NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
16636 2ai6 6625 cing 1-original 7 AMBER distance NOE simple


#
#  120 TRP  HD1         120 TRP  HE1         2.80    (#      8:10  Unique         2.55, 2.55 A)
 &rst
  ixpk= 8, nxpk= 10, iat=1825,1827, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:9      120 TRP  HE1         3.50    (#      9:10  Single Ambig)
 &rst
  ixpk= 9, nxpk= 10, iat=  -1,1827, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1542,1821,1822,1821,1822,
 &end
#
#  103 ALA  MB          120 TRP  HE1         3.50    (#     10:10  Unique         3.72, 4.50 A)
 &rst
  ixpk= 10, nxpk= 10, iat=  -1,1827, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1544,1545,1546,
 &end
#
#    0 AMB  10-2:11     120 TRP  HE1         4.50    (#     11:10  Single Ambig)
 &rst
  ixpk= 11, nxpk= 10, iat=  -1,1827, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1586,1587,1588,1809,1810,1811,
 &end
#
#  117 GLU  HA          118 VAL  HN          2.80    (#     14:10  Unique         2.36, 2.45 A)
 &rst
  ixpk= 14, nxpk= 10, iat=1774,1787, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:15     118 VAL  HN          3.50    (#     15:10  Single Ambig)
 &rst
  ixpk= 15, nxpk= 10, iat=  -1,1787, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1791,1776,1777,
 &end
#
#  117 GLU  HG-         118 VAL  HN          5.50    (#     16:10  Unique         2.01, 2.31 A)
 &rst
  ixpk= 16, nxpk= 10, iat=  -1,1787, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1779,1780,
 &end
#
#    0 AMB  10-2:17     118 VAL  HN          4.50    (#     17:10  Single Ambig)
 &rst
  ixpk= 17, nxpk= 10, iat=  -1,1787, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1793,1794,1795,1797,1798,1799,1793,1794,1795,1797,
      1798,1799,
 &end
#
#  118 VAL  HA          118 VAL  HN          4.50    (#     18:10  Unique         2.90, 2.92 A)
 &rst
  ixpk= 18, nxpk= 10, iat=1789,1787, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  117 GLU  HG+         118 VAL  HN          4.50    (#     19:10  Unique         2.01, 2.31 A)
 &rst
  ixpk= 19, nxpk= 10, iat=  -1,1787, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1779,1780,
 &end
#
#   90 VAL  HA           90 VAL  HN          5.50    (#     21:10  Unique         2.98, 2.98 A)
 &rst
  ixpk= 21, nxpk= 10, iat=1353,1351, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   45 ARG  HA           45 ARG  HN          4.50    (#     24:10  Unique         2.96, 2.97 A)
 &rst
  ixpk= 24, nxpk= 10, iat= 662, 660, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   45 ARG  HB2          45 ARG  HN          3.50    (#     26:10  Unique         2.68, 2.76 A)
 &rst
  ixpk= 26, nxpk= 10, iat= 664, 660, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:27      45 ARG  HN          4.50    (#     27:10  Single Ambig)
 &rst
  ixpk= 27, nxpk= 10, iat=  -1, 660, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 667, 668, 350, 351,
 &end
#
#   45 ARG  HG+          45 ARG  HN          4.50    (#     28:10  Unique         3.26, 3.93 A)
 &rst
  ixpk= 28, nxpk= 10, iat=  -1, 660, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 667, 668,
 &end
#
#    0 AMB  10-2:29      45 ARG  HN          3.50    (#     29:10  Single Ambig)
 &rst
  ixpk= 29, nxpk= 10, iat=  -1, 660, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 650, 651, 652, 654, 655, 656, 923, 924, 925, 927,
       928, 929, 849, 850, 851,
 &end
#
#    0 AMB  10-2:30      45 ARG  HN          3.50    (#     30:10  Single Ambig)
 &rst
  ixpk= 30, nxpk= 10, iat=  -1, 660, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 336, 337, 338, 340, 341, 342, 336, 337, 338, 340,
       341, 342, 371, 372, 373, 856, 857, 858, 355, 356,
       357, 359, 360, 361,
 &end
#
#   44 VAL  MGX          45 ARG  HN          3.50    (#     31:10  Unique         3.29, 4.55 A)
 &rst
  ixpk= 31, nxpk= 10, iat=  -1, 660, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 650, 651, 652, 654, 655, 656,
 &end
#
#  120 TRP  HA           90 VAL  HN          3.50    (#     34:10  Unique         2.29, 2.36 A)
 &rst
  ixpk= 34, nxpk= 10, iat=1819,1351, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   89 HIS  HA           90 VAL  HN          2.80    (#     35:10  Unique         2.30, 2.33 A)
 &rst
  ixpk= 35, nxpk= 10, iat=1336,1351, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  120 TRP  HB+          90 VAL  HN          3.50    (#     36:10  Unique         3.56, 3.86 A)
 &rst
  ixpk= 36, nxpk= 10, iat=  -1,1351, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1821,1822,
 &end
#
#   90 VAL  HB           90 VAL  HN          3.50    (#     37:10  Unique         2.73, 2.78 A)
 &rst
  ixpk= 37, nxpk= 10, iat=1355,1351, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   90 VAL  MGX          90 VAL  HN          3.50    (#     38:10  Unique         2.55, 4.10 A)
 &rst
  ixpk= 38, nxpk= 10, iat=  -1,1351, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1357,1358,1359,1361,1362,1363,
 &end
#
#   90 VAL  MGY          90 VAL  HN          3.50    (#     39:10  Unique         2.55, 4.10 A)
 &rst
  ixpk= 39, nxpk= 10, iat=  -1,1351, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1357,1358,1359,1361,1362,1363,
 &end
#
#   75 GLY  HN           74 LEU  HN          3.50    (#     40:10  Unique         2.34, 2.39 A)
 &rst
  ixpk= 40, nxpk= 10, iat=1122,1103, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   74 LEU  HB2          74 LEU  HN          3.50    (#     41:10  Unique         2.46, 2.47 A)
 &rst
  ixpk= 41, nxpk= 10, iat=1107,1103, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   74 LEU  MDY          74 LEU  HN          4.50    (#     42:10  Unique         3.47, 4.48 A)
 &rst
  ixpk= 42, nxpk= 10, iat=  -1,1103, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1112,1113,1114,1116,1117,1118,
 &end
#
#   74 LEU  HA           74 LEU  HN          4.50    (#     44:10  Unique         2.92, 2.93 A)
 &rst
  ixpk= 44, nxpk= 10, iat=1105,1103, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   73 CYS  HA           74 LEU  HN          2.80    (#     45:10  Unique         2.18, 2.19 A)
 &rst
  ixpk= 45, nxpk= 10, iat=1094,1103, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:46      74 LEU  HN          3.50    (#     46:10  Single Ambig)
 &rst
  ixpk= 46, nxpk= 10, iat=  -1,1103, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1108, 389,
 &end
#
#   74 LEU  HG           74 LEU  HN          3.50    (#     47:10  Unique         2.48, 2.52 A)
 &rst
  ixpk= 47, nxpk= 10, iat=1110,1103, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:48      74 LEU  HN          4.50    (#     48:10  Single Ambig)
 &rst
  ixpk= 48, nxpk= 10, iat=  -1,1103, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 336, 337, 338, 340, 341, 342, 336, 337, 338, 340,
       341, 342, 378, 379, 380,
 &end
#
#    0 AMB  10-2:49      74 LEU  HN          3.50    (#     49:10  Single Ambig)
 &rst
  ixpk= 49, nxpk= 10, iat=  -1,1103, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 355, 356, 357, 359, 360, 361,1112,1113,1114,1116,
      1117,1118,
 &end
#
#   26 ARG  HN           74 LEU  HN          4.50    (#     51:10  Unique         3.39, 3.45 A)
 &rst
  ixpk= 51, nxpk= 10, iat= 384,1103, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    4 ALA  HA            4 ALA  HN          3.50    (#     57:10  Unique         2.84, 2.89 A)
 &rst
  ixpk= 57, nxpk= 10, iat=  49,  47, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    3 VAL  HA            4 ALA  HN          2.80    (#     58:10  Unique         2.18, 2.27 A)
 &rst
  ixpk= 58, nxpk= 10, iat=  33,  47, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    4 ALA  MB            4 ALA  HN          3.50    (#     59:10  Unique         2.49, 3.10 A)
 &rst
  ixpk= 59, nxpk= 10, iat=  -1,  47, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  51,  52,  53,
 &end
#
#    0 AMB  10-2:60       4 ALA  HN          4.50    (#     60:10  Single Ambig)
 &rst
  ixpk= 60, nxpk= 10, iat=  -1,  47, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=  37,  38,  39,  41,  42,  43,  37,  38,  39,  41,
        42,  43,
 &end
#
#    0 AMB  10-2:61       4 ALA  HN          5.50    (#     61:10  Single Ambig)
 &rst
  ixpk= 61, nxpk= 10, iat=  -1,  47, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  31,  57,
 &end
#
#    0 AMB  10-2:62       4 ALA  HN          4.50    (#     62:10  Single Ambig)
 &rst
  ixpk= 62, nxpk= 10, iat=  -1,  47, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 466, 467,  35,
 &end
#
#   73 CYS  HA           26 ARG  HN          5.50    (#     70:10  Unique         3.38, 3.48 A)
 &rst
  ixpk= 70, nxpk= 10, iat=1094, 384, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:71      26 ARG  HN          3.50    (#     71:10  Single Ambig)
 &rst
  ixpk= 71, nxpk= 10, iat=  -1, 384, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 388, 617, 618,
 &end
#
#   74 LEU  HG           26 ARG  HN          3.50    (#     72:10  Unique         2.78, 2.86 A)
 &rst
  ixpk= 72, nxpk= 10, iat=1110, 384, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   74 LEU  HN           26 ARG  HN          5.50    (#     74:10  Unique         3.39, 3.45 A)
 &rst
  ixpk= 74, nxpk= 10, iat=1103, 384, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   72 GLU  HN           26 ARG  HN          3.50    (#     75:10  Unique         2.82, 2.90 A)
 &rst
  ixpk= 75, nxpk= 10, iat=1077, 384, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:77      26 ARG  HN          3.50    (#     77:10  Single Ambig)
 &rst
  ixpk= 77, nxpk= 10, iat=  -1, 384, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 378, 379, 380, 391, 392, 414, 415, 416, 418, 419,
       420, 336, 337, 338, 340, 341, 342,
 &end
#
#    0 AMB  10-2:78      26 ARG  HN          3.50    (#     78:10  Single Ambig)
 &rst
  ixpk= 78, nxpk= 10, iat=  -1, 384, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1112,1113,1114,1116,1117,1118, 355, 356, 357, 359,
       360, 361,
 &end
#
#   26 ARG  HA           26 ARG  HN          4.50    (#     79:10  Unique         2.93, 2.94 A)
 &rst
  ixpk= 79, nxpk= 10, iat= 386, 384, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   26 ARG  HB3          26 ARG  HN          3.50    (#     80:10  Unique         2.30, 2.40 A)
 &rst
  ixpk= 80, nxpk= 10, iat= 389, 384, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   74 LEU  MDY          26 ARG  HN          4.50    (#     81:10  Unique         3.85, 4.78 A)
 &rst
  ixpk= 81, nxpk= 10, iat=  -1, 384, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1112,1113,1114,1116,1117,1118,
 &end
#
#   51 GLU  HA           51 GLU  HN          3.50    (#     82:10  Unique         2.83, 2.85 A)
 &rst
  ixpk= 82, nxpk= 10, iat= 770, 768, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:83      51 GLU  HN          2.80    (#     83:10  Single Ambig)
 &rst
  ixpk= 83, nxpk= 10, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 772, 773, 775, 776,
 &end
#
#   52 TYR  HN           51 GLU  HN          3.50    (#     85:10  Unique         2.72, 2.76 A)
 &rst
  ixpk= 85, nxpk= 10, iat= 783, 768, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   50 ALA  HA           51 GLU  HN          2.80    (#     86:10  Unique         2.32, 2.34 A)
 &rst
  ixpk= 86, nxpk= 10, iat= 760, 768, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:87      51 GLU  HN          3.50    (#     87:10  Single Ambig)
 &rst
  ixpk= 87, nxpk= 10, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 772, 773, 775, 776,
 &end
#
#    0 AMB  10-2:88      51 GLU  HN          4.50    (#     88:10  Single Ambig)
 &rst
  ixpk= 88, nxpk= 10, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 762, 763, 764, 849, 850, 851,
 &end
#
#    0 AMB  10-2:89      51 GLU  HN          5.50    (#     89:10  Single Ambig)
 &rst
  ixpk= 89, nxpk= 10, iat=  -1, 768, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 753, 831,
 &end
#
#    0 AMB  10-2:90      25 ILE  HN          5.50    (#     90:10  Single Ambig)
 &rst
  ixpk= 90, nxpk= 10, iat=  -1, 365, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 635, 636, 923, 924, 925, 927, 928, 929,
 &end
#
#   41 LYS  HN           27 VAL  HN          3.50    (#     92:10  Unique         2.65, 2.68 A)
 &rst
  ixpk= 92, nxpk= 10, iat= 588, 408, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:93      27 VAL  HN          4.50    (#     93:10  Single Ambig)
 &rst
  ixpk= 93, nxpk= 10, iat=  -1, 408, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 617, 618, 614, 615,1081,1082,
 &end
#
#    0 AMB  10-2:94      27 VAL  HN          4.50    (#     94:10  Single Ambig)
 &rst
  ixpk= 94, nxpk= 10, iat=  -1, 408, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 631, 632, 633, 130, 131, 132,1112,1113,1114,1116,
      1117,1118, 123, 124, 125,
 &end
#
#   42 GLU  HA           27 VAL  HN          3.50    (#     95:10  Unique         3.33, 3.42 A)
 &rst
  ixpk= 95, nxpk= 10, iat= 612, 408, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   26 ARG  HA           27 VAL  HN          2.80    (#     96:10  Unique         2.24, 2.27 A)
 &rst
  ixpk= 96, nxpk= 10, iat= 386, 408, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   27 VAL  HA           27 VAL  HN          4.50    (#     97:10  Unique         2.96, 2.97 A)
 &rst
  ixpk= 97, nxpk= 10, iat= 410, 408, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   26 ARG  HG+          27 VAL  HN          3.50    (#     99:10  Unique         2.47, 2.81 A)
 &rst
  ixpk= 99, nxpk= 10, iat=  -1, 408, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 391, 392,
 &end
#
#   43 ILE  HN           25 ILE  HN          3.50    (#    101:10  Unique         2.86, 2.92 A)
 &rst
  ixpk= 101, nxpk= 10, iat= 625, 365, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   24 LEU  HA           25 ILE  HN          2.80    (#    103:10  Unique         2.26, 2.27 A)
 &rst
  ixpk= 103, nxpk= 10, iat= 348, 365, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:104     25 ILE  HN          3.50    (#    104:10  Single Ambig)
 &rst
  ixpk= 104, nxpk= 10, iat=  -1, 365, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 375, 376, 369,
 &end
#
#    0 AMB  10-2:105     25 ILE  HN          3.50    (#    105:10  Single Ambig)
 &rst
  ixpk= 105, nxpk= 10, iat=  -1, 365, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 635, 636, 353,
 &end
#
#   43 ILE  HG1+         25 ILE  HN          4.50    (#    106:10  Unique         3.16, 3.52 A)
 &rst
  ixpk= 106, nxpk= 10, iat=  -1, 365, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 635, 636,
 &end
#
#    0 AMB  10-2:107     25 ILE  HN          2.80    (#    107:10  Single Ambig)
 &rst
  ixpk= 107, nxpk= 10, iat=  -1, 365, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 371, 372, 373, 355, 356, 357, 359, 360, 361,
 &end
#
#   29 SER  HA           30 ALA  HN          2.80    (#    113:10  Unique         2.34, 2.59 A)
 &rst
  ixpk= 113, nxpk= 10, iat= 443, 452, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   29 SER  HB+          30 ALA  HN          5.50    (#    114:10  Unique         1.93, 4.09 A)
 &rst
  ixpk= 114, nxpk= 10, iat=  -1, 452, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 445, 446,
 &end
#
#    0 AMB  10-2:115     30 ALA  HN          5.50    (#    115:10  Single Ambig)
 &rst
  ixpk= 115, nxpk= 10, iat=  -1, 452, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 441,  69,
 &end
#
#    0 AMB  10-2:116     30 ALA  HN          2.80    (#    116:10  Single Ambig)
 &rst
  ixpk= 116, nxpk= 10, iat=  -1, 452, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 456, 457, 458, 522, 523, 524, 546, 547, 548,
 &end
#
#    0 AMB  10-2:117     13 ASP  HN          4.50    (#    117:10  Single Ambig)
 &rst
  ixpk= 117, nxpk= 10, iat=  -1, 178, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 190, 162,
 &end
#
#   45 ARG  HE           13 ASP  HN          3.50    (#    119:10  Unique         2.40, 2.67 A)
 &rst
  ixpk= 119, nxpk= 10, iat= 673, 178, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:120     13 ASP  HN          4.50    (#    120:10  Single Ambig)
 &rst
  ixpk= 120, nxpk= 10, iat=  -1, 178, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 662, 192,
 &end
#
#   13 ASP  HA           13 ASP  HN          4.50    (#    121:10  Unique         2.86, 2.88 A)
 &rst
  ixpk= 121, nxpk= 10, iat= 180, 178, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   12 VAL  HA           13 ASP  HN          2.80    (#    122:10  Unique         2.19, 2.22 A)
 &rst
  ixpk= 122, nxpk= 10, iat= 164, 178, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   13 ASP  HB2          13 ASP  HN          4.50    (#    123:10  Unique         3.49, 3.54 A)
 &rst
  ixpk= 123, nxpk= 10, iat= 182, 178, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   44 VAL  MGY          13 ASP  HN          4.50    (#    124:10  Unique         3.94, 5.77 A)
 &rst
  ixpk= 124, nxpk= 10, iat=  -1, 178, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 650, 651, 652, 654, 655, 656,
 &end
#
#    0 AMB  10-2:125     13 ASP  HN          3.50    (#    125:10  Single Ambig)
 &rst
  ixpk= 125, nxpk= 10, iat=  -1, 178, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 168, 169, 170, 172, 173, 174, 200, 201,
 &end
#
#    0 AMB  10-2:126     13 ASP  HN          3.50    (#    126:10  Single Ambig)
 &rst
  ixpk= 126, nxpk= 10, iat=  -1, 178, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 168, 169, 170, 172, 173, 174, 196, 197, 198, 650,
       651, 652, 654, 655, 656,
 &end
#
#   13 ASP  HB3          13 ASP  HN          4.50    (#    127:10  Unique         3.02, 3.07 A)
 &rst
  ixpk= 127, nxpk= 10, iat= 183, 178, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:128     13 ASP  HN          4.50    (#    128:10  Single Ambig)
 &rst
  ixpk= 128, nxpk= 10, iat=  -1, 178, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 648, 629,
 &end
#
#    0 AMB  10-2:131    100 ALA  HN          4.50    (#    131:10  Single Ambig)
 &rst
  ixpk= 131, nxpk= 10, iat=  -1,1496, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1533, 319, 324,
 &end
#
#   99 PRO  HA          100 ALA  HN          3.50    (#    133:10  Unique         2.15, 2.17 A)
 &rst
  ixpk= 133, nxpk= 10, iat=1492,1496, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  100 ALA  HA          100 ALA  HN          3.50    (#    134:10  Unique         2.90, 2.93 A)
 &rst
  ixpk= 134, nxpk= 10, iat=1498,1496, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  100 ALA  MB          100 ALA  HN          2.80    (#    135:10  Unique         2.25, 2.86 A)
 &rst
  ixpk= 135, nxpk= 10, iat=  -1,1496, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1500,1501,1502,
 &end
#
#   76 GLY  HN          100 ALA  HN          4.50    (#    136:10  Unique         2.85, 2.93 A)
 &rst
  ixpk= 136, nxpk= 10, iat=1129,1496, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   73 CYS  HB-          73 CYS  HN          4.50    (#    139:10  Unique         2.90, 3.28 A)
 &rst
  ixpk= 139, nxpk= 10, iat=  -1,1092, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1096,1097,
 &end
#
#    0 AMB  10-2:140     73 CYS  HN          3.50    (#    140:10  Single Ambig)
 &rst
  ixpk= 140, nxpk= 10, iat=  -1,1092, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1096,1097,1081,1082,
 &end
#
#   24 LEU  HA           24 LEU  HN          4.50    (#    141:10  Unique         2.98, 2.98 A)
 &rst
  ixpk= 141, nxpk= 10, iat= 348, 346, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   23 VAL  HA           24 LEU  HN          2.80    (#    143:10  Unique         2.32, 2.35 A)
 &rst
  ixpk= 143, nxpk= 10, iat= 332, 346, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   76 GLY  HA+          24 LEU  HN          4.50    (#    144:10  Unique         3.02, 3.52 A)
 &rst
  ixpk= 144, nxpk= 10, iat=  -1, 346, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1131,1132,
 &end
#
#    0 AMB  10-2:145     24 LEU  HN          4.50    (#    145:10  Single Ambig)
 &rst
  ixpk= 145, nxpk= 10, iat=  -1, 346, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1096,1097, 334,
 &end
#
#   24 LEU  HB+          24 LEU  HN          3.50    (#    146:10  Unique         2.50, 2.72 A)
 &rst
  ixpk= 146, nxpk= 10, iat=  -1, 346, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 350, 351,
 &end
#
#   24 LEU  HB-          24 LEU  HN          3.50    (#    147:10  Unique         2.50, 2.72 A)
 &rst
  ixpk= 147, nxpk= 10, iat=  -1, 346, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 350, 351,
 &end
#
#    0 AMB  10-2:148     24 LEU  HN          3.50    (#    148:10  Single Ambig)
 &rst
  ixpk= 148, nxpk= 10, iat=  -1, 346, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 336, 337, 338, 340, 341, 342, 336, 337, 338, 340,
       341, 342,
 &end
#
#    0 AMB  10-2:149     24 LEU  HN          3.50    (#    149:10  Single Ambig)
 &rst
  ixpk= 149, nxpk= 10, iat=  -1, 346, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1500,1501,1502, 355, 356, 357, 359, 360, 361,
 &end
#
#    0 AMB  10-2:151    102 HIS  HN          4.50    (#    151:10  Single Ambig)
 &rst
  ixpk= 151, nxpk= 10, iat=  -1,1523, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1836,1533, 319, 324,
 &end
#
#  102 HIS  HB3         102 HIS  HN          4.50    (#    152:10  Unique         3.58, 3.59 A)
 &rst
  ixpk= 152, nxpk= 10, iat=1528,1523, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:153    102 HIS  HN          4.50    (#    153:10  Single Ambig)
 &rst
  ixpk= 153, nxpk= 10, iat=  -1,1523, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1510,1511,1554,1355,
 &end
#
#  103 ALA  MB          102 HIS  HN          5.50    (#    154:10  Unique         5.02, 5.58 A)
 &rst
  ixpk= 154, nxpk= 10, iat=  -1,1523, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1544,1545,1546,
 &end
#
#    0 AMB  10-2:155    102 HIS  HN          4.50    (#    155:10  Single Ambig)
 &rst
  ixpk= 155, nxpk= 10, iat=  -1,1523, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1500,1501,1502, 355, 356, 357, 359, 360, 361,
 &end
#
#    0 AMB  10-2:159    102 HIS  HN          2.80    (#    159:10  Single Ambig)
 &rst
  ixpk= 159, nxpk= 10, iat=  -1,1523, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1508,1525,
 &end
#
#  102 HIS  HB2         102 HIS  HN          3.50    (#    160:10  Unique         2.61, 2.63 A)
 &rst
  ixpk= 160, nxpk= 10, iat=1527,1523, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  103 ALA  HN          102 HIS  HN          4.50    (#    161:10  Unique         2.86, 2.90 A)
 &rst
  ixpk= 161, nxpk= 10, iat=1540,1523, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    7 ALA  HN            6 LEU  HN          3.50    (#    162:10  Unique         2.88, 2.91 A)
 &rst
  ixpk= 162, nxpk= 10, iat=  88,  69, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    5 ASP  HA            6 LEU  HN          2.80    (#    164:10  Unique         2.32, 2.37 A)
 &rst
  ixpk= 164, nxpk= 10, iat=  59,  69, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:165      6 LEU  HN          3.50    (#    165:10  Single Ambig)
 &rst
  ixpk= 165, nxpk= 10, iat=  -1,  69, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  71, 463, 464,
 &end
#
#    6 LEU  HB2           6 LEU  HN          2.80    (#    166:10  Unique         2.35, 2.44 A)
 &rst
  ixpk= 166, nxpk= 10, iat=  73,  69, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    6 LEU  HG            6 LEU  HN          2.80    (#    167:10  Unique         2.30, 2.34 A)
 &rst
  ixpk= 167, nxpk= 10, iat=  76,  69, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    6 LEU  HB3           6 LEU  HN          3.50    (#    168:10  Unique         3.52, 3.55 A)
 &rst
  ixpk= 168, nxpk= 10, iat=  74,  69, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    6 LEU  MDY           6 LEU  HN          4.50    (#    169:10  Unique         3.13, 4.33 A)
 &rst
  ixpk= 169, nxpk= 10, iat=  -1,  69, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  78,  79,  80,  82,  83,  84,
 &end
#
#    5 ASP  HB+           6 LEU  HN          5.50    (#    170:10  Unique         3.83, 3.92 A)
 &rst
  ixpk= 170, nxpk= 10, iat=  -1,  69, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  61,  62,
 &end
#
#    5 ASP  HB-           6 LEU  HN          5.50    (#    171:10  Unique         3.83, 3.92 A)
 &rst
  ixpk= 171, nxpk= 10, iat=  -1,  69, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  61,  62,
 &end
#
#    6 LEU  MDX           6 LEU  HN          4.50    (#    172:10  Unique         3.13, 4.33 A)
 &rst
  ixpk= 172, nxpk= 10, iat=  -1,  69, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  78,  79,  80,  82,  83,  84,
 &end
#
#   52 TYR  HA           53 HIS  HN          4.50    (#    175:10  Unique         2.19, 2.22 A)
 &rst
  ixpk= 175, nxpk= 10, iat= 785, 804, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   53 HIS  HB-          53 HIS  HN          7.00    (#    177:10  Unique         2.67, 3.16 A)
 &rst
  ixpk= 177, nxpk= 10, iat=  -1, 804, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 808, 809,
 &end
#
#   53 HIS  HA           53 HIS  HN          5.50    (#    178:10  Unique         2.76, 2.78 A)
 &rst
  ixpk= 178, nxpk= 10, iat= 806, 804, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   34 GLY  HA+          35 ALA  HN          4.50    (#    185:10  Unique         2.62, 3.32 A)
 &rst
  ixpk= 185, nxpk= 10, iat=  -1, 518, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 513, 514,
 &end
#
#   34 GLY  HA-          35 ALA  HN          4.50    (#    186:10  Unique         2.62, 3.32 A)
 &rst
  ixpk= 186, nxpk= 10, iat=  -1, 518, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 513, 514,
 &end
#
#    0 AMB  10-2:187     35 ALA  HN          4.50    (#    187:10  Single Ambig)
 &rst
  ixpk= 187, nxpk= 10, iat=  -1, 518, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 463, 464, 529, 530,
 &end
#
#    0 AMB  10-2:188     35 ALA  HN          2.80    (#    188:10  Single Ambig)
 &rst
  ixpk= 188, nxpk= 10, iat=  -1, 518, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 522, 523, 524, 456, 457, 458,
 &end
#
#    0 AMB  10-2:193     38 ALA  HN          3.50    (#    193:10  Single Ambig)
 &rst
  ixpk= 193, nxpk= 10, iat=  -1, 552, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 544, 554,
 &end
#
#   38 ALA  MB           38 ALA  HN          3.50    (#    194:10  Unique         2.83, 3.38 A)
 &rst
  ixpk= 194, nxpk= 10, iat=  -1, 552, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 556, 557, 558,
 &end
#
#   52 TYR  HB+          54 ALA  HN          4.50    (#    200:10  Unique         2.64, 3.59 A)
 &rst
  ixpk= 200, nxpk= 10, iat=  -1, 821, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 787, 788,
 &end
#
#   53 HIS  HB+          54 ALA  HN          4.50    (#    201:10  Unique         2.82, 3.55 A)
 &rst
  ixpk= 201, nxpk= 10, iat=  -1, 821, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 808, 809,
 &end
#
#    0 AMB  10-2:205     82 GLN  HN          3.50    (#    205:10  Single Ambig)
 &rst
  ixpk= 205, nxpk= 10, iat=  -1,1214, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1199,1216,
 &end
#
#   82 GLN  HG+          82 GLN  HN          4.50    (#    206:10  Unique         2.48, 3.63 A)
 &rst
  ixpk= 206, nxpk= 10, iat=  -1,1214, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1221,1222,
 &end
#
#    0 AMB  10-2:207     82 GLN  HN          2.80    (#    207:10  Single Ambig)
 &rst
  ixpk= 207, nxpk= 10, iat=  -1,1214, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1218,1219,1218,1219,
 &end
#
#   27 VAL  HA           28 HIS  HN          2.80    (#    209:10  Unique         2.19, 2.24 A)
 &rst
  ixpk= 209, nxpk= 10, iat= 410, 424, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   28 HIS  HB3          28 HIS  HN          4.50    (#    210:10  Unique         3.58, 3.64 A)
 &rst
  ixpk= 210, nxpk= 10, iat= 429, 424, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 HIS  HB2          28 HIS  HN          3.50    (#    211:10  Unique         2.35, 2.47 A)
 &rst
  ixpk= 211, nxpk= 10, iat= 428, 424, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:213     28 HIS  HN          4.50    (#    213:10  Single Ambig)
 &rst
  ixpk= 213, nxpk= 10, iat=  -1, 424, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1054, 452,
 &end
#
#   28 HIS  HD2          28 HIS  HN          5.50    (#    214:10  Unique         3.09, 3.16 A)
 &rst
  ixpk= 214, nxpk= 10, iat= 437, 424, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   71 CYS  HA           28 HIS  HN          5.50    (#    215:10  Unique         3.49, 3.56 A)
 &rst
  ixpk= 215, nxpk= 10, iat=1068, 424, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   28 HIS  HA           28 HIS  HN          4.50    (#    216:10  Unique         2.94, 2.97 A)
 &rst
  ixpk= 216, nxpk= 10, iat= 426, 424, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:217     28 HIS  HN          3.50    (#    217:10  Single Ambig)
 &rst
  ixpk= 217, nxpk= 10, iat=  -1, 424, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 414, 415, 416, 418, 419, 420, 391, 392,
 &end
#
#   64 MET  HN           63 ASP  HN          3.50    (#    218:10  Unique         2.60, 2.64 A)
 &rst
  ixpk= 218, nxpk= 10, iat= 963, 951, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 GLY  HN           63 ASP  HN          3.50    (#    220:10  Unique         2.74, 2.79 A)
 &rst
  ixpk= 220, nxpk= 10, iat= 944, 951, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   63 ASP  HA           63 ASP  HN          2.80    (#    221:10  Unique         2.87, 2.87 A)
 &rst
  ixpk= 221, nxpk= 10, iat= 953, 951, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   62 GLY  HA+          63 ASP  HN          3.50    (#    222:10  Unique         2.84, 3.24 A)
 &rst
  ixpk= 222, nxpk= 10, iat=  -1, 951, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 946, 947,
 &end
#
#    0 AMB  10-2:223     63 ASP  HN          3.50    (#    223:10  Single Ambig)
 &rst
  ixpk= 223, nxpk= 10, iat=  -1, 951, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 946, 947, 919,
 &end
#
#   63 ASP  HB3          63 ASP  HN          2.80    (#    224:10  Unique         2.54, 2.58 A)
 &rst
  ixpk= 224, nxpk= 10, iat= 956, 951, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   63 ASP  HB2          63 ASP  HN          2.80    (#    225:10  Unique         2.58, 2.60 A)
 &rst
  ixpk= 225, nxpk= 10, iat= 955, 951, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   55 ASP  HN           54 ALA  HN          4.50    (#    226:10  Unique         2.75, 2.77 A)
 &rst
  ixpk= 226, nxpk= 10, iat= 831, 821, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   97 TYR  HE           54 ALA  HN          5.50    (#    227:10  Unique         3.31, 5.22 A)
 &rst
  ixpk= 227, nxpk= 10, iat=  -1, 821, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1464,1469,
 &end
#
#   54 ALA  MB           54 ALA  HN          2.80    (#    229:10  Unique         2.51, 2.89 A)
 &rst
  ixpk= 229, nxpk= 10, iat=  -1, 821, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 825, 826, 827,
 &end
#
#    0 AMB  10-2:230     54 ALA  HN          4.50    (#    230:10  Single Ambig)
 &rst
  ixpk= 230, nxpk= 10, iat=  -1, 821, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1448,1449,1450, 762, 763, 764, 336, 337, 338, 340,
       341, 342, 336, 337, 338, 340, 341, 342,
 &end
#
#   52 TYR  HB-          54 ALA  HN          4.50    (#    232:10  Unique         2.64, 3.59 A)
 &rst
  ixpk= 232, nxpk= 10, iat=  -1, 821, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 787, 788,
 &end
#
#   53 HIS  HB-          54 ALA  HN          5.50    (#    233:10  Unique         2.82, 3.55 A)
 &rst
  ixpk= 233, nxpk= 10, iat=  -1, 821, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 808, 809,
 &end
#
#   94 SER  HA           54 ALA  HN          7.00    (#    234:10  Unique         6.72, 6.91 A)
 &rst
  ixpk= 234, nxpk= 10, iat=1418, 821, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   96 ALA  MB           96 ALA  HN          4.50    (#    235:10  Unique         2.45, 3.12 A)
 &rst
  ixpk= 235, nxpk= 10, iat=  -1,1444, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1448,1449,1450,
 &end
#
#    8 LEU  HA            9 ILE  HN          4.50    (#    242:10  Unique         3.49, 3.52 A)
 &rst
  ixpk= 242, nxpk= 10, iat= 100, 117, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    9 ILE  HA            9 ILE  HN          3.50    (#    243:10  Unique         2.80, 2.84 A)
 &rst
  ixpk= 243, nxpk= 10, iat= 119, 117, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:244      9 ILE  HN          4.50    (#    244:10  Single Ambig)
 &rst
  ixpk= 244, nxpk= 10, iat=  -1, 117, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  90, 137, 138,
 &end
#
#    6 LEU  HA            9 ILE  HN          5.50    (#    245:10  Unique         3.29, 3.42 A)
 &rst
  ixpk= 245, nxpk= 10, iat=  71, 117, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    9 ILE  HB            9 ILE  HN          2.80    (#    246:10  Unique         2.32, 2.41 A)
 &rst
  ixpk= 246, nxpk= 10, iat= 121, 117, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    9 ILE  HG1+          9 ILE  HN          3.50    (#    248:10  Unique         2.14, 2.85 A)
 &rst
  ixpk= 248, nxpk= 10, iat=  -1, 117, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 127, 128,
 &end
#
#    0 AMB  10-2:249      9 ILE  HN          3.50    (#    249:10  Single Ambig)
 &rst
  ixpk= 249, nxpk= 10, iat=  -1, 117, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 130, 131, 132, 123, 124, 125, 107, 108, 109, 111,
       112, 113,
 &end
#
#    9 ILE  HG1-          9 ILE  HN          3.50    (#    251:10  Unique         2.14, 2.85 A)
 &rst
  ixpk= 251, nxpk= 10, iat=  -1, 117, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 127, 128,
 &end
#
#    0 AMB  10-2:253     50 ALA  HN          3.50    (#    253:10  Single Ambig)
 &rst
  ixpk= 253, nxpk= 10, iat=  -1, 758, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 760, 736,
 &end
#
#   56 ILE  QD1          50 ALA  HN          4.50    (#    255:10  Unique         4.77, 5.82 A)
 &rst
  ixpk= 255, nxpk= 10, iat=  -1, 758, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 856, 857, 858,
 &end
#
#   90 VAL  MGY          91 TYR  HN          5.50    (#    256:10  Unique         2.87, 4.55 A)
 &rst
  ixpk= 256, nxpk= 10, iat=  -1,1367, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1357,1358,1359,1361,1362,1363,
 &end
#
#    0 AMB  10-2:257     91 TYR  HN          5.50    (#    257:10  Single Ambig)
 &rst
  ixpk= 257, nxpk= 10, iat=  -1,1367, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=1147,1148,1177,1178,1173,1174,1175,
 &end
#
#   78 ARG  HN           91 TYR  HN          3.50    (#    258:10  Unique         2.83, 2.88 A)
 &rst
  ixpk= 258, nxpk= 10, iat=1143,1367, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 LYS  HN           65 GLN  HN          3.50    (#    260:10  Unique         2.70, 2.73 A)
 &rst
  ixpk= 260, nxpk= 10, iat= 997, 980, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   64 MET  HB2          65 GLN  HN          3.50    (#    261:10  Unique         2.53, 2.55 A)
 &rst
  ixpk= 261, nxpk= 10, iat= 967, 980, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   49 TRP  HZ3          50 ALA  HN          4.50    (#    267:10  Unique         4.53, 4.54 A)
 &rst
  ixpk= 267, nxpk= 10, iat= 751, 758, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   91 TYR  HE           91 TYR  HN          4.50    (#    269:10  Unique         4.11, 5.31 A)
 &rst
  ixpk= 269, nxpk= 10, iat=  -1,1367, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1377,1382,
 &end
#
#   91 TYR  HD           91 TYR  HN          3.50    (#    271:10  Unique         2.09, 3.73 A)
 &rst
  ixpk= 271, nxpk= 10, iat=  -1,1367, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1375,1384,
 &end
#
#   90 VAL  HA           91 TYR  HN          2.80    (#    273:10  Unique         2.23, 2.25 A)
 &rst
  ixpk= 273, nxpk= 10, iat=1353,1367, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   90 VAL  MGX          91 TYR  HN          3.50    (#    274:10  Unique         2.87, 4.55 A)
 &rst
  ixpk= 274, nxpk= 10, iat=  -1,1367, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1357,1358,1359,1361,1362,1363,
 &end
#
#   64 MET  HN           65 GLN  HN          3.50    (#    276:10  Unique         2.84, 2.90 A)
 &rst
  ixpk= 276, nxpk= 10, iat= 963, 980, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:278     65 GLN  HN          2.80    (#    278:10  Single Ambig)
 &rst
  ixpk= 278, nxpk= 10, iat=  -1, 980, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 982, 965,
 &end
#
#   65 GLN  HG+          65 GLN  HN          3.50    (#    279:10  Unique         2.49, 3.16 A)
 &rst
  ixpk= 279, nxpk= 10, iat=  -1, 980, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 987, 988,
 &end
#
#    0 AMB  10-2:280     65 GLN  HN          4.50    (#    280:10  Single Ambig)
 &rst
  ixpk= 280, nxpk= 10, iat=  -1, 980, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1047,1026,1027,
 &end
#
#   65 GLN  HB2          65 GLN  HN          3.50    (#    281:10  Unique         2.25, 2.26 A)
 &rst
  ixpk= 281, nxpk= 10, iat= 984, 980, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   65 GLN  HG-          65 GLN  HN          3.50    (#    282:10  Unique         2.49, 3.16 A)
 &rst
  ixpk= 282, nxpk= 10, iat=  -1, 980, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 987, 988,
 &end
#
#   64 MET  HB3          65 GLN  HN          4.50    (#    283:10  Unique         3.61, 3.62 A)
 &rst
  ixpk= 283, nxpk= 10, iat= 968, 980, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 HIS  HN           70 ASP  HN          4.50    (#    284:10  Unique         2.71, 2.83 A)
 &rst
  ixpk= 284, nxpk= 10, iat= 424,1054, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   70 ASP  HA           70 ASP  HN          3.50    (#    285:10  Unique         2.94, 2.94 A)
 &rst
  ixpk= 285, nxpk= 10, iat=1056,1054, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   28 HIS  HB2          70 ASP  HN          4.50    (#    286:10  Unique         2.71, 3.13 A)
 &rst
  ixpk= 286, nxpk= 10, iat= 428,1054, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   69 CYS  HB3          70 ASP  HN          3.50    (#    287:10  Unique         2.09, 2.11 A)
 &rst
  ixpk= 287, nxpk= 10, iat=1048,1054, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:288     70 ASP  HN          3.50    (#    288:10  Single Ambig)
 &rst
  ixpk= 288, nxpk= 10, iat=  -1,1054, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1058,1059,1047,
 &end
#
#   36 PRO  HA           37 ALA  HN          3.50    (#    291:10  Unique         2.54, 3.29 A)
 &rst
  ixpk= 291, nxpk= 10, iat= 538, 542, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:292     37 ALA  HN          3.50    (#    292:10  Single Ambig)
 &rst
  ixpk= 292, nxpk= 10, iat=  -1, 542, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 546, 547, 548, 522, 523, 524,
 &end
#
#  107 GLU  HA          107 GLU  HN          2.80    (#    299:10  Unique         2.83, 2.84 A)
 &rst
  ixpk= 299, nxpk= 10, iat=1596,1594, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:300    107 GLU  HN          5.50    (#    300:10  Single Ambig)
 &rst
  ixpk= 300, nxpk= 10, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1616,1617,1660,1661,1657,1658,1635,1619,1620,1614,
      
 &end
#
#  106 THR  HN          107 GLU  HN          3.50    (#    301:10  Unique         2.91, 2.95 A)
 &rst
  ixpk= 301, nxpk= 10, iat=1580,1594, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  104 ILE  HA          107 GLU  HN          4.50    (#    302:10  Unique         3.45, 3.75 A)
 &rst
  ixpk= 302, nxpk= 10, iat=1552,1594, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  107 GLU  HG+         107 GLU  HN          3.50    (#    303:10  Unique         2.42, 3.05 A)
 &rst
  ixpk= 303, nxpk= 10, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1601,1602,
 &end
#
#  107 GLU  HG-         107 GLU  HN          3.50    (#    304:10  Unique         2.42, 3.05 A)
 &rst
  ixpk= 304, nxpk= 10, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1601,1602,
 &end
#
#  107 GLU  HB+         107 GLU  HN          2.80    (#    305:10  Unique         2.32, 2.98 A)
 &rst
  ixpk= 305, nxpk= 10, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1598,1599,
 &end
#
#  106 THR  MG2         107 GLU  HN          4.50    (#    306:10  Unique         4.74, 5.08 A)
 &rst
  ixpk= 306, nxpk= 10, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1586,1587,1588,
 &end
#
#    0 AMB  10-2:308     70 ASP  HN          2.80    (#    308:10  Single Ambig)
 &rst
  ixpk= 308, nxpk= 10, iat=  -1,1054, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1045, 410,
 &end
#
#   70 ASP  HB+          70 ASP  HN          3.50    (#    309:10  Unique         2.69, 3.02 A)
 &rst
  ixpk= 309, nxpk= 10, iat=  -1,1054, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1058,1059,
 &end
#
#  104 ILE  HN          103 ALA  HN          3.50    (#    310:10  Unique         2.72, 2.75 A)
 &rst
  ixpk= 310, nxpk= 10, iat=1550,1540, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  102 HIS  HN          103 ALA  HN          4.50    (#    311:10  Unique         2.86, 2.90 A)
 &rst
  ixpk= 311, nxpk= 10, iat=1523,1540, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:313    103 ALA  HN          4.50    (#    313:10  Single Ambig)
 &rst
  ixpk= 313, nxpk= 10, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1508,1525,
 &end
#
#    0 AMB  10-2:314    103 ALA  HN          3.50    (#    314:10  Single Ambig)
 &rst
  ixpk= 314, nxpk= 10, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1542,1821,1822,
 &end
#
#   79 ILE  HB           79 ILE  HN          3.50    (#    318:10  Unique         2.37, 2.43 A)
 &rst
  ixpk= 318, nxpk= 10, iat=1171,1167, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   78 ARG  HG+          79 ILE  HN          3.50    (#    321:10  Unique         2.30, 2.88 A)
 &rst
  ixpk= 321, nxpk= 10, iat=  -1,1167, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1150,1151,
 &end
#
#  114 PRO  HA          115 ASP  HN          3.50    (#    323:10  Unique         2.12, 3.22 A)
 &rst
  ixpk= 323, nxpk= 10, iat=1735,1739, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   32 ARG  HA           32 ARG  HN          5.50    (#    328:10  Unique         2.24, 2.54 A)
 &rst
  ixpk= 328, nxpk= 10, iat= 478, 476, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   31 PRO  HA           32 ARG  HN          3.50    (#    329:10  Unique         2.18, 2.66 A)
 &rst
  ixpk= 329, nxpk= 10, iat= 472, 476, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   32 ARG  HG+          32 ARG  HN          5.50    (#    330:10  Unique         2.51, 3.79 A)
 &rst
  ixpk= 330, nxpk= 10, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 483, 484,
 &end
#
#    0 AMB  10-2:331     32 ARG  HN          4.50    (#    331:10  Single Ambig)
 &rst
  ixpk= 331, nxpk= 10, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 480, 481, 469, 470,
 &end
#
#   32 ARG  HB-          32 ARG  HN          4.50    (#    332:10  Unique         2.71, 3.41 A)
 &rst
  ixpk= 332, nxpk= 10, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 480, 481,
 &end
#
#   20 PHE  HA           20 PHE  HN          3.50    (#    333:10  Unique         2.88, 2.89 A)
 &rst
  ixpk= 333, nxpk= 10, iat= 269, 267, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   19 VAL  MG1          20 PHE  HN          3.50    (#    334:10  Unique         2.93, 3.76 A)
 &rst
  ixpk= 334, nxpk= 10, iat=  -1, 267, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 257, 258, 259,
 &end
#
#   79 ILE  HN           20 PHE  HN          3.50    (#    335:10  Unique         2.95, 3.05 A)
 &rst
  ixpk= 335, nxpk= 10, iat=1167, 267, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   19 VAL  HA           20 PHE  HN          2.80    (#    337:10  Unique         2.24, 2.25 A)
 &rst
  ixpk= 337, nxpk= 10, iat= 253, 267, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  124 GLY  HA+         125 TYR  HN          3.50    (#    339:10  Unique         2.36, 2.58 A)
 &rst
  ixpk= 339, nxpk= 10, iat=  -1,1884, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1879,1880,
 &end
#
#  124 GLY  HA+         125 TYR  HN          4.50    (#    344:10  Unique         2.36, 2.58 A)
 &rst
  ixpk= 344, nxpk= 10, iat=  -1,1884, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1879,1880,
 &end
#
#   91 TYR  HE          125 TYR  HN          4.50    (#    346:10  Unique         3.33, 5.29 A)
 &rst
  ixpk= 346, nxpk= 10, iat=  -1,1884, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1377,1382,
 &end
#
#    0 AMB  10-2:347    125 TYR  HN          4.50    (#    347:10  Single Ambig)
 &rst
  ixpk= 347, nxpk= 10, iat=  -1,1884, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1886,1390,1391,
 &end
#
#  124 GLY  HA-         125 TYR  HN          3.50    (#    348:10  Unique         2.36, 2.58 A)
 &rst
  ixpk= 348, nxpk= 10, iat=  -1,1884, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1879,1880,
 &end
#
#  125 TYR  HB+         125 TYR  HN          4.50    (#    349:10  Unique         2.89, 3.38 A)
 &rst
  ixpk= 349, nxpk= 10, iat=  -1,1884, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1888,1889,
 &end
#
#    0 AMB  10-2:350    125 TYR  HN          4.50    (#    350:10  Single Ambig)
 &rst
  ixpk= 350, nxpk= 10, iat=  -1,1884, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1888,1889,1371,1372,
 &end
#
#    0 AMB  10-2:351    121 ALA  HN          5.50    (#    351:10  Single Ambig)
 &rst
  ixpk= 351, nxpk= 10, iat=  -1,1841, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1344,1834,
 &end
#
#   91 TYR  HA          121 ALA  HN          4.50    (#    352:10  Unique         2.98, 3.11 A)
 &rst
  ixpk= 352, nxpk= 10, iat=1369,1841, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  120 TRP  HB+         121 ALA  HN          2.80    (#    354:10  Unique         2.23, 3.07 A)
 &rst
  ixpk= 354, nxpk= 10, iat=  -1,1841, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1821,1822,
 &end
#
#  120 TRP  HZ3         121 ALA  HN          5.50    (#    355:10  Unique         5.30, 5.38 A)
 &rst
  ixpk= 355, nxpk= 10, iat=1834,1841, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  120 TRP  HA          121 ALA  HN          2.80    (#    356:10  Unique         2.31, 2.38 A)
 &rst
  ixpk= 356, nxpk= 10, iat=1819,1841, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  121 ALA  HA          121 ALA  HN          4.50    (#    357:10  Unique         2.89, 2.90 A)
 &rst
  ixpk= 357, nxpk= 10, iat=1843,1841, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  121 ALA  MB          121 ALA  HN          3.50    (#    358:10  Unique         2.92, 3.44 A)
 &rst
  ixpk= 358, nxpk= 10, iat=  -1,1841, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1845,1846,1847,
 &end
#
#   43 ILE  HG1-         44 VAL  HN          5.50    (#    366:10  Unique         3.78, 4.32 A)
 &rst
  ixpk= 366, nxpk= 10, iat=  -1, 644, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 635, 636,
 &end
#
#   44 VAL  MGY          44 VAL  HN          3.50    (#    368:10  Unique         2.72, 4.10 A)
 &rst
  ixpk= 368, nxpk= 10, iat=  -1, 644, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 650, 651, 652, 654, 655, 656,
 &end
#
#    0 AMB  10-2:369     44 VAL  HN          3.50    (#    369:10  Single Ambig)
 &rst
  ixpk= 369, nxpk= 10, iat=  -1, 644, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 631, 632, 633, 355, 356, 357, 359, 360, 361, 371,
       372, 373,
 &end
#
#    0 AMB  10-2:370     44 VAL  HN          4.50    (#    370:10  Single Ambig)
 &rst
  ixpk= 370, nxpk= 10, iat=  -1, 644, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 638, 639, 640,1641,1642,
 &end
#
#  108 LYS  HN          109 ILE  HN          3.50    (#    372:10  Unique         2.71, 2.78 A)
 &rst
  ixpk= 372, nxpk= 10, iat=1609,1631, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:373    109 ILE  HN          2.80    (#    373:10  Single Ambig)
 &rst
  ixpk= 373, nxpk= 10, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1641,1642,1613,
 &end
#
#    0 AMB  10-2:374    109 ILE  HN          2.80    (#    374:10  Single Ambig)
 &rst
  ixpk= 374, nxpk= 10, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1635,1614,
 &end
#
#    0 AMB  10-2:375    109 ILE  HN          3.50    (#    375:10  Single Ambig)
 &rst
  ixpk= 375, nxpk= 10, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 168, 169, 170, 172, 173, 174,1793,1794,1795,1797,
      1798,1799,1793,1794,1795,1797,1798,1799,
 &end
#
#  109 ILE  HG1-        109 ILE  HN          3.50    (#    376:10  Unique         2.35, 3.12 A)
 &rst
  ixpk= 376, nxpk= 10, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1641,1642,
 &end
#
#  109 ILE  QD1         109 ILE  HN          3.50    (#    377:10  Unique         3.68, 4.35 A)
 &rst
  ixpk= 377, nxpk= 10, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1644,1645,1646,
 &end
#
#  110 LYS  HN          109 ILE  HN          3.50    (#    378:10  Unique         2.77, 2.80 A)
 &rst
  ixpk= 378, nxpk= 10, iat=1650,1631, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:379    109 ILE  HN          3.50    (#    379:10  Single Ambig)
 &rst
  ixpk= 379, nxpk= 10, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 168, 169, 170, 172, 173, 174, 650, 651, 652, 654,
       655, 656,
 &end
#
#    0 AMB  10-2:380    109 ILE  HN          3.50    (#    380:10  Single Ambig)
 &rst
  ixpk= 380, nxpk= 10, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1633,1582,
 &end
#
#   44 VAL  MGY         109 ILE  HN          5.50    (#    381:10  Unique         3.99, 5.53 A)
 &rst
  ixpk= 381, nxpk= 10, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 650, 651, 652, 654, 655, 656,
 &end
#
#   58 ASP  HB+          58 ASP  HN          2.80    (#    384:10  Unique         2.45, 2.51 A)
 &rst
  ixpk= 384, nxpk= 10, iat=  -1, 883, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 887, 888,
 &end
#
#   57 TYR  HN           58 ASP  HN          3.50    (#    385:10  Unique         2.84, 2.88 A)
 &rst
  ixpk= 385, nxpk= 10, iat= 862, 883, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:386     58 ASP  HN          2.80    (#    386:10  Single Ambig)
 &rst
  ixpk= 386, nxpk= 10, iat=  -1, 883, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 895, 870, 879,
 &end
#
#   55 ASP  HA           58 ASP  HN          5.50    (#    387:10  Unique         3.68, 3.72 A)
 &rst
  ixpk= 387, nxpk= 10, iat= 833, 883, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   58 ASP  HA           58 ASP  HN          2.80    (#    388:10  Unique         2.83, 2.84 A)
 &rst
  ixpk= 388, nxpk= 10, iat= 885, 883, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   57 TYR  HA           58 ASP  HN          4.50    (#    389:10  Unique         3.62, 3.63 A)
 &rst
  ixpk= 389, nxpk= 10, iat= 864, 883, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   57 TYR  HB3          58 ASP  HN          3.50    (#    390:10  Unique         2.53, 2.61 A)
 &rst
  ixpk= 390, nxpk= 10, iat= 867, 883, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   57 TYR  HB2          58 ASP  HN          4.50    (#    391:10  Unique         3.93, 3.99 A)
 &rst
  ixpk= 391, nxpk= 10, iat= 866, 883, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   58 ASP  HB-          58 ASP  HN          3.50    (#    392:10  Unique         2.45, 2.51 A)
 &rst
  ixpk= 392, nxpk= 10, iat=  -1, 883, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 887, 888,
 &end
#
#    0 AMB  10-2:393     58 ASP  HN          4.50    (#    393:10  Single Ambig)
 &rst
  ixpk= 393, nxpk= 10, iat=  -1, 883, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 825, 826, 827, 902, 903,
 &end
#
#   45 ARG  HE           44 VAL  HN          4.50    (#    394:10  Unique         3.30, 3.58 A)
 &rst
  ixpk= 394, nxpk= 10, iat= 673, 644, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   43 ILE  HA           44 VAL  HN          2.80    (#    395:10  Unique         2.24, 2.28 A)
 &rst
  ixpk= 395, nxpk= 10, iat= 627, 644, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:397     44 VAL  HN          2.80    (#    397:10  Single Ambig)
 &rst
  ixpk= 397, nxpk= 10, iat=  -1, 644, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 648, 629,
 &end
#
#    0 AMB  10-2:398     44 VAL  HN          3.50    (#    398:10  Single Ambig)
 &rst
  ixpk= 398, nxpk= 10, iat=  -1, 644, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 164, 152,
 &end
#
#    0 AMB  10-2:399     44 VAL  HN          3.50    (#    399:10  Single Ambig)
 &rst
  ixpk= 399, nxpk= 10, iat=  -1, 644, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 650, 651, 652, 654, 655, 656, 168, 169, 170, 172,
       173, 174,
 &end
#
#   20 PHE  HB-          21 LYS  HN          3.50    (#    400:10  Unique         2.37, 3.11 A)
 &rst
  ixpk= 400, nxpk= 10, iat=  -1, 287, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 271, 272,
 &end
#
#   20 PHE  HA           21 LYS  HN          2.80    (#    402:10  Unique         2.46, 2.48 A)
 &rst
  ixpk= 402, nxpk= 10, iat= 269, 287, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   20 PHE  HB+          21 LYS  HN          4.50    (#    403:10  Unique         2.37, 3.11 A)
 &rst
  ixpk= 403, nxpk= 10, iat=  -1, 287, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 271, 272,
 &end
#
#   21 LYS  HB2          21 LYS  HN          3.50    (#    405:10  Unique         2.45, 2.59 A)
 &rst
  ixpk= 405, nxpk= 10, iat= 291, 287, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   79 ILE  HB           21 LYS  HN          5.50    (#    407:10  Unique         5.38, 5.43 A)
 &rst
  ixpk= 407, nxpk= 10, iat=1171, 287, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   21 LYS  HB3          21 LYS  HN          4.50    (#    408:10  Unique         3.64, 3.68 A)
 &rst
  ixpk= 408, nxpk= 10, iat= 292, 287, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   39 GLU  HG+          39 GLU  HN          3.50    (#    409:10  Unique         2.58, 3.26 A)
 &rst
  ixpk= 409, nxpk= 10, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 569, 570,
 &end
#
#    0 AMB  10-2:412     39 GLU  HN          3.50    (#    412:10  Single Ambig)
 &rst
  ixpk= 412, nxpk= 10, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 564, 443,
 &end
#
#    0 AMB  10-2:413     39 GLU  HN          2.80    (#    413:10  Single Ambig)
 &rst
  ixpk= 413, nxpk= 10, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 554, 544,
 &end
#
#   39 GLU  HB+          39 GLU  HN          3.50    (#    414:10  Unique         2.40, 3.04 A)
 &rst
  ixpk= 414, nxpk= 10, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 566, 567,
 &end
#
#   39 GLU  HB-          39 GLU  HN          3.50    (#    415:10  Unique         2.40, 3.04 A)
 &rst
  ixpk= 415, nxpk= 10, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 566, 567,
 &end
#
#   38 ALA  MB           39 GLU  HN          4.50    (#    416:10  Unique         4.20, 4.49 A)
 &rst
  ixpk= 416, nxpk= 10, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 556, 557, 558,
 &end
#
#    0 AMB  10-2:417    110 LYS  HN          3.50    (#    417:10  Single Ambig)
 &rst
  ixpk= 417, nxpk= 10, iat=  -1,1650, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1793,1794,1795,1797,1798,1799,1793,1794,1795,1797,
      1798,1799,
 &end
#
#  111 ALA  HN          110 LYS  HN          3.50    (#    418:10  Unique         2.76, 2.79 A)
 &rst
  ixpk= 418, nxpk= 10, iat=1672,1650, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  107 GLU  HA          110 LYS  HN          4.50    (#    419:10  Unique         3.61, 3.80 A)
 &rst
  ixpk= 419, nxpk= 10, iat=1596,1650, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  110 LYS  HA          110 LYS  HN          3.50    (#    420:10  Unique         2.84, 2.86 A)
 &rst
  ixpk= 420, nxpk= 10, iat=1652,1650, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:421    110 LYS  HN          4.50    (#    421:10  Single Ambig)
 &rst
  ixpk= 421, nxpk= 10, iat=  -1,1650, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1582,1633,
 &end
#
#  110 LYS  HB+         110 LYS  HN          2.80    (#    422:10  Unique         2.37, 3.03 A)
 &rst
  ixpk= 422, nxpk= 10, iat=  -1,1650, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1654,1655,
 &end
#
#  110 LYS  HB-         110 LYS  HN          2.80    (#    423:10  Unique         2.37, 3.03 A)
 &rst
  ixpk= 423, nxpk= 10, iat=  -1,1650, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1654,1655,
 &end
#
#    0 AMB  10-2:424    110 LYS  HN          2.80    (#    424:10  Single Ambig)
 &rst
  ixpk= 424, nxpk= 10, iat=  -1,1650, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1657,1658,1635,
 &end
#
#  109 ILE  HN          110 LYS  HN          3.50    (#    425:10  Unique         2.77, 2.80 A)
 &rst
  ixpk= 425, nxpk= 10, iat=1631,1650, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  110 LYS  HG-         110 LYS  HN          3.50    (#    428:10  Unique         2.43, 3.07 A)
 &rst
  ixpk= 428, nxpk= 10, iat=  -1,1650, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1657,1658,
 &end
#
#   58 ASP  HB-          59 LYS  HN          3.50    (#    429:10  Unique         2.51, 3.21 A)
 &rst
  ixpk= 429, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 887, 888,
 &end
#
#   60 VAL  HN           59 LYS  HN          3.50    (#    430:10  Unique         2.81, 2.83 A)
 &rst
  ixpk= 430, nxpk= 10, iat= 917, 895, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   58 ASP  HB+          59 LYS  HN          3.50    (#    431:10  Unique         2.51, 3.21 A)
 &rst
  ixpk= 431, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 887, 888,
 &end
#
#   19 VAL  MG2          19 VAL  HN          3.50    (#    432:10  Unique         2.28, 3.84 A)
 &rst
  ixpk= 432, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 261, 262, 263,
 &end
#
#   19 VAL  MG1          19 VAL  HN          4.50    (#    433:10  Unique         4.44, 4.75 A)
 &rst
  ixpk= 433, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 257, 258, 259,
 &end
#
#   19 VAL  HA           19 VAL  HN          4.50    (#    435:10  Unique         2.91, 2.92 A)
 &rst
  ixpk= 435, nxpk= 10, iat= 253, 251, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   19 VAL  HB           19 VAL  HN          3.50    (#    438:10  Unique         2.47, 2.81 A)
 &rst
  ixpk= 438, nxpk= 10, iat= 255, 251, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   58 ASP  HN           59 LYS  HN          3.50    (#    439:10  Unique         2.80, 2.82 A)
 &rst
  ixpk= 439, nxpk= 10, iat= 883, 895, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:441     59 LYS  HN          2.80    (#    441:10  Single Ambig)
 &rst
  ixpk= 441, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 897, 885,
 &end
#
#   59 LYS  HB+          59 LYS  HN          2.80    (#    442:10  Unique         2.32, 2.47 A)
 &rst
  ixpk= 442, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 899, 900,
 &end
#
#    0 AMB  10-2:443     59 LYS  HN          4.50    (#    443:10  Single Ambig)
 &rst
  ixpk= 443, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 902, 903, 825, 826, 827,
 &end
#
#    6 LEU  HN            7 ALA  HN          3.50    (#    444:10  Unique         2.88, 2.91 A)
 &rst
  ixpk= 444, nxpk= 10, iat=  69,  88, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:446      7 ALA  HN          3.50    (#    446:10  Single Ambig)
 &rst
  ixpk= 446, nxpk= 10, iat=  -1,  88, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  98, 117,
 &end
#
#    5 ASP  HA            7 ALA  HN          4.50    (#    447:10  Unique         4.31, 4.33 A)
 &rst
  ixpk= 447, nxpk= 10, iat=  59,  88, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    7 ALA  HA            7 ALA  HN          2.80    (#    448:10  Unique         2.83, 2.86 A)
 &rst
  ixpk= 448, nxpk= 10, iat=  90,  88, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    6 LEU  HA            7 ALA  HN          5.50    (#    449:10  Unique         3.55, 3.57 A)
 &rst
  ixpk= 449, nxpk= 10, iat=  71,  88, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:450      7 ALA  HN          3.50    (#    450:10  Single Ambig)
 &rst
  ixpk= 450, nxpk= 10, iat=  -1,  88, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  73, 102, 103,
 &end
#
#    0 AMB  10-2:451      7 ALA  HN          4.50    (#    451:10  Single Ambig)
 &rst
  ixpk= 451, nxpk= 10, iat=  -1,  88, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 127, 128, 598, 599,
 &end
#
#    7 ALA  MB            7 ALA  HN          2.80    (#    452:10  Unique         2.48, 2.88 A)
 &rst
  ixpk= 452, nxpk= 10, iat=  -1,  88, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=  92,  93,  94,
 &end
#
#    6 LEU  HB3           7 ALA  HN          4.50    (#    453:10  Unique         3.70, 3.81 A)
 &rst
  ixpk= 453, nxpk= 10, iat=  74,  88, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   42 GLU  HB-          42 GLU  HN          3.50    (#    454:10  Unique         2.33, 3.09 A)
 &rst
  ixpk= 454, nxpk= 10, iat=  -1, 610, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 614, 615,
 &end
#
#    0 AMB  10-2:455     42 GLU  HN          5.50    (#    455:10  Single Ambig)
 &rst
  ixpk= 455, nxpk= 10, iat=  -1, 610, r1= 1.30, r2= 1.80, r3= 9.14, r4= 9.64,
 igr1= 631, 632, 633,1556,1557,1558,1563,1564,1565, 355,
       356, 357, 359, 360, 361,  78,  79,  80,  82,  83,
        84,
 &end
#
#   42 GLU  HA           42 GLU  HN          3.50    (#    457:10  Unique         2.98, 2.98 A)
 &rst
  ixpk= 457, nxpk= 10, iat= 612, 610, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 LYS  HA           42 GLU  HN          2.80    (#    458:10  Unique         2.46, 2.48 A)
 &rst
  ixpk= 458, nxpk= 10, iat= 590, 610, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   42 GLU  HG+          42 GLU  HN          4.50    (#    459:10  Unique         3.94, 4.27 A)
 &rst
  ixpk= 459, nxpk= 10, iat=  -1, 610, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 617, 618,
 &end
#
#    0 AMB  10-2:460     42 GLU  HN          2.80    (#    460:10  Single Ambig)
 &rst
  ixpk= 460, nxpk= 10, iat=  -1, 610, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 614, 615, 592, 593,
 &end
#
#    8 LEU  MDX           5 ASP  HN          5.50    (#    462:10  Unique         2.24, 4.53 A)
 &rst
  ixpk= 462, nxpk= 10, iat=  -1,  57, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 107, 108, 109, 111, 112, 113,
 &end
#
#    5 ASP  HA            5 ASP  HN          3.50    (#    463:10  Unique         2.93, 2.94 A)
 &rst
  ixpk= 463, nxpk= 10, iat=  59,  57, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    4 ALA  HA            5 ASP  HN          2.80    (#    464:10  Unique         2.39, 2.60 A)
 &rst
  ixpk= 464, nxpk= 10, iat=  49,  57, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    5 ASP  HB+           5 ASP  HN          3.50    (#    465:10  Unique         2.77, 3.11 A)
 &rst
  ixpk= 465, nxpk= 10, iat=  -1,  57, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  61,  62,
 &end
#
#    5 ASP  HB-           5 ASP  HN          3.50    (#    466:10  Unique         2.77, 3.11 A)
 &rst
  ixpk= 466, nxpk= 10, iat=  -1,  57, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  61,  62,
 &end
#
#    4 ALA  MB            5 ASP  HN          2.80    (#    467:10  Unique         2.12, 3.17 A)
 &rst
  ixpk= 467, nxpk= 10, iat=  -1,  57, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=  51,  52,  53,
 &end
#
#    2 ALA  HA            3 VAL  HN          2.80    (#    472:10  Unique         2.34, 2.47 A)
 &rst
  ixpk= 472, nxpk= 10, iat=  23,  31, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    3 VAL  HA            3 VAL  HN          3.50    (#    473:10  Unique         2.85, 2.90 A)
 &rst
  ixpk= 473, nxpk= 10, iat=  33,  31, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    3 VAL  HB            3 VAL  HN          3.50    (#    474:10  Unique         2.46, 2.63 A)
 &rst
  ixpk= 474, nxpk= 10, iat=  35,  31, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    2 ALA  MB            3 VAL  HN          3.50    (#    475:10  Unique         2.19, 3.28 A)
 &rst
  ixpk= 475, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  25,  26,  27,
 &end
#
#    0 AMB  10-2:476      3 VAL  HN          2.80    (#    476:10  Single Ambig)
 &rst
  ixpk= 476, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=  37,  38,  39,  41,  42,  43,  37,  38,  39,  41,
        42,  43,
 &end
#
#    0 AMB  10-2:478    101 GLN  HN          3.50    (#    478:10  Single Ambig)
 &rst
  ixpk= 478, nxpk= 10, iat=  -1,1506, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1508,1525,
 &end
#
#  101 GLN  HG+         101 GLN  HN          4.50    (#    479:10  Unique         2.65, 3.37 A)
 &rst
  ixpk= 479, nxpk= 10, iat=  -1,1506, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1513,1514,
 &end
#
#  101 GLN  HB-         101 GLN  HN          2.80    (#    480:10  Unique         2.33, 3.01 A)
 &rst
  ixpk= 480, nxpk= 10, iat=  -1,1506, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1510,1511,
 &end
#
#    0 AMB  10-2:481    101 GLN  HN          2.80    (#    481:10  Single Ambig)
 &rst
  ixpk= 481, nxpk= 10, iat=  -1,1506, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 355, 356, 357, 359, 360, 361,1500,1501,1502,
 &end
#
#  100 ALA  HA          101 GLN  HN          2.80    (#    482:10  Unique         2.37, 2.44 A)
 &rst
  ixpk= 482, nxpk= 10, iat=1498,1506, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  101 GLN  HG-         101 GLN  HN          4.50    (#    483:10  Unique         2.65, 3.37 A)
 &rst
  ixpk= 483, nxpk= 10, iat=  -1,1506, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1513,1514,
 &end
#
#  101 GLN  HB+         101 GLN  HN          3.50    (#    484:10  Unique         2.33, 3.01 A)
 &rst
  ixpk= 484, nxpk= 10, iat=  -1,1506, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1510,1511,
 &end
#
#  118 VAL  MGX         119 THR  HN          3.50    (#    486:10  Unique         2.36, 4.30 A)
 &rst
  ixpk= 486, nxpk= 10, iat=  -1,1803, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1793,1794,1795,1797,1798,1799,
 &end
#
#   89 HIS  HA          119 THR  HN          3.50    (#    487:10  Unique         2.24, 2.31 A)
 &rst
  ixpk= 487, nxpk= 10, iat=1336,1803, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  118 VAL  HA          119 THR  HN          2.80    (#    488:10  Unique         2.32, 2.40 A)
 &rst
  ixpk= 488, nxpk= 10, iat=1789,1803, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  119 THR  HA          119 THR  HN          4.50    (#    489:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 489, nxpk= 10, iat=1805,1803, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:490    119 THR  HN          3.50    (#    490:10  Single Ambig)
 &rst
  ixpk= 490, nxpk= 10, iat=  -1,1803, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1586,1587,1588,1809,1810,1811,
 &end
#
#   65 GLN  HN           64 MET  HN          3.50    (#    491:10  Unique         2.84, 2.90 A)
 &rst
  ixpk= 491, nxpk= 10, iat= 980, 963, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   64 MET  HG-          64 MET  HN          3.50    (#    492:10  Unique         2.17, 2.92 A)
 &rst
  ixpk= 492, nxpk= 10, iat=  -1, 963, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 970, 971,
 &end
#
#   63 ASP  HN           64 MET  HN          3.50    (#    494:10  Unique         2.60, 2.64 A)
 &rst
  ixpk= 494, nxpk= 10, iat= 951, 963, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   64 MET  HA           64 MET  HN          3.50    (#    495:10  Unique         2.82, 2.84 A)
 &rst
  ixpk= 495, nxpk= 10, iat= 965, 963, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 SER  HA           64 MET  HN          4.50    (#    496:10  Unique         2.97, 3.22 A)
 &rst
  ixpk= 496, nxpk= 10, iat= 935, 963, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   63 ASP  HB3          64 MET  HN          3.50    (#    497:10  Unique         2.50, 2.59 A)
 &rst
  ixpk= 497, nxpk= 10, iat= 956, 963, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   64 MET  HG+          64 MET  HN          2.80    (#    498:10  Unique         2.17, 2.92 A)
 &rst
  ixpk= 498, nxpk= 10, iat=  -1, 963, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 970, 971,
 &end
#
#   64 MET  HB2          64 MET  HN          3.50    (#    499:10  Unique         2.48, 2.54 A)
 &rst
  ixpk= 499, nxpk= 10, iat= 967, 963, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   64 MET  ME           64 MET  HN          4.50    (#    500:10  Unique         3.00, 3.81 A)
 &rst
  ixpk= 500, nxpk= 10, iat=  -1, 963, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 974, 975, 976,
 &end
#
#   63 ASP  HA           64 MET  HN          4.50    (#    501:10  Unique         3.58, 3.61 A)
 &rst
  ixpk= 501, nxpk= 10, iat= 953, 963, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:502     64 MET  HN          4.50    (#    502:10  Single Ambig)
 &rst
  ixpk= 502, nxpk= 10, iat=  -1, 963, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 923, 924, 925, 927, 928, 929, 378, 379, 380, 414,
       415, 416, 418, 419, 420,
 &end
#
#   77 GLY  HN           22 TYR  HN          4.50    (#    503:10  Unique         3.09, 3.18 A)
 &rst
  ixpk= 503, nxpk= 10, iat=1136, 309, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   21 LYS  HA           22 TYR  HN          2.80    (#    504:10  Unique         2.38, 2.42 A)
 &rst
  ixpk= 504, nxpk= 10, iat= 289, 309, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   22 TYR  HE           22 TYR  HN          5.50    (#    506:10  Unique         5.23, 6.17 A)
 &rst
  ixpk= 506, nxpk= 10, iat=  -1, 309, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 319, 324,
 &end
#
#   22 TYR  HA           22 TYR  HN          4.50    (#    507:10  Unique         2.91, 2.93 A)
 &rst
  ixpk= 507, nxpk= 10, iat= 311, 309, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   21 LYS  HB3          22 TYR  HN          4.50    (#    509:10  Unique         2.34, 2.41 A)
 &rst
  ixpk= 509, nxpk= 10, iat= 292, 309, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   65 GLN  HB2          66 LYS  HN          4.50    (#    512:10  Unique         2.87, 2.98 A)
 &rst
  ixpk= 512, nxpk= 10, iat= 984, 997, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   66 LYS  HB+          66 LYS  HN          2.80    (#    513:10  Unique         2.25, 2.44 A)
 &rst
  ixpk= 513, nxpk= 10, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1001,1002,
 &end
#
#    0 AMB  10-2:514     66 LYS  HN          4.50    (#    514:10  Single Ambig)
 &rst
  ixpk= 514, nxpk= 10, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1004,1005,1007,1008,
 &end
#
#   65 GLN  HN           66 LYS  HN          3.50    (#    515:10  Unique         2.70, 2.73 A)
 &rst
  ixpk= 515, nxpk= 10, iat= 980, 997, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   67 GLN  HN           66 LYS  HN          3.50    (#    516:10  Unique         2.69, 2.73 A)
 &rst
  ixpk= 516, nxpk= 10, iat=1019, 997, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   63 ASP  HA           66 LYS  HN          5.50    (#    517:10  Unique         3.05, 3.32 A)
 &rst
  ixpk= 517, nxpk= 10, iat= 953, 997, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:518     66 LYS  HN          4.50    (#    518:10  Single Ambig)
 &rst
  ixpk= 518, nxpk= 10, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 982, 965,
 &end
#
#   66 LYS  HA           66 LYS  HN          3.50    (#    519:10  Unique         2.86, 2.87 A)
 &rst
  ixpk= 519, nxpk= 10, iat= 999, 997, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   65 GLN  HB3          66 LYS  HN          4.50    (#    520:10  Unique         3.70, 3.75 A)
 &rst
  ixpk= 520, nxpk= 10, iat= 985, 997, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   66 LYS  HG-          66 LYS  HN          4.50    (#    521:10  Unique         4.37, 4.47 A)
 &rst
  ixpk= 521, nxpk= 10, iat=  -1, 997, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1004,1005,
 &end
#
#  103 ALA  HN          104 ILE  HN          3.50    (#    522:10  Unique         2.72, 2.75 A)
 &rst
  ixpk= 522, nxpk= 10, iat=1540,1550, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:524    104 ILE  HN          5.50    (#    524:10  Single Ambig)
 &rst
  ixpk= 524, nxpk= 10, iat=  -1,1550, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1594,1609,1834,1832,
 &end
#
#    0 AMB  10-2:525    104 ILE  HN          4.50    (#    525:10  Single Ambig)
 &rst
  ixpk= 525, nxpk= 10, iat=  -1,1550, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1525,1508,
 &end
#
#  104 ILE  HA          104 ILE  HN          3.50    (#    526:10  Unique         2.87, 2.87 A)
 &rst
  ixpk= 526, nxpk= 10, iat=1552,1550, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:527    104 ILE  HN          2.80    (#    527:10  Single Ambig)
 &rst
  ixpk= 527, nxpk= 10, iat=  -1,1550, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1554,1510,1511,
 &end
#
#  104 ILE  HG1+        104 ILE  HN          3.50    (#    528:10  Unique         2.06, 2.75 A)
 &rst
  ixpk= 528, nxpk= 10, iat=  -1,1550, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1560,1561,
 &end
#
#    0 AMB  10-2:529    104 ILE  HN          3.50    (#    529:10  Single Ambig)
 &rst
  ixpk= 529, nxpk= 10, iat=  -1,1550, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1563,1564,1565, 355, 356, 357, 359, 360, 361,1556,
      1557,1558,
 &end
#
#  105 SER  HN          104 ILE  HN          3.50    (#    530:10  Unique         2.56, 2.64 A)
 &rst
  ixpk= 530, nxpk= 10, iat=1569,1550, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  104 ILE  HG1-        104 ILE  HN          3.50    (#    531:10  Unique         2.06, 2.75 A)
 &rst
  ixpk= 531, nxpk= 10, iat=  -1,1550, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1560,1561,
 &end
#
#  103 ALA  MB          104 ILE  HN          3.50    (#    532:10  Unique         2.66, 3.51 A)
 &rst
  ixpk= 532, nxpk= 10, iat=  -1,1550, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1544,1545,1546,
 &end
#
#   72 GLU  HB+          72 GLU  HN          4.50    (#    534:10  Unique         2.73, 3.13 A)
 &rst
  ixpk= 534, nxpk= 10, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1081,1082,
 &end
#
#   71 CYS  HA           72 GLU  HN          2.80    (#    536:10  Unique         2.40, 2.41 A)
 &rst
  ixpk= 536, nxpk= 10, iat=1068,1077, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   71 CYS  HB2          72 GLU  HN          4.50    (#    538:10  Unique         3.47, 3.53 A)
 &rst
  ixpk= 538, nxpk= 10, iat=1070,1077, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   71 CYS  HB3          72 GLU  HN          3.50    (#    539:10  Unique         2.41, 2.45 A)
 &rst
  ixpk= 539, nxpk= 10, iat=1071,1077, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   72 GLU  HB-          72 GLU  HN          3.50    (#    540:10  Unique         2.73, 3.13 A)
 &rst
  ixpk= 540, nxpk= 10, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1081,1082,
 &end
#
#    0 AMB  10-2:541     72 GLU  HN          3.50    (#    541:10  Single Ambig)
 &rst
  ixpk= 541, nxpk= 10, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 378, 379, 380, 391, 392, 414, 415, 416, 418, 419,
       420,
 &end
#
#   26 ARG  HN           72 GLU  HN          3.50    (#    542:10  Unique         2.82, 2.90 A)
 &rst
  ixpk= 542, nxpk= 10, iat= 384,1077, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:543     72 GLU  HN          3.50    (#    543:10  Single Ambig)
 &rst
  ixpk= 543, nxpk= 10, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1084,1085,1084,1085,
 &end
#
#  122 ASN  HN          123 ASP  HN          5.50    (#    544:10  Unique         2.43, 2.84 A)
 &rst
  ixpk= 544, nxpk= 10, iat=1851,1865, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  122 ASN  HA          123 ASP  HN          3.50    (#    547:10  Unique         2.83, 3.19 A)
 &rst
  ixpk= 547, nxpk= 10, iat=1853,1865, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  123 ASP  HA          123 ASP  HN          3.50    (#    548:10  Unique         2.80, 2.88 A)
 &rst
  ixpk= 548, nxpk= 10, iat=1867,1865, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  123 ASP  HB+         123 ASP  HN          3.50    (#    549:10  Unique         2.42, 2.87 A)
 &rst
  ixpk= 549, nxpk= 10, iat=  -1,1865, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1869,1870,
 &end
#
#  121 ALA  MB          123 ASP  HN          4.50    (#    550:10  Unique         2.76, 3.64 A)
 &rst
  ixpk= 550, nxpk= 10, iat=  -1,1865, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1845,1846,1847,
 &end
#
#    0 AMB  10-2:551     57 TYR  HN          4.50    (#    551:10  Single Ambig)
 &rst
  ixpk= 551, nxpk= 10, iat=  -1, 862, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 895, 870, 879, 751,
 &end
#
#   54 ALA  HA           57 TYR  HN          4.50    (#    552:10  Unique         3.22, 3.32 A)
 &rst
  ixpk= 552, nxpk= 10, iat= 823, 862, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   56 ILE  HG1-         57 TYR  HN          5.50    (#    553:10  Unique         2.65, 3.12 A)
 &rst
  ixpk= 553, nxpk= 10, iat=  -1, 862, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 853, 854,
 &end
#
#    0 AMB  10-2:554     57 TYR  HN          3.50    (#    554:10  Single Ambig)
 &rst
  ixpk= 554, nxpk= 10, iat=  -1, 862, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 864, 806,
 &end
#
#  122 ASN  HN          123 ASP  HN          4.50    (#    555:10  Unique         2.43, 2.84 A)
 &rst
  ixpk= 555, nxpk= 10, iat=1851,1865, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  123 ASP  HA          123 ASP  HN          4.50    (#    557:10  Unique         2.80, 2.88 A)
 &rst
  ixpk= 557, nxpk= 10, iat=1867,1865, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  122 ASN  HA          123 ASP  HN          3.50    (#    558:10  Unique         2.83, 3.19 A)
 &rst
  ixpk= 558, nxpk= 10, iat=1853,1865, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:559    123 ASP  HN          4.50    (#    559:10  Single Ambig)
 &rst
  ixpk= 559, nxpk= 10, iat=  -1,1865, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1855,1856,1371,1372,
 &end
#
#  123 ASP  HB+         123 ASP  HN          3.50    (#    560:10  Unique         2.42, 2.87 A)
 &rst
  ixpk= 560, nxpk= 10, iat=  -1,1865, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1869,1870,
 &end
#
#  121 ALA  MB          123 ASP  HN          3.50    (#    561:10  Unique         2.76, 3.64 A)
 &rst
  ixpk= 561, nxpk= 10, iat=  -1,1865, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1845,1846,1847,
 &end
#
#   61 SER  HN           60 VAL  HN          3.50    (#    562:10  Unique         2.70, 2.75 A)
 &rst
  ixpk= 562, nxpk= 10, iat= 933, 917, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   59 LYS  HN           60 VAL  HN          3.50    (#    564:10  Unique         2.81, 2.83 A)
 &rst
  ixpk= 564, nxpk= 10, iat= 895, 917, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:565     60 VAL  HN          4.50    (#    565:10  Single Ambig)
 &rst
  ixpk= 565, nxpk= 10, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 897, 885, 935,
 &end
#
#    0 AMB  10-2:566     60 VAL  HN          3.50    (#    566:10  Single Ambig)
 &rst
  ixpk= 566, nxpk= 10, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 919, 864,
 &end
#
#   59 LYS  HB+          60 VAL  HN          2.80    (#    567:10  Unique         2.53, 3.25 A)
 &rst
  ixpk= 567, nxpk= 10, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 899, 900,
 &end
#
#   60 VAL  HB           60 VAL  HN          3.50    (#    568:10  Unique         2.40, 2.44 A)
 &rst
  ixpk= 568, nxpk= 10, iat= 921, 917, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   59 LYS  HG+          60 VAL  HN          4.50    (#    569:10  Unique         3.35, 3.82 A)
 &rst
  ixpk= 569, nxpk= 10, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 902, 903,
 &end
#
#   60 VAL  MGY          60 VAL  HN          2.80    (#    570:10  Unique         2.17, 3.79 A)
 &rst
  ixpk= 570, nxpk= 10, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 923, 924, 925, 927, 928, 929,
 &end
#
#   60 VAL  MGX          60 VAL  HN          3.50    (#    571:10  Unique         2.17, 3.79 A)
 &rst
  ixpk= 571, nxpk= 10, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 923, 924, 925, 927, 928, 929,
 &end
#
#    0 AMB  10-2:572     60 VAL  HN          5.50    (#    572:10  Single Ambig)
 &rst
  ixpk= 572, nxpk= 10, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 371, 372, 373, 336, 337, 338, 340, 341, 342, 856,
       857, 858,
 &end
#
#   57 TYR  HB3          57 TYR  HN          3.50    (#    573:10  Unique         2.42, 2.47 A)
 &rst
  ixpk= 573, nxpk= 10, iat= 867, 862, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   58 ASP  HN           57 TYR  HN          3.50    (#    574:10  Unique         2.84, 2.88 A)
 &rst
  ixpk= 574, nxpk= 10, iat= 883, 862, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:576     57 TYR  HN          2.80    (#    576:10  Single Ambig)
 &rst
  ixpk= 576, nxpk= 10, iat=  -1, 862, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 843, 831,
 &end
#
#   57 TYR  HB2          57 TYR  HN          2.80    (#    577:10  Unique         2.62, 2.65 A)
 &rst
  ixpk= 577, nxpk= 10, iat= 866, 862, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:578     57 TYR  HN          3.50    (#    578:10  Single Ambig)
 &rst
  ixpk= 578, nxpk= 10, iat=  -1, 862, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 847, 334,1096,1097,
 &end
#
#    0 AMB  10-2:579     57 TYR  HN          3.50    (#    579:10  Single Ambig)
 &rst
  ixpk= 579, nxpk= 10, iat=  -1, 862, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 336, 337, 338, 340, 341, 342, 336, 337, 338, 340,
       341, 342,
 &end
#
#  123 ASP  HN          122 ASN  HN          4.50    (#    580:10  Unique         2.43, 2.84 A)
 &rst
  ixpk= 580, nxpk= 10, iat=1865,1851, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  121 ALA  HA          122 ASN  HN          2.80    (#    582:10  Unique         2.23, 2.26 A)
 &rst
  ixpk= 582, nxpk= 10, iat=1843,1851, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  122 ASN  HB+         122 ASN  HN          3.50    (#    583:10  Unique         2.40, 2.63 A)
 &rst
  ixpk= 583, nxpk= 10, iat=  -1,1851, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1855,1856,
 &end
#
#  122 ASN  HB-         122 ASN  HN          3.50    (#    584:10  Unique         2.40, 2.63 A)
 &rst
  ixpk= 584, nxpk= 10, iat=  -1,1851, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1855,1856,
 &end
#
#  121 ALA  MB          122 ASN  HN          3.50    (#    585:10  Unique         2.93, 3.74 A)
 &rst
  ixpk= 585, nxpk= 10, iat=  -1,1851, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1845,1846,1847,
 &end
#
#  122 ASN  HA          122 ASN  HN          4.50    (#    586:10  Unique         2.89, 2.92 A)
 &rst
  ixpk= 586, nxpk= 10, iat=1853,1851, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  112 LYS  HN          113 TYR  HN          2.80    (#    588:10  Unique         2.44, 2.59 A)
 &rst
  ixpk= 588, nxpk= 10, iat=1682,1704, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  112 LYS  HB+         113 TYR  HN          3.50    (#    589:10  Unique         2.44, 3.43 A)
 &rst
  ixpk= 589, nxpk= 10, iat=  -1,1704, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1686,1687,
 &end
#
#    0 AMB  10-2:590    113 TYR  HN          4.50    (#    590:10  Single Ambig)
 &rst
  ixpk= 590, nxpk= 10, iat=  -1,1704, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1726,1727,1684,
 &end
#
#  114 PRO  HG+         113 TYR  HN          4.50    (#    591:10  Unique         4.45, 4.97 A)
 &rst
  ixpk= 591, nxpk= 10, iat=  -1,1704, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1729,1730,
 &end
#
#  112 LYS  HB-         113 TYR  HN          4.50    (#    592:10  Unique         2.44, 3.43 A)
 &rst
  ixpk= 592, nxpk= 10, iat=  -1,1704, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1686,1687,
 &end
#
#   79 ILE  HA           80 SER  HN          2.80    (#    593:10  Unique         2.20, 2.26 A)
 &rst
  ixpk= 593, nxpk= 10, iat=1169,1186, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   80 SER  HB-          80 SER  HN          4.50    (#    594:10  Unique         2.87, 3.48 A)
 &rst
  ixpk= 594, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1190,1191,
 &end
#
#    0 AMB  10-2:595     80 SER  HN          5.50    (#    595:10  Single Ambig)
 &rst
  ixpk= 595, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1321,1322,1323,1171,1357,1358,1359,1361,1362,1363,
      
 &end
#
#    0 AMB  10-2:596     80 SER  HN          3.50    (#    596:10  Single Ambig)
 &rst
  ixpk= 596, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1173,1174,1175,1177,1178,
 &end
#
#   80 SER  HB+          80 SER  HN          3.50    (#    597:10  Unique         2.87, 3.48 A)
 &rst
  ixpk= 597, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1190,1191,
 &end
#
#  113 TYR  HN          112 LYS  HN          2.80    (#    599:10  Unique         2.44, 2.59 A)
 &rst
  ixpk= 599, nxpk= 10, iat=1704,1682, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  112 LYS  HB+         112 LYS  HN          3.50    (#    601:10  Unique         2.33, 2.81 A)
 &rst
  ixpk= 601, nxpk= 10, iat=  -1,1682, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1686,1687,
 &end
#
#  112 LYS  HB-         112 LYS  HN          2.80    (#    602:10  Unique         2.33, 2.81 A)
 &rst
  ixpk= 602, nxpk= 10, iat=  -1,1682, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1686,1687,
 &end
#
#  111 ALA  MB          112 LYS  HN          3.50    (#    603:10  Unique         2.53, 3.46 A)
 &rst
  ixpk= 603, nxpk= 10, iat=  -1,1682, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1676,1677,1678,
 &end
#
#  111 ALA  HN          112 LYS  HN          3.50    (#    604:10  Unique         2.78, 2.82 A)
 &rst
  ixpk= 604, nxpk= 10, iat=1672,1682, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:605    112 LYS  HN          3.50    (#    605:10  Single Ambig)
 &rst
  ixpk= 605, nxpk= 10, iat=  -1,1682, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1684,1726,1727,1674,1611,
 &end
#
#  112 LYS  HG+         112 LYS  HN          4.00    (#    606:10  Unique         2.29, 3.72 A)
 &rst
  ixpk= 606, nxpk= 10, iat=  -1,1682, r1= 1.30, r2= 1.80, r3= 4.5, r4= 5.0,
 igr1=1689,1690,
 &end
#
#   68 GLY  HA-          69 CYS  HN          4.50    (#    612:10  Unique         3.20, 3.33 A)
 &rst
  ixpk= 612, nxpk= 10, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1038,1039,
 &end
#
#   69 CYS  HB2          69 CYS  HN          3.50    (#    613:10  Unique         2.31, 2.46 A)
 &rst
  ixpk= 613, nxpk= 10, iat=1047,1043, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   64 MET  HB3          69 CYS  HN          4.50    (#    614:10  Unique         3.93, 4.00 A)
 &rst
  ixpk= 614, nxpk= 10, iat= 968,1043, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   69 CYS  HA           69 CYS  HN          4.50    (#    616:10  Unique         2.82, 2.85 A)
 &rst
  ixpk= 616, nxpk= 10, iat=1045,1043, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:617     69 CYS  HN          3.50    (#    617:10  Single Ambig)
 &rst
  ixpk= 617, nxpk= 10, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 982, 965,
 &end
#
#   68 GLY  HA+          69 CYS  HN          4.50    (#    618:10  Unique         3.20, 3.33 A)
 &rst
  ixpk= 618, nxpk= 10, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1038,1039,
 &end
#
#   69 CYS  HB3          69 CYS  HN          4.50    (#    619:10  Unique         3.50, 3.52 A)
 &rst
  ixpk= 619, nxpk= 10, iat=1048,1043, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  110 LYS  HB+         111 ALA  HN          3.50    (#    620:10  Unique         2.67, 3.22 A)
 &rst
  ixpk= 620, nxpk= 10, iat=  -1,1672, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1654,1655,
 &end
#
#    0 AMB  10-2:621    111 ALA  HN          4.50    (#    621:10  Single Ambig)
 &rst
  ixpk= 621, nxpk= 10, iat=  -1,1672, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
 igr1=1657,1658,1686,1687,1614,1660,1661,1619,1620,1616,
      1617,
 &end
#
#  110 LYS  HN          111 ALA  HN          3.50    (#    622:10  Unique         2.76, 2.79 A)
 &rst
  ixpk= 622, nxpk= 10, iat=1650,1672, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  112 LYS  HN          111 ALA  HN          3.50    (#    623:10  Unique         2.78, 2.82 A)
 &rst
  ixpk= 623, nxpk= 10, iat=1682,1672, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:625    111 ALA  HN          2.80    (#    625:10  Single Ambig)
 &rst
  ixpk= 625, nxpk= 10, iat=  -1,1672, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1674,1611,
 &end
#
#  110 LYS  HB-         111 ALA  HN          3.50    (#    626:10  Unique         2.67, 3.22 A)
 &rst
  ixpk= 626, nxpk= 10, iat=  -1,1672, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1654,1655,
 &end
#
#  111 ALA  MB          111 ALA  HN          2.80    (#    627:10  Unique         2.50, 2.89 A)
 &rst
  ixpk= 627, nxpk= 10, iat=  -1,1672, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1676,1677,1678,
 &end
#
#    0 AMB  10-2:628     41 LYS  HN          4.50    (#    628:10  Single Ambig)
 &rst
  ixpk= 628, nxpk= 10, iat=  -1, 588, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 426, 386,
 &end
#
#   50 ALA  MB           52 TYR  HN          3.50    (#    629:10  Unique         3.20, 4.12 A)
 &rst
  ixpk= 629, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 762, 763, 764,
 &end
#
#   52 TYR  HD           52 TYR  HN          3.50    (#    631:10  Unique         3.16, 3.66 A)
 &rst
  ixpk= 631, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 791, 800,
 &end
#
#   50 ALA  HA           52 TYR  HN          3.50    (#    632:10  Unique         3.00, 3.07 A)
 &rst
  ixpk= 632, nxpk= 10, iat= 760, 783, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   51 GLU  HN           52 TYR  HN          2.80    (#    633:10  Unique         2.72, 2.76 A)
 &rst
  ixpk= 633, nxpk= 10, iat= 768, 783, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:634     52 TYR  HN          5.50    (#    634:10  Single Ambig)
 &rst
  ixpk= 634, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 831, 753,
 &end
#
#   51 GLU  HA           52 TYR  HN          4.50    (#    635:10  Unique         3.35, 3.42 A)
 &rst
  ixpk= 635, nxpk= 10, iat= 770, 783, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   55 ASP  HB3          52 TYR  HN          3.50    (#    636:10  Unique         3.35, 3.43 A)
 &rst
  ixpk= 636, nxpk= 10, iat= 836, 783, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   52 TYR  HB+          52 TYR  HN          3.50    (#    637:10  Unique         3.62, 3.70 A)
 &rst
  ixpk= 637, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 787, 788,
 &end
#
#    0 AMB  10-2:638     52 TYR  HN          3.50    (#    638:10  Single Ambig)
 &rst
  ixpk= 638, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 772, 773, 775, 776,
 &end
#
#    0 AMB  10-2:639     52 TYR  HN          3.50    (#    639:10  Single Ambig)
 &rst
  ixpk= 639, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 772, 773, 775, 776,
 &end
#
#   52 TYR  HA           52 TYR  HN          4.50    (#    640:10  Unique         2.91, 2.93 A)
 &rst
  ixpk= 640, nxpk= 10, iat= 785, 783, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   52 TYR  HB-          52 TYR  HN          3.50    (#    641:10  Unique         3.62, 3.70 A)
 &rst
  ixpk= 641, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 787, 788,
 &end
#
#   14 ILE  HA           14 ILE  HN          4.50    (#    642:10  Unique         2.91, 2.93 A)
 &rst
  ixpk= 642, nxpk= 10, iat= 192, 190, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13 ASP  HA           14 ILE  HN          2.80    (#    643:10  Unique         2.15, 2.19 A)
 &rst
  ixpk= 643, nxpk= 10, iat= 180, 190, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:644      0 AMB  10-1:644    2.80    (#    644:10  Double Ambig)
 &rst
  ixpk= 644, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 200, 201, 168, 169, 170, 172, 173, 174,
 igr2= 190, 162,
 &end
#
#   13 ASP  HB2           0 AMB  10-1:645    4.50    (#    645:10  Single Ambig)
 &rst
  ixpk= 645, nxpk= 10, iat= 182,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 190, 162,
 &end
#
#   27 VAL  HN           41 LYS  HN          3.50    (#    647:10  Unique         2.65, 2.68 A)
 &rst
  ixpk= 647, nxpk= 10, iat= 408, 588, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   40 SER  HA           41 LYS  HN          2.80    (#    649:10  Unique         2.32, 2.34 A)
 &rst
  ixpk= 649, nxpk= 10, iat= 579, 588, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   41 LYS  HA           41 LYS  HN          4.50    (#    650:10  Unique         2.88, 2.93 A)
 &rst
  ixpk= 650, nxpk= 10, iat= 590, 588, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   40 SER  HB2          41 LYS  HN          3.50    (#    651:10  Unique         3.48, 3.50 A)
 &rst
  ixpk= 651, nxpk= 10, iat= 581, 588, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:652     41 LYS  HN          4.50    (#    652:10  Single Ambig)
 &rst
  ixpk= 652, nxpk= 10, iat=  -1, 588, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 592, 593, 617, 618, 388,
 &end
#
#    0 AMB  10-2:653     41 LYS  HN          3.50    (#    653:10  Single Ambig)
 &rst
  ixpk= 653, nxpk= 10, iat=  -1, 588, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 595, 596, 391, 392,
 &end
#
#    6 LEU  MDX          41 LYS  HN          3.50    (#    654:10  Unique         2.81, 4.33 A)
 &rst
  ixpk= 654, nxpk= 10, iat=  -1, 588, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=  78,  79,  80,  82,  83,  84,
 &end
#
#   40 SER  HB3          41 LYS  HN          3.50    (#    655:10  Unique         2.53, 2.63 A)
 &rst
  ixpk= 655, nxpk= 10, iat= 582, 588, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 LYS  HG+          41 LYS  HN          4.50    (#    656:10  Unique         2.43, 3.13 A)
 &rst
  ixpk= 656, nxpk= 10, iat=  -1, 588, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 595, 596,
 &end
#
#   11 ASP  HB-          12 VAL  HN          4.50    (#    658:10  Unique         2.64, 3.39 A)
 &rst
  ixpk= 658, nxpk= 10, iat=  -1, 162, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 154, 155,
 &end
#
#    0 AMB  10-2:659      0 AMB  10-1:659    2.80    (#    659:10  Double Ambig)
 &rst
  ixpk= 659, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 200, 201,1732,1733,1692,1693,
 igr2= 190, 162,
 &end
#
#   12 VAL  HA           12 VAL  HN          3.50    (#    661:10  Unique         2.94, 2.97 A)
 &rst
  ixpk= 661, nxpk= 10, iat= 164, 162, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:662     12 VAL  HN          3.50    (#    662:10  Single Ambig)
 &rst
  ixpk= 662, nxpk= 10, iat=  -1, 162, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 154, 155,1695,1696,
 &end
#
#  114 PRO  HB+          14 ILE  HN          4.50    (#    663:10  Unique         3.55, 4.89 A)
 &rst
  ixpk= 663, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1732,1733,
 &end
#
#   12 VAL  HB           12 VAL  HN          2.80    (#    664:10  Unique         2.51, 2.71 A)
 &rst
  ixpk= 664, nxpk= 10, iat= 166, 162, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:665      0 AMB  10-1:665    2.80    (#    665:10  Double Ambig)
 &rst
  ixpk= 665, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1689,1690, 168, 169, 170, 172, 173, 174,
 igr2= 162, 190,
 &end
#
#   46 GLY  HA+          47 TYR  HN          2.80    (#    668:10  Unique         2.20, 2.68 A)
 &rst
  ixpk= 668, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 686, 687,
 &end
#
#   46 GLY  HA-          47 TYR  HN          3.50    (#    669:10  Unique         2.20, 2.68 A)
 &rst
  ixpk= 669, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 686, 687,
 &end
#
#   56 ILE  QD1          47 TYR  HN          2.80    (#    670:10  Unique         2.80, 3.72 A)
 &rst
  ixpk= 670, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 856, 857, 858,
 &end
#
#   47 TYR  HD           47 TYR  HN          3.50    (#    671:10  Unique         3.02, 4.17 A)
 &rst
  ixpk= 671, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 699, 708,
 &end
#
#    0 AMB  10-2:672     47 TYR  HN          4.50    (#    672:10  Single Ambig)
 &rst
  ixpk= 672, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 693, 311,
 &end
#
#    0 AMB  10-2:673     47 TYR  HN          3.50    (#    673:10  Single Ambig)
 &rst
  ixpk= 673, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 762, 763, 764, 849, 850, 851,
 &end
#
#   71 CYS  HA           71 CYS  HN          4.50    (#    676:10  Unique         2.96, 2.96 A)
 &rst
  ixpk= 676, nxpk= 10, iat=1068,1066, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   70 ASP  HA           71 CYS  HN          2.80    (#    677:10  Unique         2.34, 2.37 A)
 &rst
  ixpk= 677, nxpk= 10, iat=1056,1066, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:678     71 CYS  HN          3.50    (#    678:10  Single Ambig)
 &rst
  ixpk= 678, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1058,1059, 987, 988,
 &end
#
#    0 AMB  10-2:679     71 CYS  HN          4.50    (#    679:10  Single Ambig)
 &rst
  ixpk= 679, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1058,1059,1047,
 &end
#
#   71 CYS  HB2          71 CYS  HN          3.50    (#    682:10  Unique         2.80, 2.87 A)
 &rst
  ixpk= 682, nxpk= 10, iat=1070,1066, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:683    108 LYS  HN          4.50    (#    683:10  Single Ambig)
 &rst
  ixpk= 683, nxpk= 10, iat=  -1,1609, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1619,1620,1676,1677,1678,
 &end
#
#  108 LYS  HA          108 LYS  HN          3.50    (#    684:10  Unique         2.85, 2.87 A)
 &rst
  ixpk= 684, nxpk= 10, iat=1611,1609, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  107 GLU  HB+         108 LYS  HN          3.50    (#    685:10  Unique         2.54, 3.04 A)
 &rst
  ixpk= 685, nxpk= 10, iat=  -1,1609, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1598,1599,
 &end
#
#  108 LYS  HB2         108 LYS  HN          3.50    (#    686:10  Unique         2.29, 2.42 A)
 &rst
  ixpk= 686, nxpk= 10, iat=1613,1609, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  109 ILE  HN          108 LYS  HN          3.50    (#    687:10  Unique         2.71, 2.78 A)
 &rst
  ixpk= 687, nxpk= 10, iat=1631,1609, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:688      0 AMB  10-1:688    2.80    (#    688:10  Double Ambig)
 &rst
  ixpk= 688, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 853, 854,1616,1617,
 igr2= 843,1609,
 &end
#
#  108 LYS  HG+         108 LYS  HN          3.50    (#    689:10  Unique         2.37, 3.01 A)
 &rst
  ixpk= 689, nxpk= 10, iat=  -1,1609, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1616,1617,
 &end
#
#   57 TYR  HN           56 ILE  HN          3.50    (#    690:10  Unique         2.66, 2.68 A)
 &rst
  ixpk= 690, nxpk= 10, iat= 862, 843, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:692     56 ILE  HN          4.50    (#    692:10  Single Ambig)
 &rst
  ixpk= 692, nxpk= 10, iat=  -1, 843, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 806, 864,
 &end
#
#   55 ASP  HB3          56 ILE  HN          4.50    (#    693:10  Unique         2.45, 2.50 A)
 &rst
  ixpk= 693, nxpk= 10, iat= 836, 843, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:694     56 ILE  HN          3.50    (#    694:10  Single Ambig)
 &rst
  ixpk= 694, nxpk= 10, iat=  -1, 843, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 847, 334,
 &end
#
#    0 AMB  10-2:695      0 AMB  10-1:695    3.50    (#    695:10  Double Ambig)
 &rst
  ixpk= 695, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 762, 763, 764, 849, 850, 851, 650, 651, 652, 654,
       655, 656, 336, 337, 338, 340, 341, 342,
 igr2= 843,1609,
 &end
#
#   56 ILE  HG1+         56 ILE  HN          3.50    (#    696:10  Unique         1.74, 2.28 A)
 &rst
  ixpk= 696, nxpk= 10, iat=  -1, 843, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 853, 854,
 &end
#
#    6 LEU  MDY          29 SER  HN          5.50    (#    697:10  Unique         2.58, 4.29 A)
 &rst
  ixpk= 697, nxpk= 10, iat=  -1, 441, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  78,  79,  80,  82,  83,  84,
 &end
#
#   29 SER  HB+          29 SER  HN          4.50    (#    698:10  Unique         2.40, 3.03 A)
 &rst
  ixpk= 698, nxpk= 10, iat=  -1, 441, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 445, 446,
 &end
#
#   29 SER  HB-          29 SER  HN          3.50    (#    699:10  Unique         2.40, 3.03 A)
 &rst
  ixpk= 699, nxpk= 10, iat=  -1, 441, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 445, 446,
 &end
#
#   28 HIS  HB2          29 SER  HN          5.50    (#    700:10  Unique         3.72, 3.78 A)
 &rst
  ixpk= 700, nxpk= 10, iat= 428, 441, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 SER  HA           29 SER  HN          4.50    (#    702:10  Unique         3.30, 3.39 A)
 &rst
  ixpk= 702, nxpk= 10, iat= 579, 441, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 HIS  HA           29 SER  HN          2.80    (#    703:10  Unique         2.30, 2.34 A)
 &rst
  ixpk= 703, nxpk= 10, iat= 426, 441, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   29 SER  HA           29 SER  HN          3.50    (#    704:10  Unique         2.80, 2.82 A)
 &rst
  ixpk= 704, nxpk= 10, iat= 443, 441, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   28 HIS  HB3          29 SER  HN          4.50    (#    705:10  Unique         2.61, 2.68 A)
 &rst
  ixpk= 705, nxpk= 10, iat= 429, 441, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    6 LEU  MDX          29 SER  HN          4.50    (#    706:10  Unique         2.58, 4.29 A)
 &rst
  ixpk= 706, nxpk= 10, iat=  -1, 441, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  78,  79,  80,  82,  83,  84,
 &end
#
#    0 AMB  10-2:713     55 ASP  HN          3.50    (#    713:10  Single Ambig)
 &rst
  ixpk= 713, nxpk= 10, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 762, 763, 764, 849, 850, 851, 336, 337, 338, 340,
       341, 342, 336, 337, 338, 340, 341, 342,
 &end
#
#   54 ALA  HN           55 ASP  HN          4.50    (#    714:10  Unique         2.75, 2.77 A)
 &rst
  ixpk= 714, nxpk= 10, iat= 821, 831, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   52 TYR  HN           55 ASP  HN          5.50    (#    715:10  Unique         3.86, 3.89 A)
 &rst
  ixpk= 715, nxpk= 10, iat= 783, 831, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   55 ASP  HA           55 ASP  HN          3.50    (#    716:10  Unique         2.87, 2.87 A)
 &rst
  ixpk= 716, nxpk= 10, iat= 833, 831, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:717     55 ASP  HN          3.50    (#    717:10  Single Ambig)
 &rst
  ixpk= 717, nxpk= 10, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 787, 788, 845,
 &end
#
#   55 ASP  HB3          55 ASP  HN          3.50    (#    718:10  Unique         2.63, 2.68 A)
 &rst
  ixpk= 718, nxpk= 10, iat= 836, 831, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   52 TYR  HB+          55 ASP  HN          3.50    (#    719:10  Unique         3.60, 4.33 A)
 &rst
  ixpk= 719, nxpk= 10, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 787, 788,
 &end
#
#   54 ALA  MB           55 ASP  HN          3.50    (#    720:10  Unique         3.00, 3.78 A)
 &rst
  ixpk= 720, nxpk= 10, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 825, 826, 827,
 &end
#
#   55 ASP  HB2          55 ASP  HN          3.50    (#    721:10  Unique         2.40, 2.45 A)
 &rst
  ixpk= 721, nxpk= 10, iat= 835, 831, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    7 ALA  MB            8 LEU  HN          4.50    (#    724:10  Unique         3.08, 3.80 A)
 &rst
  ixpk= 724, nxpk= 10, iat=  -1,  98, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  92,  93,  94,
 &end
#
#    0 AMB  10-2:725      8 LEU  HN          3.50    (#    725:10  Single Ambig)
 &rst
  ixpk= 725, nxpk= 10, iat=  -1,  98, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 107, 108, 109, 111, 112, 113, 130, 131, 132,
 &end
#
#    7 ALA  HN            8 LEU  HN          3.50    (#    726:10  Unique         2.43, 2.59 A)
 &rst
  ixpk= 726, nxpk= 10, iat=  88,  98, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    8 LEU  HA            8 LEU  HN          3.50    (#    728:10  Unique         2.93, 2.95 A)
 &rst
  ixpk= 728, nxpk= 10, iat= 100,  98, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    8 LEU  HB+           8 LEU  HN          2.80    (#    729:10  Unique         2.45, 3.07 A)
 &rst
  ixpk= 729, nxpk= 10, iat=  -1,  98, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 102, 103,
 &end
#
#    8 LEU  HG            8 LEU  HN          2.80    (#    730:10  Unique         2.36, 2.53 A)
 &rst
  ixpk= 730, nxpk= 10, iat= 105,  98, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    8 LEU  MDX           8 LEU  HN          3.50    (#    731:10  Unique         3.44, 4.52 A)
 &rst
  ixpk= 731, nxpk= 10, iat=  -1,  98, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 107, 108, 109, 111, 112, 113,
 &end
#
#   39 GLU  HA           40 SER  HN          2.80    (#    734:10  Unique         2.50, 2.64 A)
 &rst
  ixpk= 734, nxpk= 10, iat= 564, 577, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   40 SER  HB3          40 SER  HN          4.50    (#    735:10  Unique         3.92, 3.95 A)
 &rst
  ixpk= 735, nxpk= 10, iat= 582, 577, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:736     40 SER  HN          4.50    (#    736:10  Single Ambig)
 &rst
  ixpk= 736, nxpk= 10, iat=  -1, 577, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 569, 570, 569, 570,
 &end
#
#   39 GLU  HB+          40 SER  HN          3.50    (#    737:10  Unique         2.01, 2.77 A)
 &rst
  ixpk= 737, nxpk= 10, iat=  -1, 577, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 566, 567,
 &end
#
#   39 GLU  HB-          40 SER  HN          4.50    (#    738:10  Unique         2.01, 2.77 A)
 &rst
  ixpk= 738, nxpk= 10, iat=  -1, 577, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 566, 567,
 &end
#
#    6 LEU  MDX          40 SER  HN          4.50    (#    739:10  Unique         3.53, 5.34 A)
 &rst
  ixpk= 739, nxpk= 10, iat=  -1, 577, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  78,  79,  80,  82,  83,  84,
 &end
#
#   40 SER  HA           40 SER  HN          3.50    (#    740:10  Unique         2.92, 2.93 A)
 &rst
  ixpk= 740, nxpk= 10, iat= 579, 577, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   67 GLN  HA           67 GLN  HN          3.50    (#    741:10  Unique         2.87, 2.88 A)
 &rst
  ixpk= 741, nxpk= 10, iat=1021,1019, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:742     67 GLN  HN          3.50    (#    742:10  Single Ambig)
 &rst
  ixpk= 742, nxpk= 10, iat=  -1,1019, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1004,1005,1007,1008,
 &end
#
#    0 AMB  10-2:743     67 GLN  HN          3.50    (#    743:10  Single Ambig)
 &rst
  ixpk= 743, nxpk= 10, iat=  -1,1019, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 965, 982,
 &end
#
#   68 GLY  HN           67 GLN  HN          2.80    (#    744:10  Unique         2.62, 2.68 A)
 &rst
  ixpk= 744, nxpk= 10, iat=1036,1019, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   66 LYS  HN           67 GLN  HN          3.50    (#    745:10  Unique         2.69, 2.73 A)
 &rst
  ixpk= 745, nxpk= 10, iat= 997,1019, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:747     67 GLN  HN          3.50    (#    747:10  Single Ambig)
 &rst
  ixpk= 747, nxpk= 10, iat=  -1,1019, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 999,1038,1039,
 &end
#
#    0 AMB  10-2:748     67 GLN  HN          2.80    (#    748:10  Single Ambig)
 &rst
  ixpk= 748, nxpk= 10, iat=  -1,1019, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1026,1027,1024,
 &end
#
#   67 GLN  HB2          67 GLN  HN          3.50    (#    749:10  Unique         2.52, 2.59 A)
 &rst
  ixpk= 749, nxpk= 10, iat=1023,1019, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   60 VAL  HN           61 SER  HN          3.50    (#    751:10  Unique         2.70, 2.75 A)
 &rst
  ixpk= 751, nxpk= 10, iat= 917, 933, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:753     61 SER  HN          3.50    (#    753:10  Single Ambig)
 &rst
  ixpk= 753, nxpk= 10, iat=  -1, 933, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 919, 864, 946, 947,
 &end
#
#   61 SER  HB+          61 SER  HN          3.50    (#    754:10  Unique         2.62, 3.12 A)
 &rst
  ixpk= 754, nxpk= 10, iat=  -1, 933, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 937, 938,
 &end
#
#   61 SER  HB-          61 SER  HN          3.50    (#    755:10  Unique         2.62, 3.12 A)
 &rst
  ixpk= 755, nxpk= 10, iat=  -1, 933, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 937, 938,
 &end
#
#   60 VAL  HB           61 SER  HN          3.50    (#    756:10  Unique         2.65, 2.75 A)
 &rst
  ixpk= 756, nxpk= 10, iat= 921, 933, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   60 VAL  MGY          61 SER  HN          3.50    (#    757:10  Unique         3.65, 4.66 A)
 &rst
  ixpk= 757, nxpk= 10, iat=  -1, 933, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 923, 924, 925, 927, 928, 929,
 &end
#
#    0 AMB  10-2:758     61 SER  HN          4.50    (#    758:10  Single Ambig)
 &rst
  ixpk= 758, nxpk= 10, iat=  -1, 933, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 371, 372, 373, 336, 337, 338, 340, 341, 342,
 &end
#
#   62 GLY  HN           61 SER  HN          3.50    (#    759:10  Unique         2.70, 2.76 A)
 &rst
  ixpk= 759, nxpk= 10, iat= 944, 933, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:760     61 SER  HN          2.80    (#    760:10  Single Ambig)
 &rst
  ixpk= 760, nxpk= 10, iat=  -1, 933, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 935, 885,
 &end
#
#    0 AMB  10-2:761     61 SER  HN          3.50    (#    761:10  Single Ambig)
 &rst
  ixpk= 761, nxpk= 10, iat=  -1, 933, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 378, 379, 380, 923, 924, 925, 927, 928, 929, 375,
       376,
 &end
#
#  105 SER  HB3         106 THR  HN          3.50    (#    764:10  Unique         3.58, 3.62 A)
 &rst
  ixpk= 764, nxpk= 10, iat=1574,1580, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:766    106 THR  HN          3.50    (#    766:10  Single Ambig)
 &rst
  ixpk= 766, nxpk= 10, iat=  -1,1580, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1594,1609,
 &end
#
#    0 AMB  10-2:767    106 THR  HN          3.50    (#    767:10  Single Ambig)
 &rst
  ixpk= 767, nxpk= 10, iat=  -1,1580, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1584,1525,
 &end
#
#    0 AMB  10-2:768    106 THR  HN          3.50    (#    768:10  Single Ambig)
 &rst
  ixpk= 768, nxpk= 10, iat=  -1,1580, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1542,1821,1822,1821,1822,
 &end
#
#  105 SER  HN          106 THR  HN          3.50    (#    769:10  Unique         2.90, 2.96 A)
 &rst
  ixpk= 769, nxpk= 10, iat=1569,1580, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  106 THR  HA          106 THR  HN          3.50    (#    770:10  Unique         2.79, 2.82 A)
 &rst
  ixpk= 770, nxpk= 10, iat=1582,1580, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  106 THR  MG2         106 THR  HN          3.50    (#    771:10  Unique         2.46, 3.53 A)
 &rst
  ixpk= 771, nxpk= 10, iat=  -1,1580, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1586,1587,1588,
 &end
#
#    0 AMB  10-2:772    106 THR  HN          4.50    (#    772:10  Single Ambig)
 &rst
  ixpk= 772, nxpk= 10, iat=  -1,1580, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1793,1794,1795,1797,1798,1799,1544,1545,1546,
 &end
#
#   91 TYR  HE           93 TYR  HN          7.00    (#    773:10  Unique         6.62, 7.82 A)
 &rst
  ixpk= 773, nxpk= 10, iat=  -1,1395, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1377,1382,
 &end
#
#   92 GLY  HA-          93 TYR  HN          3.50    (#    774:10  Unique         2.26, 2.57 A)
 &rst
  ixpk= 774, nxpk= 10, iat=  -1,1395, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1390,1391,
 &end
#
#   77 GLY  HA+          93 TYR  HN          4.50    (#    777:10  Unique         2.59, 3.76 A)
 &rst
  ixpk= 777, nxpk= 10, iat=  -1,1395, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1138,1139,
 &end
#
#    0 AMB  10-2:778     93 TYR  HN          2.80    (#    778:10  Single Ambig)
 &rst
  ixpk= 778, nxpk= 10, iat=  -1,1395, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1390,1391,1886,
 &end
#
#   77 GLY  HA-          93 TYR  HN          3.50    (#    779:10  Unique         2.59, 3.76 A)
 &rst
  ixpk= 779, nxpk= 10, iat=  -1,1395, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1138,1139,
 &end
#
#  106 THR  HN          105 SER  HN          3.50    (#    780:10  Unique         2.90, 2.96 A)
 &rst
  ixpk= 780, nxpk= 10, iat=1580,1569, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  104 ILE  HN          105 SER  HN          2.80    (#    781:10  Unique         2.56, 2.64 A)
 &rst
  ixpk= 781, nxpk= 10, iat=1550,1569, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  102 HIS  HA          105 SER  HN          3.50    (#    783:10  Unique         2.79, 2.86 A)
 &rst
  ixpk= 783, nxpk= 10, iat=1525,1569, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  105 SER  HA          105 SER  HN          3.50    (#    784:10  Unique         2.75, 2.76 A)
 &rst
  ixpk= 784, nxpk= 10, iat=1571,1569, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  105 SER  HB3         105 SER  HN          3.50    (#    785:10  Unique         3.45, 3.50 A)
 &rst
  ixpk= 785, nxpk= 10, iat=1574,1569, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  104 ILE  HB          105 SER  HN          2.80    (#    786:10  Unique         2.30, 2.42 A)
 &rst
  ixpk= 786, nxpk= 10, iat=1554,1569, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   44 VAL  MGY         105 SER  HN          5.50    (#    787:10  Unique         3.84, 5.25 A)
 &rst
  ixpk= 787, nxpk= 10, iat=  -1,1569, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 650, 651, 652, 654, 655, 656,
 &end
#
#  105 SER  HB2         105 SER  HN          3.50    (#    789:10  Unique         2.48, 2.59 A)
 &rst
  ixpk= 789, nxpk= 10, iat=1573,1569, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   22 TYR  HB+          23 VAL  HN          3.50    (#    790:10  Unique         2.95, 3.51 A)
 &rst
  ixpk= 790, nxpk= 10, iat=  -1, 330, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 313, 314,
 &end
#
#    0 AMB  10-2:791     23 VAL  HN          7.00    (#    791:10  Single Ambig)
 &rst
  ixpk= 791, nxpk= 10, iat=  -1, 330, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 691,1536,
 &end
#
#   45 ARG  HN           23 VAL  HN          3.50    (#    793:10  Unique         3.04, 3.09 A)
 &rst
  ixpk= 793, nxpk= 10, iat= 660, 330, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   22 TYR  HA           23 VAL  HN          2.80    (#    794:10  Unique         2.43, 2.46 A)
 &rst
  ixpk= 794, nxpk= 10, iat= 311, 330, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:795     23 VAL  HN          3.50    (#    795:10  Single Ambig)
 &rst
  ixpk= 795, nxpk= 10, iat=  -1, 330, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 332, 686, 687,
 &end
#
#   22 TYR  HB-          23 VAL  HN          4.50    (#    796:10  Unique         2.95, 3.51 A)
 &rst
  ixpk= 796, nxpk= 10, iat=  -1, 330, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 313, 314,
 &end
#
#    0 AMB  10-2:797     23 VAL  HN          2.80    (#    797:10  Single Ambig)
 &rst
  ixpk= 797, nxpk= 10, iat=  -1, 330, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 336, 337, 338, 340, 341, 342, 336, 337, 338, 340,
       341, 342,
 &end
#
#   89 HIS  HE1         120 TRP  HN          5.50    (#    799:10  Unique         3.52, 3.60 A)
 &rst
  ixpk= 799, nxpk= 10, iat=1344,1817, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  120 TRP  HD1         120 TRP  HN          3.50    (#    800:10  Unique         2.60, 2.65 A)
 &rst
  ixpk= 800, nxpk= 10, iat=1825,1817, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  120 TRP  HA          120 TRP  HN          3.50    (#    801:10  Unique         2.90, 2.91 A)
 &rst
  ixpk= 801, nxpk= 10, iat=1819,1817, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  119 THR  HA          120 TRP  HN          2.80    (#    802:10  Unique         2.56, 2.61 A)
 &rst
  ixpk= 802, nxpk= 10, iat=1805,1817, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  119 THR  HB          120 TRP  HN          2.80    (#    804:10  Unique         2.27, 2.35 A)
 &rst
  ixpk= 804, nxpk= 10, iat=1807,1817, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  120 TRP  HB+         120 TRP  HN          4.50    (#    805:10  Unique         3.34, 3.67 A)
 &rst
  ixpk= 805, nxpk= 10, iat=  -1,1817, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1821,1822,
 &end
#
#    0 AMB  10-2:806    120 TRP  HN          3.50    (#    806:10  Single Ambig)
 &rst
  ixpk= 806, nxpk= 10, iat=  -1,1817, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1586,1587,1588,1809,1810,1811,
 &end
#
#   43 ILE  HG1-         43 ILE  HN          3.50    (#    807:10  Unique         2.34, 2.74 A)
 &rst
  ixpk= 807, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 635, 636,
 &end
#
#   25 ILE  HN           43 ILE  HN          3.50    (#    809:10  Unique         2.86, 2.92 A)
 &rst
  ixpk= 809, nxpk= 10, iat= 365, 625, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   42 GLU  HA           43 ILE  HN          2.80    (#    810:10  Unique         2.21, 2.26 A)
 &rst
  ixpk= 810, nxpk= 10, iat= 612, 625, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   26 ARG  HA           43 ILE  HN          4.50    (#    811:10  Unique         3.71, 3.78 A)
 &rst
  ixpk= 811, nxpk= 10, iat= 386, 625, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:812     43 ILE  HN          3.50    (#    812:10  Single Ambig)
 &rst
  ixpk= 812, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 614, 615, 617, 618, 629,
 &end
#
#    0 AMB  10-2:813     43 ILE  HN          3.50    (#    813:10  Single Ambig)
 &rst
  ixpk= 813, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 614, 615, 598, 599,
 &end
#
#   43 ILE  HG1+         43 ILE  HN          3.50    (#    814:10  Unique         2.34, 2.74 A)
 &rst
  ixpk= 814, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 635, 636,
 &end
#
#    0 AMB  10-2:815     43 ILE  HN          2.80    (#    815:10  Single Ambig)
 &rst
  ixpk= 815, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 355, 356, 357, 359, 360, 361, 631, 632, 633, 371,
       372, 373,
 &end
#
#   43 ILE  QD1          43 ILE  HN          4.50    (#    816:10  Unique         4.68, 4.87 A)
 &rst
  ixpk= 816, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 638, 639, 640,
 &end
#
#   82 GLN  HG+          82 GLN  HE2-        4.50    (#    820:10  Unique         2.24, 3.33 A)
 &rst
  ixpk= 820, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1221,1222,
 igr2=1226,1227,
 &end
#
#   96 ALA  MB           97 TYR  HN          4.50    (#    827:10  Unique         2.70, 3.83 A)
 &rst
  ixpk= 827, nxpk= 10, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1448,1449,1450,
 &end
#
#  122 ASN  HB+         122 ASN  HD2-        4.50    (#    843:10  Unique         2.25, 3.29 A)
 &rst
  ixpk= 843, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1855,1856,
 igr2=1860,1861,
 &end
#
#  122 ASN  HB-         122 ASN  HD2-        3.50    (#    844:10  Unique         2.25, 3.29 A)
 &rst
  ixpk= 844, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1855,1856,
 igr2=1860,1861,
 &end
#
#  122 ASN  HB+         122 ASN  HD2+        4.50    (#    845:10  Unique         2.25, 3.29 A)
 &rst
  ixpk= 845, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1855,1856,
 igr2=1860,1861,
 &end
#
#  122 ASN  HB-         122 ASN  HD2+        3.50    (#    849:10  Unique         2.25, 3.29 A)
 &rst
  ixpk= 849, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1855,1856,
 igr2=1860,1861,
 &end
#
#   84 GLN  HG+          84 GLN  HE2+        5.50    (#    858:10  Unique         2.27, 3.36 A)
 &rst
  ixpk= 858, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1249,1250,
 igr2=1254,1255,
 &end
#
#   94 SER  HB-          94 SER  HN          4.50    (#    861:10  Unique         2.36, 3.09 A)
 &rst
  ixpk= 861, nxpk= 10, iat=  -1,1416, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1420,1421,
 &end
#
#   14 ILE  QG2          46 GLY  HN          3.50    (#    864:10  Unique         2.34, 3.46 A)
 &rst
  ixpk= 864, nxpk= 10, iat=  -1, 684, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 196, 197, 198,
 &end
#
#    0 AMB  10-2:865     46 GLY  HN          2.80    (#    865:10  Single Ambig)
 &rst
  ixpk= 865, nxpk= 10, iat=  -1, 684, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 662, 192,
 &end
#
#    0 AMB  10-2:866     46 GLY  HN          4.50    (#    866:10  Single Ambig)
 &rst
  ixpk= 866, nxpk= 10, iat=  -1, 684, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 686, 687, 670, 671,
 &end
#
#    0 AMB  10-2:868     94 SER  HN          3.50    (#    868:10  Single Ambig)
 &rst
  ixpk= 868, nxpk= 10, iat=  -1,1416, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1129,1454,1395,
 &end
#
#   93 TYR  HA           94 SER  HN          3.50    (#    870:10  Unique         2.34, 2.40 A)
 &rst
  ixpk= 870, nxpk= 10, iat=1397,1416, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   93 TYR  HB-          94 SER  HN          4.50    (#    871:10  Unique         2.73, 3.49 A)
 &rst
  ixpk= 871, nxpk= 10, iat=  -1,1416, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1399,1400,
 &end
#
#    0 AMB  10-2:872     94 SER  HN          3.50    (#    872:10  Single Ambig)
 &rst
  ixpk= 872, nxpk= 10, iat=  -1,1416, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1420,1421,1399,1400,
 &end
#
#   61 SER  HN           62 GLY  HN          3.50    (#    876:10  Unique         2.70, 2.76 A)
 &rst
  ixpk= 876, nxpk= 10, iat= 933, 944, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   63 ASP  HN           62 GLY  HN          3.50    (#    877:10  Unique         2.74, 2.79 A)
 &rst
  ixpk= 877, nxpk= 10, iat= 951, 944, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:879     62 GLY  HN          3.50    (#    879:10  Single Ambig)
 &rst
  ixpk= 879, nxpk= 10, iat=  -1, 944, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 935, 897, 885,
 &end
#
#   62 GLY  HA+          62 GLY  HN          2.80    (#    880:10  Unique         2.27, 2.55 A)
 &rst
  ixpk= 880, nxpk= 10, iat=  -1, 944, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 946, 947,
 &end
#
#   62 GLY  HA-          62 GLY  HN          2.80    (#    881:10  Unique         2.27, 2.55 A)
 &rst
  ixpk= 881, nxpk= 10, iat=  -1, 944, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 946, 947,
 &end
#
#   61 SER  HB-          62 GLY  HN          5.50    (#    882:10  Unique         2.81, 3.49 A)
 &rst
  ixpk= 882, nxpk= 10, iat=  -1, 944, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 937, 938,
 &end
#
#   67 GLN  HG+          67 GLN  HE2-        4.50    (#    884:10  Unique         2.26, 3.21 A)
 &rst
  ixpk= 884, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1026,1027,
 igr2=1031,1032,
 &end
#
#   67 GLN  HG+          67 GLN  HE2+        5.50    (#    888:10  Unique         2.26, 3.21 A)
 &rst
  ixpk= 888, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1026,1027,
 igr2=1031,1032,
 &end
#
#   98 GLY  HA+          98 GLY  HN          3.50    (#    892:10  Unique         2.29, 2.62 A)
 &rst
  ixpk= 892, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1477,1478,
 &end
#
#   98 GLY  HA-          98 GLY  HN          3.50    (#    894:10  Unique         2.29, 2.62 A)
 &rst
  ixpk= 894, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1477,1478,
 &end
#
#   77 GLY  HA+          78 ARG  HN          2.80    (#    896:10  Unique         2.33, 2.63 A)
 &rst
  ixpk= 896, nxpk= 10, iat=  -1,1143, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1138,1139,
 &end
#
#   77 GLY  HA-          78 ARG  HN          3.50    (#    897:10  Unique         2.33, 2.63 A)
 &rst
  ixpk= 897, nxpk= 10, iat=  -1,1143, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1138,1139,
 &end
#
#   47 TYR  HD           49 TRP  HE1         4.50    (#    898:10  Unique         3.41, 4.19 A)
 &rst
  ixpk= 898, nxpk= 10, iat=  -1, 744, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 699, 708,
 &end
#
#   49 TRP  HZ2          49 TRP  HE1         3.50    (#    899:10  Unique         2.90, 2.90 A)
 &rst
  ixpk= 899, nxpk= 10, iat= 747, 744, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   49 TRP  HD1          49 TRP  HE1         2.80    (#    901:10  Unique         2.55, 2.55 A)
 &rst
  ixpk= 901, nxpk= 10, iat= 742, 744, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  123 ASP  HB+         124 GLY  HN          2.80    (#    904:10  Unique         2.86, 3.40 A)
 &rst
  ixpk= 904, nxpk= 10, iat=  -1,1877, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1869,1870,
 &end
#
#  123 ASP  HA          124 GLY  HN          3.50    (#    905:10  Unique         2.56, 2.97 A)
 &rst
  ixpk= 905, nxpk= 10, iat=1867,1877, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  124 GLY  HA+         124 GLY  HN          3.50    (#    907:10  Unique         2.30, 2.69 A)
 &rst
  ixpk= 907, nxpk= 10, iat=  -1,1877, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1879,1880,
 &end
#
#  124 GLY  HA-         124 GLY  HN          2.80    (#    908:10  Unique         2.30, 2.69 A)
 &rst
  ixpk= 908, nxpk= 10, iat=  -1,1877, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1879,1880,
 &end
#
#   92 GLY  HA-          92 GLY  HN          3.50    (#    912:10  Unique         2.26, 2.61 A)
 &rst
  ixpk= 912, nxpk= 10, iat=  -1,1388, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1390,1391,
 &end
#
#    0 AMB  10-2:913     92 GLY  HN          3.50    (#    913:10  Single Ambig)
 &rst
  ixpk= 913, nxpk= 10, iat=  -1,1388, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1390,1391,1886,
 &end
#
#   91 TYR  HB-          92 GLY  HN          3.50    (#    914:10  Unique         1.97, 2.92 A)
 &rst
  ixpk= 914, nxpk= 10, iat=  -1,1388, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1371,1372,
 &end
#
#   67 GLN  HN           68 GLY  HN          2.80    (#    918:10  Unique         2.62, 2.68 A)
 &rst
  ixpk= 918, nxpk= 10, iat=1019,1036, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:919     68 GLY  HN          3.50    (#    919:10  Single Ambig)
 &rst
  ixpk= 919, nxpk= 10, iat=  -1,1036, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 982, 965,
 &end
#
#   68 GLY  HA-          68 GLY  HN          2.80    (#    920:10  Unique         2.35, 2.73 A)
 &rst
  ixpk= 920, nxpk= 10, iat=  -1,1036, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1038,1039,
 &end
#
#    0 AMB  10-2:921     68 GLY  HN          3.50    (#    921:10  Single Ambig)
 &rst
  ixpk= 921, nxpk= 10, iat=  -1,1036, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1024,1047,1026,1027,
 &end
#
#   67 GLN  HA           68 GLY  HN          3.50    (#    922:10  Unique         3.46, 3.50 A)
 &rst
  ixpk= 922, nxpk= 10, iat=1021,1036, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   68 GLY  HA+          68 GLY  HN          2.80    (#    923:10  Unique         2.35, 2.73 A)
 &rst
  ixpk= 923, nxpk= 10, iat=  -1,1036, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1038,1039,
 &end
#
#   76 GLY  HA+          77 GLY  HN          3.50    (#    924:10  Unique         2.38, 2.58 A)
 &rst
  ixpk= 924, nxpk= 10, iat=  -1,1136, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1131,1132,
 &end
#
#   77 GLY  HA-          77 GLY  HN          4.50    (#    925:10  Unique         2.81, 2.82 A)
 &rst
  ixpk= 925, nxpk= 10, iat=  -1,1136, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1138,1139,
 &end
#
#    0 AMB  10-2:926     77 GLY  HN          3.50    (#    926:10  Single Ambig)
 &rst
  ixpk= 926, nxpk= 10, iat=  -1,1136, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1131,1132,1420,1421,
 &end
#
#   74 LEU  HN           75 GLY  HN          3.50    (#    928:10  Unique         2.34, 2.39 A)
 &rst
  ixpk= 928, nxpk= 10, iat=1103,1122, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:930     75 GLY  HN          3.50    (#    930:10  Single Ambig)
 &rst
  ixpk= 930, nxpk= 10, iat=  -1,1122, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1105, 332,
 &end
#
#    0 AMB  10-2:931     75 GLY  HN          3.50    (#    931:10  Single Ambig)
 &rst
  ixpk= 931, nxpk= 10, iat=  -1,1122, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1124,1125,1094,
 &end
#
#   75 GLY  HA-          75 GLY  HN          3.50    (#    932:10  Unique         2.76, 2.81 A)
 &rst
  ixpk= 932, nxpk= 10, iat=  -1,1122, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1124,1125,
 &end
#
#    0 AMB  10-2:933     75 GLY  HN          4.50    (#    933:10  Single Ambig)
 &rst
  ixpk= 933, nxpk= 10, iat=  -1,1122, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1500,1501,1502, 355, 356, 357, 359, 360, 361,1112,
      1113,1114,1116,1117,1118,
 &end
#
#   78 ARG  HB+          78 ARG  HN          4.50    (#    936:10  Unique         2.66, 3.05 A)
 &rst
  ixpk= 936, nxpk= 10, iat=  -1,1143, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1147,1148,
 &end
#
#    0 AMB  10-2:937     78 ARG  HN          4.50    (#    937:10  Single Ambig)
 &rst
  ixpk= 937, nxpk= 10, iat=  -1,1143, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 319, 324,1533,
 &end
#
#  101 GLN  HN          102 HIS  HN          5.50    (#    938:10  Unique         3.77, 3.80 A)
 &rst
  ixpk= 938, nxpk= 10, iat=1506,1523, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   52 TYR  HB-          54 ALA  HN          4.50    (#    939:10  Unique         2.64, 3.59 A)
 &rst
  ixpk= 939, nxpk= 10, iat=  -1, 821, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 787, 788,
 &end
#
#   52 TYR  HA           54 ALA  HN          5.50    (#    940:10  Unique         4.17, 4.21 A)
 &rst
  ixpk= 940, nxpk= 10, iat= 785, 821, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   55 ASP  HA           54 ALA  HN          5.50    (#    941:10  Unique         5.29, 5.32 A)
 &rst
  ixpk= 941, nxpk= 10, iat= 833, 821, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   97 TYR  HE           54 ALA  HN          5.50    (#    942:10  Unique         3.31, 5.22 A)
 &rst
  ixpk= 942, nxpk= 10, iat=  -1, 821, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1464,1469,
 &end
#
#    0 AMB  10-2:943     54 ALA  HN          7.00    (#    943:10  Single Ambig)
 &rst
  ixpk= 943, nxpk= 10, iat=  -1, 821, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1462,1471, 793, 798,
 &end
#
#   53 HIS  HN           54 ALA  HN          4.50    (#    945:10  Unique         2.81, 2.85 A)
 &rst
  ixpk= 945, nxpk= 10, iat= 804, 821, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:946     58 ASP  HN          4.50    (#    946:10  Single Ambig)
 &rst
  ixpk= 946, nxpk= 10, iat=  -1, 883, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
 igr1= 336, 337, 338, 340, 341, 342, 336, 337, 338, 340,
       341, 342, 923, 924, 925, 927, 928, 929, 849, 850,
       851, 762, 763, 764, 378, 379, 380,
 &end
#
#   59 LYS  HB+          58 ASP  HN          5.50    (#    947:10  Unique         4.76, 5.07 A)
 &rst
  ixpk= 947, nxpk= 10, iat=  -1, 883, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 899, 900,
 &end
#
#    0 AMB  10-2:948     26 ARG  HN          5.50    (#    948:10  Single Ambig)
 &rst
  ixpk= 948, nxpk= 10, iat=  -1, 384, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1081,1082,1096,1097,
 &end
#
#   26 ARG  HB3          27 VAL  HN          4.50    (#    949:10  Unique         3.93, 4.01 A)
 &rst
  ixpk= 949, nxpk= 10, iat= 389, 408, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:950     27 VAL  HN          5.50    (#    950:10  Single Ambig)
 &rst
  ixpk= 950, nxpk= 10, iat=  -1, 408, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 595, 596, 635, 636,
 &end
#
#    0 AMB  10-2:951     27 VAL  HN          2.80    (#    951:10  Single Ambig)
 &rst
  ixpk= 951, nxpk= 10, iat=  -1, 408, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1= 391, 392, 414, 415, 416, 418, 419, 420, 595, 596,
      
 &end
#
#   43 ILE  HN           27 VAL  HN          5.50    (#    952:10  Unique         4.80, 4.85 A)
 &rst
  ixpk= 952, nxpk= 10, iat= 625, 408, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:953     26 ARG  HN          5.50    (#    953:10  Single Ambig)
 &rst
  ixpk= 953, nxpk= 10, iat=  -1, 384, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 391, 392, 353, 635, 636,
 &end
#
#    0 AMB  10-2:954     26 ARG  HN          5.50    (#    954:10  Single Ambig)
 &rst
  ixpk= 954, nxpk= 10, iat=  -1, 384, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 635, 636,1096,1097,
 &end
#
#   73 CYS  HA           73 CYS  HN          5.50    (#    955:10  Unique         2.90, 2.91 A)
 &rst
  ixpk= 955, nxpk= 10, iat=1094,1092, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:956    119 THR  HN          5.50    (#    956:10  Single Ambig)
 &rst
  ixpk= 956, nxpk= 10, iat=  -1,1803, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1357,1358,1359,1361,1362,1363,1321,1322,1323,
 &end
#
#   32 ARG  HA           33 SER  HN          5.50    (#    957:10  Unique         2.21, 2.91 A)
 &rst
  ixpk= 957, nxpk= 10, iat= 478, 500, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   90 VAL  MGY         119 THR  HN          5.50    (#    958:10  Unique         3.38, 6.06 A)
 &rst
  ixpk= 958, nxpk= 10, iat=  -1,1803, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1357,1358,1359,1361,1362,1363,
 &end
#
#    0 AMB  10-2:959    119 THR  HN          5.50    (#    959:10  Single Ambig)
 &rst
  ixpk= 959, nxpk= 10, iat=  -1,1803, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1357,1358,1359,1361,1362,1363,1321,1322,1323,
 &end
#
#  118 VAL  HN          119 THR  HN          5.50    (#    960:10  Unique         4.32, 4.37 A)
 &rst
  ixpk= 960, nxpk= 10, iat=1787,1803, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   43 ILE  QD1          25 ILE  HN          5.50    (#    961:10  Unique         5.11, 5.65 A)
 &rst
  ixpk= 961, nxpk= 10, iat=  -1, 365, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 638, 639, 640,
 &end
#
#    0 AMB  10-2:962     25 ILE  HN          5.50    (#    962:10  Single Ambig)
 &rst
  ixpk= 962, nxpk= 10, iat=  -1, 365, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 614, 615, 629, 648,
 &end
#
#    0 AMB  10-2:963     25 ILE  HN          4.50    (#    963:10  Single Ambig)
 &rst
  ixpk= 963, nxpk= 10, iat=  -1, 365, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 650, 651, 652, 654, 655, 656,1112,1113,1114,1116,
      1117,1118,
 &end
#
#   44 VAL  MGX          23 VAL  HN          4.50    (#    964:10  Unique         4.84, 6.51 A)
 &rst
  ixpk= 964, nxpk= 10, iat=  -1, 330, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 650, 651, 652, 654, 655, 656,
 &end
#
#    0 AMB  10-2:965     23 VAL  HN          5.50    (#    965:10  Single Ambig)
 &rst
  ixpk= 965, nxpk= 10, iat=  -1, 330, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 334, 847,
 &end
#
#   46 GLY  HA-          23 VAL  HN          5.50    (#    966:10  Unique         3.86, 4.01 A)
 &rst
  ixpk= 966, nxpk= 10, iat=  -1, 330, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 686, 687,
 &end
#
#   22 TYR  HD           23 VAL  HN          4.50    (#    967:10  Unique         2.70, 3.55 A)
 &rst
  ixpk= 967, nxpk= 10, iat=  -1, 330, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 317, 326,
 &end
#
#    0 AMB  10-2:968     74 LEU  HN          5.50    (#    968:10  Single Ambig)
 &rst
  ixpk= 968, nxpk= 10, iat=  -1,1103, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1096,1097, 617, 618,1081,1082,1458,1459,
 &end
#
#   25 ILE  HG1-         74 LEU  HN          5.50    (#    970:10  Unique         4.92, 5.92 A)
 &rst
  ixpk= 970, nxpk= 10, iat=  -1,1103, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 375, 376,
 &end
#
#   73 CYS  HB-          74 LEU  HN          5.50    (#    971:10  Unique         3.45, 3.91 A)
 &rst
  ixpk= 971, nxpk= 10, iat=  -1,1103, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1096,1097,
 &end
#
#   55 ASP  HB3          51 GLU  HN          5.50    (#    972:10  Unique         4.23, 4.30 A)
 &rst
  ixpk= 972, nxpk= 10, iat= 836, 768, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   90 VAL  MGY          80 SER  HN          5.50    (#    976:10  Unique         4.41, 6.00 A)
 &rst
  ixpk= 976, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1357,1358,1359,1361,1362,1363,
 &end
#
#   91 TYR  HE           80 SER  HN          5.50    (#    977:10  Unique         3.01, 5.63 A)
 &rst
  ixpk= 977, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1377,1382,
 &end
#
#   52 TYR  HB-          53 HIS  HN          5.50    (#    978:10  Unique         2.98, 3.36 A)
 &rst
  ixpk= 978, nxpk= 10, iat=  -1, 804, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 787, 788,
 &end
#
#   54 ALA  HN           53 HIS  HN          5.50    (#    979:10  Unique         2.81, 2.85 A)
 &rst
  ixpk= 979, nxpk= 10, iat= 821, 804, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   52 TYR  HB+          53 HIS  HN          5.50    (#    980:10  Unique         2.98, 3.36 A)
 &rst
  ixpk= 980, nxpk= 10, iat=  -1, 804, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 787, 788,
 &end
#
#    0 AMB  10-2:981     72 GLU  HN          5.50    (#    981:10  Single Ambig)
 &rst
  ixpk= 981, nxpk= 10, iat=  -1,1077, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1112,1113,1114,1116,1117,1118, 371, 372, 373,
 &end
#
#   26 ARG  HB2          72 GLU  HN          4.50    (#    982:10  Unique         4.52, 4.55 A)
 &rst
  ixpk= 982, nxpk= 10, iat= 388,1077, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 VAL  HA           72 GLU  HN          4.50    (#    983:10  Unique         4.10, 4.21 A)
 &rst
  ixpk= 983, nxpk= 10, iat= 410,1077, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:984    121 ALA  HN          4.50    (#    984:10  Single Ambig)
 &rst
  ixpk= 984, nxpk= 10, iat=  -1,1841, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1371,1372,1527,
 &end
#
#   91 TYR  HA          121 ALA  HN          4.50    (#    985:10  Unique         2.98, 3.11 A)
 &rst
  ixpk= 985, nxpk= 10, iat=1369,1841, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 VAL  HB           28 HIS  HN          5.50    (#    987:10  Unique         3.91, 4.15 A)
 &rst
  ixpk= 987, nxpk= 10, iat= 412, 424, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:988     28 HIS  HN          5.50    (#    988:10  Single Ambig)
 &rst
  ixpk= 988, nxpk= 10, iat=  -1, 424, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1058,1059,1047,
 &end
#
#    0 AMB  10-2:989    110 LYS  HN          5.50    (#    989:10  Single Ambig)
 &rst
  ixpk= 989, nxpk= 10, iat=  -1,1650, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1637,1638,1639, 168, 169, 170, 172, 173, 174,
 &end
#
#    0 AMB  10-2:990     61 SER  HN          5.50    (#    990:10  Single Ambig)
 &rst
  ixpk= 990, nxpk= 10, iat=  -1, 933, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 899, 900, 984,
 &end
#
#    0 AMB  10-2:991     61 SER  HN          5.50    (#    991:10  Single Ambig)
 &rst
  ixpk= 991, nxpk= 10, iat=  -1, 933, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 870, 879, 895,
 &end
#
#    0 AMB  10-2:992     21 LYS  HN          5.50    (#    992:10  Single Ambig)
 &rst
  ixpk= 992, nxpk= 10, iat=  -1, 287, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 762, 763, 764, 849, 850, 851,
 &end
#
#   21 LYS  HA           21 LYS  HN          4.50    (#    993:10  Unique         2.91, 2.95 A)
 &rst
  ixpk= 993, nxpk= 10, iat= 289, 287, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   51 GLU  HA           21 LYS  HN          7.00    (#    994:10  Unique         4.05, 4.34 A)
 &rst
  ixpk= 994, nxpk= 10, iat= 770, 287, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:995    118 VAL  HN          4.50    (#    995:10  Single Ambig)
 &rst
  ixpk= 995, nxpk= 10, iat=  -1,1787, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1809,1810,1811,1586,1587,1588,
 &end
#
#    0 AMB  10-2:996    118 VAL  HN          5.50    (#    996:10  Single Ambig)
 &rst
  ixpk= 996, nxpk= 10, iat=  -1,1787, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1657,1658,1660,1661,
 &end
#
#    0 AMB  10-2:997    118 VAL  HN          3.50    (#    997:10  Single Ambig)
 &rst
  ixpk= 997, nxpk= 10, iat=  -1,1787, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1793,1794,1795,1797,1798,1799,1793,1794,1795,1797,
      1798,1799,
 &end
#
#   90 VAL  HB           91 TYR  HN          5.50    (#    999:10  Unique         4.12, 4.18 A)
 &rst
  ixpk= 999, nxpk= 10, iat=1355,1367, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   91 TYR  HB-          91 TYR  HN          5.50    (#   1000:10  Unique         3.31, 3.68 A)
 &rst
  ixpk= 1000, nxpk= 10, iat=  -1,1367, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1371,1372,
 &end
#
#   91 TYR  HB+          91 TYR  HN          5.50    (#   1001:10  Unique         3.31, 3.68 A)
 &rst
  ixpk= 1001, nxpk= 10, iat=  -1,1367, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1371,1372,
 &end
#
#   91 TYR  HA           91 TYR  HN          4.50    (#   1002:10  Unique         2.91, 2.92 A)
 &rst
  ixpk= 1002, nxpk= 10, iat=1369,1367, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 ASP  HN            6 LEU  HN          5.50    (#   1003:10  Unique         4.32, 4.35 A)
 &rst
  ixpk= 1003, nxpk= 10, iat=  57,  69, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1004    64 MET  HN          5.50    (#   1004:10  Single Ambig)
 &rst
  ixpk= 1004, nxpk= 10, iat=  -1, 963, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 919, 946, 947,
 &end
#
#   20 PHE  HN           79 ILE  HN          4.50    (#   1005:10  Unique         2.95, 3.05 A)
 &rst
  ixpk= 1005, nxpk= 10, iat= 267,1167, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1006    79 ILE  HN          5.50    (#   1006:10  Single Ambig)
 &rst
  ixpk= 1006, nxpk= 10, iat=  -1,1167, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 309, 251,
 &end
#
#   79 ILE  HA           79 ILE  HN          5.50    (#   1007:10  Unique         2.96, 2.97 A)
 &rst
  ixpk= 1007, nxpk= 10, iat=1169,1167, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1008    79 ILE  HN          5.50    (#   1008:10  Single Ambig)
 &rst
  ixpk= 1008, nxpk= 10, iat=  -1,1167, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 289,1353,
 &end
#
#   79 ILE  HG1-         79 ILE  HN          5.50    (#   1009:10  Unique         3.04, 3.68 A)
 &rst
  ixpk= 1009, nxpk= 10, iat=  -1,1167, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1177,1178,
 &end
#
#   78 ARG  HB+          79 ILE  HN          4.50    (#   1010:10  Unique         2.17, 3.72 A)
 &rst
  ixpk= 1010, nxpk= 10, iat=  -1,1167, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1147,1148,
 &end
#
#    0 AMB  10-2:1011    79 ILE  HN          3.50    (#   1011:10  Single Ambig)
 &rst
  ixpk= 1011, nxpk= 10, iat=  -1,1167, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1147,1148,1177,1178,
 &end
#
#   78 ARG  HB-          79 ILE  HN          4.50    (#   1012:10  Unique         2.17, 3.72 A)
 &rst
  ixpk= 1012, nxpk= 10, iat=  -1,1167, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1147,1148,
 &end
#
#   79 ILE  QD1          79 ILE  HN          5.50    (#   1013:10  Unique         4.10, 4.85 A)
 &rst
  ixpk= 1013, nxpk= 10, iat=  -1,1167, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1180,1181,1182,
 &end
#
#   38 ALA  MB           29 SER  HN          5.50    (#   1014:10  Unique         5.48, 6.15 A)
 &rst
  ixpk= 1014, nxpk= 10, iat=  -1, 441, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 556, 557, 558,
 &end
#
#   30 ALA  HN           29 SER  HN          4.50    (#   1019:10  Unique         3.43, 3.89 A)
 &rst
  ixpk= 1019, nxpk= 10, iat= 452, 441, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1020    45 ARG  HN          5.50    (#   1020:10  Single Ambig)
 &rst
  ixpk= 1020, nxpk= 10, iat=  -1, 660, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 648, 629,
 &end
#
#    0 AMB  10-2:1021    45 ARG  HN          5.50    (#   1021:10  Single Ambig)
 &rst
  ixpk= 1021, nxpk= 10, iat=  -1, 660, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 635, 636, 923, 924, 925, 927, 928, 929,
 &end
#
#    0 AMB  10-2:1022    45 ARG  HN          3.50    (#   1022:10  Single Ambig)
 &rst
  ixpk= 1022, nxpk= 10, iat=  -1, 660, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 330, 365,
 &end
#
#    0 AMB  10-2:1023    41 LYS  HN          3.50    (#   1023:10  Single Ambig)
 &rst
  ixpk= 1023, nxpk= 10, iat=  -1, 588, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 592, 593, 412,
 &end
#
#    6 LEU  MDY          41 LYS  HN          4.50    (#   1024:10  Unique         2.81, 4.33 A)
 &rst
  ixpk= 1024, nxpk= 10, iat=  -1, 588, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  78,  79,  80,  82,  83,  84,
 &end
#
#    6 LEU  HB3          41 LYS  HN          5.50    (#   1025:10  Unique         4.75, 4.96 A)
 &rst
  ixpk= 1025, nxpk= 10, iat=  74, 588, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   90 VAL  MGX         106 THR  HN          5.50    (#   1026:10  Unique         4.39, 5.64 A)
 &rst
  ixpk= 1026, nxpk= 10, iat=  -1,1580, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1357,1358,1359,1361,1362,1363,
 &end
#
#    0 AMB  10-2:1027   106 THR  HN          5.50    (#   1027:10  Single Ambig)
 &rst
  ixpk= 1027, nxpk= 10, iat=  -1,1580, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=1355,1554,1613,1660,1661,1654,1655,
 &end
#
#    0 AMB  10-2:1028   106 THR  HN          5.50    (#   1028:10  Single Ambig)
 &rst
  ixpk= 1028, nxpk= 10, iat=  -1,1580, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1571,1552,
 &end
#
#  104 ILE  HN          106 THR  HN          5.50    (#   1029:10  Unique         4.22, 4.31 A)
 &rst
  ixpk= 1029, nxpk= 10, iat=1550,1580, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   65 GLN  HB3          65 GLN  HN          3.50    (#   1030:10  Unique         3.52, 3.52 A)
 &rst
  ixpk= 1030, nxpk= 10, iat= 985, 980, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1031    65 GLN  HN          5.50    (#   1031:10  Single Ambig)
 &rst
  ixpk= 1031, nxpk= 10, iat=  -1, 980, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 935, 999,
 &end
#
#   62 GLY  HA-          65 GLN  HN          5.50    (#   1032:10  Unique         3.62, 4.27 A)
 &rst
  ixpk= 1032, nxpk= 10, iat=  -1, 980, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 946, 947,
 &end
#
#   71 CYS  HB3          71 CYS  HN          4.50    (#   1033:10  Unique         3.87, 3.89 A)
 &rst
  ixpk= 1033, nxpk= 10, iat=1071,1066, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1043   109 ILE  HN          5.50    (#   1043:10  Single Ambig)
 &rst
  ixpk= 1043, nxpk= 10, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1611,1726,1727,
 &end
#
#    0 AMB  10-2:1048    90 VAL  HN          5.50    (#   1048:10  Single Ambig)
 &rst
  ixpk= 1048, nxpk= 10, iat=  -1,1351, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1586,1587,1588,1809,1810,1811,
 &end
#
#   89 HIS  HB-          90 VAL  HN          4.50    (#   1049:10  Unique         3.77, 4.05 A)
 &rst
  ixpk= 1049, nxpk= 10, iat=  -1,1351, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1338,1339,
 &end
#
#    0 AMB  10-2:1050    90 VAL  HN          4.50    (#   1050:10  Single Ambig)
 &rst
  ixpk= 1050, nxpk= 10, iat=  -1,1351, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1338,1339,1528,
 &end
#
#   90 VAL  HA           90 VAL  HN          5.50    (#   1051:10  Unique         2.98, 2.98 A)
 &rst
  ixpk= 1051, nxpk= 10, iat=1353,1351, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1052    90 VAL  HN          4.50    (#   1052:10  Single Ambig)
 &rst
  ixpk= 1052, nxpk= 10, iat=  -1,1351, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1841,1186,
 &end
#
#  119 THR  HN           90 VAL  HN          5.50    (#   1053:10  Unique         3.50, 3.68 A)
 &rst
  ixpk= 1053, nxpk= 10, iat=1803,1351, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   13 ASP  HN            0 AMB  10-1:1054   5.50    (#   1054:10  Single Ambig)
 &rst
  ixpk= 1054, nxpk= 10, iat= 178,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 190, 162,
 &end
#
#   44 VAL  HN           12 VAL  HN          5.50    (#   1055:10  Unique         4.80, 4.93 A)
 &rst
  ixpk= 1055, nxpk= 10, iat= 644, 162, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    2 ALA  MB            2 ALA  HN          5.50    (#   1057:10  Unique         2.47, 3.10 A)
 &rst
  ixpk= 1057, nxpk= 10, iat=  -1,  21, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  25,  26,  27,
 &end
#
#   29 SER  HB-          30 ALA  HN          5.50    (#   1058:10  Unique         1.93, 4.09 A)
 &rst
  ixpk= 1058, nxpk= 10, iat=  -1, 452, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 445, 446,
 &end
#
#   27 VAL  MGY          70 ASP  HN          5.50    (#   1061:10  Unique         3.53, 5.48 A)
 &rst
  ixpk= 1061, nxpk= 10, iat=  -1,1054, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 414, 415, 416, 418, 419, 420,
 &end
#
#   28 HIS  HB3          70 ASP  HN          5.50    (#   1062:10  Unique         4.36, 4.80 A)
 &rst
  ixpk= 1062, nxpk= 10, iat= 429,1054, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   56 ILE  QD1          22 TYR  HN          4.50    (#   1063:10  Unique         3.38, 4.28 A)
 &rst
  ixpk= 1063, nxpk= 10, iat=  -1, 309, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 856, 857, 858,
 &end
#
#    0 AMB  10-2:1064    22 TYR  HN          5.50    (#   1064:10  Single Ambig)
 &rst
  ixpk= 1064, nxpk= 10, iat=  -1, 309, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 336, 337, 338, 340, 341, 342, 336, 337, 338, 340,
       341, 342, 762, 763, 764, 849, 850, 851,
 &end
#
#    0 AMB  10-2:1065    22 TYR  HN          5.50    (#   1065:10  Single Ambig)
 &rst
  ixpk= 1065, nxpk= 10, iat=  -1, 309, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=1171,1357,1358,1359,1361,1362,1363,
 &end
#
#   90 VAL  MGY          22 TYR  HN          5.50    (#   1067:10  Unique         6.06, 7.88 A)
 &rst
  ixpk= 1067, nxpk= 10, iat=  -1, 309, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1357,1358,1359,1361,1362,1363,
 &end
#
#   21 LYS  HB2          22 TYR  HN          4.50    (#   1068:10  Unique         3.34, 3.53 A)
 &rst
  ixpk= 1068, nxpk= 10, iat= 291, 309, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   22 TYR  HB-          22 TYR  HN          4.50    (#   1069:10  Unique         2.73, 3.34 A)
 &rst
  ixpk= 1069, nxpk= 10, iat=  -1, 309, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 313, 314,
 &end
#
#   22 TYR  HB+          22 TYR  HN          5.50    (#   1070:10  Unique         2.73, 3.34 A)
 &rst
  ixpk= 1070, nxpk= 10, iat=  -1, 309, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 313, 314,
 &end
#
#    0 AMB  10-2:1071    22 TYR  HN          5.50    (#   1071:10  Single Ambig)
 &rst
  ixpk= 1071, nxpk= 10, iat=  -1, 309, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 275, 283, 691,1536,
 &end
#
#   79 ILE  HN           22 TYR  HN          5.50    (#   1072:10  Unique         4.40, 4.54 A)
 &rst
  ixpk= 1072, nxpk= 10, iat=1167, 309, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 VAL  HN           22 TYR  HN          5.50    (#   1073:10  Unique         4.37, 4.39 A)
 &rst
  ixpk= 1073, nxpk= 10, iat= 330, 309, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   31 PRO  HB+          32 ARG  HN          5.50    (#   1075:10  Unique         2.90, 3.63 A)
 &rst
  ixpk= 1075, nxpk= 10, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 469, 470,
 &end
#
#    0 AMB  10-2:1076    32 ARG  HN          7.00    (#   1076:10  Single Ambig)
 &rst
  ixpk= 1076, nxpk= 10, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 522, 523, 524, 456, 457, 458,
 &end
#
#   40 SER  HB2          40 SER  HN          4.50    (#   1080:10  Unique         2.91, 3.01 A)
 &rst
  ixpk= 1080, nxpk= 10, iat= 581, 577, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 LEU  MDX         103 ALA  HN          5.50    (#   1081:10  Unique         5.50, 7.64 A)
 &rst
  ixpk= 1081, nxpk= 10, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 355, 356, 357, 359, 360, 361,
 &end
#
#   19 VAL  MG2          20 PHE  HN          4.50    (#   1082:10  Unique         4.61, 5.21 A)
 &rst
  ixpk= 1082, nxpk= 10, iat=  -1, 267, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 261, 262, 263,
 &end
#
#   78 ARG  HG+          20 PHE  HN          5.50    (#   1083:10  Unique         3.21, 3.99 A)
 &rst
  ixpk= 1083, nxpk= 10, iat=  -1, 267, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1150,1151,
 &end
#
#  102 HIS  HB2         103 ALA  HN          5.50    (#   1084:10  Unique         3.16, 3.22 A)
 &rst
  ixpk= 1084, nxpk= 10, iat=1527,1540, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  105 SER  HN          103 ALA  HN          5.50    (#   1085:10  Unique         4.26, 4.28 A)
 &rst
  ixpk= 1085, nxpk= 10, iat=1569,1540, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1086    42 GLU  HN          4.50    (#   1086:10  Single Ambig)
 &rst
  ixpk= 1086, nxpk= 10, iat=  -1, 610, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 391, 392, 355, 356, 357, 359, 360, 361,
 &end
#
#  108 LYS  HE+          42 GLU  HN          5.50    (#   1087:10  Unique         3.15, 4.67 A)
 &rst
  ixpk= 1087, nxpk= 10, iat=  -1, 610, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1622,1623,
 &end
#
#   41 LYS  HG+          42 GLU  HN          5.50    (#   1088:10  Unique         3.37, 4.29 A)
 &rst
  ixpk= 1088, nxpk= 10, iat=  -1, 610, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 595, 596,
 &end
#
#   93 TYR  HA           93 TYR  HN          5.50    (#   1089:10  Unique         2.90, 2.91 A)
 &rst
  ixpk= 1089, nxpk= 10, iat=1397,1395, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   93 TYR  HD           93 TYR  HN          5.50    (#   1090:10  Unique         2.91, 4.01 A)
 &rst
  ixpk= 1090, nxpk= 10, iat=  -1,1395, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1403,1412,
 &end
#
#    0 AMB  10-2:1091    57 TYR  HN          5.50    (#   1091:10  Single Ambig)
 &rst
  ixpk= 1091, nxpk= 10, iat=  -1, 862, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 825, 826, 827, 665, 902, 903,
 &end
#
#   56 ILE  HG1+         57 TYR  HN          5.50    (#   1092:10  Unique         2.65, 3.12 A)
 &rst
  ixpk= 1092, nxpk= 10, iat=  -1, 862, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 853, 854,
 &end
#
#   97 TYR  HB-          97 TYR  HN          4.50    (#   1096:10  Unique         2.69, 3.34 A)
 &rst
  ixpk= 1096, nxpk= 10, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1458,1459,
 &end
#
#   97 TYR  HB+          97 TYR  HN          5.50    (#   1097:10  Unique         2.69, 3.34 A)
 &rst
  ixpk= 1097, nxpk= 10, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1458,1459,
 &end
#
#   97 TYR  HA           97 TYR  HN          4.50    (#   1099:10  Unique         2.93, 2.97 A)
 &rst
  ixpk= 1099, nxpk= 10, iat=1456,1454, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   94 SER  HB+          98 GLY  HN          5.50    (#   1102:10  Unique         2.61, 4.18 A)
 &rst
  ixpk= 1102, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1420,1421,
 &end
#
#   94 SER  HB-          98 GLY  HN          7.00    (#   1103:10  Unique         2.61, 4.18 A)
 &rst
  ixpk= 1103, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1420,1421,
 &end
#
#   97 TYR  HB-          98 GLY  HN          5.50    (#   1104:10  Unique         2.45, 3.79 A)
 &rst
  ixpk= 1104, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1458,1459,
 &end
#
#   97 TYR  HA           98 GLY  HN          5.50    (#   1105:10  Unique         2.48, 3.21 A)
 &rst
  ixpk= 1105, nxpk= 10, iat=1456,1475, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  122 ASN  HB-         123 ASP  HN          5.50    (#   1106:10  Unique         3.08, 4.15 A)
 &rst
  ixpk= 1106, nxpk= 10, iat=  -1,1865, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1855,1856,
 &end
#
#    0 AMB  10-2:1108    63 ASP  HN          7.00    (#   1108:10  Single Ambig)
 &rst
  ixpk= 1108, nxpk= 10, iat=  -1, 951, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 968, 905, 906,
 &end
#
#    0 AMB  10-2:1109    63 ASP  HN          5.50    (#   1109:10  Single Ambig)
 &rst
  ixpk= 1109, nxpk= 10, iat=  -1, 951, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 923, 924, 925, 927, 928, 929, 378, 379, 380,
 &end
#
#    0 AMB  10-2:1110    63 ASP  HN          4.50    (#   1110:10  Single Ambig)
 &rst
  ixpk= 1110, nxpk= 10, iat=  -1, 951, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 935, 897, 885,
 &end
#
#    0 AMB  10-2:1111    63 ASP  HN          4.50    (#   1111:10  Single Ambig)
 &rst
  ixpk= 1111, nxpk= 10, iat=  -1, 951, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 980, 917,
 &end
#
#    0 AMB  10-2:1112   113 TYR  HN          4.50    (#   1112:10  Single Ambig)
 &rst
  ixpk= 1112, nxpk= 10, iat=  -1,1704, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1689,1690, 168, 169, 170, 172, 173, 174,
 &end
#
#    0 AMB  10-2:1114   113 TYR  HN          5.50    (#   1114:10  Single Ambig)
 &rst
  ixpk= 1114, nxpk= 10, iat=  -1,1704, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1676,1677,1678,1657,1658,
 &end
#
#  110 LYS  HA          113 TYR  HN          4.50    (#   1117:10  Unique         3.28, 3.63 A)
 &rst
  ixpk= 1117, nxpk= 10, iat=1652,1704, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  111 ALA  HN          113 TYR  HN          5.50    (#   1119:10  Unique         3.96, 4.23 A)
 &rst
  ixpk= 1119, nxpk= 10, iat=1672,1704, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   25 ILE  HN           24 LEU  HN          4.50    (#   1120:10  Unique         4.22, 4.25 A)
 &rst
  ixpk= 1120, nxpk= 10, iat= 365, 346, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   76 GLY  HA-          24 LEU  HN          4.50    (#   1121:10  Unique         3.02, 3.52 A)
 &rst
  ixpk= 1121, nxpk= 10, iat=  -1, 346, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1131,1132,
 &end
#
#    0 AMB  10-2:1124   125 TYR  HN          5.50    (#   1124:10  Single Ambig)
 &rst
  ixpk= 1124, nxpk= 10, iat=  -1,1884, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1375,1384,1405,1410,
 &end
#
#    0 AMB  10-2:1131    69 CYS  HN          5.50    (#   1131:10  Single Ambig)
 &rst
  ixpk= 1131, nxpk= 10, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1023, 466, 467,
 &end
#
#   67 GLN  HN           69 CYS  HN          5.50    (#   1132:10  Unique         3.96, 4.03 A)
 &rst
  ixpk= 1132, nxpk= 10, iat=1019,1043, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   61 SER  HB+          62 GLY  HN          5.50    (#   1133:10  Unique         2.81, 3.49 A)
 &rst
  ixpk= 1133, nxpk= 10, iat=  -1, 944, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 937, 938,
 &end
#
#   26 ARG  HD+          26 ARG  HE          4.50    (#   1134:10  Unique         2.40, 2.78 A)
 &rst
  ixpk= 1134, nxpk= 10, iat=  -1, 397, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 394, 395,
 &end
#
#   26 ARG  HG+          26 ARG  HE          5.50    (#   1135:10  Unique         2.26, 3.06 A)
 &rst
  ixpk= 1135, nxpk= 10, iat=  -1, 397, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 391, 392,
 &end
#
#   74 LEU  MDX          26 ARG  HE          5.50    (#   1136:10  Unique         2.69, 5.26 A)
 &rst
  ixpk= 1136, nxpk= 10, iat=  -1, 397, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1112,1113,1114,1116,1117,1118,
 &end
#
#   44 VAL  HN           13 ASP  HN          5.50    (#   1137:10  Unique         4.14, 4.35 A)
 &rst
  ixpk= 1137, nxpk= 10, iat= 644, 178, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   45 ARG  HD+          13 ASP  HN          5.50    (#   1138:10  Unique         2.20, 3.96 A)
 &rst
  ixpk= 1138, nxpk= 10, iat=  -1, 178, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 670, 671,
 &end
#
#   45 ARG  HD-          13 ASP  HN          5.50    (#   1140:10  Unique         2.20, 3.96 A)
 &rst
  ixpk= 1140, nxpk= 10, iat=  -1, 178, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 670, 671,
 &end
#
#   12 VAL  HB           13 ASP  HN          5.50    (#   1141:10  Unique         4.03, 4.10 A)
 &rst
  ixpk= 1141, nxpk= 10, iat= 166, 178, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 ALA  MB          101 GLN  HE2-        5.50    (#   1142:10  Unique         3.82, 5.99 A)
 &rst
  ixpk= 1142, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1544,1545,1546,
 igr2=1518,1519,
 &end
#
#  104 ILE  QD1         101 GLN  HE2-        5.50    (#   1143:10  Unique         3.43, 6.12 A)
 &rst
  ixpk= 1143, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1563,1564,1565,
 igr2=1518,1519,
 &end
#
#    7 ALA  HN            9 ILE  HN          5.50    (#   1145:10  Unique         3.92, 4.13 A)
 &rst
  ixpk= 1145, nxpk= 10, iat=  88, 117, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    8 LEU  MDX           9 ILE  HN          5.50    (#   1146:10  Unique         5.17, 5.94 A)
 &rst
  ixpk= 1146, nxpk= 10, iat=  -1, 117, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 107, 108, 109, 111, 112, 113,
 &end
#
#    7 ALA  HA            8 LEU  HN          4.50    (#   1147:10  Unique         3.49, 3.51 A)
 &rst
  ixpk= 1147, nxpk= 10, iat=  90,  98, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   93 TYR  HA          100 ALA  HN          5.50    (#   1148:10  Unique         3.55, 3.71 A)
 &rst
  ixpk= 1148, nxpk= 10, iat=1397,1496, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1149   100 ALA  HN          5.50    (#   1149:10  Single Ambig)
 &rst
  ixpk= 1149, nxpk= 10, iat=  -1,1496, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1124,1125,1508,1525,
 &end
#
#    0 AMB  10-2:1150   100 ALA  HN          5.50    (#   1150:10  Single Ambig)
 &rst
  ixpk= 1150, nxpk= 10, iat=  -1,1496, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1124,1125,1131,1132,
 &end
#
#   99 PRO  HB+         100 ALA  HN          5.50    (#   1151:10  Unique         3.35, 3.71 A)
 &rst
  ixpk= 1151, nxpk= 10, iat=  -1,1496, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1489,1490,
 &end
#
#   99 PRO  HB-         100 ALA  HN          5.50    (#   1152:10  Unique         3.35, 3.71 A)
 &rst
  ixpk= 1152, nxpk= 10, iat=  -1,1496, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1489,1490,
 &end
#
#    0 AMB  10-2:1154     0 AMB  10-1:1154   3.50    (#   1154:10  Double Ambig)
 &rst
  ixpk= 1154, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 856, 857, 858, 168, 169, 170, 172, 173, 174,1793,
      1794,1795,1797,1798,1799,
 igr2= 843,1609,
 &end
#
#   55 ASP  HB2          56 ILE  HN          5.50    (#   1155:10  Unique         3.65, 3.74 A)
 &rst
  ixpk= 1155, nxpk= 10, iat= 835, 843, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  107 GLU  HA          108 LYS  HN          4.50    (#   1156:10  Unique         3.58, 3.60 A)
 &rst
  ixpk= 1156, nxpk= 10, iat=1596,1609, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1157   108 LYS  HN          4.50    (#   1157:10  Single Ambig)
 &rst
  ixpk= 1157, nxpk= 10, iat=  -1,1609, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1556,1557,1558, 168, 169, 170, 172, 173, 174,1563,
      1564,1565,
 &end
#
#    0 AMB  10-2:1158   107 GLU  HN          5.50    (#   1158:10  Single Ambig)
 &rst
  ixpk= 1158, nxpk= 10, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1563,1564,1565,1556,1557,1558,1637,1638,1639,
 &end
#
#    0 AMB  10-2:1159   107 GLU  HN          5.50    (#   1159:10  Single Ambig)
 &rst
  ixpk= 1159, nxpk= 10, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1544,1545,1546,1793,1794,1795,1797,1798,1799,
 &end
#
#    0 AMB  10-2:1160   107 GLU  HN          5.50    (#   1160:10  Single Ambig)
 &rst
  ixpk= 1160, nxpk= 10, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1613,1660,1661,1654,1655,1554,
 &end
#
#   45 ARG  HB3          46 GLY  HN          5.50    (#   1161:10  Unique         2.74, 2.83 A)
 &rst
  ixpk= 1161, nxpk= 10, iat= 665, 684, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1162    46 GLY  HN          4.50    (#   1162:10  Single Ambig)
 &rst
  ixpk= 1162, nxpk= 10, iat=  -1, 684, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 849, 850, 851, 650, 651, 652, 654, 655, 656, 336,
       337, 338, 340, 341, 342,
 &end
#
#   12 VAL  MGY         112 LYS  HN          5.50    (#   1163:10  Unique         3.95, 5.55 A)
 &rst
  ixpk= 1163, nxpk= 10, iat=  -1,1682, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 168, 169, 170, 172, 173, 174,
 &end
#
#  109 ILE  HA          112 LYS  HN          5.50    (#   1164:10  Unique         3.32, 3.41 A)
 &rst
  ixpk= 1164, nxpk= 10, iat=1633,1682, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1165   105 SER  HN          4.50    (#   1165:10  Single Ambig)
 &rst
  ixpk= 1165, nxpk= 10, iat=  -1,1569, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1560,1561,1619,1620,
 &end
#
#  104 ILE  HG1+        105 SER  HN          4.50    (#   1166:10  Unique         3.98, 4.49 A)
 &rst
  ixpk= 1166, nxpk= 10, iat=  -1,1569, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1560,1561,
 &end
#
#    0 AMB  10-2:1167   105 SER  HN          4.50    (#   1167:10  Single Ambig)
 &rst
  ixpk= 1167, nxpk= 10, iat=  -1,1569, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 355, 356, 357, 359, 360, 361,1544,1545,1546,
 &end
#
#    0 AMB  10-2:1168   105 SER  HN          3.50    (#   1168:10  Single Ambig)
 &rst
  ixpk= 1168, nxpk= 10, iat=  -1,1569, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 355, 356, 357, 359, 360, 361,1556,1557,1558,1563,
      1564,1565,
 &end
#
#   90 VAL  MGX         105 SER  HN          4.50    (#   1169:10  Unique         4.93, 6.43 A)
 &rst
  ixpk= 1169, nxpk= 10, iat=  -1,1569, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1357,1358,1359,1361,1362,1363,
 &end
#
#   60 VAL  MGY          59 LYS  HN          5.50    (#   1170:10  Unique         4.38, 6.37 A)
 &rst
  ixpk= 1170, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 923, 924, 925, 927, 928, 929,
 &end
#
#    0 AMB  10-2:1171    59 LYS  HN          5.50    (#   1171:10  Single Ambig)
 &rst
  ixpk= 1171, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 923, 924, 925, 927, 928, 929, 849, 850, 851,
 &end
#
#    0 AMB  10-2:1172    59 LYS  HN          5.50    (#   1172:10  Single Ambig)
 &rst
  ixpk= 1172, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 905, 906, 853, 854,
 &end
#
#   56 ILE  HA           59 LYS  HN          4.50    (#   1173:10  Unique         3.31, 3.38 A)
 &rst
  ixpk= 1173, nxpk= 10, iat= 845, 895, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  101 GLN  HB-         102 HIS  HN          4.50    (#   1174:10  Unique         4.23, 4.42 A)
 &rst
  ixpk= 1174, nxpk= 10, iat=  -1,1523, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1510,1511,
 &end
#
#    0 AMB  10-2:1175   111 ALA  HN          4.50    (#   1175:10  Single Ambig)
 &rst
  ixpk= 1175, nxpk= 10, iat=  -1,1672, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1635,1614,1660,1661,1616,1617,1692,1693,
 &end
#
#    0 AMB  10-2:1176   111 ALA  HN          5.50    (#   1176:10  Single Ambig)
 &rst
  ixpk= 1176, nxpk= 10, iat=  -1,1672, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1616,1617,1692,1693,
 &end
#
#  110 LYS  HA          111 ALA  HN          4.50    (#   1177:10  Unique         3.60, 3.61 A)
 &rst
  ixpk= 1177, nxpk= 10, iat=1652,1672, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   64 MET  ME           67 GLN  HE2+        5.50    (#   1179:10  Unique         2.42, 3.15 A)
 &rst
  ixpk= 1179, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 974, 975, 976,
 igr2=1031,1032,
 &end
#
#   27 VAL  MGY          67 GLN  HE2+        5.50    (#   1180:10  Unique         6.28, 7.90 A)
 &rst
  ixpk= 1180, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 414, 415, 416, 418, 419, 420,
 igr2=1031,1032,
 &end
#
#    0 AMB  10-2:1181     0 AMB  10-1:1181   5.50    (#   1181:10  Double Ambig)
 &rst
  ixpk= 1181, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 123, 124, 125, 130, 131, 132,
 igr2=1031,1032,1031,1032,
 &end
#
#  104 ILE  QD1         101 GLN  HE2+        4.50    (#   1183:10  Unique         3.43, 6.12 A)
 &rst
  ixpk= 1183, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1563,1564,1565,
 igr2=1518,1519,
 &end
#
#  103 ALA  MB          101 GLN  HE2+        5.50    (#   1184:10  Unique         3.82, 5.99 A)
 &rst
  ixpk= 1184, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1544,1545,1546,
 igr2=1518,1519,
 &end
#
#    0 AMB  10-2:1185    47 TYR  HN          4.50    (#   1185:10  Single Ambig)
 &rst
  ixpk= 1185, nxpk= 10, iat=  -1, 691, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 853, 854, 292,
 &end
#
#   50 ALA  MB           50 ALA  HN          2.80    (#   1186:10  Unique         2.41, 3.00 A)
 &rst
  ixpk= 1186, nxpk= 10, iat=  -1, 758, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 762, 763, 764,
 &end
#
#   49 TRP  HE3          50 ALA  HN          5.50    (#   1187:10  Unique         3.05, 3.08 A)
 &rst
  ixpk= 1187, nxpk= 10, iat= 753, 758, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 GLU  HN           50 ALA  HN          5.50    (#   1188:10  Unique         3.71, 3.83 A)
 &rst
  ixpk= 1188, nxpk= 10, iat= 768, 758, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 PRO  HA           94 SER  HN          4.50    (#   1190:10  Unique         2.89, 3.19 A)
 &rst
  ixpk= 1190, nxpk= 10, iat=1492,1416, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   78 ARG  HG+          78 ARG  HN          5.50    (#   1193:10  Unique         2.80, 4.32 A)
 &rst
  ixpk= 1193, nxpk= 10, iat=  -1,1143, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1150,1151,
 &end
#
#    0 AMB  10-2:1194    78 ARG  HN          5.50    (#   1194:10  Single Ambig)
 &rst
  ixpk= 1194, nxpk= 10, iat=  -1,1143, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1353, 289,
 &end
#
#    0 AMB  10-2:1195    78 ARG  HN          5.50    (#   1195:10  Single Ambig)
 &rst
  ixpk= 1195, nxpk= 10, iat=  -1,1143, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1390,1391,1886,
 &end
#
#  100 ALA  MB           76 GLY  HN          4.50    (#   1196:10  Unique         3.06, 4.04 A)
 &rst
  ixpk= 1196, nxpk= 10, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1500,1501,1502,
 &end
#
#    0 AMB  10-2:1198    76 GLY  HN          5.50    (#   1198:10  Single Ambig)
 &rst
  ixpk= 1198, nxpk= 10, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1458,1459,1489,1490,
 &end
#
#   94 SER  HB-          76 GLY  HN          5.50    (#   1201:10  Unique         2.69, 3.72 A)
 &rst
  ixpk= 1201, nxpk= 10, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1420,1421,
 &end
#
#  100 ALA  HA           76 GLY  HN          4.50    (#   1202:10  Unique         3.85, 3.94 A)
 &rst
  ixpk= 1202, nxpk= 10, iat=1498,1129, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   99 PRO  HA           76 GLY  HN          5.50    (#   1204:10  Unique         3.26, 3.34 A)
 &rst
  ixpk= 1204, nxpk= 10, iat=1492,1129, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   91 TYR  HA           92 GLY  HN          3.50    (#   1206:10  Unique         2.56, 2.67 A)
 &rst
  ixpk= 1206, nxpk= 10, iat=1369,1388, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   67 GLN  HB2          68 GLY  HN          4.50    (#   1207:10  Unique         2.43, 3.02 A)
 &rst
  ixpk= 1207, nxpk= 10, iat=1023,1036, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1208    77 GLY  HN          4.50    (#   1208:10  Single Ambig)
 &rst
  ixpk= 1208, nxpk= 10, iat=  -1,1136, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 336, 337, 338, 340, 341, 342, 336, 337, 338, 340,
       341, 342,
 &end
#
#   77 GLY  HA+          77 GLY  HN          4.50    (#   1209:10  Unique         2.81, 2.82 A)
 &rst
  ixpk= 1209, nxpk= 10, iat=  -1,1136, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1138,1139,
 &end
#
#   23 VAL  HA           77 GLY  HN          4.50    (#   1210:10  Unique         3.33, 3.44 A)
 &rst
  ixpk= 1210, nxpk= 10, iat= 332,1136, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   22 TYR  HN           77 GLY  HN          5.50    (#   1211:10  Unique         3.09, 3.18 A)
 &rst
  ixpk= 1211, nxpk= 10, iat= 309,1136, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1212    77 GLY  HN          5.50    (#   1212:10  Single Ambig)
 &rst
  ixpk= 1212, nxpk= 10, iat=  -1,1136, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1129,1395,
 &end
#
#   74 LEU  HB2          75 GLY  HN          4.50    (#   1213:10  Unique         2.90, 2.95 A)
 &rst
  ixpk= 1213, nxpk= 10, iat=1107,1122, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1214    75 GLY  HN          5.50    (#   1214:10  Single Ambig)
 &rst
  ixpk= 1214, nxpk= 10, iat=  -1,1122, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 336, 337, 338, 340, 341, 342, 336, 337, 338, 340,
       341, 342,
 &end
#
#   74 LEU  HB3          75 GLY  HN          5.50    (#   1215:10  Unique         3.87, 3.91 A)
 &rst
  ixpk= 1215, nxpk= 10, iat=1108,1122, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   74 LEU  HG           75 GLY  HN          5.50    (#   1216:10  Unique         4.46, 4.50 A)
 &rst
  ixpk= 1216, nxpk= 10, iat=1110,1122, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 LEU  HB+          75 GLY  HN          5.50    (#   1217:10  Unique         2.98, 3.86 A)
 &rst
  ixpk= 1217, nxpk= 10, iat=  -1,1122, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 350, 351,
 &end
#
#   74 LEU  MDY          75 GLY  HN          5.50    (#   1218:10  Unique         5.18, 5.89 A)
 &rst
  ixpk= 1218, nxpk= 10, iat=  -1,1122, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1112,1113,1114,1116,1117,1118,
 &end
#
#   97 TYR  HB-          75 GLY  HN          5.50    (#   1219:10  Unique         3.97, 4.52 A)
 &rst
  ixpk= 1219, nxpk= 10, iat=  -1,1122, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1458,1459,
 &end
#
#   73 CYS  HB+          75 GLY  HN          5.50    (#   1220:10  Unique         2.95, 3.76 A)
 &rst
  ixpk= 1220, nxpk= 10, iat=  -1,1122, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1096,1097,
 &end
#
#   97 TYR  HB+          75 GLY  HN          5.50    (#   1221:10  Unique         3.97, 4.52 A)
 &rst
  ixpk= 1221, nxpk= 10, iat=  -1,1122, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1458,1459,
 &end
#
#    0 AMB  10-2:1223    75 GLY  HN          5.50    (#   1223:10  Single Ambig)
 &rst
  ixpk= 1223, nxpk= 10, iat=  -1,1122, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1129,1454,
 &end
#
#   24 LEU  HN           75 GLY  HN          5.50    (#   1224:10  Unique         3.23, 3.28 A)
 &rst
  ixpk= 1224, nxpk= 10, iat= 346,1122, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   13 ASP  HB3           0 AMB  10-1:1225   4.50    (#   1225:10  Single Ambig)
 &rst
  ixpk= 1225, nxpk= 10, iat= 183,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 190, 162,
 &end
#
#   55 ASP  HB2          52 TYR  HN          5.50    (#   1226:10  Unique         3.26, 3.39 A)
 &rst
  ixpk= 1226, nxpk= 10, iat= 835, 783, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   69 CYS  HB3          28 HIS  HN          5.50    (#   1228:10  Unique         3.27, 3.37 A)
 &rst
  ixpk= 1228, nxpk= 10, iat=1048, 424, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   45 ARG  HD+          45 ARG  HE          5.50    (#   1232:10  Unique         2.31, 2.67 A)
 &rst
  ixpk= 1232, nxpk= 10, iat=  -1, 673, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 670, 671,
 &end
#
#   48 LYS  HA           48 LYS  HN          4.50    (#   1234:10  Unique         2.80, 2.83 A)
 &rst
  ixpk= 1234, nxpk= 10, iat= 714, 712, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   51 GLU  HG+          48 LYS  HN          7.00    (#   1236:10  Unique         7.38, 7.75 A)
 &rst
  ixpk= 1236, nxpk= 10, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 775, 776,
 &end
#
#   27 VAL  MGY          69 CYS  HN          5.50    (#   1251:10  Unique         5.20, 6.89 A)
 &rst
  ixpk= 1251, nxpk= 10, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 414, 415, 416, 418, 419, 420,
 &end
#
#    0 AMB  10-2:1252    69 CYS  HN          5.50    (#   1252:10  Single Ambig)
 &rst
  ixpk= 1252, nxpk= 10, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 987, 988, 970, 971,
 &end
#
#    0 AMB  10-2:1253    69 CYS  HN          5.50    (#   1253:10  Single Ambig)
 &rst
  ixpk= 1253, nxpk= 10, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1054, 452,
 &end
#
#    4 ALA  HN            5 ASP  HN          5.50    (#   1255:10  Unique         4.28, 4.50 A)
 &rst
  ixpk= 1255, nxpk= 10, iat=  47,  57, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  117 GLU  HB+         118 VAL  HN          5.50    (#   1257:10  Unique         3.45, 3.78 A)
 &rst
  ixpk= 1257, nxpk= 10, iat=  -1,1787, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1776,1777,
 &end
#
#   24 LEU  HA           45 ARG  HN          7.00    (#   1258:10  Unique         3.79, 3.90 A)
 &rst
  ixpk= 1258, nxpk= 10, iat= 348, 660, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:1260    24 LEU  HN          4.50    (#   1260:10  Single Ambig)
 &rst
  ixpk= 1260, nxpk= 10, iat=  -1, 346, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 353,1107,
 &end
#
#    7 ALA  MB            9 ILE  HN          5.50    (#   1261:10  Unique         5.13, 5.56 A)
 &rst
  ixpk= 1261, nxpk= 10, iat=  -1, 117, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  92,  93,  94,
 &end
#
#   36 PRO  HB-          37 ALA  HN          4.50    (#   1264:10  Unique         2.15, 3.87 A)
 &rst
  ixpk= 1264, nxpk= 10, iat=  -1, 542, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 535, 536,
 &end
#
#   36 PRO  HG+          37 ALA  HN          5.50    (#   1265:10  Unique         2.69, 3.71 A)
 &rst
  ixpk= 1265, nxpk= 10, iat=  -1, 542, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 532, 533,
 &end
#
#  106 THR  HA          107 GLU  HN          5.50    (#   1267:10  Unique         3.63, 3.64 A)
 &rst
  ixpk= 1267, nxpk= 10, iat=1582,1594, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   19 VAL  HB           20 PHE  HN          4.50    (#   1268:10  Unique         4.14, 4.28 A)
 &rst
  ixpk= 1268, nxpk= 10, iat= 255, 267, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1269    20 PHE  HN          5.50    (#   1269:10  Single Ambig)
 &rst
  ixpk= 1269, nxpk= 10, iat=  -1, 267, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1147,1148,1173,1174,1175,
 &end
#
#  120 TRP  HD1         121 ALA  HN          7.00    (#   1270:10  Unique         5.27, 5.34 A)
 &rst
  ixpk= 1270, nxpk= 10, iat=1825,1841, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:1273     7 ALA  HN          4.50    (#   1273:10  Single Ambig)
 &rst
  ixpk= 1273, nxpk= 10, iat=  -1,  88, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 102, 103,  76,
 &end
#
#    0 AMB  10-2:1274     7 ALA  HN          5.50    (#   1274:10  Single Ambig)
 &rst
  ixpk= 1274, nxpk= 10, iat= 105,  88, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  106 THR  HN          104 ILE  HN          5.50    (#   1275:10  Unique         4.22, 4.31 A)
 &rst
  ixpk= 1275, nxpk= 10, iat=1580,1550, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1276   104 ILE  HN          5.50    (#   1276:10  Single Ambig)
 &rst
  ixpk= 1276, nxpk= 10, iat=  -1,1550, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1598,1599,1513,1514,
 &end
#
#  101 GLN  HB-         104 ILE  HN          5.50    (#   1277:10  Unique         3.12, 3.48 A)
 &rst
  ixpk= 1277, nxpk= 10, iat=  -1,1550, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1510,1511,
 &end
#
#    0 AMB  10-2:1278    60 VAL  HN          5.50    (#   1278:10  Single Ambig)
 &rst
  ixpk= 1278, nxpk= 10, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 667, 668, 905, 906, 853, 854, 375, 376,
 &end
#
#   45 ARG  HG+          60 VAL  HN          5.50    (#   1279:10  Unique         4.83, 6.01 A)
 &rst
  ixpk= 1279, nxpk= 10, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 667, 668,
 &end
#
#  112 LYS  HD+          12 VAL  HN          5.50    (#   1282:10  Unique         3.56, 5.18 A)
 &rst
  ixpk= 1282, nxpk= 10, iat=  -1, 162, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1692,1693,
 &end
#
#  105 SER  HA          108 LYS  HN          5.50    (#   1283:10  Unique         3.65, 3.77 A)
 &rst
  ixpk= 1283, nxpk= 10, iat=1571,1609, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1284     0 AMB  10-1:1284   4.50    (#   1284:10  Double Ambig)
 &rst
  ixpk= 1284, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 845,1596,
 igr2= 843,1609,
 &end
#
#   40 SER  HB2          29 SER  HN          7.00    (#   1285:10  Unique         5.78, 5.91 A)
 &rst
  ixpk= 1285, nxpk= 10, iat= 581, 441, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:1286    29 SER  HN          7.00    (#   1286:10  Single Ambig)
 &rst
  ixpk= 1286, nxpk= 10, iat=  -1, 441, r1= 1.30, r2= 1.80, r3=10.27, r4=10.77,
 igr1= 414, 415, 416, 418, 419, 420, 595, 596, 391, 392,
      
 &end
#
#    0 AMB  10-2:1288     0 AMB  10-1:1288   4.50    (#   1288:10  Double Ambig)
 &rst
  ixpk= 1288, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 853, 854, 968,
 igr2= 831,1019,
 &end
#
#  118 VAL  MGY         106 THR  HN          5.50    (#   1289:10  Unique         4.69, 6.23 A)
 &rst
  ixpk= 1289, nxpk= 10, iat=  -1,1580, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1793,1794,1795,1797,1798,1799,
 &end
#
#   44 VAL  MGX         106 THR  HN          5.50    (#   1290:10  Unique         5.68, 6.60 A)
 &rst
  ixpk= 1290, nxpk= 10, iat=  -1,1580, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 650, 651, 652, 654, 655, 656,
 &end
#
#   90 VAL  HN          120 TRP  HN          5.50    (#   1292:10  Unique         4.51, 4.60 A)
 &rst
  ixpk= 1292, nxpk= 10, iat=1351,1817, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   44 VAL  HN           43 ILE  HN          5.50    (#   1295:10  Unique         4.38, 4.43 A)
 &rst
  ixpk= 1295, nxpk= 10, iat= 644, 625, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   43 ILE  HA           43 ILE  HN          3.50    (#   1297:10  Unique         2.95, 2.97 A)
 &rst
  ixpk= 1297, nxpk= 10, iat= 627, 625, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   24 LEU  HA           43 ILE  HN          5.50    (#   1298:10  Unique         4.48, 4.54 A)
 &rst
  ixpk= 1298, nxpk= 10, iat= 348, 625, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   42 GLU  HG+          43 ILE  HN          5.50    (#   1299:10  Unique         3.75, 4.54 A)
 &rst
  ixpk= 1299, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 617, 618,
 &end
#
#   90 VAL  MGY          79 ILE  HN          5.50    (#   1302:10  Unique         4.91, 6.60 A)
 &rst
  ixpk= 1302, nxpk= 10, iat=  -1,1167, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1357,1358,1359,1361,1362,1363,
 &end
#
#   94 SER  HB+          97 TYR  HN          5.50    (#   1303:10  Unique         2.11, 2.98 A)
 &rst
  ixpk= 1303, nxpk= 10, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1420,1421,
 &end
#
#   99 PRO  HD-          98 GLY  HN          7.00    (#   1304:10  Unique         4.65, 4.90 A)
 &rst
  ixpk= 1304, nxpk= 10, iat=  -1,1475, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1483,1484,
 &end
#
#  118 VAL  MGY         113 TYR  HN          7.00    (#   1307:10  Unique         6.10, 7.74 A)
 &rst
  ixpk= 1307, nxpk= 10, iat=  -1,1704, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1793,1794,1795,1797,1798,1799,
 &end
#
#  114 PRO  HB+         113 TYR  HN          5.50    (#   1309:10  Unique         4.59, 5.81 A)
 &rst
  ixpk= 1309, nxpk= 10, iat=  -1,1704, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1732,1733,
 &end
#
#   36 PRO  HB+          37 ALA  HN          7.00    (#   1310:10  Unique         2.15, 3.87 A)
 &rst
  ixpk= 1310, nxpk= 10, iat=  -1, 542, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 535, 536,
 &end
#
#   91 TYR  HD           92 GLY  HN          4.50    (#   1317:10  Unique         2.97, 4.08 A)
 &rst
  ixpk= 1317, nxpk= 10, iat=  -1,1388, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1375,1384,
 &end
#
#   91 TYR  HB+          92 GLY  HN          3.50    (#   1319:10  Unique         1.97, 2.92 A)
 &rst
  ixpk= 1319, nxpk= 10, iat=  -1,1388, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1371,1372,
 &end
#
#  100 ALA  HN           76 GLY  HN          4.50    (#   1320:10  Unique         2.85, 2.93 A)
 &rst
  ixpk= 1320, nxpk= 10, iat=1496,1129, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1321    76 GLY  HN          3.50    (#   1321:10  Single Ambig)
 &rst
  ixpk= 1321, nxpk= 10, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1131,1132,1420,1421,
 &end
#
#   75 GLY  HA+          76 GLY  HN          4.50    (#   1322:10  Unique         2.48, 2.62 A)
 &rst
  ixpk= 1322, nxpk= 10, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1124,1125,
 &end
#
#    0 AMB  10-2:1323   109 ILE  HN          5.50    (#   1323:10  Single Ambig)
 &rst
  ixpk= 1323, nxpk= 10, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1729,1730,1791,
 &end
#
#  105 SER  HN          103 ALA  HN          5.50    (#   1324:10  Unique         4.26, 4.28 A)
 &rst
  ixpk= 1324, nxpk= 10, iat=1569,1540, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   93 TYR  HA           93 TYR  HN          5.50    (#   1325:10  Unique         2.90, 2.91 A)
 &rst
  ixpk= 1325, nxpk= 10, iat=1397,1395, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   97 TYR  HD           97 TYR  HN          5.50    (#   1326:10  Unique         3.30, 4.05 A)
 &rst
  ixpk= 1326, nxpk= 10, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1462,1471,
 &end
#
#    0 AMB  10-2:1330    21 LYS  HN          4.50    (#   1330:10  Single Ambig)
 &rst
  ixpk= 1330, nxpk= 10, iat=  -1, 287, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 856, 857, 858, 257, 258, 259,
 &end
#
#    0 AMB  10-2:1331     0 AMB  10-1:1331   3.50    (#   1331:10  Double Ambig)
 &rst
  ixpk= 1331, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 853, 854,1616,1617,
 igr2= 843,1609,
 &end
#
#   26 ARG  HG+          41 LYS  HN          5.50    (#   1334:10  Unique         3.07, 3.83 A)
 &rst
  ixpk= 1334, nxpk= 10, iat=  -1, 588, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 391, 392,
 &end
#
#   64 MET  HB2          61 SER  HN          7.00    (#   1335:10  Unique         5.01, 5.08 A)
 &rst
  ixpk= 1335, nxpk= 10, iat= 967, 933, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   78 ARG  HB-          78 ARG  HN          5.50    (#   1338:10  Unique         2.66, 3.05 A)
 &rst
  ixpk= 1338, nxpk= 10, iat=  -1,1143, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1147,1148,
 &end
#
#    0 AMB  10-2:1339    78 ARG  HN          4.50    (#   1339:10  Single Ambig)
 &rst
  ixpk= 1339, nxpk= 10, iat=  -1,1143, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1377,1382,1536,
 &end
#
#   91 TYR  HN           78 ARG  HN          4.50    (#   1340:10  Unique         2.83, 2.88 A)
 &rst
  ixpk= 1340, nxpk= 10, iat=1367,1143, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   12 VAL  HA           45 ARG  HE          5.50    (#   1341:10  Unique         2.78, 3.17 A)
 &rst
  ixpk= 1341, nxpk= 10, iat= 164, 673, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   93 TYR  HD           93 TYR  HN          5.50    (#   1342:10  Unique         2.91, 4.01 A)
 &rst
  ixpk= 1342, nxpk= 10, iat=  -1,1395, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1403,1412,
 &end
#
#   93 TYR  HD           94 SER  HN          5.50    (#   1344:10  Unique         3.25, 4.56 A)
 &rst
  ixpk= 1344, nxpk= 10, iat=  -1,1416, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1403,1412,
 &end
#
#   52 TYR  HD           55 ASP  HN          5.50    (#   1345:10  Unique         2.53, 4.21 A)
 &rst
  ixpk= 1345, nxpk= 10, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 791, 800,
 &end
#
#   96 ALA  HA           97 TYR  HN          7.00    (#   1349:10  Unique         3.24, 3.51 A)
 &rst
  ixpk= 1349, nxpk= 10, iat=1446,1454, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   94 SER  HB-          97 TYR  HN          7.00    (#   1351:10  Unique         2.11, 2.98 A)
 &rst
  ixpk= 1351, nxpk= 10, iat=  -1,1454, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1420,1421,
 &end
#
#    6 LEU  HN            5 ASP  HN          5.50    (#   1353:10  Unique         4.32, 4.35 A)
 &rst
  ixpk= 1353, nxpk= 10, iat=  69,  57, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1354   120 TRP  HE1         7.00    (#   1354:10  Single Ambig)
 &rst
  ixpk= 1354, nxpk= 10, iat=  -1,1827, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1584,1525,
 &end
#
#    0 AMB  10-2:1355     0 AMB  10-1:1355   5.50    (#   1355:10  Double Ambig)
 &rst
  ixpk= 1355, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.53, r4=10.03,
 igr1= 123, 124, 125, 856, 857, 858, 130, 131, 132,
 igr2=1031,1032, 684,
 &end


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