    HA   LEU  21           HA       LEU  21   2.467   2.165  -3.856
  181    HB2  LEU  21           2HB      LEU  21   2.971   2.851  -1.478
  182    HB3  LEU  21           3HB      LEU  21   1.325   3.475  -1.359
  183    HG   LEU  21           HG       LEU  21   0.441   1.167  -1.785
  184   HD11  LEU  21          1HD1      LEU  21   2.012  -0.749  -1.536
  185   HD12  LEU  21          2HD1      LEU  21   2.311   0.160  -3.017
  186   HD13  LEU  21          3HD1      LEU  21   3.381   0.386  -1.609
  187   HD21  LEU  21          3HD2      LEU  21   0.763   1.991   0.514
  188   HD22  LEU  21          1HD2      LEU  21   1.082   0.252   0.411
  189   HD23  LEU  21          2HD2      LEU  21   2.437   1.395   0.505
  190    H    LYS  22           H        LYS  22   0.274   4.898  -3.418
  191    HA   LYS  22           HA       LYS  22  -2.232   3.617  -4.151
  192    HB2  LYS  22           2HB      LYS  22  -2.214   5.759  -3.054
  193    HB3  LYS  22           3HB      LYS  22  -1.236   6.482  -4.334
  194    HG2  LYS  22           2HG      LYS  22  -3.099   6.256  -5.931
  195    HG3  LYS  22           3HG      LYS  22  -4.092   5.489  -4.676
  196    HD2  LYS  22           2HD      LYS  22  -3.987   7.543  -3.309
  197    HD3  LYS  22           3HD      LYS  22  -2.854   8.265  -4.460
  198    HE2  LYS  22           2HE      LYS  22  -4.866   9.283  -5.014
  199    HE3  LYS  22           3HE      LYS  22  -4.675   8.030  -6.243
  200    HZ1  LYS  22           HZ1      LYS  22  -6.928   8.060  -5.347
  201    HZ2  LYS  22           HZ2      LYS  22  -6.238   6.639  -4.939
  202    HZ3  LYS  22           HZ3      LYS  22  -6.395   7.825  -3.823
  203    H    LEU  23           H        LEU  23   0.335   5.093  -6.032
  204    HA   LEU  23           HA       LEU  23  -0.845   4.615  -8.605
  205    HB2  LEU  23           2HB      LEU  23   1.473   5.899  -7.526
  206    HB3  LEU  23           3HB      LEU  23   2.089   4.665  -8.587
  207    HG   LEU  23           HG       LEU  23   1.917   6.788  -9.724
  208   HD11  LEU  23          1HD1      LEU  23   1.457   4.774 -11.090
  209   HD12  LEU  23          2HD1      LEU  23  -0.286   4.992 -10.813
  210   HD13  LEU  23          3HD1      LEU  23   0.636   6.222 -11.700
  211   HD21  LEU  23          3HD2      LEU  23  -1.084   6.754  -9.194
  212   HD22  LEU  23          1HD2      LEU  23   0.104   7.781  -8.365
  213   HD23  LEU  23          2HD2      LEU  23  -0.168   7.971 -10.105
  214    H    VAL  24           H        VAL  24   0.560   2.310  -6.456
  215    HA   VAL  24           HA       VAL  24   1.287   0.402  -8.653
  216    HB   VAL  24           HB       VAL  24   1.823   0.458  -5.656
  217   HG11  VAL  24          1HG1      VAL  24   3.153  -1.614  -5.991
  218   HG12  VAL  24          2HG1      VAL  24   1.418  -1.867  -6.176
  219   HG13  VAL  24          3HG1      VAL  24   2.459  -1.774  -7.621
  220   HG21  VAL  24          3HG2      VAL  24   3.753   0.401  -8.008
  221   HG22  VAL  24          1HG2      VAL  24   3.279   1.863  -7.126
  222   HG23  VAL  24          2HG2      VAL  24   4.149   0.587  -6.278
  223    H    CYS  25           H        CYS  25  -0.684   0.820  -5.759
  224    HA   CYS  25           HA       CYS  25  -2.016  -1.752  -6.075
  225    HB2  CYS  25           2HB      CYS  25  -1.702   0.422  -3.989
  226    HB3  CYS  25           3HB      CYS  25  -2.674  -0.982  -3.733
  227    H    LYS  26           H        LYS  26  -2.760   1.345  -7.106
  228    HA   LYS  26           HA       LYS  26  -4.606   2.497  -7.720
  229    HB2  LYS  26           2HB      LYS  26  -5.491  -0.325  -8.391
  230    HB3  LYS  26           3HB      LYS  26  -6.347   1.122  -8.945
  231    HG2  LYS  26           2HG      LYS  26  -3.366   0.774  -9.400
  232    HG3  LYS  26           3HG      LYS  26  -4.549   0.083 -10.515
  233    HD2  LYS  26           2HD      LYS  26  -5.346   2.196 -11.204
  234    HD3  LYS  26           3HD      LYS  26  -4.650   3.044  -9.810
  235    HE2  LYS  26           2HE      LYS  26  -2.390   2.621 -10.570
  236    HE3  LYS  26           3HE      LYS  26  -2.976   1.637 -11.923
  237    HZ1  LYS  26           HZ1      LYS  26  -4.049   3.630 -12.827
  238    HZ2  LYS  26           HZ2      LYS  26  -3.514   4.545 -11.584
  239    HZ3  LYS  26           HZ3      LYS  26  -2.453   3.899 -12.645
  240    H    CYS  27           H        CYS  27  -4.515   2.903  -5.495
  241    HA   CYS  27           HA       CYS  27  -6.737   1.971  -3.790
  242    HB2  CYS  27           2HB      CYS  27  -4.471   3.886  -3.124
  243    HB3  CYS  27           3HB      CYS  27  -5.578   3.127  -2.007
  Start of MODEL   43
    1    H1   GLY   1           1H       GLY   1   9.893 -10.096   3.621
    2    H2   GLY   1           2H       GLY   1  10.484  -9.218   2.373
    3    H3   GLY   1           3H       GLY   1  10.759  -8.735   3.914
    4    HA2  GLY   1           HA2      GLY   1   8.419  -8.310   4.271
    5    HA3  GLY   1           HA3      GLY   1   9.065  -7.350   2.928
    6    H    LEU   2           H        LEU   2   6.377  -7.725   3.069
    7    HA   LEU   2           HA       LEU   2   5.453 -10.003   1.525
    8    HB2  LEU   2           2HB      LEU   2   4.144  -7.376   2.317
    9    HB3  LEU   2           3HB      LEU   2   3.296  -8.666   1.472
   10    HG   LEU   2           HG       LEU   2   4.538  -8.937   4.247
   11   HD11  LEU   2          1HD1      LEU   2   2.637  -7.381   4.230
   12   HD12  LEU   2          2HD1      LEU   2   1.639  -8.579   3.381
   13   HD13  LEU   2          3HD1      LEU   2   2.201  -8.893   5.037
   14   HD21  LEU   2          3HD2      LEU   2   3.145 -11.005   4.359
   15   HD22  LEU   2          1HD2      LEU   2   2.727 -10.800   2.645
   16   HD23  LEU   2          2HD2      LEU   2   4.408 -11.117   3.132
   17    HA   PRO   3           HA       PRO   3   6.019  -8.175  -2.570
   18    HB2  PRO   3           2HB      PRO   3   4.412  -9.759  -4.082
   19    HB3  PRO   3           3HB      PRO   3   5.913 -10.384  -3.329
   20    HG2  PRO   3           2HG      PRO   3   3.072 -10.614  -2.283
   21    HG3  PRO   3           3HG      PRO   3   4.289 -11.918  -2.462
   22    HD2  PRO   3           2HD      PRO   3   3.862 -10.598  -0.097
   23    HD3  PRO   3           3HD      PRO   3   5.485 -11.186  -0.569
   24    H    ARG   4           H        ARG   4   4.837  -6.859  -4.053
   25    HA   ARG   4           HA       ARG   4   3.111  -4.989  -2.947
   26    HB2  ARG   4           2HB      ARG   4   3.519  -5.807  -5.856
   27    HB3  ARG   4           3HB      ARG   4   2.558  -4.400  -5.382
   28    HG2  ARG   4           2HG      ARG   4   4.453  -3.341  -4.319
   29    HG3  ARG   4           3HG      ARG   4   5.483  -4.761  -4.594
   30    HD2  ARG   4           2HD      ARG   4   5.395  -4.471  -6.988
   31    HD3  ARG   4           3HD      ARG   4   4.147  -3.222  -6.848
   32    HE   ARG   4           HE       ARG   4   6.507  -2.460  -5.379
   33   HH11  ARG   4          1HH2      ARG   4   5.383  -2.640  -8.694
   34   HH12  ARG   4          2HH2      ARG   4   6.423  -1.343  -9.213
   35   HH21  ARG   4          1HH1      ARG   4   7.811  -0.817  -6.110
   36   HH22  ARG   4          2HH1      ARG   4   7.762  -0.345  -7.784
   37    H    LYS   5           H        LYS   5   2.044  -7.822  -4.809
   38    HA   LYS   5           HA       LYS   5  -0.736  -7.099  -4.863
   39    HB2  LYS   5           2HB      LYS   5  -1.123  -9.295  -5.763
   40    HB3  LYS   5           3HB      LYS   5   0.328  -8.606  -6.488
   41    HG2  LYS   5           2HG      LYS   5   1.723  -9.997  -4.901
   42    HG3  LYS   5           3HG      LYS   5   0.223 -10.727  -4.298
   43    HD2  LYS   5           2HD      LYS   5  -0.294 -11.564  -6.570
   44    HD3  LYS   5           3HD      LYS   5   1.213 -10.843  -7.178
   45    HE2  LYS   5           2HE      LYS   5   2.520 -12.253  -5.600
   46    HE3  LYS   5           3HE      LYS   5   1.021 -12.968  -4.991
   47    HZ1  LYS   5           HZ1      LYS   5   1.999 -13.194  -7.790
   48    HZ2  LYS   5           HZ2      LYS   5   2.053 -14.381  -6.674
   49    HZ3  LYS   5           HZ3      LYS   5   0.613 -13.853  -7.228
   50    H    ILE   6           H        ILE   6   1.103  -8.483  -2.299
   51    HA   ILE   6           HA       ILE   6  -1.382  -9.188  -0.777
   52    HB   ILE   6           HB       ILE   6   1.520  -9.834  -0.145
   53   HG12  ILE   6          2HG1      ILE   6  -0.752 -11.623  -1.142
   54   HG13  ILE   6          3HG1      ILE   6   0.649 -11.119  -2.083
   55   HG21  ILE   6          1HG2      ILE   6   0.121  -9.507   1.877
   56   HG22  ILE   6          2HG2      ILE   6  -1.086 -10.635   1.235
   57   HG23  ILE   6          3HG2      ILE   6   0.537 -11.202   1.690
   58   HD11  ILE   6          3HD1      ILE   6   0.677 -12.985   0.303
   59   HD12  ILE   6          1HD1      ILE   6   1.056 -13.346  -1.386
   60   HD13  ILE   6          2HD1      ILE   6   2.141 -12.303  -0.448
   61    H    LEU   7           H        LEU   7   1.632  -7.244  -0.569
   62    HA   LEU   7           HA       LEU   7   1.128  -5.982   1.896
   63    HB2  LEU   7           2HB      LEU   7   3.244  -6.069   0.586
   64    HB3  LEU   7           3HB      LEU   7   2.587  -4.953  -0.583
   65    HG   LEU   7           HG       LEU   7   4.248  -4.065   1.077
   66   HD11  LEU   7          1HD1      LEU   7   3.292  -1.918   1.294
   67   HD12  LEU   7          2HD1      LEU   7   2.675  -2.608  -0.218
   68   HD13  LEU   7          3HD1      LEU   7   1.639  -2.528   1.224
   69   HD21  LEU   7          3HD2      LEU   7   1.954  -4.139   3.075
   70   HD22  LEU   7          1HD2      LEU   7   3.389  -5.191   3.113
   71   HD23  LEU   7          2HD2      LEU   7   3.565  -3.441   3.312
   72    H    CYS   8           H        CYS   8  -0.094  -5.148  -1.351
   73    HA   CYS   8           HA       CYS   8  -1.279  -2.643  -0.570
   74    HB2  CYS   8           2HB      CYS   8  -0.789  -3.280  -2.892
   75    HB3  CYS   8           3HB      CYS   8  -2.061  -4.501  -2.835
   76    H    ALA   9           H        ALA   9  -2.376  -5.968  -0.116
   77    HA   ALA   9           HA       ALA   9  -5.164  -5.230   0.419
   78    HB1  ALA   9           3HB      ALA   9  -5.437  -7.541   1.055
   79    HB2  ALA   9           1HB      ALA   9  -4.507  -7.469  -0.455
   80    HB3  ALA   9           2HB      ALA   9  -3.684  -7.802   1.090
   81    H    ILE  10           H        ILE  10  -2.186  -5.234   2.215
   82    HA   ILE  10           HA       ILE  10  -3.488  -4.795   4.830
   83    HB   ILE  10           HB       ILE  10  -0.605  -4.246   4.038
   84   HG12  ILE  10          2HG1      ILE  10  -1.004  -6.590   3.521
   85   HG13  ILE  10          3HG1      ILE  10   0.046  -6.405   4.892
   86   HG21  ILE  10          1HG2      ILE  10  -1.266  -3.140   6.088
   87   HG22  ILE  10          2HG2      ILE  10  -1.945  -4.648   6.735
   88   HG23  ILE  10          3HG2      ILE  10  -0.194  -4.495   6.468
   89   HD11  ILE  10          3HD1      ILE  10  -2.922  -7.123   5.040
   90   HD12  ILE  10          1HD1      ILE  10  -1.560  -8.243   5.217
   91   HD13  ILE  10          2HD1      ILE  10  -1.822  -6.984   6.435
   92    H    ALA  11           H        ALA  11  -1.744  -2.875   2.341
   93    HA   ALA  11           HA       ALA  11  -1.909  -0.365   3.492
   94    HB1  ALA  11           3HB      ALA  11  -0.663  -1.067   1.381
   95    HB2  ALA  11           1HB      ALA  11  -2.211  -0.907   0.504
   96    HB3  ALA  11           2HB      ALA  11  -1.470   0.499   1.286
   97    H    LYS  12           H        LYS  12  -4.401  -1.903   1.432
   98    HA   LYS  12           HA       LYS  12  -6.231   0.355   1.571
   99    HB2  LYS  12           2HB      LYS  12  -6.565  -2.517   0.635
  100    HB3  LYS  12           3HB      LYS  12  -7.800  -1.258   0.449
  101    HG2  LYS  12           2HG      LYS  12  -6.248   0.140  -0.856
  102    HG3  LYS  12           3HG      LYS  12  -4.971  -1.057  -0.698
  103    HD2  LYS  12           2HD      LYS  12  -7.589  -1.380  -2.197
  104    HD3  LYS  12           3HD      LYS  12  -5.959  -1.203  -2.872
  105    HE2  LYS  12           2HE      LYS  12  -5.299  -3.359  -1.790
  106    HE3  LYS  12           3HE      LYS  12  -6.963  -3.563  -1.225
  107    HZ1  LYS  12           HZ1      LYS  12  -6.157  -3.388  -4.083
  108    HZ2  LYS  12           HZ2      LYS  12  -6.595  -4.757  -3.309
  109    HZ3  LYS  12           HZ3      LYS  12  -7.690  -3.574  -3.550
  110    H    LYS  13           H        LYS  13  -5.892  -2.545   3.580
  111    HA   LYS  13           HA       LYS  13  -8.383  -2.104   5.062
  112    HB2  LYS  13           2HB      LYS  13  -5.888  -3.757   5.604
  113    HB3  LYS  13           3HB      LYS  13  -7.214  -3.623   6.766
  114    HG2  LYS  13           2HG      LYS  13  -8.816  -4.509   5.139
  115    HG3  LYS  13           3HG      LYS  13  -7.548  -4.606   3.908
  116    HD2  LYS  13           2HD      LYS  13  -6.280  -6.198   5.419
  117    HD3  LYS  13           3HD      LYS  13  -7.618  -6.107   6.570
  118    HE2  LYS  13           2HE      LYS  13  -7.900  -8.122   5.319
  119    HE3  LYS  13           3HE      LYS  13  -9.165  -6.999   4.810
  120    HZ1  LYS  13           HZ1      LYS  13  -6.628  -7.479   3.337
  121    HZ2  LYS  13           HZ2      LYS  13  -8.079  -8.113   2.918
  122    HZ3  LYS  13           HZ3      LYS  13  -7.831  -6.498   2.836
  123    H    LYS  14           H        LYS  14  -4.989  -1.174   5.621
  124    HA   LYS  14           HA       LYS  14  -5.621   0.227   8.134
  125    HB2  LYS  14           2HB      LYS  14  -3.124  -0.222   6.474
  126    HB3  LYS  14           3HB      LYS  14  -3.146   1.024   7.712
  127    HG2  LYS  14           2HG      LYS  14  -2.196  -1.012   8.591
  128    HG3  LYS  14           3HG      LYS  14  -3.659  -0.543   9.460
  129    HD2  LYS  14           2HD      LYS  14  -4.943  -2.323   8.346
  130    HD3  LYS  14           3HD      LYS  14  -3.564  -2.692   7.303
  131    HE2  LYS  14           2HE      LYS  14  -3.644  -4.362   9.010
  132    HE3  LYS  14           3HE      LYS  14  -2.229  -3.347   9.298
  133    HZ1  LYS  14           HZ1      LYS  14  -3.496  -2.195  11.038
  134    HZ2  LYS  14           HZ2      LYS  14  -4.821  -3.110  10.745
  135    HZ3  LYS  14           HZ3      LYS  14  -3.470  -3.794  11.347
  136    H    GLY  15           H        GLY  15  -5.501   1.193   4.792
  137    HA2  GLY  15           HA2      GLY  15  -6.355   3.212   3.896
  138    HA3  GLY  15           HA3      GLY  15  -6.271   3.988   5.485
  139    H    LYS  16           H        LYS  16  -3.546   2.128   4.540
  140    HA   LYS  16           HA       LYS  16  -1.773   4.473   4.474
  141    HB2  LYS  16           2HB      LYS  16  -1.450   1.458   4.677
  142    HB3  LYS  16           3HB      LYS  16  -0.058   2.478   4.442
  143    HG2  LYS  16           2HG      LYS  16  -1.925   3.123   6.734
  144    HG3  LYS  16           3HG      LYS  16  -0.880   1.713   6.849
  145    HD2  LYS  16           2HD      LYS  16   0.171   3.595   7.929
  146    HD3  LYS  16           3HD      LYS  16   1.124   3.067   6.538
  147    HE2  LYS  16           2HE      LYS  16   0.238   4.942   5.193
  148    HE3  LYS  16           3HE      LYS  16  -0.788   5.446   6.548
  149    HZ1  LYS  16           HZ1      LYS  16   1.269   6.739   6.459
  150    HZ2  LYS  16           HZ2      LYS  16   1.240   5.865   7.834
  151    HZ3  LYS  16           HZ3      LYS  16   2.185   5.395   6.587
  152    H    CYS  17           H        CYS  17  -3.480   2.906   2.031
  153    HA   CYS  17           HA       CYS  17  -1.326   2.897   0.079
  154    HB2  CYS  17           2HB      CYS  17  -3.337   1.357   0.089
  155    HB3  CYS  17           3HB      CYS  17  -4.258   2.737  -0.539
  156    H    LYS  18           H        LYS  18  -0.557   4.924   0.306
  157    HA   LYS  18           HA       LYS  18  -1.907   7.101  -1.248
  158    HB2  LYS  18           2HB      LYS  18  -0.398   7.437   1.384
  159    HB3  LYS  18           3HB      LYS  18  -0.942   8.751   0.337
  160    HG2  LYS  18           2HG      LYS  18  -3.317   7.904   0.627
  161    HG3  LYS  18           3HG      LYS  18  -2.703   6.785   1.862
  162    HD2  LYS  18           2HD      LYS  18  -1.836   8.730   3.172
  163    HD3  LYS  18           3HD      LYS  18  -2.408   9.820   1.906
  164    HE2  LYS  18           2HE      LYS  18  -4.076   9.979   3.513
  165    HE3  LYS  18           3HE      LYS  18  -4.760   8.892   2.304
  166    HZ1  LYS  18           HZ1      LYS  18  -4.157   7.013   3.788
  167    HZ2  LYS  18           HZ2      LYS  18  -3.507   8.051   4.872
  168    HZ3  LYS  18           HZ3      LYS  18  -5.106   8.077   4.571
  169    H    GLY  19           H        GLY  19  -0.363   8.715  -2.080
  170    HA2  GLY  19           HA2      GLY  19   1.488   9.248  -3.368
  171    HA3  GLY  19           HA3      GLY  19   2.405   8.525  -2.053
  172    HA   PRO  20           HA       PRO  20   3.757   5.947  -5.561
  173    HB2  PRO  20           2HB      PRO  20   5.174   4.532  -3.296
  174    HB3  PRO  20           3HB      PRO  20   5.794   4.970  -4.920
  175    HG2  PRO  20           2HG      PRO  20   6.449   6.485  -2.780
  176    HG3  PRO  20           3HG      PRO  20   5.951   7.285  -4.308
  177    HD2  PRO  20           2HD      PRO  20   4.274   6.746  -1.838
  178    HD3  PRO  20           3HD      PRO  20   4.415   8.244  -2.805
  179    H    LEU  21           H        LEU  21   2.565   4.509  -2.464
  180    HA   LEU  21           HA       LEU  21   2.096   1.902  -3.552
  181    HB2  LEU  21           2HB      LEU  21   1.987   3.086  -1.028
  182    HB3  LEU  21           3HB      LEU  21   0.299   2.809  -1.359
  183    HG   LEU  21           HG       LEU  21   1.151   0.979  -0.094
  184   HD11  LEU  21          1HD1      LEU  21  -0.417   0.261  -1.869
  185   HD12  LEU  21          2HD1      LEU  21   0.954  -0.058  -2.952
  186   HD13  LEU  21          3HD1      LEU  21   0.758  -0.992  -1.458
  187   HD21  LEU  21          3HD2      LEU  21   3.541   1.295  -0.628
  188   HD22  LEU  21          1HD2      LEU  21   3.033  -0.392  -0.736
  189   HD23  LEU  21          2HD2      LEU  21   3.283   0.544  -2.221
  190    H    LYS  22           H        LYS  22   0.074   4.760  -3.380
  191    HA   LYS  22           HA       LYS  22  -2.398   3.619  -4.426
  192    HB2  LYS  22           2HB      LYS  22  -2.380   5.630  -3.067
  193    HB3  LYS  22           3HB      LYS  22  -1.358   6.476  -4.231
  194    HG2  LYS  22           2HG      LYS  22  -3.139   6.385  -5.921
  195    HG3  LYS  22           3HG      LYS  22  -4.179   5.474  -4.818
  196    HD2  LYS  22           2HD      LYS  22  -3.034   8.218  -4.163
  197    HD3  LYS  22           3HD      LYS  22  -4.552   8.032  -5.036
  198    HE2  LYS  22           2HE      LYS  22  -4.134   6.671  -2.351
  199    HE3  LYS  22           3HE      LYS  22  -4.582   8.378  -2.437
  200    HZ1  LYS  22           HZ1      LYS  22  -6.521   6.879  -2.275
  201    HZ2  LYS  22           HZ2      LYS  22  -6.572   7.787  -3.630
  202    HZ3  LYS  22           HZ3      LYS  22  -6.168   6.213  -3.731
  203    H    LEU  23           H        LEU  23   0.401   5.294  -5.911
  204    HA   LEU  23           HA       LEU  23  -0.622   5.232  -8.594
  205    HB2  LEU  23           2HB      LEU  23   1.150   6.717  -7.751
  206    HB3  LEU  23           3HB      LEU  23   2.231   5.363  -7.519
  207    HG   LEU  23           HG       LEU  23   2.664   6.847  -9.479
  208   HD11  LEU  23          1HD1      LEU  23   3.583   4.534  -9.339
  209   HD12  LEU  23          2HD1      LEU  23   2.231   3.972 -10.350
  210   HD13  LEU  23          3HD1      LEU  23   3.380   5.154 -10.985
  211   HD21  LEU  23          3HD2      LEU  23   0.290   5.469 -10.784
  212   HD22  LEU  23          1HD2      LEU  23   0.316   7.159 -10.219
  213   HD23  LEU  23          2HD2      LEU  23   1.400   6.639 -11.522
  214    H    VAL  24           H        VAL  24   1.449   2.951  -6.795
  215    HA   VAL  24           HA       VAL  24   1.876   1.053  -8.887
  216    HB   VAL  24           HB       VAL  24   1.959   0.882  -5.856
  217   HG11  VAL  24          1HG1      VAL  24   1.596  -1.423  -6.581
  218   HG12  VAL  24          2HG1      VAL  24   2.867  -1.260  -7.817
  219   HG13  VAL  24          3HG1      VAL  24   3.269  -1.197  -6.083
  220   HG21  VAL  24          3HG2      VAL  24   3.664   2.300  -7.093
  221   HG22  VAL  24          1HG2      VAL  24   4.343   0.992  -6.126
  222   HG23  VAL  24          2HG2      VAL  24   4.220   0.828  -7.899
  223    H    CYS  25           H        CYS  25  -0.610   1.105  -6.306
  224    HA   CYS  25           HA       CYS  25  -1.776  -1.393  -7.399
  225    HB2  CYS  25           2HB      CYS  25  -0.929  -1.095  -5.054
  226    HB3  CYS  25           3HB      CYS  25  -2.266   0.006  -4.767
  227    H    LYS  26           H        LYS  26  -2.513   1.908  -7.516
  228    HA   LYS  26           HA       LYS  26  -4.295   3.192  -8.046
  229    HB2  LYS  26           2HB      LYS  26  -5.088   0.726  -9.609
  230    HB3  LYS  26           3HB      LYS  26  -5.905   2.286  -9.764
  231    HG2  LYS  26           2HG      LYS  26  -2.893   2.052 -10.048
  232    HG3  LYS  26           3HG      LYS  26  -3.972   1.738 -11.413
  233    HD2  LYS  26           2HD      LYS  26  -4.766   3.993 -11.459
  234    HD3  LYS  26           3HD      LYS  26  -4.142   4.342  -9.850
  235    HE2  LYS  26           2HE      LYS  26  -2.708   5.421 -11.420
  236    HE3  LYS  26           3HE      LYS  26  -1.830   4.107 -10.633
  237    HZ1  LYS  26           HZ1      LYS  26  -3.041   3.948 -13.348
  238    HZ2  LYS  26           HZ2      LYS  26  -1.452   4.152 -13.048
  239    HZ3  LYS  26           HZ3      LYS  26  -2.181   2.756 -12.628
  240    H    CYS  27           H        CYS  27  -4.411   2.948  -5.802
  241    HA   CYS  27           HA       CYS  27  -6.738   1.663  -4.560
  242    HB2  CYS  27           2HB      CYS  27  -4.609   3.534  -3.434
  243    HB3  CYS  27           3HB      CYS  27  -5.884   2.815  -2.502
  Start of MODEL   44
    1    H1   GLY   1           1H       GLY   1   8.986  -4.521   4.791
    2    H2   GLY   1           2H       GLY   1   8.584  -4.576   3.203
    3    H3   GLY   1           3H       GLY   1   7.482  -4.081   4.307
    4    HA2  GLY   1           HA2      GLY   1   8.605  -6.798   4.115
    5    HA3  GLY   1           HA3      GLY   1   7.428  -6.264   5.329
    6    H    LEU   2           H        LEU   2   7.226  -8.359   3.324
    7    HA   LEU   2           HA       LEU   2   5.890  -9.344   1.865
    8    HB2  LEU   2           2HB      LEU   2   3.943  -7.256   2.838
    9    HB3  LEU   2           3HB      LEU   2   3.521  -8.299   1.502
   10    HG   LEU   2           HG       LEU   2   3.800 -10.301   2.850
   11   HD11  LEU   2          1HD1      LEU   2   4.027 -10.127   5.335
   12   HD12  LEU   2          2HD1      LEU   2   5.506  -9.690   4.481
   13   HD13  LEU   2          3HD1      LEU   2   4.459  -8.412   5.152
   14   HD21  LEU   2          3HD2      LEU   2   1.636  -9.063   2.784
   15   HD22  LEU   2          1HD2      LEU   2   1.857  -9.955   4.297
   16   HD23  LEU   2          2HD2      LEU   2   2.105  -8.195   4.258
   17    HA   PRO   3           HA       PRO   3   6.437  -7.442  -2.139
   18    HB2  PRO   3           2HB      PRO   3   5.121  -9.146  -3.785
   19    HB3  PRO   3           3HB      PRO   3   6.609  -9.635  -2.918
   20    HG2  PRO   3           2HG      PRO   3   3.733 -10.155  -2.113
   21    HG3  PRO   3           3HG      PRO   3   5.081 -11.332  -2.197
   22    HD2  PRO   3           2HD      PRO   3   4.326 -10.093   0.130
   23    HD3  PRO   3           3HD      PRO   3   6.032 -10.524  -0.203
   24    H    ARG   4           H        ARG   4   5.304  -6.100  -3.570
   25    HA   ARG   4           HA       ARG   4   3.219  -4.592  -2.467
   26    HB2  ARG   4           2HB      ARG   4   4.232  -4.780  -5.323
   27    HB3  ARG   4           3HB      ARG   4   3.016  -3.602  -4.803
   28    HG2  ARG   4           2HG      ARG   4   4.517  -2.641  -3.155
   29    HG3  ARG   4           3HG      ARG   4   5.749  -3.871  -3.486
   30    HD2  ARG   4           2HD      ARG   4   5.919  -3.033  -5.829
   31    HD3  ARG   4           3HD      ARG   4   4.782  -1.744  -5.442
   32    HE   ARG   4           HE       ARG   4   7.569  -2.062  -4.476
   33   HH11  ARG   4          1HH2      ARG   4   4.686  -0.089  -4.240
   34   HH12  ARG   4          2HH2      ARG   4   5.558   1.253  -3.545
   35   HH21  ARG   4          2HH1      ARG   4   8.614  -0.308  -3.625
   36   HH22  ARG   4          1HH1      ARG   4   7.723   1.122  -3.204
   37    H    LYS   5           H        LYS   5   2.855  -7.272  -4.735
   38    HA   LYS   5           HA       LYS   5   0.059  -6.881  -5.289
   39    HB2  LYS   5           2HB      LYS   5   0.123  -9.039  -6.324
   40    HB3  LYS   5           3HB      LYS   5   1.590  -8.154  -6.736
   41    HG2  LYS   5           2HG      LYS   5   2.800  -9.455  -4.914
   42    HG3  LYS   5           3HG      LYS   5   1.334 -10.421  -4.707
   43    HD2  LYS   5           2HD      LYS   5   2.938 -10.189  -7.287
   44    HD3  LYS   5           3HD      LYS   5   3.045 -11.518  -6.124
   45    HE2  LYS   5           2HE      LYS   5   0.633 -12.028  -6.482
   46    HE3  LYS   5           3HE      LYS   5   0.540 -10.730  -7.681
   47    HZ1  LYS   5           HZ1      LYS   5   2.275 -13.134  -7.908
   48    HZ2  LYS   5           HZ2      LYS   5   0.895 -12.883  -8.741
   49    HZ3  LYS   5           HZ3      LYS   5   2.192 -11.932  -9.014
   50    H    ILE   6           H        ILE   6   1.586  -8.227  -2.494
   51    HA   ILE   6           HA       ILE   6  -1.034  -9.257  -1.464
   52    HB   ILE   6           HB       ILE   6   1.752  -9.636  -0.311
   53   HG12  ILE   6          2HG1      ILE   6  -0.023 -11.591  -1.854
   54   HG13  ILE   6          3HG1      ILE   6   1.465 -10.861  -2.452
   55   HG21  ILE   6          1HG2      ILE   6  -0.126  -9.641   1.370
   56   HG22  ILE   6          2HG2      ILE   6  -0.916 -10.926   0.441
   57   HG23  ILE   6          3HG2      ILE   6   0.654 -11.208   1.231
   58   HD11  ILE   6          3HD1      ILE   6   1.241 -12.886  -0.211
   59   HD12  ILE   6          1HD1      ILE   6   2.005 -13.070  -1.797
   60   HD13  ILE   6          2HD1      ILE   6   2.730 -11.984  -0.595
   61    H    LEU   7           H        LEU   7   1.683  -7.058  -0.655
   62    HA   LEU   7           HA       LEU   7   0.665  -6.009   1.739
   63    HB2  LEU   7           2HB      LEU   7   2.964  -5.881   0.788
   64    HB3  LEU   7           3HB      LEU   7   2.428  -4.692  -0.374
   65    HG   LEU   7           HG       LEU   7   3.769  -3.923   1.621
   66   HD11  LEU   7          1HD1      LEU   7   1.121  -2.480   1.344
   67   HD12  LEU   7          2HD1      LEU   7   2.673  -1.821   1.871
   68   HD13  LEU   7          3HD1      LEU   7   2.475  -2.360   0.197
   69   HD21  LEU   7          3HD2      LEU   7   1.162  -4.186   3.160
   70   HD22  LEU   7          1HD2      LEU   7   2.585  -5.238   3.365
   71   HD23  LEU   7          2HD2      LEU   7   2.696  -3.511   3.739
   72    H    CYS   8           H        CYS   8  -0.224  -5.160  -1.570
   73    HA   CYS   8           HA       CYS   8  -1.696  -2.771  -1.176
   74    HB2  CYS   8           2HB      CYS   8  -1.150  -3.657  -3.338
   75    HB3  CYS   8           3HB      CYS   8  -2.078  -5.123  -3.049
   76    H    ALA   9           H        ALA   9  -2.681  -6.127  -0.379
   77    HA   ALA   9           HA       ALA   9  -5.467  -5.651   0.052
   78    HB1  ALA   9           3HB      ALA   9  -4.328  -7.898  -0.028
   79    HB2  ALA   9           1HB      ALA   9  -3.564  -7.532   1.545
   80    HB3  ALA   9           2HB      ALA   9  -5.328  -7.678   1.426
   81    H    ILE  10           H        ILE  10  -2.619  -5.123   2.033
   82    HA   ILE  10           HA       ILE  10  -4.097  -4.478   4.484
   83    HB   ILE  10           HB       ILE  10  -1.116  -4.414   3.875
   84   HG12  ILE  10          2HG1      ILE  10  -2.760  -6.665   5.132
   85   HG13  ILE  10          3HG1      ILE  10  -2.164  -6.684   3.480
   86   HG21  ILE  10          1HG2      ILE  10  -1.792  -3.088   5.873
   87   HG22  ILE  10          2HG2      ILE  10  -2.603  -4.526   6.536
   88   HG23  ILE  10          3HG2      ILE  10  -0.840  -4.504   6.318
   89   HD11  ILE  10          3HD1      ILE  10  -0.722  -8.021   4.718
   90   HD12  ILE  10          1HD1      ILE  10   0.159  -6.555   4.256
   91   HD13  ILE  10          2HD1      ILE  10  -0.423  -6.757   5.935
   92    H    ALA  11           H        ALA  11  -2.010  -2.809   2.103
   93    HA   ALA  11           HA       ALA  11  -2.010  -0.206   3.089
   94    HB1  ALA  11           3HB      ALA  11  -0.854  -1.249   1.022
   95    HB2  ALA  11           1HB      ALA  11  -2.361  -0.909   0.134
   96    HB3  ALA  11           2HB      ALA  11  -1.422   0.411   0.864
   97    H    LYS  12           H        LYS  12  -4.348  -1.608   0.830
   98    HA   LYS  12           HA       LYS  12  -6.182   0.545   0.745
   99    HB2  LYS  12           2HB      LYS  12  -5.611  -1.370  -0.836
  100    HB3  LYS  12           3HB      LYS  12  -6.715  -2.382   0.089
  101    HG2  LYS  12           2HG      LYS  12  -8.568  -1.364  -0.840
  102    HG3  LYS  12           3HG      LYS  12  -7.826   0.240  -0.840
  103    HD2  LYS  12           2HD      LYS  12  -8.130  -0.509  -3.138
  104    HD3  LYS  12           3HD      LYS  12  -6.399  -0.368  -2.755
  105    HE2  LYS  12           2HE      LYS  12  -6.136  -2.744  -2.539
  106    HE3  LYS  12           3HE      LYS  12  -7.889  -3.016  -2.595
  107    HZ1  LYS  12           HZ1      LYS  12  -6.287  -1.922  -4.852
  108    HZ2  LYS  12           HZ2      LYS  12  -6.825  -3.467  -4.749
  109    HZ3  LYS  12           HZ3      LYS  12  -7.890  -2.236  -4.891
  110    H    LYS  13           H        LYS  13  -6.164  -2.265   2.927
  111    HA   LYS  13           HA       LYS  13  -8.774  -1.584   4.101
  112    HB2  LYS  13           2HB      LYS  13  -6.575  -3.540   4.850
  113    HB3  LYS  13           3HB      LYS  13  -7.990  -3.266   5.876
  114    HG2  LYS  13           2HG      LYS  13  -9.516  -3.899   4.080
  115    HG3  LYS  13           3HG      LYS  13  -8.172  -4.109   2.951
  116    HD2  LYS  13           2HD      LYS  13  -7.249  -5.916   4.416
  117    HD3  LYS  13           3HD      LYS  13  -8.640  -5.715   5.506
  118    HE2  LYS  13           2HE      LYS  13 -10.176  -6.248   3.612
  119    HE3  LYS  13           3HE      LYS  13  -8.778  -6.474   2.551
  120    HZ1  LYS  13           HZ1      LYS  13  -9.571  -8.594   3.434
  121    HZ2  LYS  13           HZ2      LYS  13  -8.066  -8.309   3.999
  122    HZ3  LYS  13           HZ3      LYS  13  -9.362  -8.099   4.973
  123    H    LYS  14           H        LYS  14  -5.399  -0.900   5.004
  124    HA   LYS  14           HA       LYS  14  -6.234   0.470   7.492
  125    HB2  LYS  14           2HB      LYS  14  -3.570  -0.270   6.252
  126    HB3  LYS  14           3HB      LYS  14  -3.651   0.912   7.536
  127    HG2  LYS  14           2HG      LYS  14  -3.133  -1.248   8.450
  128    HG3  LYS  14           3HG      LYS  14  -4.665  -0.638   9.074
  129    HD2  LYS  14           2HD      LYS  14  -5.920  -2.208   7.658
  130    HD3  LYS  14           3HD      LYS  14  -4.427  -2.704   6.849
  131    HE2  LYS  14           2HE      LYS  14  -4.997  -4.412   8.421
  132    HE3  LYS  14           3HE      LYS  14  -3.554  -3.584   9.008
  133    HZ1  LYS  14           HZ1      LYS  14  -6.322  -3.089   9.988
  134    HZ2  LYS  14           HZ2      LYS  14  -5.187  -3.949  10.779
  135    HZ3  LYS  14           HZ3      LYS  14  -4.980  -2.349  10.560
  136    H    GLY  15           H        GLY  15  -5.868   1.512   4.267
  137    HA2  GLY  15           HA2      GLY  15  -5.945   3.644   3.343
  138    HA3  GLY  15           HA3      GLY  15  -6.143   4.347   4.956
  139    H    LYS  16           H        LYS  16  -3.551   2.198   3.825
  140    HA   LYS  16           HA       LYS  16  -1.477   4.264   4.492
  141    HB2  LYS  16           2HB      LYS  16  -1.657   2.219   5.956
  142    HB3  LYS  16           3HB      LYS  16  -1.177   1.237   4.569
  143    HG2  LYS  16           2HG      LYS  16   1.008   2.344   4.492
  144    HG3  LYS  16           3HG      LYS  16   0.480   3.545   5.678
  145    HD2  LYS  16           2HD      LYS  16   1.929   1.939   6.745
  146    HD3  LYS  16           3HD      LYS  16   0.294   1.771   7.398
  147    HE2  LYS  16           2HE      LYS  16  -0.095  -0.202   5.946
  148    HE3  LYS  16           3HE      LYS  16   1.508   0.001   5.224
  149    HZ1  LYS  16           HZ1      LYS  16   1.536  -1.674   6.988
  150    HZ2  LYS  16           HZ2      LYS  16   2.478  -0.414   7.420
  151    HZ3  LYS  16           HZ3      LYS  16   1.002  -0.597   8.093
  152    H    CYS  17           H        CYS  17  -3.027   2.990   1.966
  153    HA   CYS  17           HA       CYS  17  -0.899   2.769  -0.018
  154    HB2  CYS  17           2HB      CYS  17  -2.926   2.793  -1.518
  155    HB3  CYS  17           3HB      CYS  17  -2.801   1.473  -0.456
  156    H    LYS  18           H        LYS  18   0.279   4.589  -0.083
  157    HA   LYS  18           HA       LYS  18  -0.919   7.058  -1.185
  158    HB2  LYS  18           2HB      LYS  18   0.148   8.496   0.484
  159    HB3  LYS  18           3HB      LYS  18  -1.033   7.424   1.227
  160    HG2  LYS  18           2HG      LYS  18   0.796   5.917   1.985
  161    HG3  LYS  18           3HG      LYS  18   1.995   7.008   1.281
  162    HD2  LYS  18           2HD      LYS  18   0.025   7.724   3.501
  163    HD3  LYS  18           3HD      LYS  18   1.717   7.264   3.738
  164    HE2  LYS  18           2HE      LYS  18   2.438   9.220   2.367
  165    HE3  LYS  18           3HE      LYS  18   0.747   9.708   2.187
  166    HZ1  LYS  18           HZ1      LYS  18   1.818  10.902   4.006
  167    HZ2  LYS  18           HZ2      LYS  18   0.630   9.960   4.609
  168    HZ3  LYS  18           HZ3      LYS  18   2.195   9.514   4.776
  169    H    GLY  19           H        GLY  19   0.764   8.654  -1.848
  170    HA2  GLY  19           HA2      GLY  19   2.493   9.104  -3.323
  171    HA3  GLY  19           HA3      GLY  19   3.462   7.994  -2.362
  172    HA   PRO  20           HA       PRO  20   3.212   5.915  -6.455
  173    HB2  PRO  20           2HB      PRO  20   5.197   4.060  -6.105
  174    HB3  PRO  20           3HB      PRO  20   5.511   5.783  -6.469
  175    HG2  PRO  20           2HG      PRO  20   5.518   4.427  -3.754
  176    HG3  PRO  20           3HG      PRO  20   6.759   5.521  -4.449
  177    HD2  PRO  20           2HD      PRO  20   4.847   6.418  -2.745
  178    HD3  PRO  20           3HD      PRO  20   5.395   7.425  -4.122
  179    H    LEU  21           H        LEU  21   3.024   4.311  -3.244
  180    HA   LEU  21           HA       LEU  21   2.104   1.790  -4.245
  181    HB2  LEU  21           2HB      LEU  21   3.045   2.152  -1.978
  182    HB3  LEU  21           3HB      LEU  21   1.614   3.096  -1.552
  183    HG   LEU  21           HG       LEU  21   0.178   1.105  -1.797
  184   HD11  LEU  21          1HD1      LEU  21   2.775  -0.398  -2.365
  185   HD12  LEU  21          2HD1      LEU  21   1.207  -1.150  -2.000
  186   HD13  LEU  21          3HD1      LEU  21   1.394  -0.213  -3.480
  187   HD21  LEU  21          3HD2      LEU  21   2.618   0.625  -0.051
  188   HD22  LEU  21          1HD2      LEU  21   1.216   1.633   0.371
  189   HD23  LEU  21          2HD2      LEU  21   1.016  -0.112   0.145
  190    H    LYS  22           H        LYS  22   0.388   4.799  -3.567
  191    HA   LYS  22           HA       LYS  22  -2.315   3.853  -3.713
  192    HB2  LYS  22           2HB      LYS  22  -1.266   6.243  -3.164
  193    HB3  LYS  22           3HB      LYS  22  -1.480   6.521  -4.888
  194    HG2  LYS  22           2HG      LYS  22  -3.927   5.762  -4.532
  195    HG3  LYS  22           3HG      LYS  22  -3.578   5.808  -2.802
  196    HD2  LYS  22           2HD      LYS  22  -4.501   7.918  -3.112
  197    HD3  LYS  22           3HD      LYS  22  -2.778   8.260  -3.243
  198    HE2  LYS  22           2HE      LYS  22  -3.662   9.409  -5.085
  199    HE3  LYS  22           3HE      LYS  22  -3.099   7.900  -5.810
  200    HZ1  LYS  22           HZ1      LYS  22  -5.895   8.599  -5.085
  201    HZ2  LYS  22           HZ2      LYS  22  -5.319   8.328  -6.586
  202    HZ3  LYS  22           HZ3      LYS  22  -5.482   7.089  -5.518
  203    H    LEU  23           H        LEU  23  -0.041   4.819  -6.223
  204    HA   LEU  23           HA       LEU  23  -1.832   4.314  -8.471
  205    HB2  LEU  23           2HB      LEU  23  -0.135   6.043  -8.472
  206    HB3  LEU  23           3HB      LEU  23   1.162   4.874  -8.300
  207    HG   LEU  23           HG       LEU  23  -0.696   4.641 -10.681
  208   HD11  LEU  23          1HD1      LEU  23   0.729   6.213 -11.945
  209   HD12  LEU  23          2HD1      LEU  23  -0.102   7.025 -10.611
  210   HD13  LEU  23          3HD1      LEU  23   1.621   6.610 -10.456
  211   HD21  LEU  23          3HD2      LEU  23   2.317   4.219 -10.341
  212   HD22  LEU  23          1HD2      LEU  23   1.107   2.924 -10.379
  213   HD23  LEU  23          2HD2      LEU  23   1.378   3.905 -11.816
  214    H    VAL  24           H        VAL  24   0.678   2.387  -6.819
  215    HA   VAL  24           HA       VAL  24   0.574   0.158  -8.680
  216    HB   VAL  24           HB       VAL  24   1.446   0.342  -5.782
  217   HG11  VAL  24          1HG1      VAL  24   1.813  -1.973  -7.726
  218   HG12  VAL  24          2HG1      VAL  24   2.666  -1.786  -6.180
  219   HG13  VAL  24          3HG1      VAL  24   0.921  -2.008  -6.185
  220   HG21  VAL  24          3HG2      VAL  24   2.805   1.630  -7.444
  221   HG22  VAL  24          1HG2      VAL  24   3.709   0.304  -6.712
  222   HG23  VAL  24          2HG2      VAL  24   3.059   0.139  -8.360
  223    H    CYS  25           H        CYS  25  -1.297   0.990  -5.782
  224    HA   CYS  25           HA       CYS  25  -2.627  -1.652  -5.781
  225    HB2  CYS  25           2HB      CYS  25  -1.412  -0.755  -3.830
  226    HB3  CYS  25           3HB      CYS  25  -2.518   0.609  -3.757
  227    H    LYS  26           H        LYS  26  -3.367   1.554  -6.712
  228    HA   LYS  26           HA       LYS  26  -5.210   2.695  -7.331
  229    HB2  LYS  26           2HB      LYS  26  -6.037  -0.102  -8.066
  230    HB3  LYS  26           3HB      LYS  26  -7.250   1.171  -8.084
  231    HG2  LYS  26           2HG      LYS  26  -6.306   1.028 -10.267
  232    HG3  LYS  26           3HG      LYS  26  -5.890   2.572  -9.510
  233    HD2  LYS  26           2HD      LYS  26  -4.075   1.735 -10.853
  234    HD3  LYS  26           3HD      LYS  26  -3.625   1.882  -9.155
  235    HE2  LYS  26           2HE      LYS  26  -3.791  -0.524  -8.834
  236    HE3  LYS  26           3HE      LYS  26  -4.495  -0.748 -10.443
  237    HZ1  LYS  26           HZ1      LYS  26  -1.805   0.430 -10.055
  238    HZ2  LYS  26           HZ2      LYS  26  -2.024  -1.189 -10.241
  239    HZ3  LYS  26           HZ3      LYS  26  -2.436  -0.154 -11.445
  240    H    CYS  27           H        CYS  27  -4.964   3.316  -5.200
  241    HA   CYS  27           HA       CYS  27  -7.441   3.021  -3.552
  242    HB2  CYS  27           2HB      CYS  27  -4.599   3.770  -2.941
  243    HB3  CYS  27           3HB      CYS  27  -5.864   4.516  -1.997
  Start of MODEL   45
    1    H1   GLY   1           1H       GLY   1  10.303  -7.554   4.774
    2    H2   GLY   1           2H       GLY   1  10.798  -6.589   3.550
    3    H3   GLY   1           3H       GLY   1  10.852  -6.044   5.095
    4    HA2  GLY   1           HA2      GLY   1   8.454  -6.097   5.269
    5    HA3  GLY   1           HA3      GLY   1   8.994  -5.043   3.950
    6    H    LEU   2           H        LEU   2   6.452  -5.872   3.830
    7    HA   LEU   2           HA       LEU   2   6.018  -8.352   2.422
    8    HB2  LEU   2           2HB      LEU   2   4.359  -5.869   2.953
    9    HB3  LEU   2           3HB      LEU   2   3.798  -7.106   1.840
   10    HG   LEU   2           HG       LEU   2   3.784  -8.802   3.569
   11   HD11  LEU   2          1HD1      LEU   2   4.009  -8.173   5.969
   12   HD12  LEU   2          2HD1      LEU   2   5.543  -8.085   5.106
   13   HD13  LEU   2          3HD1      LEU   2   4.648  -6.588   5.482
   14   HD21  LEU   2          3HD2      LEU   2   1.813  -7.330   3.160
   15   HD22  LEU   2          1HD2      LEU   2   1.887  -7.911   4.831
   16   HD23  LEU   2          2HD2      LEU   2   2.373  -6.244   4.447
   17    HA   PRO   3           HA       PRO   3   6.794  -6.810  -1.791
   18    HB2  PRO   3           2HB      PRO   3   5.654  -8.777  -3.267
   19    HB3  PRO   3           3HB      PRO   3   7.148  -9.062  -2.321
   20    HG2  PRO   3           2HG      PRO   3   4.292  -9.707  -1.523
   21    HG3  PRO   3           3HG      PRO   3   5.724 -10.781  -1.451
   22    HD2  PRO   3           2HD      PRO   3   4.812  -9.348   0.709
   23    HD3  PRO   3           3HD      PRO   3   6.550  -9.703   0.469
   24    H    ARG   4           H        ARG   4   5.559  -5.775  -3.439
   25    HA   ARG   4           HA       ARG   4   3.323  -4.379  -2.529
   26    HB2  ARG   4           2HB      ARG   4   3.186  -3.320  -4.650
   27    HB3  ARG   4           3HB      ARG   4   4.868  -3.583  -4.225
   28    HG2  ARG   4           2HG      ARG   4   4.929  -4.214  -6.431
   29    HG3  ARG   4           3HG      ARG   4   4.629  -5.773  -5.672
   30    HD2  ARG   4           2HD      ARG   4   2.050  -5.033  -6.090
   31    HD3  ARG   4           3HD      ARG   4   2.815  -4.020  -7.318
   32    HE   ARG   4           HE       ARG   4   3.828  -6.696  -7.463
   33   HH11  ARG   4          1HH1      ARG   4   0.895  -4.955  -8.265
   34   HH12  ARG   4          2HH1      ARG   4   0.455  -6.081  -9.519
   35   HH21  ARG   4          1HH2      ARG   4   3.231  -8.069  -9.124
   36   HH22  ARG   4          2HH2      ARG   4   1.743  -7.799  -9.979
   37    H    LYS   5           H        LYS   5   3.222  -7.384  -4.315
   38    HA   LYS   5           HA       LYS   5   0.406  -7.307  -4.947
   39    HB2  LYS   5           2HB      LYS   5   0.652  -9.595  -5.609
   40    HB3  LYS   5           3HB      LYS   5   2.041  -8.671  -6.177
   41    HG2  LYS   5           2HG      LYS   5   3.360  -9.547  -4.199
   42    HG3  LYS   5           3HG      LYS   5   1.978 -10.565  -3.783
   43    HD2  LYS   5           2HD      LYS   5   3.525 -10.689  -6.405
   44    HD3  LYS   5           3HD      LYS   5   3.753 -11.769  -5.022
   45    HE2  LYS   5           2HE      LYS   5   1.376 -12.508  -5.215
   46    HE3  LYS   5           3HE      LYS   5   1.178 -11.476  -6.636
   47    HZ1  LYS   5           HZ1      LYS   5   2.905 -12.793  -7.750
   48    HZ2  LYS   5           HZ2      LYS   5   3.082 -13.750  -6.436
   49    HZ3  LYS   5           HZ3      LYS   5   1.683 -13.762  -7.271
   50    H    ILE   6           H        ILE   6   2.017  -8.049  -1.981
   51    HA   ILE   6           HA       ILE   6  -0.516  -9.102  -0.772
   52    HB   ILE   6           HB       ILE   6   2.293  -9.033   0.390
   53   HG12  ILE   6          2HG1      ILE   6   0.655 -11.367  -0.717
   54   HG13  ILE   6          3HG1      ILE   6   2.077 -10.660  -1.476
   55   HG21  ILE   6          1HG2      ILE   6  -0.258 -10.352   1.438
   56   HG22  ILE   6          2HG2      ILE   6   1.337 -10.358   2.228
   57   HG23  ILE   6          3HG2      ILE   6   0.437  -8.859   2.087
   58   HD11  ILE   6          3HD1      ILE   6   2.031 -12.231   1.116
   59   HD12  ILE   6          1HD1      ILE   6   2.776 -12.671  -0.427
   60   HD13  ILE   6          2HD1      ILE   6   3.446 -11.329   0.519
   61    H    LEU   7           H        LEU   7   2.022  -6.594  -0.313
   62    HA   LEU   7           HA       LEU   7   0.883  -5.244   1.856
   63    HB2  LEU   7           2HB      LEU   7   3.179  -4.942   0.936
   64    HB3  LEU   7           3HB      LEU   7   2.502  -4.144  -0.478
   65    HG   LEU   7           HG       LEU   7   1.685  -2.282   0.929
   66   HD11  LEU   7          1HD1      LEU   7   1.341  -3.409   3.088
   67   HD12  LEU   7          2HD1      LEU   7   3.085  -3.747   3.211
   68   HD13  LEU   7          3HD1      LEU   7   2.482  -2.077   3.273
   69   HD21  LEU   7          3HD2      LEU   7   3.885  -1.328   1.451
   70   HD22  LEU   7          1HD2      LEU   7   4.627  -2.941   1.339
   71   HD23  LEU   7          2HD2      LEU   7   3.915  -2.178  -0.101
   72    H    CYS   8           H        CYS   8   0.015  -4.967  -1.570
   73    HA   CYS   8           HA       CYS   8  -1.544  -2.594  -1.449
   74    HB2  CYS   8           2HB      CYS   8  -0.786  -3.580  -3.509
   75    HB3  CYS   8           3HB      CYS   8  -1.662  -5.075  -3.203
   76    H    ALA   9           H        ALA   9  -2.432  -5.949  -0.557
   77    HA   ALA   9           HA       ALA   9  -5.282  -5.374  -0.300
   78    HB1  ALA   9           3HB      ALA   9  -4.409  -7.646  -0.753
   79    HB2  ALA   9           1HB      ALA   9  -3.581  -7.648   0.822
   80    HB3  ALA   9           2HB      ALA   9  -5.354  -7.595   0.748
   81    H    ILE  10           H        ILE  10  -2.482  -5.467   1.899
   82    HA   ILE  10           HA       ILE  10  -3.904  -4.884   4.331
   83    HB   ILE  10           HB       ILE  10  -1.016  -4.213   3.649
   84   HG12  ILE  10          2HG1      ILE  10  -1.296  -6.555   3.123
   85   HG13  ILE  10          3HG1      ILE  10  -0.356  -6.368   4.575
   86   HG21  ILE  10          1HG2      ILE  10  -0.650  -4.498   6.092
   87   HG22  ILE  10          2HG2      ILE  10  -1.740  -3.159   5.719
   88   HG23  ILE  10          3HG2      ILE  10  -2.401  -4.692   6.318
   89   HD11  ILE  10          3HD1      ILE  10  -2.330  -7.005   5.957
   90   HD12  ILE  10          1HD1      ILE  10  -3.302  -7.169   4.473
   91   HD13  ILE  10          2HD1      ILE  10  -1.924  -8.243   4.760
   92    H    ALA  11           H        ALA  11  -2.218  -2.766   1.982
   93    HA   ALA  11           HA       ALA  11  -2.470  -0.338   3.320
   94    HB1  ALA  11           3HB      ALA  11  -1.084  -0.901   1.289
   95    HB2  ALA  11           1HB      ALA  11  -2.556  -0.761   0.293
   96    HB3  ALA  11           2HB      ALA  11  -1.922   0.644   1.182
   97    H    LYS  12           H        LYS  12  -4.808  -1.780   1.019
   98    HA   LYS  12           HA       LYS  12  -6.683   0.455   1.292
   99    HB2  LYS  12           2HB      LYS  12  -6.877  -2.210  -0.171
  100    HB3  LYS  12           3HB      LYS  12  -8.102  -0.927  -0.227
  101    HG2  LYS  12           2HG      LYS  12  -6.317   0.678  -0.988
  102    HG3  LYS  12           3HG      LYS  12  -5.197  -0.675  -1.122
  103    HD2  LYS  12           2HD      LYS  12  -7.769  -0.303  -2.709
  104    HD3  LYS  12           3HD      LYS  12  -6.118  -0.012  -3.268
  105    HE2  LYS  12           2HE      LYS  12  -5.641  -2.478  -2.747
  106    HE3  LYS  12           3HE      LYS  12  -7.389  -2.685  -2.592
  107    HZ1  LYS  12           HZ1      LYS  12  -7.614  -1.857  -4.881
  108    HZ2  LYS  12           HZ2      LYS  12  -6.000  -1.630  -5.020
  109    HZ3  LYS  12           HZ3      LYS  12  -6.610  -3.144  -4.868
  110    H    LYS  13           H        LYS  13  -6.327  -2.595   2.965
  111    HA   LYS  13           HA       LYS  13  -8.965  -2.443   4.271
  112    HB2  LYS  13           2HB      LYS  13  -6.462  -4.101   4.758
  113    HB3  LYS  13           3HB      LYS  13  -7.883  -4.181   5.808
  114    HG2  LYS  13           2HG      LYS  13  -9.312  -4.879   3.981
  115    HG3  LYS  13           3HG      LYS  13  -8.009  -4.681   2.803
  116    HD2  LYS  13           2HD      LYS  13  -6.679  -6.424   4.013
  117    HD3  LYS  13           3HD      LYS  13  -8.040  -6.690   5.110
  118    HE2  LYS  13           2HE      LYS  13  -8.124  -7.034   2.073
  119    HE3  LYS  13           3HE      LYS  13  -7.842  -8.346   3.218
  120    HZ1  LYS  13           HZ1      LYS  13 -10.167  -8.259   2.588
  121    HZ2  LYS  13           HZ2      LYS  13 -10.044  -7.908   4.174
  122    HZ3  LYS  13           HZ3      LYS  13 -10.324  -6.717   3.089
  123    H    LYS  14           H        LYS  14  -5.660  -1.448   5.140
  124    HA   LYS  14           HA       LYS  14  -6.527  -0.332   7.739
  125    HB2  LYS  14           2HB      LYS  14  -3.880  -0.676   6.304
  126    HB3  LYS  14           3HB      LYS  14  -4.009   0.453   7.635
  127    HG2  LYS  14           2HG      LYS  14  -3.170  -1.682   8.401
  128    HG3  LYS  14           3HG      LYS  14  -4.683  -1.239   9.190
  129    HD2  LYS  14           2HD      LYS  14  -5.923  -2.861   7.833
  130    HD3  LYS  14           3HD      LYS  14  -4.449  -3.260   6.916
  131    HE2  LYS  14           2HE      LYS  14  -3.364  -4.058   8.980
  132    HE3  LYS  14           3HE      LYS  14  -4.767  -3.570   9.937
  133    HZ1  LYS  14           HZ1      LYS  14  -6.093  -5.219   8.741
  134    HZ2  LYS  14           HZ2      LYS  14  -4.805  -5.676   7.837
  135    HZ3  LYS  14           HZ3      LYS  14  -4.816  -5.943   9.446
  136    H    GLY  15           H        GLY  15  -6.342   0.933   4.540
  137    HA2  GLY  15           HA2      GLY  15  -6.817   3.056   3.739
  138    HA3  GLY  15           HA3      GLY  15  -7.110   3.624   5.387
  139    H    LYS  16           H        LYS  16  -4.141   2.048   4.331
  140    HA   LYS  16           HA       LYS  16  -2.550   4.436   5.159
  141    HB2  LYS  16           2HB      LYS  16  -2.507   2.151   6.363
  142    HB3  LYS  16           3HB      LYS  16  -1.587   1.566   4.974
  143    HG2  LYS  16           2HG      LYS  16   0.188   3.252   5.469
  144    HG3  LYS  16           3HG      LYS  16  -0.819   3.937   6.749
  145    HD2  LYS  16           2HD      LYS  16   0.899   2.550   7.724
  146    HD3  LYS  16           3HD      LYS  16  -0.676   1.792   8.000
  147    HE2  LYS  16           2HE      LYS  16  -0.271   0.233   6.116
  148    HE3  LYS  16           3HE      LYS  16   1.261   1.039   5.758
  149    HZ1  LYS  16           HZ1      LYS  16   2.067   0.339   7.950
  150    HZ2  LYS  16           HZ2      LYS  16   0.652  -0.401   8.291
  151    HZ3  LYS  16           HZ3      LYS  16   1.604  -0.967   7.093
  152    H    CYS  17           H        CYS  17  -3.622   3.456   2.326
  153    HA   CYS  17           HA       CYS  17  -1.191   3.140   0.767
  154    HB2  CYS  17           2HB      CYS  17  -3.469   1.994   0.405
  155    HB3  CYS  17           3HB      CYS  17  -4.019   3.552  -0.208
  156    H    LYS  18           H        LYS  18  -0.026   4.750  -0.002
  157    HA   LYS  18           HA       LYS  18  -1.109   7.235  -1.113
  158    HB2  LYS  18           2HB      LYS  18   0.135   8.718   0.492
  159    HB3  LYS  18           3HB      LYS  18  -1.201   7.855   1.234
  160    HG2  LYS  18           2HG      LYS  18   0.333   6.227   2.247
  161    HG3  LYS  18           3HG      LYS  18   1.719   6.992   1.442
  162    HD2  LYS  18           2HD      LYS  18   1.286   9.089   2.691
  163    HD3  LYS  18           3HD      LYS  18  -0.120   8.334   3.477
  164    HE2  LYS  18           2HE      LYS  18   1.361   6.598   4.458
  165    HE3  LYS  18           3HE      LYS  18   2.761   7.342   3.676
  166    HZ1  LYS  18           HZ1      LYS  18   2.550   8.069   5.984
  167    HZ2  LYS  18           HZ2      LYS  18   2.347   9.352   4.996
  168    HZ3  LYS  18           HZ3      LYS  18   1.053   8.664   5.721
  169    H    GLY  19           H        GLY  19   0.690   8.773  -1.731
  170    HA2  GLY  19           HA2      GLY  19   2.529   9.180  -3.068
  171    HA3  GLY  19           HA3      GLY  19   3.376   8.066  -2.007
  172    HA   PRO  20           HA       PRO  20   3.599   5.972  -6.086
  173    HB2  PRO  20           2HB      PRO  20   5.477   4.073  -5.479
  174    HB3  PRO  20           3HB      PRO  20   5.879   5.787  -5.804
  175    HG2  PRO  20           2HG      PRO  20   5.510   4.444  -3.108
  176    HG3  PRO  20           3HG      PRO  20   6.851   5.509  -3.641
  177    HD2  PRO  20           2HD      PRO  20   4.752   6.449  -2.195
  178    HD3  PRO  20           3HD      PRO  20   5.501   7.442  -3.484
  179    H    LEU  21           H        LEU  21   3.032   4.369  -2.909
  180    HA   LEU  21           HA       LEU  21   2.204   1.871  -4.012
  181    HB2  LEU  21           2HB      LEU  21   2.901   2.263  -1.648
  182    HB3  LEU  21           3HB      LEU  21   1.407   3.151  -1.368
  183    HG   LEU  21           HG       LEU  21   0.079   1.110  -1.791
  184   HD11  LEU  21          1HD1      LEU  21   2.773  -0.272  -2.134
  185   HD12  LEU  21          2HD1      LEU  21   1.214  -1.102  -1.919
  186   HD13  LEU  21          3HD1      LEU  21   1.490  -0.126  -3.361
  187   HD21  LEU  21          3HD2      LEU  21   0.849   1.616   0.488
  188   HD22  LEU  21          1HD2      LEU  21   0.783  -0.133   0.210
  189   HD23  LEU  21          2HD2      LEU  21   2.348   0.703   0.195
  190    H    LYS  22           H        LYS  22   0.394   4.841  -3.390
  191    HA   LYS  22           HA       LYS  22  -2.257   3.855  -4.005
  192    HB2  LYS  22           2HB      LYS  22  -2.000   5.902  -2.815
  193    HB3  LYS  22           3HB      LYS  22  -0.994   6.615  -4.083
  194    HG2  LYS  22           2HG      LYS  22  -2.875   6.768  -5.604
  195    HG3  LYS  22           3HG      LYS  22  -3.918   5.863  -4.491
  196    HD2  LYS  22           2HD      LYS  22  -3.783   7.657  -2.833
  197    HD3  LYS  22           3HD      LYS  22  -2.579   8.508  -3.814
  198    HE2  LYS  22           2HE      LYS  22  -4.535   9.690  -4.254
  199    HE3  LYS  22           3HE      LYS  22  -4.343   8.646  -5.664
  200    HZ1  LYS  22           HZ1      LYS  22  -6.002   7.125  -4.643
  201    HZ2  LYS  22           HZ2      LYS  22  -6.162   8.133  -3.366
  202    HZ3  LYS  22           HZ3      LYS  22  -6.625   8.618  -4.852
  203    H    LEU  23           H        LEU  23   0.304   5.114  -6.085
  204    HA   LEU  23           HA       LEU  23  -1.246   4.907  -8.529
  205    HB2  LEU  23           2HB      LEU  23   0.682   6.377  -8.213
  206    HB3  LEU  23           3HB      LEU  23   1.771   5.007  -8.083
  207    HG   LEU  23           HG       LEU  23   0.077   5.388 -10.578
  208   HD11  LEU  23          1HD1      LEU  23   1.931   6.689 -11.561
  209   HD12  LEU  23          2HD1      LEU  23   1.218   7.532 -10.179
  210   HD13  LEU  23          3HD1      LEU  23   2.772   6.688  -9.993
  211   HD21  LEU  23          3HD2      LEU  23   2.049   4.320 -11.677
  212   HD22  LEU  23          1HD2      LEU  23   2.845   4.170 -10.097
  213   HD23  LEU  23          2HD2      LEU  23   1.361   3.264 -10.452
  214    H    VAL  24           H        VAL  24   1.064   2.688  -6.933
  215    HA   VAL  24           HA       VAL  24   0.973   0.623  -8.927
  216    HB   VAL  24           HB       VAL  24   1.716   0.555  -5.977
  217   HG11  VAL  24          1HG1      VAL  24   3.017  -1.497  -6.528
  218   HG12  VAL  24          2HG1      VAL  24   1.276  -1.753  -6.643
  219   HG13  VAL  24          3HG1      VAL  24   2.240  -1.541  -8.126
  220   HG21  VAL  24          3HG2      VAL  24   3.485   0.629  -8.461
  221   HG22  VAL  24          1HG2      VAL  24   3.124   2.033  -7.447
  222   HG23  VAL  24          2HG2      VAL  24   4.013   0.679  -6.759
  223    H    CYS  25           H        CYS  25  -0.844   1.017  -5.900
  224    HA   CYS  25           HA       CYS  25  -2.313  -1.508  -6.280
  225    HB2  CYS  25           2HB      CYS  25  -1.114  -0.879  -4.225
  226    HB3  CYS  25           3HB      CYS  25  -2.141   0.526  -4.043
  227    H    LYS  26           H        LYS  26  -2.850   1.699  -7.070
  228    HA   LYS  26           HA       LYS  26  -4.600   3.003  -7.712
  229    HB2  LYS  26           2HB      LYS  26  -5.741   0.309  -8.497
  230    HB3  LYS  26           3HB      LYS  26  -6.422   1.852  -9.007
  231    HG2  LYS  26           2HG      LYS  26  -3.512   1.096  -9.457
  232    HG3  LYS  26           3HG      LYS  26  -4.780   0.693 -10.617
  233    HD2  LYS  26           2HD      LYS  26  -3.971   3.516  -9.772
  234    HD3  LYS  26           3HD      LYS  26  -3.491   2.693 -11.256
  235    HE2  LYS  26           2HE      LYS  26  -5.889   2.505 -11.926
  236    HE3  LYS  26           3HE      LYS  26  -6.354   3.400 -10.474
  237    HZ1  LYS  26           HZ1      LYS  26  -5.049   5.289 -11.301
  238    HZ2  LYS  26           HZ2      LYS  26  -4.622   4.460 -12.645
  239    HZ3  LYS  26           HZ3      LYS  26  -6.181   4.868 -12.398
  240    H    CYS  27           H        CYS  27  -4.493   3.260  -5.430
  241    HA   CYS  27           HA       CYS  27  -6.815   2.452  -3.804
  242    HB2  CYS  27           2HB      CYS  27  -4.456   4.234  -3.101
  243    HB3  CYS  27           3HB      CYS  27  -5.649   3.594  -1.986
  Start of MODEL   46
    1    H1   GLY   1           1H       GLY   1  10.045  -8.994   4.504
    2    H2   GLY   1           2H       GLY   1  10.680  -8.126   3.270
    3    H3   GLY   1           3H       GLY   1  10.741  -7.541   4.800
    4    HA2  GLY   1           HA2      GLY   1   8.346  -7.337   4.890
    5    HA3  GLY   1           HA3      GLY   1   9.038  -6.385   3.565
    6    H    LEU   2           H        LEU   2   6.381  -7.075   3.506
    7    HA   LEU   2           HA       LEU   2   5.887  -9.492   1.979
    8    HB2  LEU   2           2HB      LEU   2   4.212  -7.032   2.593
    9    HB3  LEU   2           3HB      LEU   2   3.597  -8.398   1.671
   10    HG   LEU   2           HG       LEU   2   4.591  -8.575   4.549
   11   HD11  LEU   2          1HD1      LEU   2   2.196  -8.772   5.113
   12   HD12  LEU   2          2HD1      LEU   2   2.552  -7.213   4.357
   13   HD13  LEU   2          3HD1      LEU   2   1.765  -8.495   3.412
   14   HD21  LEU   2          3HD2      LEU   2   3.129 -10.581   2.770
   15   HD22  LEU   2          1HD2      LEU   2   4.778 -10.744   3.414
   16   HD23  LEU   2          2HD2      LEU   2   3.402 -10.772   4.516
   17    HA   PRO   3           HA       PRO   3   6.559  -7.753  -2.136
   18    HB2  PRO   3           2HB      PRO   3   5.275  -9.566  -3.691
   19    HB3  PRO   3           3HB      PRO   3   6.761  -9.992  -2.788
   20    HG2  PRO   3           2HG      PRO   3   3.879 -10.492  -1.964
   21    HG3  PRO   3           3HG      PRO   3   5.237 -11.662  -1.986
   22    HD2  PRO   3           2HD      PRO   3   4.477 -10.302   0.271
   23    HD3  PRO   3           3HD      PRO   3   6.186 -10.736  -0.039
   24    H    ARG   4           H        ARG   4   5.343  -6.640  -3.782
   25    HA   ARG   4           HA       ARG   4   3.234  -5.041  -2.844
   26    HB2  ARG   4           2HB      ARG   4   3.925  -5.699  -5.742
   27    HB3  ARG   4           3HB      ARG   4   2.914  -4.355  -5.222
   28    HG2  ARG   4           2HG      ARG   4   5.878  -4.691  -4.596
   29    HG3  ARG   4           3HG      ARG   4   5.160  -3.611  -5.793
   30    HD2  ARG   4           2HD      ARG   4   3.943  -2.424  -3.943
   31    HD3  ARG   4           3HD      ARG   4   4.813  -3.446  -2.775
   32    HE   ARG   4           HE       ARG   4   6.679  -2.189  -4.554
   33   HH11  ARG   4          1HH2      ARG   4   4.677  -1.339  -1.810
   34   HH12  ARG   4          2HH2      ARG   4   5.728  -0.032  -1.336
   35   HH21  ARG   4          2HH1      ARG   4   7.964  -0.506  -3.901
   36   HH22  ARG   4          1HH1      ARG   4   7.531   0.430  -2.502
   37    H    LYS   5           H        LYS   5   2.893  -8.064  -4.644
   38    HA   LYS   5           HA       LYS   5   0.073  -7.841  -5.125
   39    HB2  LYS   5           2HB      LYS   5   0.166 -10.148  -5.797
   40    HB3  LYS   5           3HB      LYS   5   1.575  -9.289  -6.415
   41    HG2  LYS   5           2HG      LYS   5   2.941 -10.257  -4.524
   42    HG3  LYS   5           3HG      LYS   5   1.509 -11.174  -4.018
   43    HD2  LYS   5           2HD      LYS   5   1.447 -12.309  -6.218
   44    HD3  LYS   5           3HD      LYS   5   2.887 -11.398  -6.726
   45    HE2  LYS   5           2HE      LYS   5   4.178 -12.398  -4.852
   46    HE3  LYS   5           3HE      LYS   5   2.744 -13.296  -4.337
   47    HZ1  LYS   5           HZ1      LYS   5   4.205 -14.671  -5.706
   48    HZ2  LYS   5           HZ2      LYS   5   2.786 -14.459  -6.481
   49    HZ3  LYS   5           HZ3      LYS   5   4.110 -13.629  -6.958
   50    H    ILE   6           H        ILE   6   1.685  -8.576  -2.185
   51    HA   ILE   6           HA       ILE   6  -0.895  -9.454  -0.921
   52    HB   ILE   6           HB       ILE   6   1.935  -9.714   0.163
   53   HG12  ILE   6          2HG1      ILE   6   0.060 -11.864  -0.938
   54   HG13  ILE   6          3HG1      ILE   6   1.503 -11.254  -1.746
   55   HG21  ILE   6          1HG2      ILE   6   0.179  -9.396   1.913
   56   HG22  ILE   6          2HG2      ILE   6  -0.740 -10.747   1.225
   57   HG23  ILE   6          3HG2      ILE   6   0.849 -11.018   1.972
   58   HD11  ILE   6          3HD1      ILE   6   2.905 -12.067   0.154
   59   HD12  ILE   6          1HD1      ILE   6   1.456 -12.866   0.817
   60   HD13  ILE   6          2HD1      ILE   6   2.081 -13.334  -0.770
   61    H    LEU   7           H        LEU   7   1.915  -7.270  -0.508
   62    HA   LEU   7           HA       LEU   7   1.029  -5.842   1.733
   63    HB2  LEU   7           2HB      LEU   7   3.295  -5.962   0.703
   64    HB3  LEU   7           3HB      LEU   7   2.767  -4.944  -0.611
   65    HG   LEU   7           HG       LEU   7   4.207  -3.941   1.206
   66   HD11  LEU   7          1HD1      LEU   7   2.917  -2.573  -0.426
   67   HD12  LEU   7          2HD1      LEU   7   1.618  -2.428   0.776
   68   HD13  LEU   7          3HD1      LEU   7   3.223  -1.779   1.129
   69   HD21  LEU   7          3HD2      LEU   7   3.020  -4.900   3.167
   70   HD22  LEU   7          1HD2      LEU   7   3.217  -3.141   3.252
   71   HD23  LEU   7          2HD2      LEU   7   1.640  -3.828   2.829
   72    H    CYS   8           H        CYS   8   0.129  -5.395  -1.660
   73    HA   CYS   8           HA       CYS   8  -1.174  -2.868  -1.510
   74    HB2  CYS   8           2HB      CYS   8  -0.691  -3.898  -3.606
   75    HB3  CYS   8           3HB      CYS   8  -1.587  -5.356  -3.197
   76    H    ALA   9           H        ALA   9  -2.409  -6.141  -0.609
   77    HA   ALA   9           HA       ALA   9  -5.147  -5.246  -0.270
   78    HB1  ALA   9           3HB      ALA   9  -3.686  -7.663   0.881
   79    HB2  ALA   9           1HB      ALA   9  -5.444  -7.421   0.821
   80    HB3  ALA   9           2HB      ALA   9  -4.522  -7.605  -0.689
   81    H    ILE  10           H        ILE  10  -2.326  -5.539   1.875
   82    HA   ILE  10           HA       ILE  10  -3.644  -4.781   4.320
   83    HB   ILE  10           HB       ILE  10  -0.732  -4.303   3.576
   84   HG12  ILE  10          2HG1      ILE  10  -1.156  -6.631   3.054
   85   HG13  ILE  10          3HG1      ILE  10  -0.152  -6.482   4.464
   86   HG21  ILE  10          1HG2      ILE  10  -1.390  -3.201   5.641
   87   HG22  ILE  10          2HG2      ILE  10  -2.094  -4.706   6.264
   88   HG23  ILE  10          3HG2      ILE  10  -0.342  -4.577   6.005
   89   HD11  ILE  10          3HD1      ILE  10  -2.089  -7.022   5.932
   90   HD12  ILE  10          1HD1      ILE  10  -3.138  -7.128   4.496
   91   HD13  ILE  10          2HD1      ILE  10  -1.811  -8.280   4.717
   92    H    ALA  11           H        ALA  11  -1.829  -2.884   1.874
   93    HA   ALA  11           HA       ALA  11  -1.738  -0.468   3.208
   94    HB1  ALA  11           3HB      ALA  11  -1.225   0.491   1.019
   95    HB2  ALA  11           1HB      ALA  11  -0.464  -1.097   1.176
   96    HB3  ALA  11           2HB      ALA  11  -1.937  -0.914   0.194
   97    H    LYS  12           H        LYS  12  -4.437  -1.510   1.050
   98    HA   LYS  12           HA       LYS  12  -5.868   1.006   1.672
   99    HB2  LYS  12           2HB      LYS  12  -7.411   0.368  -0.069
  100    HB3  LYS  12           3HB      LYS  12  -5.738   0.501  -0.583
  101    HG2  LYS  12           2HG      LYS  12  -5.612  -2.037  -0.501
  102    HG3  LYS  12           3HG      LYS  12  -7.361  -2.054  -0.238
  103    HD2  LYS  12           2HD      LYS  12  -7.734  -0.913  -2.373
  104    HD3  LYS  12           3HD      LYS  12  -5.996  -0.635  -2.578
  105    HE2  LYS  12           2HE      LYS  12  -5.612  -3.089  -2.669
  106    HE3  LYS  12           3HE      LYS  12  -7.361  -3.352  -2.573
  107    HZ1  LYS  12           HZ1      LYS  12  -5.962  -1.869  -4.759
  108    HZ2  LYS  12           HZ2      LYS  12  -6.607  -3.364  -4.881
  109    HZ3  LYS  12           HZ3      LYS  12  -7.581  -2.075  -4.657
  110    H    LYS  13           H        LYS  13  -6.011  -2.250   2.836
  111    HA   LYS  13           HA       LYS  13  -8.599  -1.824   4.209
  112    HB2  LYS  13           2HB      LYS  13  -6.443  -3.928   4.311
  113    HB3  LYS  13           3HB      LYS  13  -7.483  -3.739   5.706
  114    HG2  LYS  13           2HG      LYS  13  -8.323  -5.459   4.184
  115    HG3  LYS  13           3HG      LYS  13  -9.476  -4.157   4.476
  116    HD2  LYS  13           2HD      LYS  13  -9.024  -3.200   2.245
  117    HD3  LYS  13           3HD      LYS  13  -7.747  -4.388   1.981
  118    HE2  LYS  13           2HE      LYS  13  -9.660  -5.130   0.771
  119    HE3  LYS  13           3HE      LYS  13  -9.419  -6.225   2.133
  120    HZ1  LYS  13           HZ1      LYS  13 -11.211  -5.053   3.304
  121    HZ2  LYS  13           HZ2      LYS  13 -11.409  -4.011   2.057
  122    HZ3  LYS  13           HZ3      LYS  13 -11.756  -5.592   1.868
  123    H    LYS  14           H        LYS  14  -5.183  -1.298   5.072
  124    HA   LYS  14           HA       LYS  14  -5.911  -0.138   7.699
  125    HB2  LYS  14           2HB      LYS  14  -3.308  -0.668   6.238
  126    HB3  LYS  14           3HB      LYS  14  -3.350   0.421   7.607
  127    HG2  LYS  14           2HG      LYS  14  -2.684  -1.784   8.318
  128    HG3  LYS  14           3HG      LYS  14  -4.184  -1.277   9.094
  129    HD2  LYS  14           2HD      LYS  14  -5.491  -2.787   7.662
  130    HD3  LYS  14           3HD      LYS  14  -4.052  -3.165   6.708
  131    HE2  LYS  14           2HE      LYS  14  -4.440  -5.005   8.182
  132    HE3  LYS  14           3HE      LYS  14  -2.985  -4.167   8.725
  133    HZ1  LYS  14           HZ1      LYS  14  -5.687  -3.854   9.939
  134    HZ2  LYS  14           HZ2      LYS  14  -4.466  -4.725  10.577
  135    HZ3  LYS  14           HZ3      LYS  14  -4.329  -3.105  10.466
  136    H    GLY  15           H        GLY  15  -5.708   1.113   4.517
  137    HA2  GLY  15           HA2      GLY  15  -6.208   3.240   3.755
  138    HA3  GLY  15           HA3      GLY  15  -6.378   3.800   5.420
  139    H    LYS  16           H        LYS  16  -3.398   2.241   4.496
  140    HA   LYS  16           HA       LYS  16  -1.861   4.730   4.959
  141    HB2  LYS  16           2HB      LYS  16  -1.415   2.560   6.143
  142    HB3  LYS  16           3HB      LYS  16  -0.919   1.855   4.599
  143    HG2  LYS  16           2HG      LYS  16   0.982   3.391   4.458
  144    HG3  LYS  16           3HG      LYS  16   0.374   4.330   5.831
  145    HD2  LYS  16           2HD      LYS  16   2.226   2.959   6.545
  146    HD3  LYS  16           3HD      LYS  16   0.746   2.392   7.330
  147    HE2  LYS  16           2HE      LYS  16   0.575   0.541   5.681
  148    HE3  LYS  16           3HE      LYS  16   2.018   1.139   4.849
  149    HZ1  LYS  16           HZ1      LYS  16   3.290   0.705   6.883
  150    HZ2  LYS  16           HZ2      LYS  16   1.958   0.158   7.657
  151    HZ3  LYS  16           HZ3      LYS  16   2.562  -0.667   6.385
  152    H    CYS  17           H        CYS  17  -3.028   3.046   2.266
  153    HA   CYS  17           HA       CYS  17  -0.872   3.172   0.455
  154    HB2  CYS  17           2HB      CYS  17  -3.001   1.798   0.368
  155    HB3  CYS  17           3HB      CYS  17  -3.825   3.260  -0.188
  156    H    LYS  18           H        LYS  18   0.143   4.936  -0.170
  157    HA   LYS  18           HA       LYS  18  -1.261   7.273  -1.369
  158    HB2  LYS  18           2HB      LYS  18   0.774   7.404   0.918
  159    HB3  LYS  18           3HB      LYS  18   0.265   8.804  -0.027
  160    HG2  LYS  18           2HG      LYS  18  -2.078   8.480   0.724
  161    HG3  LYS  18           3HG      LYS  18  -1.561   7.144   1.758
  162    HD2  LYS  18           2HD      LYS  18  -0.562  10.008   1.999
  163    HD3  LYS  18           3HD      LYS  18  -1.841   9.277   2.981
  164    HE2  LYS  18           2HE      LYS  18  -0.226   7.549   3.786
  165    HE3  LYS  18           3HE      LYS  18   1.059   8.332   2.860
  166    HZ1  LYS  18           HZ1      LYS  18   0.720  10.339   4.205
  167    HZ2  LYS  18           HZ2      LYS  18  -0.464   9.614   5.068
  168    HZ3  LYS  18           HZ3      LYS  18   1.071   9.071   5.170
  169    H    GLY  19           H        GLY  19   0.247   8.793  -2.397
  170    HA2  GLY  19           HA2      GLY  19   1.824   9.248  -4.015
  171    HA3  GLY  19           HA3      GLY  19   2.928   8.456  -2.909
  172    HA   PRO  20           HA       PRO  20   3.350   5.844  -6.625
  173    HB2  PRO  20           2HB      PRO  20   5.325   4.153  -5.759
  174    HB3  PRO  20           3HB      PRO  20   5.627   5.840  -6.276
  175    HG2  PRO  20           2HG      PRO  20   5.267   4.798  -3.448
  176    HG3  PRO  20           3HG      PRO  20   6.549   5.883  -4.075
  177    HD2  PRO  20           2HD      PRO  20   4.353   6.843  -2.794
  178    HD3  PRO  20           3HD      PRO  20   5.070   7.724  -4.180
  179    H    LEU  21           H        LEU  21   2.854   4.533  -3.298
  180    HA   LEU  21           HA       LEU  21   2.128   1.894  -4.157
  181    HB2  LEU  21           2HB      LEU  21   2.667   3.050  -1.750
  182    HB3  LEU  21           3HB      LEU  21   0.913   3.030  -1.667
  183    HG   LEU  21           HG       LEU  21   2.838   0.688  -1.943
  184   HD11  LEU  21          1HD1      LEU  21   2.482   1.649   0.300
  185   HD12  LEU  21          2HD1      LEU  21   0.725   1.437   0.110
  186   HD13  LEU  21          3HD1      LEU  21   1.789   0.021   0.191
  187   HD21  LEU  21          3HD2      LEU  21   0.944   0.047  -3.345
  188   HD22  LEU  21          1HD2      LEU  21   0.892  -0.846  -1.827
  189   HD23  LEU  21          2HD2      LEU  21  -0.199   0.531  -2.069
  190    H    LYS  22           H        LYS  22   0.254   4.838  -3.655
  191    HA   LYS  22           HA       LYS  22  -2.406   3.786  -4.101
  192    HB2  LYS  22           2HB      LYS  22  -2.053   5.908  -3.018
  193    HB3  LYS  22           3HB      LYS  22  -1.240   6.573  -4.443
  194    HG2  LYS  22           2HG      LYS  22  -3.326   6.494  -5.724
  195    HG3  LYS  22           3HG      LYS  22  -4.157   5.695  -4.373
  196    HD2  LYS  22           2HD      LYS  22  -3.819   7.675  -2.956
  197    HD3  LYS  22           3HD      LYS  22  -2.841   8.435  -4.218
  198    HE2  LYS  22           2HE      LYS  22  -4.925   9.492  -4.389
  199    HE3  LYS  22           3HE      LYS  22  -4.870   8.359  -5.740
  200    HZ1  LYS  22           HZ1      LYS  22  -6.272   6.833  -4.424
  201    HZ2  LYS  22           HZ2      LYS  22  -6.284   7.882  -3.165
  202    HZ3  LYS  22           HZ3      LYS  22  -7.003   8.282  -4.572
  203    H    LEU  23           H        LEU  23   0.045   4.975  -6.333
  204    HA   LEU  23           HA       LEU  23  -1.562   4.551  -8.720
  205    HB2  LEU  23           2HB      LEU  23   0.334   6.092  -8.551
  206    HB3  LEU  23           3HB      LEU  23   1.463   4.759  -8.384
  207    HG   LEU  23           HG       LEU  23  -0.333   4.993 -10.829
  208   HD11  LEU  23          1HD1      LEU  23   2.396   6.288 -10.413
  209   HD12  LEU  23          2HD1      LEU  23   1.492   6.225 -11.944
  210   HD13  LEU  23          3HD1      LEU  23   0.845   7.142 -10.579
  211   HD21  LEU  23          3HD2      LEU  23   1.602   3.860 -11.945
  212   HD22  LEU  23          1HD2      LEU  23   2.430   3.757 -10.378
  213   HD23  LEU  23          2HD2      LEU  23   0.923   2.865 -10.667
  214    H    VAL  24           H        VAL  24   0.926   2.531  -7.100
  215    HA   VAL  24           HA       VAL  24   0.889   0.354  -8.945
  216    HB   VAL  24           HB       VAL  24   1.685   0.536  -6.017
  217   HG11  VAL  24          1HG1      VAL  24   2.245  -1.747  -7.952
  218   HG12  VAL  24          2HG1      VAL  24   3.059  -1.508  -6.391
  219   HG13  VAL  24          3HG1      VAL  24   1.329  -1.841  -6.430
  220   HG21  VAL  24          3HG2      VAL  24   2.982   1.903  -7.722
  221   HG22  VAL  24          1HG2      VAL  24   3.938   0.722  -6.830
  222   HG23  VAL  24          2HG2      VAL  24   3.432   0.387  -8.509
  223    H    CYS  25           H        CYS  25  -0.955   0.824  -5.943
  224    HA   CYS  25           HA       CYS  25  -2.274  -1.819  -6.197
  225    HB2  CYS  25           2HB      CYS  25  -1.044  -1.158  -4.194
  226    HB3  CYS  25           3HB      CYS  25  -2.056   0.259  -3.999
  227    H    LYS  26           H        LYS  26  -2.926   1.344  -7.014
  228    HA   LYS  26           HA       LYS  26  -4.694   2.601  -7.570
  229    HB2  LYS  26           2HB      LYS  26  -4.851   0.269  -8.970
  230    HB3  LYS  26           3HB      LYS  26  -6.481   0.336  -8.316
  231    HG2  LYS  26           2HG      LYS  26  -5.033   2.582  -9.788
  232    HG3  LYS  26           3HG      LYS  26  -6.166   1.455 -10.544
  233    HD2  LYS  26           2HD      LYS  26  -8.008   2.285  -9.132
  234    HD3  LYS  26           3HD      LYS  26  -6.903   3.408  -8.307
  235    HE2  LYS  26           2HE      LYS  26  -6.416   4.548 -10.420
  236    HE3  LYS  26           3HE      LYS  26  -7.460   3.422 -11.300
  237    HZ1  LYS  26           HZ1      LYS  26  -9.348   4.261 -10.003
  238    HZ2  LYS  26           HZ2      LYS  26  -8.385   5.302  -9.189
  239    HZ3  LYS  26           HZ3      LYS  26  -8.624   5.492 -10.791
  240    H    CYS  27           H        CYS  27  -4.703   3.173  -5.363
  241    HA   CYS  27           HA       CYS  27  -6.865   2.105  -3.644
  242    HB2  CYS  27           2HB      CYS  27  -4.544   3.959  -3.002
  243    HB3  CYS  27           3HB      CYS  27  -5.666   3.267  -1.850
  Start of MODEL   47
    1    H1   GLY   1           1H       GLY   1   7.417  -4.318   3.930
    2    H2   GLY   1           2H       GLY   1   8.949  -4.743   4.333
    3    H3   GLY   1           3H       GLY   1   8.461  -4.812   2.769
    4    HA2  GLY   1           HA2      GLY   1   8.552  -7.028   3.693
    5    HA3  GLY   1           HA3      GLY   1   7.438  -6.495   4.967
    6    H    LEU   2           H        LEU   2   7.045  -8.634   3.141
    7    HA   LEU   2           HA       LEU   2   5.642  -9.664   1.799
    8    HB2  LEU   2           2HB      LEU   2   3.757  -7.386   2.428
    9    HB3  LEU   2           3HB      LEU   2   3.275  -8.827   1.559
   10    HG   LEU   2           HG       LEU   2   4.397  -8.852   4.397
   11   HD11  LEU   2          1HD1      LEU   2   2.254  -7.647   4.289
   12   HD12  LEU   2          2HD1      LEU   2   1.516  -9.012   3.424
   13   HD13  LEU   2          3HD1      LEU   2   2.068  -9.209   5.101
   14   HD21  LEU   2          3HD2      LEU   2   2.976 -10.991   2.742
   15   HD22  LEU   2          1HD2      LEU   2   4.678 -11.020   3.257
   16   HD23  LEU   2          2HD2      LEU   2   3.394 -11.129   4.462
   17    HA   PRO   3           HA       PRO   3   6.143  -8.120  -2.346
   18    HB2  PRO   3           2HB      PRO   3   4.844  -9.991  -3.814
   19    HB3  PRO   3           3HB      PRO   3   6.330 -10.380  -2.895
   20    HG2  PRO   3           2HG      PRO   3   3.452 -10.829  -2.035
   21    HG3  PRO   3           3HG      PRO   3   4.805 -12.004  -2.011
   22    HD2  PRO   3           2HD      PRO   3   4.057 -10.548   0.182
   23    HD3  PRO   3           3HD      PRO   3   5.765 -10.994  -0.120
   24    H    ARG   4           H        ARG   4   4.980  -7.048  -4.008
   25    HA   ARG   4           HA       ARG   4   3.052  -5.271  -3.138
   26    HB2  ARG   4           2HB      ARG   4   3.724  -6.169  -5.969
   27    HB3  ARG   4           3HB      ARG   4   2.608  -4.842  -5.626
   28    HG2  ARG   4           2HG      ARG   4   4.343  -3.613  -4.410
   29    HG3  ARG   4           3HG      ARG   4   5.512  -4.919  -4.699
   30    HD2  ARG   4           2HD      ARG   4   5.400  -4.571  -7.104
   31    HD3  ARG   4           3HD      ARG   4   4.078  -3.404  -6.915
   32    HE   ARG   4           HE       ARG   4   6.389  -2.571  -5.407
   33   HH11  ARG   4          1HH2      ARG   4   5.261  -2.657  -8.724
   34   HH12  ARG   4          2HH2      ARG   4   6.225  -1.280  -9.183
   35   HH21  ARG   4          1HH1      ARG   4   7.597  -0.825  -6.063
   36   HH22  ARG   4          2HH1      ARG   4   7.512  -0.278  -7.711
   37    H    LYS   5           H        LYS   5   2.245  -8.227  -4.991
   38    HA   LYS   5           HA       LYS   5  -0.546  -7.608  -5.130
   39    HB2  LYS   5           2HB      LYS   5  -0.899  -9.634  -6.154
   40    HB3  LYS   5           3HB      LYS   5   0.708  -9.165  -6.663
   41    HG2  LYS   5           2HG      LYS   5   0.033 -11.257  -4.535
   42    HG3  LYS   5           3HG      LYS   5   0.448 -11.572  -6.214
   43    HD2  LYS   5           2HD      LYS   5   2.719 -10.557  -5.822
   44    HD3  LYS   5           3HD      LYS   5   2.283 -10.346  -4.120
   45    HE2  LYS   5           2HE      LYS   5   3.586 -12.338  -4.253
   46    HE3  LYS   5           3HE      LYS   5   1.918 -12.815  -3.921
   47    HZ1  LYS   5           HZ1      LYS   5   2.946 -14.194  -5.651
   48    HZ2  LYS   5           HZ2      LYS   5   1.688 -13.380  -6.289
   49    HZ3  LYS   5           HZ3      LYS   5   3.219 -12.898  -6.600
   50    H    ILE   6           H        ILE   6   1.185  -8.740  -2.437
   51    HA   ILE   6           HA       ILE   6  -1.329  -9.549  -1.015
   52    HB   ILE   6           HB       ILE   6   1.576  -9.938  -0.199
   53   HG12  ILE   6          2HG1      ILE   6  -0.503 -11.947  -1.194
   54   HG13  ILE   6          3HG1      ILE   6   0.908 -11.397  -2.095
   55   HG21  ILE   6          1HG2      ILE   6   0.640 -11.238   1.681
   56   HG22  ILE   6          2HG2      ILE   6   0.017  -9.597   1.724
   57   HG23  ILE   6          3HG2      ILE   6  -1.012 -10.902   1.108
   58   HD11  ILE   6          3HD1      ILE   6   0.934 -13.108   0.408
   59   HD12  ILE   6          1HD1      ILE   6   1.435 -13.543  -1.231
   60   HD13  ILE   6          2HD1      ILE   6   2.387 -12.367  -0.306
   61    H    LEU   7           H        LEU   7   1.577  -7.459  -0.698
   62    HA   LEU   7           HA       LEU   7   0.821  -6.079   1.628
   63    HB2  LEU   7           2HB      LEU   7   3.049  -6.216   0.519
   64    HB3  LEU   7           3HB      LEU   7   2.501  -5.147  -0.747
   65    HG   LEU   7           HG       LEU   7   4.010  -4.217   1.055
   66   HD11  LEU   7          1HD1      LEU   7   3.050  -2.047   1.097
   67   HD12  LEU   7          2HD1      LEU   7   2.690  -2.780  -0.476
   68   HD13  LEU   7          3HD1      LEU   7   1.427  -2.655   0.769
   69   HD21  LEU   7          3HD2      LEU   7   2.876  -5.229   3.026
   70   HD22  LEU   7          1HD2      LEU   7   3.101  -3.479   3.162
   71   HD23  LEU   7          2HD2      LEU   7   1.500  -4.128   2.772
   72    H    CYS   8           H        CYS   8  -0.153  -5.482  -1.726
   73    HA   CYS   8           HA       CYS   8  -1.386  -2.935  -1.401
   74    HB2  CYS   8           2HB      CYS   8  -0.871  -3.875  -3.547
   75    HB3  CYS   8           3HB      CYS   8  -1.883  -5.285  -3.263
   76    H    ALA   9           H        ALA   9  -2.619  -6.198  -0.596
   77    HA   ALA   9           HA       ALA   9  -5.366  -5.314  -0.160
   78    HB1  ALA   9           3HB      ALA   9  -5.658  -7.524   0.837
   79    HB2  ALA   9           1HB      ALA   9  -4.767  -7.667  -0.690
   80    HB3  ALA   9           2HB      ALA   9  -3.906  -7.792   0.861
   81    H    ILE  10           H        ILE  10  -2.473  -5.770   1.884
   82    HA   ILE  10           HA       ILE  10  -3.664  -5.032   4.389
   83    HB   ILE  10           HB       ILE  10  -0.777  -4.595   3.544
   84   HG12  ILE  10          2HG1      ILE  10  -1.277  -6.904   3.007
   85   HG13  ILE  10          3HG1      ILE  10  -0.219  -6.801   4.382
   86   HG21  ILE  10          1HG2      ILE  10  -0.306  -4.919   5.956
   87   HG22  ILE  10          2HG2      ILE  10  -1.323  -3.508   5.647
   88   HG23  ILE  10          3HG2      ILE  10  -2.051  -4.998   6.276
   89   HD11  ILE  10          3HD1      ILE  10  -3.217  -7.378   4.511
   90   HD12  ILE  10          1HD1      ILE  10  -1.908  -8.562   4.669
   91   HD13  ILE  10          2HD1      ILE  10  -2.115  -7.317   5.910
   92    H    ALA  11           H        ALA  11  -1.906  -3.085   1.938
   93    HA   ALA  11           HA       ALA  11  -1.926  -0.607   3.210
   94    HB1  ALA  11           3HB      ALA  11  -0.687  -1.252   1.115
   95    HB2  ALA  11           1HB      ALA  11  -2.218  -1.127   0.210
   96    HB3  ALA  11           2HB      ALA  11  -1.511   0.300   0.985
   97    H    LYS  12           H        LYS  12  -4.485  -1.927   1.057
   98    HA   LYS  12           HA       LYS  12  -6.231   0.378   1.496
   99    HB2  LYS  12           2HB      LYS  12  -6.639  -2.246   0.010
  100    HB3  LYS  12           3HB      LYS  12  -7.822  -0.922   0.069
  101    HG2  LYS  12           2HG      LYS  12  -6.072   0.647  -0.793
  102    HG3  LYS  12           3HG      LYS  12  -4.972  -0.715  -0.993
  103    HD2  LYS  12           2HD      LYS  12  -7.590  -0.251  -2.471
  104    HD3  LYS  12           3HD      LYS  12  -5.943  -0.063  -3.092
  105    HE2  LYS  12           2HE      LYS  12  -5.590  -2.544  -2.588
  106    HE3  LYS  12           3HE      LYS  12  -7.334  -2.654  -2.319
  107    HZ1  LYS  12           HZ1      LYS  12  -6.047  -1.705  -4.838
  108    HZ2  LYS  12           HZ2      LYS  12  -6.738  -3.177  -4.633
  109    HZ3  LYS  12           HZ3      LYS  12  -7.660  -1.829  -4.598
  110    H    LYS  13           H        LYS  13  -6.102  -2.866   2.963
  111    HA   LYS  13           HA       LYS  13  -8.621  -2.567   4.393
  112    HB2  LYS  13           2HB      LYS  13  -6.201  -4.365   4.783
  113    HB3  LYS  13           3HB      LYS  13  -7.589  -4.392   5.876
  114    HG2  LYS  13           2HG      LYS  13  -9.120  -4.958   4.082
  115    HG3  LYS  13           3HG      LYS  13  -7.844  -4.821   2.868
  116    HD2  LYS  13           2HD      LYS  13  -6.612  -6.696   3.948
  117    HD3  LYS  13           3HD      LYS  13  -7.906  -6.835   5.160
  118    HE2  LYS  13           2HE      LYS  13  -9.546  -7.264   3.323
  119    HE3  LYS  13           3HE      LYS  13  -8.233  -7.176   2.142
  120    HZ1  LYS  13           HZ1      LYS  13  -8.434  -9.179   4.332
  121    HZ2  LYS  13           HZ2      LYS  13  -8.720  -9.475   2.755
  122    HZ3  LYS  13           HZ3      LYS  13  -7.210  -9.103   3.252
  123    H    LYS  14           H        LYS  14  -5.275  -1.703   5.249
  124    HA   LYS  14           HA       LYS  14  -6.094  -0.557   7.857
  125    HB2  LYS  14           2HB      LYS  14  -3.478  -0.837   6.346
  126    HB3  LYS  14           3HB      LYS  14  -3.609   0.300   7.669
  127    HG2  LYS  14           2HG      LYS  14  -2.672  -1.801   8.426
  128    HG3  LYS  14           3HG      LYS  14  -4.171  -1.398   9.260
  129    HD2  LYS  14           2HD      LYS  14  -5.404  -3.072   7.962
  130    HD3  LYS  14           3HD      LYS  14  -3.952  -3.431   6.996
  131    HE2  LYS  14           2HE      LYS  14  -2.768  -4.187   9.017
  132    HE3  LYS  14           3HE      LYS  14  -4.140  -3.722  10.028
  133    HZ1  LYS  14           HZ1      LYS  14  -4.155  -6.101   9.562
  134    HZ2  LYS  14           HZ2      LYS  14  -5.478  -5.413   8.908
  135    HZ3  LYS  14           HZ3      LYS  14  -4.222  -5.849   7.953
  136    H    GLY  15           H        GLY  15  -6.075   0.599   4.629
  137    HA2  GLY  15           HA2      GLY  15  -6.577   2.665   3.733
  138    HA3  GLY  15           HA3      GLY  15  -6.890   3.291   5.357
  139    H    LYS  16           H        LYS  16  -3.811   1.792   4.672
  140    HA   LYS  16           HA       LYS  16  -2.419   4.406   5.071
  141    HB2  LYS  16           2HB      LYS  16  -2.245   2.605   6.850
  142    HB3  LYS  16           3HB      LYS  16  -1.436   1.591   5.661
  143    HG2  LYS  16           2HG      LYS  16   0.254   2.576   7.022
  144    HG3  LYS  16           3HG      LYS  16   0.356   3.388   5.460
  145    HD2  LYS  16           2HD      LYS  16  -0.936   5.324   6.415
  146    HD3  LYS  16           3HD      LYS  16  -0.995   4.474   7.975
  147    HE2  LYS  16           2HE      LYS  16   1.515   4.424   7.983
  148    HE3  LYS  16           3HE      LYS  16   1.512   5.346   6.472
  149    HZ1  LYS  16           HZ1      LYS  16   0.377   7.153   7.665
  150    HZ2  LYS  16           HZ2      LYS  16   0.387   6.297   9.057
  151    HZ3  LYS  16           HZ3      LYS  16   1.791   6.802   8.398
  152    H    CYS  17           H        CYS  17  -2.913   4.663   2.750
  153    HA   CYS  17           HA       CYS  17  -0.698   3.644   1.044
  154    HB2  CYS  17           2HB      CYS  17  -2.704   2.130   0.877
  155    HB3  CYS  17           3HB      CYS  17  -3.643   3.512   0.327
  156    H    LYS  18           H        LYS  18   0.247   5.344   0.153
  157    HA   LYS  18           HA       LYS  18  -1.261   7.503  -1.194
  158    HB2  LYS  18           2HB      LYS  18   0.854   8.020   0.958
  159    HB3  LYS  18           3HB      LYS  18   0.226   9.243  -0.147
  160    HG2  LYS  18           2HG      LYS  18  -2.089   8.796   0.774
  161    HG3  LYS  18           3HG      LYS  18  -1.333   7.806   2.031
  162    HD2  LYS  18           2HD      LYS  18  -0.794  10.763   1.514
  163    HD3  LYS  18           3HD      LYS  18  -1.819  10.101   2.794
  164    HE2  LYS  18           2HE      LYS  18   0.147   8.918   3.761
  165    HE3  LYS  18           3HE      LYS  18   1.178   9.606   2.499
  166    HZ1  LYS  18           HZ1      LYS  18   1.288  10.921   4.535
  167    HZ2  LYS  18           HZ2      LYS  18   0.630  11.824   3.347
  168    HZ3  LYS  18           HZ3      LYS  18  -0.320  11.191   4.518
  169    H    GLY  19           H        GLY  19   0.239   8.898  -2.469
  170    HA2  GLY  19           HA2      GLY  19   1.873   9.176  -4.084
  171    HA3  GLY  19           HA3      GLY  19   2.923   8.535  -2.830
  172    HA   PRO  20           HA       PRO  20   3.744   5.583  -6.206
  173    HB2  PRO  20           2HB      PRO  20   5.411   4.358  -4.000
  174    HB3  PRO  20           3HB      PRO  20   5.823   4.602  -5.726
  175    HG2  PRO  20           2HG      PRO  20   6.791   6.302  -3.862
  176    HG3  PRO  20           3HG      PRO  20   6.120   6.959  -5.393
  177    HD2  PRO  20           2HD      PRO  20   4.765   6.745  -2.687
  178    HD3  PRO  20           3HD      PRO  20   4.818   8.130  -3.821
  179    H    LEU  21           H        LEU  21   2.949   4.529  -2.831
  180    HA   LEU  21           HA       LEU  21   2.200   1.862  -3.584
  181    HB2  LEU  21           2HB      LEU  21   2.588   3.147  -1.196
  182    HB3  LEU  21           3HB      LEU  21   0.845   3.164  -1.243
  183    HG   LEU  21           HG       LEU  21   1.491   1.270   0.010
  184   HD11  LEU  21          1HD1      LEU  21   0.684  -0.692  -1.151
  185   HD12  LEU  21          2HD1      LEU  21  -0.313   0.690  -1.613
  186   HD13  LEU  21          3HD1      LEU  21   0.921   0.071  -2.732
  187   HD21  LEU  21          3HD2      LEU  21   3.071  -0.421  -0.711
  188   HD22  LEU  21          1HD2      LEU  21   3.335   0.412  -2.255
  189   HD23  LEU  21          2HD2      LEU  21   3.841   1.169  -0.726
  190    H    LYS  22           H        LYS  22   0.366   4.852  -3.335
  191    HA   LYS  22           HA       LYS  22  -2.274   3.800  -3.938
  192    HB2  LYS  22           2HB      LYS  22  -1.966   5.923  -2.806
  193    HB3  LYS  22           3HB      LYS  22  -1.090   6.592  -4.189
  194    HG2  LYS  22           2HG      LYS  22  -3.130   6.466  -5.573
  195    HG3  LYS  22           3HG      LYS  22  -4.017   5.750  -4.214
  196    HD2  LYS  22           2HD      LYS  22  -3.628   7.807  -2.875
  197    HD3  LYS  22           3HD      LYS  22  -2.652   8.475  -4.190
  198    HE2  LYS  22           2HE      LYS  22  -4.707   9.544  -4.453
  199    HE3  LYS  22           3HE      LYS  22  -4.713   8.283  -5.689
  200    HZ1  LYS  22           HZ1      LYS  22  -6.082   8.120  -3.050
  201    HZ2  LYS  22           HZ2      LYS  22  -6.818   8.365  -4.484
  202    HZ3  LYS  22           HZ3      LYS  22  -6.112   6.928  -4.173
  203    H    LEU  23           H        LEU  23   0.299   5.151  -5.988
  204    HA   LEU  23           HA       LEU  23  -1.083   4.848  -8.484
  205    HB2  LEU  23           2HB      LEU  23   0.863   6.265  -8.080
  206    HB3  LEU  23           3HB      LEU  23   1.902   4.869  -7.850
  207    HG   LEU  23           HG       LEU  23   0.394   5.247 -10.463
  208   HD11  LEU  23          1HD1      LEU  23   1.564   7.367 -10.021
  209   HD12  LEU  23          2HD1      LEU  23   3.078   6.487  -9.713
  210   HD13  LEU  23          3HD1      LEU  23   2.348   6.482 -11.335
  211   HD21  LEU  23          3HD2      LEU  23   2.409   4.110 -11.404
  212   HD22  LEU  23          1HD2      LEU  23   3.086   3.965  -9.769
  213   HD23  LEU  23          2HD2      LEU  23   1.607   3.092 -10.215
  214    H    VAL  24           H        VAL  24   1.073   2.585  -6.740
  215    HA   VAL  24           HA       VAL  24   1.017   0.472  -8.688
  216    HB   VAL  24           HB       VAL  24   1.651   0.548  -5.715
  217   HG11  VAL  24          1HG1      VAL  24   2.839  -1.599  -6.007
  218   HG12  VAL  24          2HG1      VAL  24   1.099  -1.786  -6.198
  219   HG13  VAL  24          3HG1      VAL  24   2.143  -1.761  -7.639
  220   HG21  VAL  24          3HG2      VAL  24   3.529   0.255  -8.095
  221   HG22  VAL  24          1HG2      VAL  24   3.151   1.807  -7.336
  222   HG23  VAL  24          2HG2      VAL  24   3.946   0.557  -6.384
  223    H    CYS  25           H        CYS  25  -0.908   1.014  -5.756
  224    HA   CYS  25           HA       CYS  25  -2.327  -1.552  -6.097
  225    HB2  CYS  25           2HB      CYS  25  -1.049  -0.968  -4.095
  226    HB3  CYS  25           3HB      CYS  25  -2.050   0.449  -3.839
  227    H    LYS  26           H        LYS  26  -2.994   1.715  -6.691
  228    HA   LYS  26           HA       LYS  26  -4.816   2.995  -7.098
  229    HB2  LYS  26           2HB      LYS  26  -5.939   0.344  -8.043
  230    HB3  LYS  26           3HB      LYS  26  -6.732   1.900  -8.324
  231    HG2  LYS  26           2HG      LYS  26  -3.833   1.438  -9.095
  232    HG3  LYS  26           3HG      LYS  26  -5.159   0.979 -10.171
  233    HD2  LYS  26           2HD      LYS  26  -5.870   3.248 -10.452
  234    HD3  LYS  26           3HD      LYS  26  -4.929   3.807  -9.072
  235    HE2  LYS  26           2HE      LYS  26  -3.786   4.518 -11.036
  236    HE3  LYS  26           3HE      LYS  26  -2.825   3.279 -10.227
  237    HZ1  LYS  26           HZ1      LYS  26  -3.633   1.669 -11.872
  238    HZ2  LYS  26           HZ2      LYS  26  -4.559   2.806 -12.602
  239    HZ3  LYS  26           HZ3      LYS  26  -2.933   2.924 -12.638
  240    H    CYS  27           H        CYS  27  -4.534   3.160  -4.888
  241    HA   CYS  27           HA       CYS  27  -6.617   2.226  -3.036
  242    HB2  CYS  27           2HB      CYS  27  -4.348   4.211  -2.609
  243    HB3  CYS  27           3HB      CYS  27  -5.360   3.514  -1.371
  Start of MODEL   48
    1    H1   GLY   1           1H       GLY   1  10.368  -9.253   2.715
    2    H2   GLY   1           2H       GLY   1  10.467  -7.630   2.920
    3    H3   GLY   1           3H       GLY   1  10.020  -8.585   4.171
    4    HA2  GLY   1           HA2      GLY   1   8.444  -8.162   1.700
    5    HA3  GLY   1           HA3      GLY   1   7.960  -9.198   3.058
    6    H    LEU   2           H        LEU   2   6.186  -6.123   3.536
    7    HA   LEU   2           HA       LEU   2   5.901  -8.747   2.292
    8    HB2  LEU   2           2HB      LEU   2   4.074  -6.337   2.581
    9    HB3  LEU   2           3HB      LEU   2   3.583  -7.825   1.786
   10    HG   LEU   2           HG       LEU   2   4.446  -7.647   4.708
   11   HD11  LEU   2          1HD1      LEU   2   2.045  -7.903   5.194
   12   HD12  LEU   2          2HD1      LEU   2   2.356  -6.420   4.279
   13   HD13  LEU   2          3HD1      LEU   2   1.675  -7.841   3.456
   14   HD21  LEU   2          3HD2      LEU   2   3.152  -9.899   3.098
   15   HD22  LEU   2          1HD2      LEU   2   4.783  -9.913   3.808
   16   HD23  LEU   2          2HD2      LEU   2   3.368  -9.892   4.860
   17    HA   PRO   3           HA       PRO   3   6.665  -7.325  -1.922
   18    HB2  PRO   3           2HB      PRO   3   5.425  -9.243  -3.389
   19    HB3  PRO   3           3HB      PRO   3   6.884  -9.598  -2.412
   20    HG2  PRO   3           2HG      PRO   3   3.982 -10.052  -1.653
   21    HG3  PRO   3           3HG      PRO   3   5.344 -11.212  -1.539
   22    HD2  PRO   3           2HD      PRO   3   4.494  -9.699   0.585
   23    HD3  PRO   3           3HD      PRO   3   6.214 -10.142   0.373
   24    H    ARG   4           H        ARG   4   5.546  -6.302  -3.646
   25    HA   ARG   4           HA       ARG   4   3.459  -4.595  -2.902
   26    HB2  ARG   4           2HB      ARG   4   4.369  -5.453  -5.680
   27    HB3  ARG   4           3HB      ARG   4   3.261  -4.110  -5.379
   28    HG2  ARG   4           2HG      ARG   4   4.947  -2.943  -4.032
   29    HG3  ARG   4           3HG      ARG   4   6.095  -4.267  -4.252
   30    HD2  ARG   4           2HD      ARG   4   4.928  -2.575  -6.504
   31    HD3  ARG   4           3HD      ARG   4   6.497  -2.301  -5.764
   32    HE   ARG   4           HE       ARG   4   5.761  -4.397  -7.681
   33   HH11  ARG   4          2HH1      ARG   4   8.238  -3.447  -5.384
   34   HH12  ARG   4          1HH1      ARG   4   9.435  -4.474  -6.123
   35   HH21  ARG   4          1HH2      ARG   4   7.336  -5.679  -8.563
   36   HH22  ARG   4          2HH2      ARG   4   8.932  -5.698  -7.873
   37    H    LYS   5           H        LYS   5   3.089  -7.680  -4.597
   38    HA   LYS   5           HA       LYS   5   0.292  -7.396  -5.192
   39    HB2  LYS   5           2HB      LYS   5   0.352  -9.706  -5.823
   40    HB3  LYS   5           3HB      LYS   5   1.812  -8.904  -6.399
   41    HG2  LYS   5           2HG      LYS   5   3.046  -9.857  -4.391
   42    HG3  LYS   5           3HG      LYS   5   1.587 -10.769  -3.993
   43    HD2  LYS   5           2HD      LYS   5   3.158 -11.007  -6.593
   44    HD3  LYS   5           3HD      LYS   5   3.282 -12.104  -5.210
   45    HE2  LYS   5           2HE      LYS   5   0.866 -12.672  -5.441
   46    HE3  LYS   5           3HE      LYS   5   0.759 -11.613  -6.854
   47    HZ1  LYS   5           HZ1      LYS   5   2.494 -14.017  -6.661
   48    HZ2  LYS   5           HZ2      LYS   5   1.105 -13.922  -7.509
   49    HZ3  LYS   5           HZ3      LYS   5   2.396 -13.037  -7.965
   50    H    ILE   6           H        ILE   6   1.828  -8.225  -2.209
   51    HA   ILE   6           HA       ILE   6  -0.782  -9.076  -1.002
   52    HB   ILE   6           HB       ILE   6   2.029  -9.216   0.153
   53   HG12  ILE   6          2HG1      ILE   6   0.196 -11.426  -0.904
   54   HG13  ILE   6          3HG1      ILE   6   1.655 -10.837  -1.697
   55   HG21  ILE   6          1HG2      ILE   6   0.254  -8.869   1.877
   56   HG22  ILE   6          2HG2      ILE   6  -0.631 -10.264   1.236
   57   HG23  ILE   6          3HG2      ILE   6   0.959 -10.470   2.002
   58   HD11  ILE   6          3HD1      ILE   6   3.004 -11.581   0.284
   59   HD12  ILE   6          1HD1      ILE   6   1.536 -12.376   0.910
   60   HD13  ILE   6          2HD1      ILE   6   2.226 -12.878  -0.640
   61    H    LEU   7           H        LEU   7   1.910  -6.732  -0.605
   62    HA   LEU   7           HA       LEU   7   0.848  -5.297   1.560
   63    HB2  LEU   7           2HB      LEU   7   3.176  -5.229   0.670
   64    HB3  LEU   7           3HB      LEU   7   2.605  -4.338  -0.737
   65    HG   LEU   7           HG       LEU   7   1.993  -2.419   0.680
   66   HD11  LEU   7          1HD1      LEU   7   2.714  -2.352   3.064
   67   HD12  LEU   7          2HD1      LEU   7   1.407  -3.503   2.799
   68   HD13  LEU   7          3HD1      LEU   7   3.076  -4.089   2.993
   69   HD21  LEU   7          3HD2      LEU   7   4.295  -2.627  -0.235
   70   HD22  LEU   7          1HD2      LEU   7   4.266  -1.750   1.304
   71   HD23  LEU   7          2HD2      LEU   7   4.807  -3.444   1.256
   72    H    CYS   8           H        CYS   8   0.013  -5.031  -1.862
   73    HA   CYS   8           HA       CYS   8  -1.484  -2.600  -1.812
   74    HB2  CYS   8           2HB      CYS   8  -0.804  -3.651  -3.845
   75    HB3  CYS   8           3HB      CYS   8  -1.626  -5.149  -3.450
   76    H    ALA   9           H        ALA   9  -2.433  -5.915  -0.791
   77    HA   ALA   9           HA       ALA   9  -5.253  -5.234  -0.475
   78    HB1  ALA   9           3HB      ALA   9  -3.617  -7.525   0.703
   79    HB2  ALA   9           1HB      ALA   9  -5.385  -7.407   0.646
   80    HB3  ALA   9           2HB      ALA   9  -4.460  -7.551  -0.862
   81    H    ILE  10           H        ILE  10  -2.427  -5.442   1.693
   82    HA   ILE  10           HA       ILE  10  -3.753  -4.711   4.120
   83    HB   ILE  10           HB       ILE  10  -0.846  -4.256   3.337
   84   HG12  ILE  10          2HG1      ILE  10  -1.338  -6.591   2.925
   85   HG13  ILE  10          3HG1      ILE  10  -0.315  -6.416   4.321
   86   HG21  ILE  10          1HG2      ILE  10  -1.398  -3.063   5.386
   87   HG22  ILE  10          2HG2      ILE  10  -2.156  -4.514   6.073
   88   HG23  ILE  10          3HG2      ILE  10  -0.405  -4.470   5.777
   89   HD11  ILE  10          3HD1      ILE  10  -2.010  -8.152   4.668
   90   HD12  ILE  10          1HD1      ILE  10  -2.262  -6.834   5.822
   91   HD13  ILE  10          2HD1      ILE  10  -3.315  -6.988   4.392
   92    H    ALA  11           H        ALA  11  -2.066  -2.699   1.674
   93    HA   ALA  11           HA       ALA  11  -2.225  -0.198   2.921
   94    HB1  ALA  11           3HB      ALA  11  -0.975  -0.790   0.822
   95    HB2  ALA  11           1HB      ALA  11  -2.526  -0.828  -0.061
   96    HB3  ALA  11           2HB      ALA  11  -1.932   0.679   0.661
   97    H    LYS  12           H        LYS  12  -4.709  -1.866   0.988
   98    HA   LYS  12           HA       LYS  12  -6.671   0.304   1.270
   99    HB2  LYS  12           2HB      LYS  12  -6.846  -2.500   0.100
  100    HB3  LYS  12           3HB      LYS  12  -8.149  -1.296   0.047
  101    HG2  LYS  12           2HG      LYS  12  -6.656   0.293  -1.133
  102    HG3  LYS  12           3HG      LYS  12  -5.358  -0.897  -1.144
  103    HD2  LYS  12           2HD      LYS  12  -8.028  -1.141  -2.572
  104    HD3  LYS  12           3HD      LYS  12  -6.449  -0.772  -3.289
  105    HE2  LYS  12           2HE      LYS  12  -5.604  -2.997  -2.493
  106    HE3  LYS  12           3HE      LYS  12  -7.234  -3.384  -1.927
  107    HZ1  LYS  12           HZ1      LYS  12  -8.018  -3.143  -4.224
  108    HZ2  LYS  12           HZ2      LYS  12  -6.514  -2.779  -4.750
  109    HZ3  LYS  12           HZ3      LYS  12  -6.839  -4.268  -4.159
  110    H    LYS  13           H        LYS  13  -6.160  -2.871   2.855
  111    HA   LYS  13           HA       LYS  13  -8.457  -2.918   4.475
  112    HB2  LYS  13           2HB      LYS  13  -6.577  -4.680   4.038
  113    HB3  LYS  13           3HB      LYS  13  -5.670  -3.854   5.296
  114    HG2  LYS  13           2HG      LYS  13  -6.713  -5.686   6.333
  115    HG3  LYS  13           3HG      LYS  13  -7.680  -4.292   6.839
  116    HD2  LYS  13           2HD      LYS  13  -9.364  -4.835   5.070
  117    HD3  LYS  13           3HD      LYS  13  -8.342  -6.193   4.530
  118    HE2  LYS  13           2HE      LYS  13  -8.510  -7.202   6.770
  119    HE3  LYS  13           3HE      LYS  13  -9.515  -5.848   7.313
  120    HZ1  LYS  13           HZ1      LYS  13 -10.263  -7.770   5.166
  121    HZ2  LYS  13           HZ2      LYS  13 -10.881  -7.766   6.675
  122    HZ3  LYS  13           HZ3      LYS  13 -11.191  -6.521   5.667
  123    H    LYS  14           H        LYS  14  -5.319  -1.371   5.112
  124    HA   LYS  14           HA       LYS  14  -6.244  -0.207   7.680
  125    HB2  LYS  14           2HB      LYS  14  -3.590  -0.376   6.217
  126    HB3  LYS  14           3HB      LYS  14  -3.814   0.780   7.515
  127    HG2  LYS  14           2HG      LYS  14  -2.769  -1.200   8.371
  128    HG3  LYS  14           3HG      LYS  14  -4.348  -0.950   9.116
  129    HD2  LYS  14           2HD      LYS  14  -5.319  -2.770   7.796
  130    HD3  LYS  14           3HD      LYS  14  -3.841  -2.894   6.829
  131    HE2  LYS  14           2HE      LYS  14  -3.851  -4.707   8.399
  132    HE3  LYS  14           3HE      LYS  14  -2.572  -3.579   8.853
  133    HZ1  LYS  14           HZ1      LYS  14  -4.054  -2.703  10.585
  134    HZ2  LYS  14           HZ2      LYS  14  -5.254  -3.722  10.141
  135    HZ3  LYS  14           HZ3      LYS  14  -3.875  -4.310  10.778
  136    H    GLY  15           H        GLY  15  -6.393   0.820   4.438
  137    HA2  GLY  15           HA2      GLY  15  -6.971   2.839   3.482
  138    HA3  GLY  15           HA3      GLY  15  -7.244   3.515   5.092
  139    H    LYS  16           H        LYS  16  -4.167   2.077   4.217
  140    HA   LYS  16           HA       LYS  16  -2.779   4.658   4.710
  141    HB2  LYS  16           2HB      LYS  16  -2.419   2.540   6.075
  142    HB3  LYS  16           3HB      LYS  16  -1.621   1.846   4.661
  143    HG2  LYS  16           2HG      LYS  16   0.137   3.563   4.783
  144    HG3  LYS  16           3HG      LYS  16  -0.776   4.453   6.008
  145    HD2  LYS  16           2HD      LYS  16   1.047   3.276   7.057
  146    HD3  LYS  16           3HD      LYS  16  -0.483   2.570   7.596
  147    HE2  LYS  16           2HE      LYS  16  -0.196   0.696   5.995
  148    HE3  LYS  16           3HE      LYS  16   1.291   1.434   5.381
  149    HZ1  LYS  16           HZ1      LYS  16   0.899   0.476   8.170
  150    HZ2  LYS  16           HZ2      LYS  16   1.771  -0.293   7.023
  151    HZ3  LYS  16           HZ3      LYS  16   2.271   1.151   7.593
  152    H    CYS  17           H        CYS  17  -3.829   3.115   2.000
  153    HA   CYS  17           HA       CYS  17  -1.539   2.962   0.334
  154    HB2  CYS  17           2HB      CYS  17  -3.845   1.898   0.122
  155    HB3  CYS  17           3HB      CYS  17  -4.387   3.423  -0.567
  156    H    LYS  18           H        LYS  18  -0.274   4.662   0.138
  157    HA   LYS  18           HA       LYS  18  -1.207   7.222  -1.087
  158    HB2  LYS  18           2HB      LYS  18   0.391   6.920   1.504
  159    HB3  LYS  18           3HB      LYS  18   0.195   8.445   0.638
  160    HG2  LYS  18           2HG      LYS  18  -2.266   8.315   0.934
  161    HG3  LYS  18           3HG      LYS  18  -2.074   6.844   1.894
  162    HD2  LYS  18           2HD      LYS  18  -0.890   9.560   2.602
  163    HD3  LYS  18           3HD      LYS  18  -2.375   8.871   3.277
  164    HE2  LYS  18           2HE      LYS  18  -1.069   6.934   4.161
  165    HE3  LYS  18           3HE      LYS  18   0.416   7.662   3.539
  166    HZ1  LYS  18           HZ1      LYS  18   0.016   9.572   5.002
  167    HZ2  LYS  18           HZ2      LYS  18  -1.352   8.896   5.586
  168    HZ3  LYS  18           HZ3      LYS  18   0.094   8.201   5.881
  169    H    GLY  19           H        GLY  19   0.593   8.627  -1.729
  170    HA2  GLY  19           HA2      GLY  19   2.437   8.994  -3.068
  171    HA3  GLY  19           HA3      GLY  19   3.277   7.970  -1.916
  172    HA   PRO  20           HA       PRO  20   3.768   5.607  -5.801
  173    HB2  PRO  20           2HB      PRO  20   5.484   3.666  -4.916
  174    HB3  PRO  20           3HB      PRO  20   5.995   5.343  -5.275
  175    HG2  PRO  20           2HG      PRO  20   5.291   4.152  -2.573
  176    HG3  PRO  20           3HG      PRO  20   6.726   5.134  -3.011
  177    HD2  PRO  20           2HD      PRO  20   4.534   6.231  -1.838
  178    HD3  PRO  20           3HD      PRO  20   5.457   7.125  -3.086
  179    H    LEU  21           H        LEU  21   2.850   4.148  -2.631
  180    HA   LEU  21           HA       LEU  21   2.012   1.642  -3.713
  181    HB2  LEU  21           2HB      LEU  21   2.383   2.637  -1.189
  182    HB3  LEU  21           3HB      LEU  21   0.638   2.718  -1.273
  183    HG   LEU  21           HG       LEU  21   1.268   0.680  -0.211
  184   HD11  LEU  21          1HD1      LEU  21   0.272  -1.062  -1.527
  185   HD12  LEU  21          2HD1      LEU  21  -0.620   0.438  -1.832
  186   HD13  LEU  21          3HD1      LEU  21   0.541  -0.172  -3.036
  187   HD21  LEU  21          3HD2      LEU  21   2.990  -0.004  -2.629
  188   HD22  LEU  21          1HD2      LEU  21   3.576   0.508  -1.030
  189   HD23  LEU  21          2HD2      LEU  21   2.703  -1.023  -1.210
  190    H    LYS  22           H        LYS  22   0.306   4.685  -3.269
  191    HA   LYS  22           HA       LYS  22  -2.359   3.860  -4.008
  192    HB2  LYS  22           2HB      LYS  22  -1.678   5.989  -2.867
  193    HB3  LYS  22           3HB      LYS  22  -1.056   6.571  -4.421
  194    HG2  LYS  22           2HG      LYS  22  -3.511   6.112  -5.272
  195    HG3  LYS  22           3HG      LYS  22  -3.908   6.038  -3.541
  196    HD2  LYS  22           2HD      LYS  22  -2.757   8.292  -3.305
  197    HD3  LYS  22           3HD      LYS  22  -2.703   8.358  -5.072
  198    HE2  LYS  22           2HE      LYS  22  -5.211   8.163  -3.339
  199    HE3  LYS  22           3HE      LYS  22  -4.597   9.634  -4.097
  200    HZ1  LYS  22           HZ1      LYS  22  -6.317   8.721  -5.465
  201    HZ2  LYS  22           HZ2      LYS  22  -4.918   8.490  -6.280
  202    HZ3  LYS  22           HZ3      LYS  22  -5.656   7.238  -5.496
  203    H    LEU  23           H        LEU  23   0.382   4.933  -5.957
  204    HA   LEU  23           HA       LEU  23  -1.043   4.724  -8.488
  205    HB2  LEU  23           2HB      LEU  23   0.883   6.219  -8.141
  206    HB3  LEU  23           3HB      LEU  23   1.930   4.833  -7.848
  207    HG   LEU  23           HG       LEU  23   1.590   4.058 -10.181
  208   HD11  LEU  23          1HD1      LEU  23   0.001   6.647 -10.498
  209   HD12  LEU  23          2HD1      LEU  23   0.565   5.616 -11.833
  210   HD13  LEU  23          3HD1      LEU  23  -0.627   4.993 -10.692
  211   HD21  LEU  23          3HD2      LEU  23   2.471   6.965  -9.949
  212   HD22  LEU  23          1HD2      LEU  23   3.474   5.539  -9.603
  213   HD23  LEU  23          2HD2      LEU  23   2.902   5.834 -11.253
  214    H    VAL  24           H        VAL  24   1.204   2.547  -6.753
  215    HA   VAL  24           HA       VAL  24   1.360   0.452  -8.689
  216    HB   VAL  24           HB       VAL  24   1.717   0.537  -5.675
  217   HG11  VAL  24          1HG1      VAL  24   2.433  -1.789  -7.499
  218   HG12  VAL  24          2HG1      VAL  24   2.952  -1.584  -5.808
  219   HG13  VAL  24          3HG1      VAL  24   1.248  -1.811  -6.169
  220   HG21  VAL  24          3HG2      VAL  24   3.793   0.262  -7.886
  221   HG22  VAL  24          1HG2      VAL  24   3.341   1.805  -7.151
  222   HG23  VAL  24          2HG2      VAL  24   4.074   0.554  -6.149
  223    H    CYS  25           H        CYS  25  -0.913   0.971  -6.034
  224    HA   CYS  25           HA       CYS  25  -2.301  -1.606  -6.530
  225    HB2  CYS  25           2HB      CYS  25  -1.310  -0.966  -4.340
  226    HB3  CYS  25           3HB      CYS  25  -2.401   0.405  -4.264
  227    H    LYS  26           H        LYS  26  -2.632   1.617  -7.338
  228    HA   LYS  26           HA       LYS  26  -4.191   3.025  -8.057
  229    HB2  LYS  26           2HB      LYS  26  -4.302   0.822  -9.616
  230    HB3  LYS  26           3HB      LYS  26  -5.998   0.915  -9.162
  231    HG2  LYS  26           2HG      LYS  26  -4.301   3.190 -10.286
  232    HG3  LYS  26           3HG      LYS  26  -5.365   2.162 -11.254
  233    HD2  LYS  26           2HD      LYS  26  -7.344   2.982 -10.039
  234    HD3  LYS  26           3HD      LYS  26  -6.319   3.997  -9.000
  235    HE2  LYS  26           2HE      LYS  26  -5.517   5.257 -10.932
  236    HE3  LYS  26           3HE      LYS  26  -6.458   4.234 -12.030
  237    HZ1  LYS  26           HZ1      LYS  26  -7.621   5.999  -9.936
  238    HZ2  LYS  26           HZ2      LYS  26  -7.624   6.309 -11.538
  239    HZ3  LYS  26           HZ3      LYS  26  -8.486   5.055 -10.954
  240    H    CYS  27           H        CYS  27  -4.464   3.475  -5.818
  241    HA   CYS  27           HA       CYS  27  -7.027   2.625  -4.564
  242    HB2  CYS  27           2HB      CYS  27  -4.622   4.062  -3.413
  243    HB3  CYS  27           3HB      CYS  27  -6.052   3.602  -2.517