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
16885 2aym 6844 cing 1-original 7 AMBER distance NOE simple


#   76 MET  HB+          76 MET  HN          3.50    (#      0:10  Unique    2.27, 2.43 A)
 &rst
  ixpk= 0, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr1=1200,1201,
 &end
#
#    0 AMB  10-2:1       76 MET  HN          4.50    (#      1:10  Single Ambig)
 &rst
  ixpk= 1, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1096,1097,1093,1094,1090,1091,
 &end
#
#   76 MET  HG-          76 MET  HN          4.50    (#      2:10  Unique    4.32, 4.40 A)
 &rst
  ixpk= 2, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1203,1204,
 &end
#
#   76 MET  HB-          76 MET  HN          3.50    (#      3:10  Unique    2.27, 2.43 A)
 &rst
  ixpk= 3, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1200,1201,
 &end
#
#   70 ILE  HG1-         76 MET  HN          5.50    (#      4:10  Unique    2.94, 3.82 A)
 &rst
  ixpk= 4, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1118,1119,
 &end
#
#    0 AMB  10-2:5       76 MET  HN          4.50    (#      5:10  Single Ambig)
 &rst
  ixpk= 5, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1118,1119,1220,1221,
 &end
#
#   75 ALA  MB           76 MET  HN          3.50    (#      6:10  Unique    3.38, 4.01 A)
 &rst
  ixpk= 6, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1190,1191,1192,
 &end
#
#    8 ASN  HB-           9 GLN  HN          4.50    (#      9:10  Unique    2.70, 3.77 A)
 &rst
  ixpk= 9, nxpk= 10, iat=  -1, 119, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 109, 110,
 &end
#
#    0 AMB  10-2:10       9 GLN  HN          3.50    (#     10:10  Single Ambig)
 &rst
  ixpk= 10, nxpk= 10, iat=  -1, 119, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 126, 127, 126, 127,
 &end
#
#    9 GLN  HB-           9 GLN  HN          3.50    (#     11:10  Unique    2.48, 3.07 A)
 &rst
  ixpk= 11, nxpk= 10, iat=  -1, 119, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 123, 124,
 &end
#
#    8 ASN  HB+           9 GLN  HN          4.50    (#     12:10  Unique    2.70, 3.77 A)
 &rst
  ixpk= 12, nxpk= 10, iat=  -1, 119, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 109, 110,
 &end
#
#    9 GLN  HB+           9 GLN  HN          3.50    (#     13:10  Unique    2.48, 3.07 A)
 &rst
  ixpk= 13, nxpk= 10, iat=  -1, 119, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 123, 124,
 &end
#
#    0 AMB  10-2:14       9 GLN  HN          3.50    (#     14:10  Single Ambig)
 &rst
  ixpk= 14, nxpk= 10, iat=  -1, 119, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 884, 885, 884, 885, 140,
 &end
#
#    0 AMB  10-2:15       9 GLN  HN          4.50    (#     15:10  Single Ambig)
 &rst
  ixpk= 15, nxpk= 10, iat=  -1, 119, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1330,1331,1330,1331,
 &end
#
#    0 AMB  10-2:16       9 GLN  HN          4.50    (#     16:10  Single Ambig)
 &rst
  ixpk= 16, nxpk= 10, iat=  -1, 119, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 146, 147, 149, 150, 151,
 &end
#
#   81 ALA  MB           11 LEU  HN          5.50    (#     18:10  Unique    3.51, 4.62 A)
 &rst
  ixpk= 18, nxpk= 10, iat=  -1, 155, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1292,1293,1294,
 &end
#
#   11 LEU  HB-          11 LEU  HN          4.50    (#     19:10  Unique    2.35, 3.10 A)
 &rst
  ixpk= 19, nxpk= 10, iat=  -1, 155, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 159, 160,
 &end
#
#   50 VAL  MGY          11 LEU  HN          5.50    (#     20:10  Unique    4.38, 5.47 A)
 &rst
  ixpk= 20, nxpk= 10, iat=  -1, 155, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 807, 808, 809, 811, 812, 813,
 &end
#
#   50 VAL  MGX          39 ARG  HN          4.50    (#     21:10  Unique    4.00, 5.58 A)
 &rst
  ixpk= 21, nxpk= 10, iat=  -1, 612, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 807, 808, 809, 811, 812, 813,
 &end
#
#   39 ARG  HB-          39 ARG  HN          3.50    (#     22:10  Unique    2.72, 3.21 A)
 &rst
  ixpk= 22, nxpk= 10, iat=  -1, 612, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 616, 617,
 &end
#
#   39 ARG  HG+          39 ARG  HN          4.50    (#     23:10  Unique    2.92, 4.15 A)
 &rst
  ixpk= 23, nxpk= 10, iat=  -1, 612, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 619, 620,
 &end
#
#   39 ARG  HG-          39 ARG  HN          4.50    (#     24:10  Unique    2.92, 4.15 A)
 &rst
  ixpk= 24, nxpk= 10, iat=  -1, 612, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 619, 620,
 &end
#
#   38 VAL  MGX          39 ARG  HN          3.50    (#     25:10  Unique    2.26, 4.10 A)
 &rst
  ixpk= 25, nxpk= 10, iat=  -1, 612, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 602, 603, 604, 606, 607, 608,
 &end
#
#   38 VAL  MGY          39 ARG  HN          3.50    (#     26:10  Unique    2.26, 4.10 A)
 &rst
  ixpk= 26, nxpk= 10, iat=  -1, 612, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 602, 603, 604, 606, 607, 608,
 &end
#
#   40 LEU  MDY          39 ARG  HN          4.50    (#     27:10  Unique    3.88, 6.53 A)
 &rst
  ixpk= 27, nxpk= 10, iat=  -1, 612, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 645, 646, 647, 649, 650, 651,
 &end
#
#   49 PHE  HB+          39 ARG  HN          5.50    (#     28:10  Unique    3.41, 4.10 A)
 &rst
  ixpk= 28, nxpk= 10, iat=  -1, 612, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 785, 786,
 &end
#
#   49 PHE  HB-          39 ARG  HN          4.50    (#     29:10  Unique    3.41, 4.10 A)
 &rst
  ixpk= 29, nxpk= 10, iat=  -1, 612, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 785, 786,
 &end
#
#   50 VAL  MGY          39 ARG  HN          5.50    (#     30:10  Unique    4.00, 5.58 A)
 &rst
  ixpk= 30, nxpk= 10, iat=  -1, 612, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 807, 808, 809, 811, 812, 813,
 &end
#
#   77 LYS  HB+          78 ILE  HN          4.50    (#     31:10  Unique    2.83, 3.93 A)
 &rst
  ixpk= 31, nxpk= 10, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1217,1218,
 &end
#
#    0 AMB  10-2:32      78 ILE  HN          3.50    (#     32:10  Single Ambig)
 &rst
  ixpk= 32, nxpk= 10, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1220,1221,1220,1221,
 &end
#
#   78 ILE  MD1          78 ILE  HN          4.50    (#     33:10  Unique    4.38, 5.03 A)
 &rst
  ixpk= 33, nxpk= 10, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1248,1249,1250,
 &end
#
#   76 MET  HG+          78 ILE  HN          4.50    (#     34:10  Unique    4.53, 5.37 A)
 &rst
  ixpk= 34, nxpk= 10, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1203,1204,
 &end
#
#    0 AMB  10-2:35      78 ILE  HN          2.80    (#     35:10  Single Ambig)
 &rst
  ixpk= 35, nxpk= 10, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1239,1245,1246,
 &end
#
#   78 ILE  HG1+         78 ILE  HN          3.50    (#     36:10  Unique    2.78, 3.42 A)
 &rst
  ixpk= 36, nxpk= 10, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1245,1246,
 &end
#
#    0 AMB  10-2:37      78 ILE  HN          4.50    (#     37:10  Single Ambig)
 &rst
  ixpk= 37, nxpk= 10, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1241,1242,1243, 203, 204, 205, 207, 208, 209,
 &end
#
#   38 VAL  HB           39 ARG  HN          4.50    (#     38:10  Unique    2.52, 3.65 A)
 &rst
  ixpk= 38, nxpk= 10, iat= 600, 612, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   40 LEU  MDY          41 VAL  HN          3.50    (#     39:10  Unique    3.60, 4.93 A)
 &rst
  ixpk= 39, nxpk= 10, iat=  -1, 655, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 645, 646, 647, 649, 650, 651,
 &end
#
#   41 VAL  HB           41 VAL  HN          3.50    (#     40:10  Unique    2.38, 2.54 A)
 &rst
  ixpk= 40, nxpk= 10, iat= 659, 655, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   40 LEU  HB+          41 VAL  HN          3.50    (#     41:10  Unique    2.08, 3.03 A)
 &rst
  ixpk= 41, nxpk= 10, iat=  -1, 655, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 640, 641,
 &end
#
#   40 LEU  HB-          41 VAL  HN          3.50    (#     42:10  Unique    2.08, 3.03 A)
 &rst
  ixpk= 42, nxpk= 10, iat=  -1, 655, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 640, 641,
 &end
#
#    0 AMB  10-2:43      41 VAL  HN          2.80    (#     43:10  Single Ambig)
 &rst
  ixpk= 43, nxpk= 10, iat=  -1, 655, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 661, 662, 663, 665, 666, 667, 661, 662, 663, 665,
       666, 667,
 &end
#
#   40 LEU  MDX          41 VAL  HN          3.50    (#     44:10  Unique    3.60, 4.93 A)
 &rst
  ixpk= 44, nxpk= 10, iat=  -1, 655, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 645, 646, 647, 649, 650, 651,
 &end
#
#   12 PHE  HB+          12 PHE  HN          3.50    (#     46:10  Unique    2.40, 2.80 A)
 &rst
  ixpk= 46, nxpk= 10, iat=  -1, 174, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 178, 179,
 &end
#
#   12 PHE  HB-          12 PHE  HN          4.50    (#     47:10  Unique    2.40, 2.80 A)
 &rst
  ixpk= 47, nxpk= 10, iat=  -1, 174, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 178, 179,
 &end
#
#   11 LEU  HB+          12 PHE  HN          4.50    (#     48:10  Unique    2.39, 3.36 A)
 &rst
  ixpk= 48, nxpk= 10, iat=  -1, 174, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 159, 160,
 &end
#
#   81 ALA  MB           12 PHE  HN          3.50    (#     49:10  Unique    3.04, 4.44 A)
 &rst
  ixpk= 49, nxpk= 10, iat=  -1, 174, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1292,1293,1294,
 &end
#
#   11 LEU  HB-          12 PHE  HN          4.50    (#     50:10  Unique    2.39, 3.36 A)
 &rst
  ixpk= 50, nxpk= 10, iat=  -1, 174, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 159, 160,
 &end
#
#   11 LEU  MDX          12 PHE  HN          4.50    (#     51:10  Unique    3.25, 5.13 A)
 &rst
  ixpk= 51, nxpk= 10, iat=  -1, 174, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 164, 165, 166, 168, 169, 170,
 &end
#
#    0 AMB  10-2:52      12 PHE  HN          4.50    (#     52:10  Single Ambig)
 &rst
  ixpk= 52, nxpk= 10, iat=  -1, 174, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 164, 165, 166, 168, 169, 170,1241,1242,1243,
 &end
#
#    0 AMB  10-2:53      55 GLU  HN          4.50    (#     53:10  Single Ambig)
 &rst
  ixpk= 53, nxpk= 10, iat=  -1, 880, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 126, 127, 126, 127, 921, 922, 921, 922,
 &end
#
#   55 GLU  HG-          55 GLU  HN          4.50    (#     54:10  Unique    1.90, 2.85 A)
 &rst
  ixpk= 54, nxpk= 10, iat=  -1, 880, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 887, 888,
 &end
#
#    0 AMB  10-2:55      55 GLU  HN          3.50    (#     55:10  Single Ambig)
 &rst
  ixpk= 55, nxpk= 10, iat=  -1, 880, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 884, 885, 884, 885,
 &end
#
#   56 LEU  HB-          55 GLU  HN          5.50    (#     56:10  Unique    4.74, 5.54 A)
 &rst
  ixpk= 56, nxpk= 10, iat=  -1, 880, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 899, 900,
 &end
#
#   54 THR  MG2          55 GLU  HN          4.50    (#     57:10  Unique    3.23, 4.08 A)
 &rst
  ixpk= 57, nxpk= 10, iat=  -1, 880, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 872, 873, 874,
 &end
#
#    0 AMB  10-2:58      79 THR  HN          4.50    (#     58:10  Single Ambig)
 &rst
  ixpk= 58, nxpk= 10, iat=  -1,1254, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 159, 160,1260,1261,1262,1220,1221,1220,1221,
 &end
#
#   78 ILE  HG1+         79 THR  HN          4.50    (#     59:10  Unique    4.33, 4.80 A)
 &rst
  ixpk= 59, nxpk= 10, iat=  -1,1254, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1245,1246,
 &end
#
#    0 AMB  10-2:60      79 THR  HN          3.50    (#     60:10  Single Ambig)
 &rst
  ixpk= 60, nxpk= 10, iat=  -1,1254, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 203, 204, 205, 207, 208, 209, 986, 987,
 &end
#
#    0 AMB  10-2:61      79 THR  HN          3.50    (#     61:10  Single Ambig)
 &rst
  ixpk= 61, nxpk= 10, iat=  -1,1254, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1241,1242,1243, 203, 204, 205, 207, 208, 209,
 &end
#
#    0 AMB  10-2:62      79 THR  HN          4.50    (#     62:10  Single Ambig)
 &rst
  ixpk= 62, nxpk= 10, iat=  -1,1254, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1239,1245,1246,
 &end
#
#   21 ASN  HB+          22 GLU  HN          3.50    (#     63:10  Unique    2.28, 3.70 A)
 &rst
  ixpk= 63, nxpk= 10, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 322, 323,
 &end
#
#   21 ASN  HB-          22 GLU  HN          3.50    (#     64:10  Unique    2.28, 3.70 A)
 &rst
  ixpk= 64, nxpk= 10, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 322, 323,
 &end
#
#    0 AMB  10-2:65      22 GLU  HN          3.50    (#     65:10  Single Ambig)
 &rst
  ixpk= 65, nxpk= 10, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 339, 340, 339, 340,
 &end
#
#   22 GLU  HB+          22 GLU  HN          3.50    (#     66:10  Unique    2.17, 2.41 A)
 &rst
  ixpk= 66, nxpk= 10, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 336, 337,
 &end
#
#   40 LEU  MDX          22 GLU  HN          3.50    (#     67:10  Unique    2.11, 4.04 A)
 &rst
  ixpk= 67, nxpk= 10, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 645, 646, 647, 649, 650, 651,
 &end
#
#   40 LEU  MDY          22 GLU  HN          5.50    (#     68:10  Unique    2.11, 4.04 A)
 &rst
  ixpk= 68, nxpk= 10, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 645, 646, 647, 649, 650, 651,
 &end
#
#    0 AMB  10-2:69      26 SER  HN          5.50    (#     69:10  Single Ambig)
 &rst
  ixpk= 69, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 418, 419, 418, 419,
 &end
#
#   38 VAL  MGY          26 SER  HN          4.50    (#     70:10  Unique    2.86, 4.47 A)
 &rst
  ixpk= 70, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 602, 603, 604, 606, 607, 608,
 &end
#
#   25 LEU  MDX          26 SER  HN          4.50    (#     71:10  Unique    5.06, 5.77 A)
 &rst
  ixpk= 71, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 390, 391, 392, 394, 395, 396,
 &end
#
#    0 AMB  10-2:72      26 SER  HN          4.50    (#     72:10  Single Ambig)
 &rst
  ixpk= 72, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 339, 340, 339, 340, 368, 369, 451, 452,
 &end
#
#    0 AMB  10-2:73      26 SER  HN          4.50    (#     73:10  Single Ambig)
 &rst
  ixpk= 73, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 600, 351, 352, 336, 337,
 &end
#
#   25 LEU  MDY          26 SER  HN          5.50    (#     74:10  Unique    5.06, 5.77 A)
 &rst
  ixpk= 74, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 390, 391, 392, 394, 395, 396,
 &end
#
#   25 LEU  HB-          26 SER  HN          4.50    (#     75:10  Unique    2.68, 3.28 A)
 &rst
  ixpk= 75, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 385, 386,
 &end
#
#   38 VAL  MGX          26 SER  HN          3.50    (#     76:10  Unique    2.86, 4.47 A)
 &rst
  ixpk= 76, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 602, 603, 604, 606, 607, 608,
 &end
#
#   25 LEU  HG           26 SER  HN          4.50    (#     77:10  Unique    4.32, 4.43 A)
 &rst
  ixpk= 77, nxpk= 10, iat= 388, 400, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   45 HIS  HB-          46 ASP  HN          5.50    (#     78:10  Unique    3.07, 3.96 A)
 &rst
  ixpk= 78, nxpk= 10, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 727, 728,
 &end
#
#    0 AMB  10-2:79      46 ASP  HN          5.50    (#     79:10  Single Ambig)
 &rst
  ixpk= 79, nxpk= 10, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 727, 728, 709, 710,
 &end
#
#   46 ASP  HB+          46 ASP  HN          3.50    (#     80:10  Unique    2.11, 2.99 A)
 &rst
  ixpk= 80, nxpk= 10, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 744, 745,
 &end
#
#   46 ASP  HB-          46 ASP  HN          3.50    (#     81:10  Unique    2.11, 2.99 A)
 &rst
  ixpk= 81, nxpk= 10, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 744, 745,
 &end
#
#   44 ARG  HB+          46 ASP  HN          4.50    (#     82:10  Unique    2.42, 3.60 A)
 &rst
  ixpk= 82, nxpk= 10, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 703, 704,
 &end
#
#   44 ARG  HB-          46 ASP  HN          4.50    (#     83:10  Unique    2.42, 3.60 A)
 &rst
  ixpk= 83, nxpk= 10, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 703, 704,
 &end
#
#    0 AMB  10-2:84      46 ASP  HN          4.50    (#     84:10  Single Ambig)
 &rst
  ixpk= 84, nxpk= 10, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 762, 763, 758, 759, 760,
 &end
#
#    0 AMB  10-2:85      46 ASP  HN          4.50    (#     85:10  Single Ambig)
 &rst
  ixpk= 85, nxpk= 10, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 706, 707, 706, 707,
 &end
#
#   75 ALA  HA           76 MET  HN          2.80    (#     86:10  Unique    2.15, 2.18 A)
 &rst
  ixpk= 86, nxpk= 10, iat=1188,1196, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   76 MET  HA           76 MET  HN          4.50    (#     87:10  Unique    2.79, 2.81 A)
 &rst
  ixpk= 87, nxpk= 10, iat=1198,1196, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    8 ASN  HA            9 GLN  HN          2.80    (#     88:10  Unique    2.25, 2.32 A)
 &rst
  ixpk= 88, nxpk= 10, iat= 107, 119, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:89       9 GLN  HN          5.50    (#     89:10  Single Ambig)
 &rst
  ixpk= 89, nxpk= 10, iat=  -1, 119, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 938, 138,
 &end
#
#    9 GLN  HA            9 GLN  HN          3.50    (#     90:10  Unique    2.86, 2.89 A)
 &rst
  ixpk= 90, nxpk= 10, iat= 121, 119, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   10 ILE  HA           11 LEU  HN          2.80    (#     91:10  Unique    2.17, 2.21 A)
 &rst
  ixpk= 91, nxpk= 10, iat= 138, 155, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:92      39 ARG  HN          2.80    (#     92:10  Single Ambig)
 &rst
  ixpk= 92, nxpk= 10, iat=  -1, 612, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 598, 614,
 &end
#
#    0 AMB  10-2:93      78 ILE  HN          2.80    (#     93:10  Single Ambig)
 &rst
  ixpk= 93, nxpk= 10, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1215,1237,
 &end
#
#   66 GLN  HA           78 ILE  HN          5.50    (#     94:10  Unique    3.78, 3.88 A)
 &rst
  ixpk= 94, nxpk= 10, iat=1044,1235, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   44 ARG  HA           41 VAL  HN          7.00    (#     95:10  Unique    5.97, 6.51 A)
 &rst
  ixpk= 95, nxpk= 10, iat= 701, 655, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   40 LEU  HA           41 VAL  HN          2.80    (#     96:10  Unique    2.20, 2.37 A)
 &rst
  ixpk= 96, nxpk= 10, iat= 638, 655, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   41 VAL  HA           41 VAL  HN          3.50    (#     97:10  Unique    2.90, 2.95 A)
 &rst
  ixpk= 97, nxpk= 10, iat= 657, 655, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   42 PRO  HD+          41 VAL  HN          5.50    (#     98:10  Unique    3.78, 4.78 A)
 &rst
  ixpk= 98, nxpk= 10, iat=  -1, 655, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 672, 673,
 &end
#
#   11 LEU  HA           12 PHE  HN          2.80    (#     99:10  Unique    2.14, 2.23 A)
 &rst
  ixpk= 99, nxpk= 10, iat= 157, 174, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   54 THR  HA           55 GLU  HN          3.50    (#    101:10  Unique    2.12, 2.16 A)
 &rst
  ixpk= 101, nxpk= 10, iat= 868, 880, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   54 THR  HB           55 GLU  HN          3.50    (#    102:10  Unique    2.63, 2.74 A)
 &rst
  ixpk= 102, nxpk= 10, iat= 870, 880, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   55 GLU  HA           55 GLU  HN          4.50    (#    103:10  Unique    2.81, 2.83 A)
 &rst
  ixpk= 103, nxpk= 10, iat= 882, 880, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   78 ILE  HA           79 THR  HN          2.80    (#    104:10  Unique    2.17, 2.24 A)
 &rst
  ixpk= 104, nxpk= 10, iat=1237,1254, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   79 THR  HA           79 THR  HN          4.50    (#    105:10  Unique    2.93, 2.96 A)
 &rst
  ixpk= 105, nxpk= 10, iat=1256,1254, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:106     79 THR  HN          3.50    (#    106:10  Single Ambig)
 &rst
  ixpk= 106, nxpk= 10, iat=  -1,1254, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 196, 157,
 &end
#
#   21 ASN  HA           22 GLU  HN          3.50    (#    108:10  Unique    2.35, 2.42 A)
 &rst
  ixpk= 108, nxpk= 10, iat= 320, 332, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   22 GLU  HA           22 GLU  HN          3.50    (#    109:10  Unique    2.77, 2.80 A)
 &rst
  ixpk= 109, nxpk= 10, iat= 334, 332, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:111     26 SER  HN          3.50    (#    111:10  Single Ambig)
 &rst
  ixpk= 111, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 349, 383,
 &end
#
#   26 SER  HB+          26 SER  HN          3.50    (#    112:10  Unique    2.54, 3.09 A)
 &rst
  ixpk= 112, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 404, 405,
 &end
#
#   26 SER  HB-          26 SER  HN          3.50    (#    113:10  Unique    2.54, 3.09 A)
 &rst
  ixpk= 113, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 404, 405,
 &end
#
#   26 SER  HA           26 SER  HN          3.50    (#    114:10  Unique    2.81, 2.84 A)
 &rst
  ixpk= 114, nxpk= 10, iat= 402, 400, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   46 ASP  HA           46 ASP  HN          3.50    (#    116:10  Unique    2.82, 2.89 A)
 &rst
  ixpk= 116, nxpk= 10, iat= 742, 740, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   10 ILE  HN            9 GLN  HN          3.50    (#    117:10  Unique    2.58, 3.01 A)
 &rst
  ixpk= 117, nxpk= 10, iat= 136, 119, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   10 ILE  HN           11 LEU  HN          5.50    (#    118:10  Unique    4.08, 4.20 A)
 &rst
  ixpk= 118, nxpk= 10, iat= 136, 155, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 VAL  HN           11 LEU  HN          4.50    (#    119:10  Unique    2.66, 2.74 A)
 &rst
  ixpk= 119, nxpk= 10, iat= 801, 155, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:120     78 ILE  HN          4.50    (#    120:10  Single Ambig)
 &rst
  ixpk= 120, nxpk= 10, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1059, 213,
 &end
#
#   66 GLN  HE2+         78 ILE  HN          3.50    (#    121:10  Unique    2.24, 3.15 A)
 &rst
  ixpk= 121, nxpk= 10, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1054,1055,
 &end
#
#   66 GLN  HE2-         78 ILE  HN          4.50    (#    122:10  Unique    2.24, 3.15 A)
 &rst
  ixpk= 122, nxpk= 10, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1054,1055,
 &end
#
#   79 THR  HN           78 ILE  HN          5.50    (#    123:10  Unique    4.26, 4.38 A)
 &rst
  ixpk= 123, nxpk= 10, iat=1254,1235, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 LEU  HN           41 VAL  HN          4.50    (#    124:10  Unique    4.45, 4.52 A)
 &rst
  ixpk= 124, nxpk= 10, iat= 636, 655, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:125     12 PHE  HN          4.50    (#    125:10  Single Ambig)
 &rst
  ixpk= 125, nxpk= 10, iat=  -1, 174, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1288,1268, 801,
 &end
#
#   79 THR  HN           12 PHE  HN          4.50    (#    126:10  Unique    2.80, 2.88 A)
 &rst
  ixpk= 126, nxpk= 10, iat=1254, 174, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   56 LEU  HN           55 GLU  HN          4.50    (#    127:10  Unique    2.68, 2.72 A)
 &rst
  ixpk= 127, nxpk= 10, iat= 895, 880, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   23 MET  HN           22 GLU  HN          3.50    (#    128:10  Unique    2.71, 2.78 A)
 &rst
  ixpk= 128, nxpk= 10, iat= 347, 332, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   75 ALA  HN           76 MET  HN          5.50    (#    129:10  Unique    4.45, 4.49 A)
 &rst
  ixpk= 129, nxpk= 10, iat=1186,1196, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   68 PHE  HN           76 MET  HN          5.50    (#    130:10  Unique    3.41, 3.56 A)
 &rst
  ixpk= 130, nxpk= 10, iat=1066,1196, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   70 ILE  HN           76 MET  HN          3.50    (#    131:10  Unique    3.05, 3.10 A)
 &rst
  ixpk= 131, nxpk= 10, iat=1108,1196, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:133     39 ARG  HN          4.50    (#    133:10  Single Ambig)
 &rst
  ixpk= 133, nxpk= 10, iat=  -1, 612, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 636, 596,
 &end
#
#   14 THR  HN           79 THR  HN          5.50    (#    134:10  Unique    5.04, 5.29 A)
 &rst
  ixpk= 134, nxpk= 10, iat= 213,1254, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 MET  HN           26 SER  HN          5.50    (#    135:10  Unique    3.84, 3.93 A)
 &rst
  ixpk= 135, nxpk= 10, iat= 364, 400, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   27 MET  HN           26 SER  HN          3.50    (#    136:10  Unique    2.69, 2.83 A)
 &rst
  ixpk= 136, nxpk= 10, iat= 411, 400, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   51 GLU  HN           39 ARG  HN          5.50    (#    137:10  Unique    5.18, 5.41 A)
 &rst
  ixpk= 137, nxpk= 10, iat= 817, 612, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   49 PHE  HN           39 ARG  HN          3.50    (#    138:10  Unique    2.67, 2.85 A)
 &rst
  ixpk= 138, nxpk= 10, iat= 781, 612, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   12 PHE  HD           13 LEU  HN          3.50    (#    139:10  Unique    2.51, 3.86 A)
 &rst
  ixpk= 139, nxpk= 10, iat=  -1, 194, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 182, 190,
 &end
#
#   49 PHE  HA           13 LEU  HN          5.50    (#    140:10  Unique    3.06, 3.18 A)
 &rst
  ixpk= 140, nxpk= 10, iat= 783, 194, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   37 GLU  HN           51 GLU  HN          3.50    (#    141:10  Unique    2.59, 2.66 A)
 &rst
  ixpk= 141, nxpk= 10, iat= 581, 817, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    8 ASN  HN            9 GLN  HN          5.50    (#    142:10  Unique    4.27, 4.33 A)
 &rst
  ixpk= 142, nxpk= 10, iat= 105, 119, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   12 PHE  HD           12 PHE  HN          5.50    (#    143:10  Unique    4.74, 4.84 A)
 &rst
  ixpk= 143, nxpk= 10, iat=  -1, 174, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 182, 190,
 &end
#
#   37 GLU  HN           38 VAL  HN          5.50    (#    144:10  Unique    4.40, 4.45 A)
 &rst
  ixpk= 144, nxpk= 10, iat= 581, 596, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   49 PHE  HA           50 VAL  HN          3.50    (#    145:10  Unique    2.28, 2.33 A)
 &rst
  ixpk= 145, nxpk= 10, iat= 783, 801, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   49 PHE  HA           49 PHE  HN          4.50    (#    146:10  Unique    2.95, 2.96 A)
 &rst
  ixpk= 146, nxpk= 10, iat= 783, 781, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   48 ALA  HN           13 LEU  HN          4.50    (#    147:10  Unique    2.68, 2.78 A)
 &rst
  ixpk= 147, nxpk= 10, iat= 771, 194, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   52 PHE  HD           52 PHE  HN          4.50    (#    148:10  Unique    2.88, 4.37 A)
 &rst
  ixpk= 148, nxpk= 10, iat=  -1, 832, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 840, 848,
 &end
#
#    8 ASN  HD2+         81 ALA  HN          4.50    (#    150:10  Unique    2.11, 3.37 A)
 &rst
  ixpk= 150, nxpk= 10, iat=  -1,1288, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 114, 115,
 &end
#
#   35 PHE  HE           38 VAL  HN          4.50    (#    151:10  Unique    3.95, 5.30 A)
 &rst
  ixpk= 151, nxpk= 10, iat=  -1, 596, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 549, 553,
 &end
#
#   35 PHE  HZ           38 VAL  HN          4.50    (#    152:10  Unique    3.65, 4.26 A)
 &rst
  ixpk= 152, nxpk= 10, iat= 551, 596, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   80 PHE  HD           80 PHE  HN          4.50    (#    153:10  Unique    2.90, 3.80 A)
 &rst
  ixpk= 153, nxpk= 10, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1276,1284,
 &end
#
#   49 PHE  HD           50 VAL  HN          4.50    (#    154:10  Unique    3.60, 4.78 A)
 &rst
  ixpk= 154, nxpk= 10, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 789, 797,
 &end
#
#   16 LEU  HN           15 ASN  HN          3.50    (#    155:10  Unique    2.73, 2.78 A)
 &rst
  ixpk= 155, nxpk= 10, iat= 241, 227, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   49 PHE  HD           49 PHE  HN          3.50    (#    156:10  Unique    2.92, 4.25 A)
 &rst
  ixpk= 156, nxpk= 10, iat=  -1, 781, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 789, 797,
 &end
#
#   54 THR  HN           53 THR  HN          3.50    (#    157:10  Unique    2.71, 2.75 A)
 &rst
  ixpk= 157, nxpk= 10, iat= 866, 852, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   52 PHE  HD           53 THR  HN          4.50    (#    158:10  Unique    2.80, 4.20 A)
 &rst
  ixpk= 158, nxpk= 10, iat=  -1, 852, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 840, 848,
 &end
#
#   20 THR  HN           19 GLU  HN          4.50    (#    159:10  Unique    2.67, 2.79 A)
 &rst
  ixpk= 159, nxpk= 10, iat= 304, 289, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   44 ARG  HN           43 ASN  HN          3.50    (#    160:10  Unique    1.77, 2.21 A)
 &rst
  ixpk= 160, nxpk= 10, iat= 699, 685, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   35 PHE  HN           34 GLY  HN          4.50    (#    161:10  Unique    2.00, 2.22 A)
 &rst
  ixpk= 161, nxpk= 10, iat= 539, 532, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 LEU  HN           26 SER  HN          4.50    (#    162:10  Unique    4.11, 4.15 A)
 &rst
  ixpk= 162, nxpk= 10, iat= 428, 400, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   25 LEU  HN           26 SER  HN          3.50    (#    163:10  Unique    2.60, 2.63 A)
 &rst
  ixpk= 163, nxpk= 10, iat= 381, 400, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   47 ILE  HN           46 ASP  HN          3.50    (#    164:10  Unique    1.79, 2.45 A)
 &rst
  ixpk= 164, nxpk= 10, iat= 752, 740, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   12 PHE  HN           81 ALA  HN          4.50    (#    165:10  Unique    3.40, 3.63 A)
 &rst
  ixpk= 165, nxpk= 10, iat= 174,1288, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   39 ARG  HN           40 LEU  HN          5.50    (#    166:10  Unique    3.74, 4.05 A)
 &rst
  ixpk= 166, nxpk= 10, iat= 612, 636, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   41 VAL  HN           40 LEU  HN          4.50    (#    167:10  Unique    4.45, 4.52 A)
 &rst
  ixpk= 167, nxpk= 10, iat= 655, 636, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   39 ARG  HN           38 VAL  HN          4.50    (#    168:10  Unique    4.26, 4.35 A)
 &rst
  ixpk= 168, nxpk= 10, iat= 612, 596, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   11 LEU  HN           50 VAL  HN          4.50    (#    169:10  Unique    2.66, 2.74 A)
 &rst
  ixpk= 169, nxpk= 10, iat= 155, 801, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   39 ARG  HN           49 PHE  HN          4.50    (#    170:10  Unique    2.67, 2.85 A)
 &rst
  ixpk= 170, nxpk= 10, iat= 612, 781, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:171     79 THR  HN          3.50    (#    171:10  Single Ambig)
 &rst
  ixpk= 171, nxpk= 10, iat=  -1,1254, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 174,1235,
 &end
#
#    0 AMB  10-2:172     51 GLU  HN          4.50    (#    172:10  Single Ambig)
 &rst
  ixpk= 172, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 832, 596,
 &end
#
#   82 LYS  HN           81 ALA  HN          5.50    (#    173:10  Unique    4.61, 4.64 A)
 &rst
  ixpk= 173, nxpk= 10, iat=1298,1288, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   52 PHE  HN           53 THR  HN          4.50    (#    174:10  Unique    4.36, 4.39 A)
 &rst
  ixpk= 174, nxpk= 10, iat= 832, 852, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   39 ARG  HN           51 GLU  HN          5.50    (#    175:10  Unique    5.18, 5.41 A)
 &rst
  ixpk= 175, nxpk= 10, iat= 612, 817, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   46 ASP  HN           44 ARG  HE          5.50    (#    176:10  Unique    2.98, 3.71 A)
 &rst
  ixpk= 176, nxpk= 10, iat= 740, 712, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   12 PHE  HN           13 LEU  HN          5.50    (#    177:10  Unique    4.27, 4.35 A)
 &rst
  ixpk= 177, nxpk= 10, iat= 174, 194, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   80 PHE  HN            5 GLN  HN          5.50    (#    178:10  Unique    3.21, 4.10 A)
 &rst
  ixpk= 178, nxpk= 10, iat=1268,  60, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 MET  HN           68 PHE  HN          5.50    (#    179:10  Unique    3.41, 3.56 A)
 &rst
  ixpk= 179, nxpk= 10, iat=1196,1066, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   26 SER  HN           23 MET  HN          5.50    (#    180:10  Unique    4.54, 4.63 A)
 &rst
  ixpk= 180, nxpk= 10, iat= 400, 347, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   26 SER  HN           24 MET  HN          5.50    (#    181:10  Unique    3.84, 3.93 A)
 &rst
  ixpk= 181, nxpk= 10, iat= 400, 364, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   79 THR  HN           14 THR  HN          5.50    (#    182:10  Unique    5.04, 5.29 A)
 &rst
  ixpk= 182, nxpk= 10, iat=1254, 213, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   13 LEU  HN           14 THR  HN          4.50    (#    183:10  Unique    4.37, 4.42 A)
 &rst
  ixpk= 183, nxpk= 10, iat= 194, 213, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   51 GLU  HN           52 PHE  HN          4.50    (#    184:10  Unique    4.30, 4.37 A)
 &rst
  ixpk= 184, nxpk= 10, iat= 817, 832, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   51 GLU  HN           38 VAL  HN          5.50    (#    185:10  Unique    4.71, 4.87 A)
 &rst
  ixpk= 185, nxpk= 10, iat= 817, 596, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   77 LYS  HN           14 THR  HN          3.50    (#    186:10  Unique    2.83, 2.91 A)
 &rst
  ixpk= 186, nxpk= 10, iat=1213, 213, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   12 PHE  HA           13 LEU  HN          2.80    (#    187:10  Unique    2.18, 2.22 A)
 &rst
  ixpk= 187, nxpk= 10, iat= 176, 194, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   51 GLU  HA           51 GLU  HN          4.50    (#    188:10  Unique    2.97, 2.98 A)
 &rst
  ixpk= 188, nxpk= 10, iat= 819, 817, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   50 VAL  HA           51 GLU  HN          2.80    (#    189:10  Unique    2.26, 2.30 A)
 &rst
  ixpk= 189, nxpk= 10, iat= 803, 817, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    2 GLN  HA            1 ALA  HN          4.50    (#    193:10  Unique    4.38, 7.81 A)
 &rst
  ixpk= 193, nxpk= 10, iat=  16,   2, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    1 ALA  HA            1 ALA  HN          5.50    (#    194:10  Unique    1.61, 7.02 A)
 &rst
  ixpk= 194, nxpk= 10, iat=   6,   2, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:195     52 PHE  HN          2.80    (#    195:10  Single Ambig)
 &rst
  ixpk= 195, nxpk= 10, iat=  -1, 832, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 819, 834,
 &end
#
#   82 LYS  HA           83 LYS  HN          2.80    (#    197:10  Unique    2.23, 2.47 A)
 &rst
  ixpk= 197, nxpk= 10, iat=1300,1320, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   80 PHE  HA           81 ALA  HN          3.50    (#    198:10  Unique    2.21, 2.25 A)
 &rst
  ixpk= 198, nxpk= 10, iat=1270,1288, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   81 ALA  HA           81 ALA  HN          4.50    (#    199:10  Unique    2.89, 2.91 A)
 &rst
  ixpk= 199, nxpk= 10, iat=1290,1288, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 GLN  HA            4 GLU  HN          5.50    (#    204:10  Unique    4.49, 5.23 A)
 &rst
  ixpk= 204, nxpk= 10, iat=  62,  45, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    3 THR  HA            4 GLU  HN          3.50    (#    205:10  Unique    2.20, 2.46 A)
 &rst
  ixpk= 205, nxpk= 10, iat=  33,  45, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    3 THR  HB            4 GLU  HN          4.50    (#    206:10  Unique    2.02, 3.45 A)
 &rst
  ixpk= 206, nxpk= 10, iat=  35,  45, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 GLN  HA            5 GLN  HN          3.50    (#    208:10  Unique    2.83, 2.92 A)
 &rst
  ixpk= 208, nxpk= 10, iat=  62,  60, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    6 PRO  HD+           5 GLN  HN          4.50    (#    209:10  Unique    4.70, 4.87 A)
 &rst
  ixpk= 209, nxpk= 10, iat=  -1,  60, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  78,  79,
 &end
#
#    4 GLU  HA            5 GLN  HN          2.80    (#    210:10  Unique    2.26, 2.37 A)
 &rst
  ixpk= 210, nxpk= 10, iat=  47,  60, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   39 ARG  HA           40 LEU  HN          2.80    (#    211:10  Unique    2.18, 2.23 A)
 &rst
  ixpk= 211, nxpk= 10, iat= 614, 636, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   40 LEU  HA           40 LEU  HN          3.50    (#    212:10  Unique    2.91, 2.96 A)
 &rst
  ixpk= 212, nxpk= 10, iat= 638, 636, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:213      0 AMB  10-1:213    5.50    (#    213:10  Double Ambig)
 &rst
  ixpk= 213, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 773,1258,
 igr2= 636,1298,
 &end
#
#   65 LEU  HA           68 PHE  HN          4.50    (#    214:10  Unique    3.63, 3.74 A)
 &rst
  ixpk= 214, nxpk= 10, iat=1025,1066, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:216     68 PHE  HN          5.50    (#    216:10  Single Ambig)
 &rst
  ixpk= 216, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1188,1088,
 &end
#
#   68 PHE  HA           68 PHE  HN          3.50    (#    218:10  Unique    2.84, 2.86 A)
 &rst
  ixpk= 218, nxpk= 10, iat=1068,1066, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 GLN  HA           68 PHE  HN          4.50    (#    219:10  Unique    3.44, 3.57 A)
 &rst
  ixpk= 219, nxpk= 10, iat=1044,1066, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   67 GLY  HA-          68 PHE  HN          4.50    (#    220:10  Unique    3.26, 3.38 A)
 &rst
  ixpk= 220, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1061,1062,
 &end
#
#   76 MET  HA           68 PHE  HN          7.00    (#    221:10  Unique    5.17, 5.29 A)
 &rst
  ixpk= 221, nxpk= 10, iat=1198,1066, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   23 MET  HA           23 MET  HN          3.50    (#    222:10  Unique    2.82, 2.86 A)
 &rst
  ixpk= 222, nxpk= 10, iat= 349, 347, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   22 GLU  HA           23 MET  HN          4.50    (#    223:10  Unique    3.52, 3.55 A)
 &rst
  ixpk= 223, nxpk= 10, iat= 334, 347, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   38 VAL  HA           38 VAL  HN          3.50    (#    225:10  Unique    2.88, 2.95 A)
 &rst
  ixpk= 225, nxpk= 10, iat= 598, 596, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   37 GLU  HA           38 VAL  HN          2.80    (#    226:10  Unique    2.33, 2.43 A)
 &rst
  ixpk= 226, nxpk= 10, iat= 583, 596, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   17 PRO  HA           18 GLU  HN          2.80    (#    228:10  Unique    2.26, 2.33 A)
 &rst
  ixpk= 228, nxpk= 10, iat= 270, 274, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   18 GLU  HA           18 GLU  HN          3.50    (#    229:10  Unique    2.79, 2.84 A)
 &rst
  ixpk= 229, nxpk= 10, iat= 276, 274, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   80 PHE  HA           80 PHE  HN          3.50    (#    230:10  Unique    2.89, 2.93 A)
 &rst
  ixpk= 230, nxpk= 10, iat=1270,1268, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   79 THR  HA           80 PHE  HN          2.80    (#    231:10  Unique    2.28, 2.37 A)
 &rst
  ixpk= 231, nxpk= 10, iat=1256,1268, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    1 ALA  HA            2 GLN  HN          4.50    (#    232:10  Unique    2.20, 2.91 A)
 &rst
  ixpk= 232, nxpk= 10, iat=   6,  14, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   10 ILE  HA           50 VAL  HN          4.50    (#    236:10  Unique    4.27, 4.41 A)
 &rst
  ixpk= 236, nxpk= 10, iat= 138, 801, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   50 VAL  HA           50 VAL  HN          5.50    (#    237:10  Unique    2.96, 2.97 A)
 &rst
  ixpk= 237, nxpk= 10, iat= 803, 801, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   22 GLU  HA           24 MET  HN          5.50    (#    238:10  Unique    4.11, 4.27 A)
 &rst
  ixpk= 238, nxpk= 10, iat= 334, 364, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:239     24 MET  HN          4.50    (#    239:10  Single Ambig)
 &rst
  ixpk= 239, nxpk= 10, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 349, 383,
 &end
#
#   24 MET  HA           24 MET  HN          3.50    (#    240:10  Unique    2.84, 2.88 A)
 &rst
  ixpk= 240, nxpk= 10, iat= 366, 364, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   67 GLY  HA+          67 GLY  HN          3.50    (#    242:10  Unique    2.27, 2.61 A)
 &rst
  ixpk= 242, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1061,1062,
 &end
#
#   66 GLN  HA           67 GLY  HN          2.80    (#    244:10  Unique    2.16, 2.18 A)
 &rst
  ixpk= 244, nxpk= 10, iat=1044,1059, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   67 GLY  HA-          67 GLY  HN          3.50    (#    245:10  Unique    2.27, 2.61 A)
 &rst
  ixpk= 245, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1061,1062,
 &end
#
#   26 SER  HA           30 ASN  HN          4.50    (#    246:10  Unique    3.85, 3.94 A)
 &rst
  ixpk= 246, nxpk= 10, iat= 402, 467, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   29 PHE  HA           30 ASN  HN          4.50    (#    247:10  Unique    3.44, 3.46 A)
 &rst
  ixpk= 247, nxpk= 10, iat= 449, 467, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   30 ASN  HA           30 ASN  HN          2.80    (#    248:10  Unique    2.78, 2.80 A)
 &rst
  ixpk= 248, nxpk= 10, iat= 469, 467, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   14 THR  HA           15 ASN  HN          3.50    (#    249:10  Unique    2.38, 2.42 A)
 &rst
  ixpk= 249, nxpk= 10, iat= 215, 227, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   14 THR  HB           15 ASN  HN          3.50    (#    250:10  Unique    2.32, 2.39 A)
 &rst
  ixpk= 250, nxpk= 10, iat= 217, 227, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:251      0 AMB  10-1:251    2.80    (#    251:10  Double Ambig)
 &rst
  ixpk= 251, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 229, 773,
 igr2= 227, 781,
 &end
#
#    0 AMB  10-2:252     49 PHE  HN          4.50    (#    252:10  Single Ambig)
 &rst
  ixpk= 252, nxpk= 10, iat=  -1, 781, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 598, 614,
 &end
#
#    0 AMB  10-2:253      0 AMB  10-1:253    4.50    (#    253:10  Double Ambig)
 &rst
  ixpk= 253, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 638, 742,
 igr2= 781, 227,
 &end
#
#   52 PHE  HA           53 THR  HN          3.50    (#    254:10  Unique    2.20, 2.26 A)
 &rst
  ixpk= 254, nxpk= 10, iat= 834, 852, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   53 THR  HB           53 THR  HN          3.50    (#    255:10  Unique    2.17, 2.21 A)
 &rst
  ixpk= 255, nxpk= 10, iat= 856, 852, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   53 THR  HA           53 THR  HN          3.50    (#    256:10  Unique    2.82, 2.84 A)
 &rst
  ixpk= 256, nxpk= 10, iat= 854, 852, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   19 GLU  HA           19 GLU  HN          2.80    (#    258:10  Unique    2.83, 2.84 A)
 &rst
  ixpk= 258, nxpk= 10, iat= 291, 289, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   17 PRO  HA           19 GLU  HN          5.50    (#    259:10  Unique    3.85, 3.96 A)
 &rst
  ixpk= 259, nxpk= 10, iat= 270, 289, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 PRO  HD+          19 GLU  HN          5.50    (#    260:10  Unique    5.34, 5.75 A)
 &rst
  ixpk= 260, nxpk= 10, iat=  -1, 289, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 261, 262,
 &end
#
#   43 ASN  HA           43 ASN  HN          2.80    (#    262:10  Unique    2.17, 2.65 A)
 &rst
  ixpk= 262, nxpk= 10, iat= 687, 685, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   42 PRO  HA           43 ASN  HN          2.80    (#    263:10  Unique    2.08, 2.59 A)
 &rst
  ixpk= 263, nxpk= 10, iat= 681, 685, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   34 GLY  HA-          34 GLY  HN          3.50    (#    265:10  Unique    2.44, 2.74 A)
 &rst
  ixpk= 265, nxpk= 10, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 534, 535,
 &end
#
#   33 PRO  HA           34 GLY  HN          3.50    (#    266:10  Unique    3.26, 3.43 A)
 &rst
  ixpk= 266, nxpk= 10, iat= 528, 532, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   32 PHE  HB+          34 GLY  HN          3.50    (#    267:10  Unique    3.02, 3.36 A)
 &rst
  ixpk= 267, nxpk= 10, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 502, 503,
 &end
#
#   13 LEU  HA           14 THR  HN          2.80    (#    269:10  Unique    2.18, 2.23 A)
 &rst
  ixpk= 269, nxpk= 10, iat= 196, 213, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:270     14 THR  HN          4.50    (#    270:10  Single Ambig)
 &rst
  ixpk= 270, nxpk= 10, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1237,1215,
 &end
#
#   14 THR  HB           14 THR  HN          4.50    (#    272:10  Unique    3.69, 3.79 A)
 &rst
  ixpk= 272, nxpk= 10, iat= 217, 213, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:273     52 PHE  HN          3.50    (#    273:10  Single Ambig)
 &rst
  ixpk= 273, nxpk= 10, iat=  -1, 832, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 836, 837, 836, 837,
 &end
#
#    0 AMB  10-2:274     52 PHE  HN          4.50    (#    274:10  Single Ambig)
 &rst
  ixpk= 274, nxpk= 10, iat=  -1, 832, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 126, 127, 126, 127,
 &end
#
#    0 AMB  10-2:275     81 ALA  HN          3.50    (#    275:10  Single Ambig)
 &rst
  ixpk= 275, nxpk= 10, iat=  -1,1288, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1272,1273, 109, 110,
 &end
#
#   80 PHE  HB+          80 PHE  HN          4.50    (#    276:10  Unique    2.26, 2.97 A)
 &rst
  ixpk= 276, nxpk= 10, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1272,1273,
 &end
#
#   80 PHE  HB-          80 PHE  HN          4.50    (#    277:10  Unique    2.26, 2.97 A)
 &rst
  ixpk= 277, nxpk= 10, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1272,1273,
 &end
#
#   49 PHE  HB+          50 VAL  HN          3.50    (#    278:10  Unique    2.52, 3.22 A)
 &rst
  ixpk= 278, nxpk= 10, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 785, 786,
 &end
#
#   15 ASN  HB-          15 ASN  HN          4.50    (#    279:10  Unique    3.01, 3.36 A)
 &rst
  ixpk= 279, nxpk= 10, iat=  -1, 227, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 231, 232,
 &end
#
#   49 PHE  HB+          49 PHE  HN          4.50    (#    280:10  Unique    2.61, 3.24 A)
 &rst
  ixpk= 280, nxpk= 10, iat=  -1, 781, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 785, 786,
 &end
#
#   49 PHE  HB-          49 PHE  HN          3.50    (#    281:10  Unique    2.61, 3.24 A)
 &rst
  ixpk= 281, nxpk= 10, iat=  -1, 781, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 785, 786,
 &end
#
#    0 AMB  10-2:282     53 THR  HN          3.50    (#    282:10  Single Ambig)
 &rst
  ixpk= 282, nxpk= 10, iat=  -1, 852, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 836, 837, 836, 837,
 &end
#
#   43 ASN  HB-          43 ASN  HN          3.50    (#    283:10  Unique    2.79, 3.33 A)
 &rst
  ixpk= 283, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 689, 690,
 &end
#
#    0 AMB  10-2:284     34 GLY  HN          4.50    (#    284:10  Single Ambig)
 &rst
  ixpk= 284, nxpk= 10, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 525, 526, 918, 919,
 &end
#
#   13 LEU  HB-          13 LEU  HN          5.50    (#    285:10  Unique    2.36, 2.91 A)
 &rst
  ixpk= 285, nxpk= 10, iat=  -1, 194, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 198, 199,
 &end
#
#   13 LEU  HB+          13 LEU  HN          3.50    (#    286:10  Unique    2.36, 2.91 A)
 &rst
  ixpk= 286, nxpk= 10, iat=  -1, 194, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 198, 199,
 &end
#
#   13 LEU  MDX          13 LEU  HN          3.50    (#    287:10  Unique    3.43, 4.76 A)
 &rst
  ixpk= 287, nxpk= 10, iat=  -1, 194, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 203, 204, 205, 207, 208, 209,
 &end
#
#    0 AMB  10-2:288     51 GLU  HN          2.80    (#    288:10  Single Ambig)
 &rst
  ixpk= 288, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 821, 822, 821, 822,
 &end
#
#   50 VAL  MGY          51 GLU  HN          3.50    (#    289:10  Unique    2.49, 4.07 A)
 &rst
  ixpk= 289, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 807, 808, 809, 811, 812, 813,
 &end
#
#   50 VAL  MGX          51 GLU  HN          4.50    (#    290:10  Unique    2.49, 4.07 A)
 &rst
  ixpk= 290, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 807, 808, 809, 811, 812, 813,
 &end
#
#   51 GLU  HG+          52 PHE  HN          3.50    (#    291:10  Unique    2.44, 2.73 A)
 &rst
  ixpk= 291, nxpk= 10, iat=  -1, 832, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 824, 825,
 &end
#
#    0 AMB  10-2:292     83 LYS  HN          4.50    (#    292:10  Single Ambig)
 &rst
  ixpk= 292, nxpk= 10, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1302,1303,1302,1303,
 &end
#
#    0 AMB  10-2:293     83 LYS  HN          3.50    (#    293:10  Single Ambig)
 &rst
  ixpk= 293, nxpk= 10, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1327,1328,1327,1328,
 &end
#
#   11 LEU  MDY          81 ALA  HN          4.50    (#    294:10  Unique    3.08, 5.58 A)
 &rst
  ixpk= 294, nxpk= 10, iat=  -1,1288, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 164, 165, 166, 168, 169, 170,
 &end
#
#   81 ALA  MB           81 ALA  HN          2.80    (#    295:10  Unique    2.48, 2.95 A)
 &rst
  ixpk= 295, nxpk= 10, iat=  -1,1288, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1292,1293,1294,
 &end
#
#    0 AMB  10-2:296      5 GLN  HN          2.80    (#    296:10  Single Ambig)
 &rst
  ixpk= 296, nxpk= 10, iat=  -1,  60, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=  49,  50,  64,  65,
 &end
#
#    0 AMB  10-2:297      0 AMB  10-1:297    2.80    (#    297:10  Double Ambig)
 &rst
  ixpk= 297, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1=1302,1303,1302,1303, 643,
 igr2=1298, 636,
 &end
#
#   39 ARG  HG+          40 LEU  HN          4.50    (#    298:10  Unique    2.77, 4.55 A)
 &rst
  ixpk= 298, nxpk= 10, iat=  -1, 636, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 619, 620,
 &end
#
#   40 LEU  MDY          40 LEU  HN          3.50    (#    299:10  Unique    3.32, 4.62 A)
 &rst
  ixpk= 299, nxpk= 10, iat=  -1, 636, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 645, 646, 647, 649, 650, 651,
 &end
#
#   40 LEU  MDX          40 LEU  HN          3.50    (#    300:10  Unique    3.32, 4.62 A)
 &rst
  ixpk= 300, nxpk= 10, iat=  -1, 636, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 645, 646, 647, 649, 650, 651,
 &end
#
#    0 AMB  10-2:301      0 AMB  10-1:301    2.80    (#    301:10  Double Ambig)
 &rst
  ixpk= 301, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1=1292,1293,1294,1305,1306, 619, 620,1327,1328,1327,
      1328,
 igr2=1298, 636,
 &end
#
#   38 VAL  MGY          38 VAL  HN          3.50    (#    302:10  Unique    2.76, 4.15 A)
 &rst
  ixpk= 302, nxpk= 10, iat=  -1, 596, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 602, 603, 604, 606, 607, 608,
 &end
#
#    0 AMB  10-2:303     38 VAL  HN          2.80    (#    303:10  Single Ambig)
 &rst
  ixpk= 303, nxpk= 10, iat=  -1, 596, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 588, 589, 585, 586,
 &end
#
#   38 VAL  MGX          38 VAL  HN          3.50    (#    304:10  Unique    2.76, 4.15 A)
 &rst
  ixpk= 304, nxpk= 10, iat=  -1, 596, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 602, 603, 604, 606, 607, 608,
 &end
#
#   50 VAL  MGY          38 VAL  HN          5.50    (#    305:10  Unique    5.00, 6.45 A)
 &rst
  ixpk= 305, nxpk= 10, iat=  -1, 596, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 807, 808, 809, 811, 812, 813,
 &end
#
#    0 AMB  10-2:306     18 GLU  HN          2.80    (#    306:10  Single Ambig)
 &rst
  ixpk= 306, nxpk= 10, iat=  -1, 274, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 278, 279, 278, 279,
 &end
#
#    0 AMB  10-2:307     18 GLU  HN          3.50    (#    307:10  Single Ambig)
 &rst
  ixpk= 307, nxpk= 10, iat=  -1, 274, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 281, 282, 281, 282,
 &end
#
#   17 PRO  HB+          18 GLU  HN          4.50    (#    308:10  Unique    3.11, 3.55 A)
 &rst
  ixpk= 308, nxpk= 10, iat=  -1, 274, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 267, 268,
 &end
#
#   17 PRO  HB-          18 GLU  HN          4.50    (#    309:10  Unique    3.11, 3.55 A)
 &rst
  ixpk= 309, nxpk= 10, iat=  -1, 274, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 267, 268,
 &end
#
#   79 THR  MG2          80 PHE  HN          4.50    (#    310:10  Unique    2.36, 3.58 A)
 &rst
  ixpk= 310, nxpk= 10, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1260,1261,1262,
 &end
#
#   50 VAL  HB           50 VAL  HN          3.50    (#    311:10  Unique    2.67, 2.72 A)
 &rst
  ixpk= 311, nxpk= 10, iat= 805, 801, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   50 VAL  MGX          50 VAL  HN          3.50    (#    312:10  Unique    3.00, 4.27 A)
 &rst
  ixpk= 312, nxpk= 10, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 807, 808, 809, 811, 812, 813,
 &end
#
#    0 AMB  10-2:313     50 VAL  HN          3.50    (#    313:10  Single Ambig)
 &rst
  ixpk= 313, nxpk= 10, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 142, 143, 144, 602, 603, 604, 606, 607, 608,
 &end
#
#    0 AMB  10-2:314     50 VAL  HN          4.50    (#    314:10  Single Ambig)
 &rst
  ixpk= 314, nxpk= 10, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 203, 204, 205, 207, 208, 209, 146, 147,
 &end
#
#   14 THR  MG2          15 ASN  HN          4.50    (#    315:10  Unique    3.77, 4.45 A)
 &rst
  ixpk= 315, nxpk= 10, iat=  -1, 227, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 219, 220, 221,
 &end
#
#    0 AMB  10-2:316      0 AMB  10-1:316    3.50    (#    316:10  Double Ambig)
 &rst
  ixpk= 316, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 758, 759, 760, 645, 646, 647, 649, 650, 651,
 igr2= 227, 781,
 &end
#
#   48 ALA  MB           49 PHE  HN          3.50    (#    317:10  Unique    2.20, 3.13 A)
 &rst
  ixpk= 317, nxpk= 10, iat=  -1, 781, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 775, 776, 777,
 &end
#
#   41 VAL  MGX          49 PHE  HN          5.50    (#    318:10  Unique    4.07, 6.89 A)
 &rst
  ixpk= 318, nxpk= 10, iat=  -1, 781, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 661, 662, 663, 665, 666, 667,
 &end
#
#    0 AMB  10-2:319     53 THR  HN          4.50    (#    319:10  Single Ambig)
 &rst
  ixpk= 319, nxpk= 10, iat=  -1, 852, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 563, 564, 858, 859, 860,
 &end
#
#    0 AMB  10-2:320     53 THR  HN          5.50    (#    320:10  Single Ambig)
 &rst
  ixpk= 320, nxpk= 10, iat=  -1, 852, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 566, 567, 569, 570,
 &end
#
#    0 AMB  10-2:321     19 GLU  HN          2.80    (#    321:10  Single Ambig)
 &rst
  ixpk= 321, nxpk= 10, iat=  -1, 289, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 296, 297, 296, 297,
 &end
#
#   19 GLU  HB-          19 GLU  HN          3.50    (#    322:10  Unique    2.40, 3.00 A)
 &rst
  ixpk= 322, nxpk= 10, iat=  -1, 289, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 293, 294,
 &end
#
#    0 AMB  10-2:323     19 GLU  HN          3.50    (#    323:10  Single Ambig)
 &rst
  ixpk= 323, nxpk= 10, iat=  -1, 289, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 278, 279, 278, 279,
 &end
#
#   42 PRO  HB-          43 ASN  HN          4.50    (#    324:10  Unique    3.10, 4.26 A)
 &rst
  ixpk= 324, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 678, 679,
 &end
#
#   42 PRO  HB+          43 ASN  HN          4.50    (#    325:10  Unique    3.10, 4.26 A)
 &rst
  ixpk= 325, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 678, 679,
 &end
#
#    5 GLN  HG+           5 GLN  HN          4.50    (#    326:10  Unique    3.30, 4.09 A)
 &rst
  ixpk= 326, nxpk= 10, iat=  -1,  60, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  67,  68,
 &end
#
#    0 AMB  10-2:327      5 GLN  HN          4.50    (#    327:10  Single Ambig)
 &rst
  ixpk= 327, nxpk= 10, iat=  -1,  60, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  67,  68,  52,  53,
 &end
#
#    0 AMB  10-2:328      5 GLN  HN          3.50    (#    328:10  Single Ambig)
 &rst
  ixpk= 328, nxpk= 10, iat=  -1,  60, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  64,  65,  52,  53,
 &end
#
#    1 ALA  MB            1 ALA  HN          5.50    (#    329:10  Unique    1.87, 7.10 A)
 &rst
  ixpk= 329, nxpk= 10, iat=  -1,   2, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=   8,   9,  10,
 &end
#
#    4 GLU  HB-           4 GLU  HN          3.50    (#    334:10  Unique    2.24, 3.21 A)
 &rst
  ixpk= 334, nxpk= 10, iat=  -1,  45, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  49,  50,
 &end
#
#    4 GLU  HG-           4 GLU  HN          4.50    (#    335:10  Unique    2.07, 3.06 A)
 &rst
  ixpk= 335, nxpk= 10, iat=  -1,  45, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  52,  53,
 &end
#
#    3 THR  MG2           4 GLU  HN          5.50    (#    336:10  Unique    2.02, 4.20 A)
 &rst
  ixpk= 336, nxpk= 10, iat=  -1,  45, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  37,  38,  39,
 &end
#
#   68 PHE  HB+          68 PHE  HN          3.50    (#    338:10  Unique    2.37, 2.49 A)
 &rst
  ixpk= 338, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1070,1071,
 &end
#
#   68 PHE  HB-          68 PHE  HN          3.50    (#    339:10  Unique    2.37, 2.49 A)
 &rst
  ixpk= 339, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1070,1071,
 &end
#
#    0 AMB  10-2:340     68 PHE  HN          7.00    (#    340:10  Single Ambig)
 &rst
  ixpk= 340, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1093,1094,1090,1091,
 &end
#
#   23 MET  HG+          23 MET  HN          4.50    (#    344:10  Unique    2.23, 3.70 A)
 &rst
  ixpk= 344, nxpk= 10, iat=  -1, 347, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 354, 355,
 &end
#
#   23 MET  HG-          23 MET  HN          4.50    (#    345:10  Unique    2.23, 3.70 A)
 &rst
  ixpk= 345, nxpk= 10, iat=  -1, 347, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 354, 355,
 &end
#
#    0 AMB  10-2:346     23 MET  HN          3.50    (#    346:10  Single Ambig)
 &rst
  ixpk= 346, nxpk= 10, iat=  -1, 347, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 339, 340, 339, 340,
 &end
#
#    0 AMB  10-2:347     23 MET  HN          2.80    (#    347:10  Single Ambig)
 &rst
  ixpk= 347, nxpk= 10, iat=  -1, 347, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 351, 352, 336, 337,
 &end
#
#    0 AMB  10-2:348     23 MET  HN          2.80    (#    348:10  Single Ambig)
 &rst
  ixpk= 348, nxpk= 10, iat=  -1, 347, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 351, 352, 336, 337,
 &end
#
#   24 MET  HG+          24 MET  HN          3.50    (#    349:10  Unique    2.18, 2.95 A)
 &rst
  ixpk= 349, nxpk= 10, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 371, 372,
 &end
#
#   23 MET  HG+          24 MET  HN          4.50    (#    350:10  Unique    4.02, 4.72 A)
 &rst
  ixpk= 350, nxpk= 10, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 354, 355,
 &end
#
#   24 MET  HG-          24 MET  HN          3.50    (#    351:10  Unique    2.18, 2.95 A)
 &rst
  ixpk= 351, nxpk= 10, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 371, 372,
 &end
#
#   24 MET  HB+          24 MET  HN          3.50    (#    352:10  Unique    2.47, 3.11 A)
 &rst
  ixpk= 352, nxpk= 10, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 368, 369,
 &end
#
#    0 AMB  10-2:353     24 MET  HN          2.80    (#    353:10  Single Ambig)
 &rst
  ixpk= 353, nxpk= 10, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 368, 369, 351, 352,
 &end
#
#   66 GLN  HB-          67 GLY  HN          4.50    (#    354:10  Unique    3.24, 4.06 A)
 &rst
  ixpk= 354, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1046,1047,
 &end
#
#   75 ALA  MB           67 GLY  HN          5.50    (#    355:10  Unique    3.68, 4.95 A)
 &rst
  ixpk= 355, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1190,1191,1192,
 &end
#
#    0 AMB  10-2:356     58 SER  HN          4.50    (#    356:10  Single Ambig)
 &rst
  ixpk= 356, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 921, 922, 921, 922,
 &end
#
#   58 SER  HA           58 SER  HN          3.50    (#    357:10  Unique    2.80, 2.85 A)
 &rst
  ixpk= 357, nxpk= 10, iat= 933, 931, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   30 ASN  HB+          30 ASN  HN          3.50    (#    358:10  Unique    2.18, 2.59 A)
 &rst
  ixpk= 358, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 471, 472,
 &end
#
#   30 ASN  HB-          30 ASN  HN          3.50    (#    359:10  Unique    2.18, 2.59 A)
 &rst
  ixpk= 359, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 471, 472,
 &end
#
#   14 THR  MG2          14 THR  HN          3.50    (#    360:10  Unique    3.31, 4.06 A)
 &rst
  ixpk= 360, nxpk= 10, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 219, 220, 221,
 &end
#
#    0 AMB  10-2:361     14 THR  HN          5.50    (#    361:10  Single Ambig)
 &rst
  ixpk= 361, nxpk= 10, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1217,1218,1245,1246,
 &end
#
#    0 AMB  10-2:362     14 THR  HN          4.50    (#    362:10  Single Ambig)
 &rst
  ixpk= 362, nxpk= 10, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 198, 199, 201,
 &end
#
#    0 AMB  10-2:363     14 THR  HN          4.50    (#    363:10  Single Ambig)
 &rst
  ixpk= 363, nxpk= 10, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 198, 199,1220,1221,1220,1221,
 &end
#
#    0 AMB  10-2:364     14 THR  HN          4.50    (#    364:10  Single Ambig)
 &rst
  ixpk= 364, nxpk= 10, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 203, 204, 205, 207, 208, 209, 758, 759, 760, 390,
       391, 392, 394, 395, 396,
 &end
#
#   16 LEU  MDX          14 THR  HN          3.50    (#    365:10  Unique    3.19, 5.02 A)
 &rst
  ixpk= 365, nxpk= 10, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 250, 251, 252, 254, 255, 256,
 &end
#
#    0 AMB  10-2:366     70 ILE  HN          3.50    (#    366:10  Single Ambig)
 &rst
  ixpk= 366, nxpk= 10, iat=  -1,1108, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1118,1119,1112,
 &end
#
#    0 AMB  10-2:367     70 ILE  HN          4.50    (#    367:10  Single Ambig)
 &rst
  ixpk= 367, nxpk= 10, iat=  -1,1108, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1090,1091,1096,1097,1093,1094,
 &end
#
#   70 ILE  HG1+         70 ILE  HN          4.50    (#    368:10  Unique    2.13, 2.92 A)
 &rst
  ixpk= 368, nxpk= 10, iat=  -1,1108, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1118,1119,
 &end
#
#    0 AMB  10-2:369     70 ILE  HN          4.50    (#    369:10  Single Ambig)
 &rst
  ixpk= 369, nxpk= 10, iat=  -1,1108, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1093,1094,1190,1191,1192,
 &end
#
#   36 LYS  HB+          36 LYS  HN          4.50    (#    371:10  Unique    2.55, 3.10 A)
 &rst
  ixpk= 371, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 563, 564,
 &end
#
#    0 AMB  10-2:372     36 LYS  HN          4.50    (#    372:10  Single Ambig)
 &rst
  ixpk= 372, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 566, 567, 569, 570,
 &end
#
#   36 LYS  HB-          36 LYS  HN          3.50    (#    373:10  Unique    2.55, 3.10 A)
 &rst
  ixpk= 373, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 563, 564,
 &end
#
#    0 AMB  10-2:374     77 LYS  HN          3.50    (#    374:10  Single Ambig)
 &rst
  ixpk= 374, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1203,1204, 231, 232,
 &end
#
#   77 LYS  HB+          77 LYS  HN          3.50    (#    375:10  Unique    2.47, 2.92 A)
 &rst
  ixpk= 375, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1217,1218,
 &end
#
#   77 LYS  HB-          77 LYS  HN          3.50    (#    376:10  Unique    2.47, 2.92 A)
 &rst
  ixpk= 376, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1217,1218,
 &end
#
#    0 AMB  10-2:378     59 ASN  HN          4.50    (#    378:10  Single Ambig)
 &rst
  ixpk= 378, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=  98,  99, 960, 961, 962,
 &end
#
#    0 AMB  10-2:379     59 ASN  HN          2.80    (#    379:10  Single Ambig)
 &rst
  ixpk= 379, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 946, 947, 946, 947,
 &end
#
#   47 ILE  HB           48 ALA  HN          3.50    (#    380:10  Unique    2.48, 2.60 A)
 &rst
  ixpk= 380, nxpk= 10, iat= 756, 771, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   13 LEU  HB+          48 ALA  HN          3.50    (#    381:10  Unique    2.98, 3.35 A)
 &rst
  ixpk= 381, nxpk= 10, iat=  -1, 771, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 198, 199,
 &end
#
#   13 LEU  HB-          48 ALA  HN          3.50    (#    382:10  Unique    2.98, 3.35 A)
 &rst
  ixpk= 382, nxpk= 10, iat=  -1, 771, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 198, 199,
 &end
#
#   48 ALA  MB           48 ALA  HN          3.50    (#    383:10  Unique    2.91, 3.48 A)
 &rst
  ixpk= 383, nxpk= 10, iat=  -1, 771, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 775, 776, 777,
 &end
#
#    0 AMB  10-2:384      0 AMB  10-1:384    3.50    (#    384:10  Double Ambig)
 &rst
  ixpk= 384, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 970, 971, 972, 762, 763, 758, 759, 760,
 igr2= 976, 771,
 &end
#
#   16 LEU  HG           48 ALA  HN          4.50    (#    385:10  Unique    4.23, 4.37 A)
 &rst
  ixpk= 385, nxpk= 10, iat= 248, 771, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   62 LYS  HB+          62 LYS  HN          3.50    (#    386:10  Unique    2.15, 2.48 A)
 &rst
  ixpk= 386, nxpk= 10, iat=  -1, 976, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 980, 981,
 &end
#
#    0 AMB  10-2:387     27 MET  HN          2.80    (#    387:10  Single Ambig)
 &rst
  ixpk= 387, nxpk= 10, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 415, 416, 415, 416,
 &end
#
#    0 AMB  10-2:388     27 MET  HN          3.50    (#    388:10  Single Ambig)
 &rst
  ixpk= 388, nxpk= 10, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 418, 419, 418, 419,
 &end
#
#   13 LEU  HB-          16 LEU  HN          5.50    (#    389:10  Unique    5.37, 6.25 A)
 &rst
  ixpk= 389, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 198, 199,
 &end
#
#   16 LEU  HB+          16 LEU  HN          3.50    (#    390:10  Unique    2.58, 3.16 A)
 &rst
  ixpk= 390, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 245, 246,
 &end
#
#   16 LEU  MDX          16 LEU  HN          3.50    (#    391:10  Unique    3.29, 4.28 A)
 &rst
  ixpk= 391, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 250, 251, 252, 254, 255, 256,
 &end
#
#   16 LEU  HG           16 LEU  HN          3.50    (#    392:10  Unique    2.18, 2.23 A)
 &rst
  ixpk= 392, nxpk= 10, iat= 248, 241, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   63 GLU  HG+          63 GLU  HN          3.50    (#    393:10  Unique    2.23, 2.98 A)
 &rst
  ixpk= 393, nxpk= 10, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1005,1006,
 &end
#
#   63 GLU  HG-          63 GLU  HN          3.50    (#    394:10  Unique    2.23, 2.98 A)
 &rst
  ixpk= 394, nxpk= 10, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1005,1006,
 &end
#
#    0 AMB  10-2:395     63 GLU  HN          2.80    (#    395:10  Single Ambig)
 &rst
  ixpk= 395, nxpk= 10, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1002,1003, 980, 981,
 &end
#
#    0 AMB  10-2:396     63 GLU  HN          4.50    (#    396:10  Single Ambig)
 &rst
  ixpk= 396, nxpk= 10, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1017,1018,1019, 960, 961, 962,
 &end
#
#   62 LYS  HD-          63 GLU  HN          4.50    (#    397:10  Unique    2.74, 4.47 A)
 &rst
  ixpk= 397, nxpk= 10, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 986, 987,
 &end
#
#   62 LYS  HD+          63 GLU  HN          4.50    (#    398:10  Unique    2.74, 4.47 A)
 &rst
  ixpk= 398, nxpk= 10, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 986, 987,
 &end
#
#   15 ASN  HB-          15 ASN  HD2+        3.50    (#    399:10  Unique    2.21, 3.26 A)
 &rst
  ixpk= 399, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 231, 232,
 igr2= 236, 237,
 &end
#
#   75 ALA  MB           15 ASN  HD2+        4.50    (#    400:10  Unique    3.01, 4.42 A)
 &rst
  ixpk= 400, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1190,1191,1192,
 igr2= 236, 237,
 &end
#
#    0 AMB  10-2:401     54 THR  HN          3.50    (#    401:10  Single Ambig)
 &rst
  ixpk= 401, nxpk= 10, iat=  -1, 866, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 921, 922, 921, 922,
 &end
#
#   53 THR  MG2          54 THR  HN          4.50    (#    402:10  Unique    3.24, 4.05 A)
 &rst
  ixpk= 402, nxpk= 10, iat=  -1, 866, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 858, 859, 860,
 &end
#
#   54 THR  MG2          54 THR  HN          3.50    (#    403:10  Unique    3.78, 4.35 A)
 &rst
  ixpk= 403, nxpk= 10, iat=  -1, 866, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 872, 873, 874,
 &end
#
#   69 LYS  HE+          69 LYS  HN          5.50    (#    404:10  Unique    4.78, 5.46 A)
 &rst
  ixpk= 404, nxpk= 10, iat=  -1,1086, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1099,1100,
 &end
#
#    0 AMB  10-2:405     32 PHE  HN          4.50    (#    405:10  Single Ambig)
 &rst
  ixpk= 405, nxpk= 10, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 488, 489, 488, 489,
 &end
#
#    0 AMB  10-2:406     10 ILE  HN          3.50    (#    406:10  Single Ambig)
 &rst
  ixpk= 406, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 126, 127, 126, 127,
 &end
#
#   66 GLN  HG-          66 GLN  HE2-        3.50    (#    407:10  Unique    2.19, 3.20 A)
 &rst
  ixpk= 407, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1049,1050,
 igr2=1054,1055,
 &end
#
#   66 GLN  HG+          66 GLN  HE2-        3.50    (#    408:10  Unique    2.19, 3.20 A)
 &rst
  ixpk= 408, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1049,1050,
 igr2=1054,1055,
 &end
#
#    0 AMB  10-2:409     36 LYS  HN          4.50    (#    409:10  Single Ambig)
 &rst
  ixpk= 409, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 543, 544, 836, 837, 836, 837,
 &end
#
#    0 AMB  10-2:410     54 THR  HN          3.50    (#    410:10  Single Ambig)
 &rst
  ixpk= 410, nxpk= 10, iat=  -1, 866, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 836, 837, 836, 837,
 &end
#
#   65 LEU  MDY          65 LEU  HN          3.50    (#    411:10  Unique    3.99, 4.79 A)
 &rst
  ixpk= 411, nxpk= 10, iat=  -1,1023, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1032,1033,1034,1036,1037,1038,
 &end
#
#   65 LEU  MDX          65 LEU  HN          4.50    (#    412:10  Unique    3.99, 4.79 A)
 &rst
  ixpk= 412, nxpk= 10, iat=  -1,1023, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1032,1033,1034,1036,1037,1038,
 &end
#
#    0 AMB  10-2:413     29 PHE  HN          5.50    (#    413:10  Single Ambig)
 &rst
  ixpk= 413, nxpk= 10, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1032,1033,1034,1036,1037,1038, 437, 438, 439, 441,
       442, 443,
 &end
#
#    0 AMB  10-2:414      0 AMB  10-1:414    4.50    (#    414:10  Double Ambig)
 &rst
  ixpk= 414, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=1032,1033,1034,1036,1037,1038, 437, 438, 439, 441,
       442, 443,
 igr2= 493, 494, 493, 494,
 &end
#
#   69 LYS  HB-          69 LYS  HN          3.50    (#    416:10  Unique    2.42, 3.05 A)
 &rst
  ixpk= 416, nxpk= 10, iat=  -1,1086, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1090,1091,
 &end
#
#   69 LYS  HG+          69 LYS  HN          4.50    (#    417:10  Unique    2.16, 3.13 A)
 &rst
  ixpk= 417, nxpk= 10, iat=  -1,1086, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1093,1094,
 &end
#
#    0 AMB  10-2:418     74 HIS  HN          4.50    (#    418:10  Single Ambig)
 &rst
  ixpk= 418, nxpk= 10, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1161,1162,1163,1093,1094,
 &end
#
#   56 LEU  MDX          56 LEU  HN          4.50    (#    419:10  Unique    2.51, 3.93 A)
 &rst
  ixpk= 419, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 904, 905, 906, 908, 909, 910,
 &end
#
#    0 AMB  10-2:420     56 LEU  HN          2.80    (#    420:10  Single Ambig)
 &rst
  ixpk= 420, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr1= 899, 900, 902, 884, 885, 884, 885,
 &end
#
#   56 LEU  HB-          56 LEU  HN          3.50    (#    421:10  Unique    2.28, 2.96 A)
 &rst
  ixpk= 421, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 899, 900,
 &end
#
#   54 THR  MG2          56 LEU  HN          4.50    (#    422:10  Unique    4.37, 4.91 A)
 &rst
  ixpk= 422, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 872, 873, 874,
 &end
#
#   31 GLN  HB+          32 PHE  HN          4.50    (#    423:10  Unique    3.38, 3.92 A)
 &rst
  ixpk= 423, nxpk= 10, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 485, 486,
 &end
#
#   61 ALA  MB           32 PHE  HN          5.50    (#    425:10  Unique    5.43, 6.42 A)
 &rst
  ixpk= 425, nxpk= 10, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 970, 971, 972,
 &end
#
#   10 ILE  HB           10 ILE  HN          3.50    (#    426:10  Unique    2.73, 2.89 A)
 &rst
  ixpk= 426, nxpk= 10, iat= 140, 136, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:427     10 ILE  HN          5.50    (#    427:10  Single Ambig)
 &rst
  ixpk= 427, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1330,1331,1330,1331,
 &end
#
#    0 AMB  10-2:428     10 ILE  HN          4.50    (#    428:10  Single Ambig)
 &rst
  ixpk= 428, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1=1292,1293,1294,1327,1328,1327,1328,
 &end
#
#   10 ILE  MG2          10 ILE  HN          4.50    (#    429:10  Unique    4.44, 4.81 A)
 &rst
  ixpk= 429, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 142, 143, 144,
 &end
#
#   44 ARG  HB+          44 ARG  HN          3.50    (#    431:10  Unique    2.27, 3.10 A)
 &rst
  ixpk= 431, nxpk= 10, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 703, 704,
 &end
#
#    0 AMB  10-2:432     44 ARG  HN          3.50    (#    432:10  Single Ambig)
 &rst
  ixpk= 432, nxpk= 10, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 661, 662, 663, 665, 666, 667, 661, 662, 663, 665,
       666, 667,
 &end
#
#   47 ILE  MD1          44 ARG  HN          4.50    (#    433:10  Unique    4.06, 5.09 A)
 &rst
  ixpk= 433, nxpk= 10, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 765, 766, 767,
 &end
#
#   44 ARG  HB-          44 ARG  HN          3.50    (#    434:10  Unique    2.27, 3.10 A)
 &rst
  ixpk= 434, nxpk= 10, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 703, 704,
 &end
#
#    0 AMB  10-2:435     44 ARG  HN          4.50    (#    435:10  Single Ambig)
 &rst
  ixpk= 435, nxpk= 10, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 706, 707, 706, 707,
 &end
#
#   64 ALA  MB           65 LEU  HN          2.80    (#    436:10  Unique    2.66, 3.49 A)
 &rst
  ixpk= 436, nxpk= 10, iat=  -1,1023, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1017,1018,1019,
 &end
#
#    7 PRO  HB-          59 ASN  HD2+        4.50    (#    437:10  Unique    4.99, 5.94 A)
 &rst
  ixpk= 437, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  98,  99,
 igr2= 951, 952,
 &end
#
#    0 AMB  10-2:438     65 LEU  HN          3.50    (#    438:10  Single Ambig)
 &rst
  ixpk= 438, nxpk= 10, iat=  -1,1023, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1027,1028,1027,1028,
 &end
#
#   65 LEU  HG           65 LEU  HN          3.50    (#    439:10  Unique    2.80, 2.84 A)
 &rst
  ixpk= 439, nxpk= 10, iat=1030,1023, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:440      0 AMB  10-1:440    3.50    (#    440:10  Double Ambig)
 &rst
  ixpk= 440, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 904, 905, 906, 908, 909, 910,1248,1249,1250,
 igr2= 951, 952,1023,
 &end
#
#   28 LEU  HB+          29 PHE  HN          4.50    (#    441:10  Unique    2.38, 2.88 A)
 &rst
  ixpk= 441, nxpk= 10, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 432, 433,
 &end
#
#   28 LEU  HB-          29 PHE  HN          4.50    (#    442:10  Unique    2.38, 2.88 A)
 &rst
  ixpk= 442, nxpk= 10, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 432, 433,
 &end
#
#   28 LEU  HG           29 PHE  HN          4.50    (#    443:10  Unique    4.50, 4.51 A)
 &rst
  ixpk= 443, nxpk= 10, iat= 435, 447, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   31 GLN  HB+          31 GLN  HE2+        5.50    (#    444:10  Unique    2.52, 3.61 A)
 &rst
  ixpk= 444, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 485, 486,
 igr2= 493, 494,
 &end
#
#   31 GLN  HB-          31 GLN  HE2+        5.50    (#    445:10  Unique    2.52, 3.61 A)
 &rst
  ixpk= 445, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 485, 486,
 igr2= 493, 494,
 &end
#
#   78 ILE  MG2          66 GLN  HE2-        5.50    (#    446:10  Unique    4.32, 5.62 A)
 &rst
  ixpk= 446, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1241,1242,1243,
 igr2=1054,1055,
 &end
#
#    0 AMB  10-2:447     66 GLN  HE2-        4.50    (#    447:10  Single Ambig)
 &rst
  ixpk= 447, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
 igr1=1239,1223,1224,1223,1224,1245,1246,
 igr2=1054,1055,
 &end
#
#    0 AMB  10-2:448     71 THR  HN          4.50    (#    448:10  Single Ambig)
 &rst
  ixpk= 448, nxpk= 10, iat=  -1,1127, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1090,1091,1118,1119,
 &end
#
#   70 ILE  HB           71 THR  HN          3.50    (#    449:10  Unique    2.50, 2.55 A)
 &rst
  ixpk= 449, nxpk= 10, iat=1112,1127, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:450     71 THR  HN          4.50    (#    450:10  Single Ambig)
 &rst
  ixpk= 450, nxpk= 10, iat=  -1,1127, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1090,1091,1096,1097,
 &end
#
#    0 AMB  10-2:451     71 THR  HN          4.50    (#    451:10  Single Ambig)
 &rst
  ixpk= 451, nxpk= 10, iat=  -1,1127, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1093,1094,1190,1191,1192,
 &end
#
#   70 ILE  MD1          71 THR  HN          4.50    (#    452:10  Unique    4.56, 5.38 A)
 &rst
  ixpk= 452, nxpk= 10, iat=  -1,1127, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1121,1122,1123,
 &end
#
#   74 HIS  HB+          74 HIS  HN          4.50    (#    453:10  Unique    2.68, 3.25 A)
 &rst
  ixpk= 453, nxpk= 10, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1173,1174,
 &end
#
#   74 HIS  HB-          74 HIS  HN          3.50    (#    454:10  Unique    2.68, 3.25 A)
 &rst
  ixpk= 454, nxpk= 10, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1173,1174,
 &end
#
#    0 AMB  10-2:455     56 LEU  HN          4.50    (#    455:10  Single Ambig)
 &rst
  ixpk= 455, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 921, 922, 921, 922,
 &end
#
#   55 GLU  HG+          56 LEU  HN          4.50    (#    456:10  Unique    4.09, 4.81 A)
 &rst
  ixpk= 456, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 887, 888,
 &end
#
#   41 VAL  HB           44 ARG  HN          4.50    (#    457:10  Unique    2.62, 3.31 A)
 &rst
  ixpk= 457, nxpk= 10, iat= 659, 699, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   45 HIS  HB+          44 ARG  HN          5.50    (#    458:10  Unique    4.52, 5.96 A)
 &rst
  ixpk= 458, nxpk= 10, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 727, 728,
 &end
#
#   43 ASN  HB-          44 ARG  HN          4.50    (#    459:10  Unique    2.73, 3.89 A)
 &rst
  ixpk= 459, nxpk= 10, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 689, 690,
 &end
#
#    0 AMB  10-2:460      0 AMB  10-1:460    3.50    (#    460:10  Double Ambig)
 &rst
  ixpk= 460, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 946, 947, 946, 947,
 igr2= 951, 952, 951, 952,
 &end
#
#   66 GLN  HB-          65 LEU  HN          5.50    (#    461:10  Unique    4.35, 5.11 A)
 &rst
  ixpk= 461, nxpk= 10, iat=  -1,1023, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1046,1047,
 &end
#
#   29 PHE  HB-          29 PHE  HN          3.50    (#    462:10  Unique    2.35, 3.00 A)
 &rst
  ixpk= 462, nxpk= 10, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 451, 452,
 &end
#
#   29 PHE  HB+          29 PHE  HN          4.50    (#    463:10  Unique    2.35, 3.00 A)
 &rst
  ixpk= 463, nxpk= 10, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 451, 452,
 &end
#
#   76 MET  ME           29 PHE  HN          5.50    (#    464:10  Unique    5.46, 6.64 A)
 &rst
  ixpk= 464, nxpk= 10, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1207,1208,1209,
 &end
#
#    0 AMB  10-2:465      0 AMB  10-1:465    3.50    (#    465:10  Double Ambig)
 &rst
  ixpk= 465, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 488, 489, 488, 489,
 igr2= 493, 494, 493, 494,
 &end
#
#   74 HIS  HB-          71 THR  HN          4.50    (#    466:10  Unique    2.47, 3.72 A)
 &rst
  ixpk= 466, nxpk= 10, iat=  -1,1127, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1173,1174,
 &end
#
#   74 HIS  HB+          71 THR  HN          5.50    (#    467:10  Unique    2.47, 3.72 A)
 &rst
  ixpk= 467, nxpk= 10, iat=  -1,1127, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1173,1174,
 &end
#
#   68 PHE  HB+          69 LYS  HN          5.50    (#    468:10  Unique    4.33, 4.38 A)
 &rst
  ixpk= 468, nxpk= 10, iat=  -1,1086, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1070,1071,
 &end
#
#    0 AMB  10-2:469     32 PHE  HN          3.50    (#    469:10  Single Ambig)
 &rst
  ixpk= 469, nxpk= 10, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 502, 503, 543, 544,
 &end
#
#   73 THR  MG2          73 THR  HN          4.50    (#    470:10  Unique    2.39, 3.41 A)
 &rst
  ixpk= 470, nxpk= 10, iat=  -1,1155, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1161,1162,1163,
 &end
#
#    0 AMB  10-2:471     35 PHE  HN          3.50    (#    471:10  Single Ambig)
 &rst
  ixpk= 471, nxpk= 10, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 543, 544, 502, 503,
 &end
#
#   57 GLN  HB-          57 GLN  HN          4.50    (#    473:10  Unique    2.43, 3.04 A)
 &rst
  ixpk= 473, nxpk= 10, iat=  -1, 914, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 918, 919,
 &end
#
#    0 AMB  10-2:474     57 GLN  HN          3.50    (#    474:10  Single Ambig)
 &rst
  ixpk= 474, nxpk= 10, iat=  -1, 914, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 921, 922, 921, 922,
 &end
#
#   56 LEU  HB+          57 GLN  HN          3.50    (#    475:10  Unique    2.80, 3.25 A)
 &rst
  ixpk= 475, nxpk= 10, iat=  -1, 914, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 899, 900,
 &end
#
#   56 LEU  HB-          57 GLN  HN          4.50    (#    476:10  Unique    2.80, 3.25 A)
 &rst
  ixpk= 476, nxpk= 10, iat=  -1, 914, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 899, 900,
 &end
#
#   54 THR  MG2          57 GLN  HN          4.50    (#    477:10  Unique    5.20, 5.45 A)
 &rst
  ixpk= 477, nxpk= 10, iat=  -1, 914, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 872, 873, 874,
 &end
#
#    0 AMB  10-2:478     60 ALA  HN          3.50    (#    478:10  Single Ambig)
 &rst
  ixpk= 478, nxpk= 10, iat=  -1, 956, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 946, 947, 946, 947,
 &end
#
#   60 ALA  MB           60 ALA  HN          2.80    (#    479:10  Unique    2.54, 2.91 A)
 &rst
  ixpk= 479, nxpk= 10, iat=  -1, 956, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 960, 961, 962,
 &end
#
#    0 AMB  10-2:480     60 ALA  HN          5.50    (#    480:10  Single Ambig)
 &rst
  ixpk= 480, nxpk= 10, iat=  -1, 956, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 904, 905, 906, 908, 909, 910, 164, 165, 166, 168,
       169, 170,
 &end
#
#   19 GLU  HB-          20 THR  HN          4.50    (#    481:10  Unique    3.29, 3.98 A)
 &rst
  ixpk= 481, nxpk= 10, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 293, 294,
 &end
#
#   16 LEU  HB+          20 THR  HN          4.50    (#    482:10  Unique    4.47, 4.75 A)
 &rst
  ixpk= 482, nxpk= 10, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 245, 246,
 &end
#
#   19 GLU  HB+          20 THR  HN          4.50    (#    483:10  Unique    3.29, 3.98 A)
 &rst
  ixpk= 483, nxpk= 10, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 293, 294,
 &end
#
#    0 AMB  10-2:484     20 THR  HN          4.50    (#    484:10  Single Ambig)
 &rst
  ixpk= 484, nxpk= 10, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 267, 268,1114,1115,1116,
 &end
#
#    0 AMB  10-2:485     25 LEU  HN          5.50    (#    485:10  Single Ambig)
 &rst
  ixpk= 485, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 371, 372, 354, 355,
 &end
#
#   24 MET  HB+          25 LEU  HN          3.50    (#    486:10  Unique    2.37, 2.97 A)
 &rst
  ixpk= 486, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 368, 369,
 &end
#
#   24 MET  HB-          25 LEU  HN          2.80    (#    487:10  Unique    2.37, 2.97 A)
 &rst
  ixpk= 487, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 368, 369,
 &end
#
#   25 LEU  MDY          25 LEU  HN          3.50    (#    488:10  Unique    3.03, 4.32 A)
 &rst
  ixpk= 488, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 390, 391, 392, 394, 395, 396,
 &end
#
#   25 LEU  HB-          25 LEU  HN          4.50    (#    489:10  Unique    2.44, 3.07 A)
 &rst
  ixpk= 489, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 385, 386,
 &end
#
#    0 AMB  10-2:490     25 LEU  HN          4.50    (#    490:10  Single Ambig)
 &rst
  ixpk= 490, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 602, 603, 604, 606, 607, 608, 432, 433,
 &end
#
#   25 LEU  MDX          25 LEU  HN          3.50    (#    491:10  Unique    3.03, 4.32 A)
 &rst
  ixpk= 491, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 390, 391, 392, 394, 395, 396,
 &end
#
#   25 LEU  HG           25 LEU  HN          3.50    (#    492:10  Unique    2.35, 2.41 A)
 &rst
  ixpk= 492, nxpk= 10, iat= 388, 381, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   38 VAL  MGX          25 LEU  HN          5.50    (#    493:10  Unique    4.00, 5.45 A)
 &rst
  ixpk= 493, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 602, 603, 604, 606, 607, 608,
 &end
#
#    0 AMB  10-2:494      0 AMB  10-1:494    2.80    (#    494:10  Double Ambig)
 &rst
  ixpk= 494, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 689, 690, 689, 690,
 igr2= 694, 695, 694, 695,
 &end
#
#    5 GLN  HG+           5 GLN  HE2+        3.50    (#    495:10  Unique    2.34, 3.38 A)
 &rst
  ixpk= 495, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  67,  68,
 igr2=  72,  73,
 &end
#
#    5 GLN  HG-           5 GLN  HE2+        3.50    (#    496:10  Unique    2.34, 3.38 A)
 &rst
  ixpk= 496, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  67,  68,
 igr2=  72,  73,
 &end
#
#    5 GLN  HB+           5 GLN  HE2+        4.50    (#    497:10  Unique    3.68, 4.47 A)
 &rst
  ixpk= 497, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  64,  65,
 igr2=  72,  73,
 &end
#
#    0 AMB  10-2:498      0 AMB  10-1:498    4.50    (#    498:10  Double Ambig)
 &rst
  ixpk= 498, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1308,1309,1308,1309,
 igr2=  72,  73,  72,  73,
 &end
#
#   21 ASN  HB+          21 ASN  HD2+        3.50    (#    499:10  Unique    2.24, 3.30 A)
 &rst
  ixpk= 499, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 322, 323,
 igr2= 327, 328,
 &end
#
#   21 ASN  HB-          21 ASN  HD2+        3.50    (#    500:10  Unique    2.24, 3.30 A)
 &rst
  ixpk= 500, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 322, 323,
 igr2= 327, 328,
 &end
#
#    2 GLN  HG+           2 GLN  HE2+        3.50    (#    501:10  Unique    2.23, 3.44 A)
 &rst
  ixpk= 501, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  21,  22,
 igr2=  26,  27,
 &end
#
#    0 AMB  10-2:502      0 AMB  10-1:502    4.50    (#    502:10  Double Ambig)
 &rst
  ixpk= 502, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.39, r4= 8.89,
 igr1=1220,1221,1220,1221,1260,1261,1262,
 igr2=  26,  27,  26,  27,  26,  27,
 &end
#
#    0 AMB  10-2:503      0 AMB  10-1:503    4.50    (#    503:10  Double Ambig)
 &rst
  ixpk= 503, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 109, 110,1272,1273,
 igr2= 114, 115, 114, 115,
 &end
#
#    8 ASN  HB-           8 ASN  HD2+        3.50    (#    504:10  Unique    2.24, 3.20 A)
 &rst
  ixpk= 504, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 109, 110,
 igr2= 114, 115,
 &end
#
#   82 LYS  HG+           8 ASN  HD2+        5.50    (#    505:10  Unique    5.38, 6.86 A)
 &rst
  ixpk= 505, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1305,1306,
 igr2= 114, 115,
 &end
#
#    0 AMB  10-2:506      0 AMB  10-1:506    4.50    (#    506:10  Double Ambig)
 &rst
  ixpk= 506, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1330,1331,1330,1331,
 igr2= 114, 115, 114, 115,
 &end
#
#    0 AMB  10-2:507      0 AMB  10-1:507    3.50    (#    507:10  Double Ambig)
 &rst
  ixpk= 507, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr1=1327,1328,1327,1328,1292,1293,1294,
 igr2= 114, 115, 114, 115, 114, 115,
 &end
#
#    0 AMB  10-2:508      0 AMB  10-1:508    3.50    (#    508:10  Double Ambig)
 &rst
  ixpk= 508, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 126, 127, 126, 127,
 igr2= 131, 132, 131, 132,
 &end
#
#    9 GLN  HB+           9 GLN  HE2+        4.50    (#    509:10  Unique    2.29, 3.40 A)
 &rst
  ixpk= 509, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 123, 124,
 igr2= 131, 132,
 &end
#
#    9 GLN  HB-           9 GLN  HE2+        4.50    (#    510:10  Unique    2.29, 3.40 A)
 &rst
  ixpk= 510, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 123, 124,
 igr2= 131, 132,
 &end
#
#    0 AMB  10-2:511      0 AMB  10-1:511    5.50    (#    511:10  Double Ambig)
 &rst
  ixpk= 511, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 149, 150, 151, 146, 147,
 igr2= 131, 132, 131, 132,
 &end
#
#   66 GLN  HB-          66 GLN  HN          3.50    (#    512:10  Unique    2.15, 2.84 A)
 &rst
  ixpk= 512, nxpk= 10, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1046,1047,
 &end
#
#   66 GLN  HB+          66 GLN  HN          2.80    (#    513:10  Unique    2.15, 2.84 A)
 &rst
  ixpk= 513, nxpk= 10, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1046,1047,
 &end
#
#   66 GLN  HG+          66 GLN  HN          4.50    (#    514:10  Unique    2.78, 3.61 A)
 &rst
  ixpk= 514, nxpk= 10, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1049,1050,
 &end
#
#   21 ASN  HB+          21 ASN  HN          4.50    (#    515:10  Unique    2.82, 3.26 A)
 &rst
  ixpk= 515, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 322, 323,
 &end
#
#   21 ASN  HB-          21 ASN  HN          4.50    (#    516:10  Unique    2.82, 3.26 A)
 &rst
  ixpk= 516, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 322, 323,
 &end
#
#   24 MET  HG-          21 ASN  HN          4.50    (#    517:10  Unique    2.44, 3.21 A)
 &rst
  ixpk= 517, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 371, 372,
 &end
#
#   24 MET  HB+          21 ASN  HN          3.50    (#    518:10  Unique    2.21, 3.16 A)
 &rst
  ixpk= 518, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 368, 369,
 &end
#
#    0 AMB  10-2:519     21 ASN  HN          5.50    (#    519:10  Single Ambig)
 &rst
  ixpk= 519, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 351, 352, 336, 337,
 &end
#
#   24 MET  HG+          21 ASN  HN          4.50    (#    520:10  Unique    2.44, 3.21 A)
 &rst
  ixpk= 520, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 371, 372,
 &end
#
#   61 ALA  HA           64 ALA  HN          5.50    (#    521:10  Unique    3.30, 3.35 A)
 &rst
  ixpk= 521, nxpk= 10, iat= 968,1013, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   63 GLU  HG+          64 ALA  HN          5.50    (#    522:10  Unique    2.81, 4.73 A)
 &rst
  ixpk= 522, nxpk= 10, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1005,1006,
 &end
#
#   63 GLU  HB-          64 ALA  HN          3.50    (#    523:10  Unique    2.72, 3.30 A)
 &rst
  ixpk= 523, nxpk= 10, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1002,1003,
 &end
#
#   63 GLU  HB+          64 ALA  HN          3.50    (#    524:10  Unique    2.72, 3.30 A)
 &rst
  ixpk= 524, nxpk= 10, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1002,1003,
 &end
#
#   63 GLU  HG-          64 ALA  HN          5.50    (#    525:10  Unique    2.81, 4.73 A)
 &rst
  ixpk= 525, nxpk= 10, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1005,1006,
 &end
#
#   30 ASN  HB+          30 ASN  HD2-        4.50    (#    526:10  Unique    2.24, 3.33 A)
 &rst
  ixpk= 526, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 471, 472,
 igr2= 476, 477,
 &end
#
#   30 ASN  HB-          30 ASN  HD2-        4.50    (#    527:10  Unique    2.24, 3.33 A)
 &rst
  ixpk= 527, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 471, 472,
 igr2= 476, 477,
 &end
#
#    0 AMB  10-2:528      0 AMB  10-1:528    3.50    (#    528:10  Double Ambig)
 &rst
  ixpk= 528, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 921, 922, 921, 922,
 igr2= 926, 927, 926, 927,
 &end
#
#   39 ARG  HD-          39 ARG  HE          5.50    (#    529:10  Unique    2.24, 2.65 A)
 &rst
  ixpk= 529, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 622, 623,
 &end
#
#   39 ARG  HD+          39 ARG  HE          4.50    (#    530:10  Unique    2.24, 2.65 A)
 &rst
  ixpk= 530, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 622, 623,
 &end
#
#   39 ARG  HB-          39 ARG  HE          4.50    (#    531:10  Unique    2.61, 4.10 A)
 &rst
  ixpk= 531, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 616, 617,
 &end
#
#   78 ILE  MD1          66 GLN  HN          3.50    (#    532:10  Unique    2.83, 3.76 A)
 &rst
  ixpk= 532, nxpk= 10, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1248,1249,1250,
 &end
#
#   70 ILE  MG2          21 ASN  HN          5.50    (#    533:10  Unique    5.53, 6.25 A)
 &rst
  ixpk= 533, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1114,1115,1116,
 &end
#
#   40 LEU  MDX          21 ASN  HN          5.50    (#    534:10  Unique    3.62, 5.46 A)
 &rst
  ixpk= 534, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 645, 646, 647, 649, 650, 651,
 &end
#
#    0 AMB  10-2:535     21 ASN  HN          4.50    (#    535:10  Single Ambig)
 &rst
  ixpk= 535, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 645, 646, 647, 649, 650, 651, 390, 391, 392, 394,
       395, 396,
 &end
#
#   25 LEU  HG           21 ASN  HN          5.50    (#    536:10  Unique    3.73, 3.87 A)
 &rst
  ixpk= 536, nxpk= 10, iat= 388, 318, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   78 ILE  MG2          66 GLN  HN          5.50    (#    537:10  Unique    5.05, 6.26 A)
 &rst
  ixpk= 537, nxpk= 10, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1241,1242,1243,
 &end
#
#   65 LEU  MDY          66 GLN  HN          5.50    (#    538:10  Unique    5.30, 6.29 A)
 &rst
  ixpk= 538, nxpk= 10, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1032,1033,1034,1036,1037,1038,
 &end
#
#    7 PRO  HB-           8 ASN  HN          5.50    (#    539:10  Unique    3.18, 3.58 A)
 &rst
  ixpk= 539, nxpk= 10, iat=  -1, 105, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  98,  99,
 &end
#
#    7 PRO  HA            8 ASN  HN          3.50    (#    540:10  Unique    2.20, 2.24 A)
 &rst
  ixpk= 540, nxpk= 10, iat= 101, 105, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:541     37 GLU  HN          2.80    (#    541:10  Single Ambig)
 &rst
  ixpk= 541, nxpk= 10, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 821, 822, 821, 822, 585, 586,
 &end
#
#    0 AMB  10-2:542     37 GLU  HN          4.50    (#    542:10  Single Ambig)
 &rst
  ixpk= 542, nxpk= 10, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 824, 825, 600,
 &end
#
#   36 LYS  HD+          37 GLU  HN          5.50    (#    543:10  Unique    4.81, 5.98 A)
 &rst
  ixpk= 543, nxpk= 10, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 569, 570,
 &end
#
#   36 LYS  HB+          37 GLU  HN          3.50    (#    544:10  Unique    2.42, 3.14 A)
 &rst
  ixpk= 544, nxpk= 10, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 563, 564,
 &end
#
#   36 LYS  HB-          37 GLU  HN          3.50    (#    545:10  Unique    2.42, 3.14 A)
 &rst
  ixpk= 545, nxpk= 10, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 563, 564,
 &end
#
#   30 ASN  HB-          30 ASN  HD2+        4.50    (#    546:10  Unique    2.24, 3.33 A)
 &rst
  ixpk= 546, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 471, 472,
 igr2= 476, 477,
 &end
#
#    0 AMB  10-2:547      8 ASN  HN          5.50    (#    547:10  Single Ambig)
 &rst
  ixpk= 547, nxpk= 10, iat=  -1, 105, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 109, 110, 946, 947,
 &end
#
#    0 AMB  10-2:548      8 ASN  HN          4.50    (#    548:10  Single Ambig)
 &rst
  ixpk= 548, nxpk= 10, iat=  -1, 105, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 109, 110,1272,1273,
 &end
#
#    0 AMB  10-2:549     37 GLU  HN          5.50    (#    549:10  Single Ambig)
 &rst
  ixpk= 549, nxpk= 10, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 572, 573, 572, 573,
 &end
#
#   30 ASN  HB+          30 ASN  HD2+        4.50    (#    551:10  Unique    2.24, 3.33 A)
 &rst
  ixpk= 551, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 471, 472,
 igr2= 476, 477,
 &end
#
#    0 AMB  10-2:553     61 ALA  HN          5.50    (#    553:10  Single Ambig)
 &rst
  ixpk= 553, nxpk= 10, iat=  -1, 966, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 980, 981,1002,1003,
 &end
#
#   61 ALA  MB           61 ALA  HN          2.80    (#    554:10  Unique    2.48, 2.89 A)
 &rst
  ixpk= 554, nxpk= 10, iat=  -1, 966, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 970, 971, 972,
 &end
#
#   58 SER  HA           61 ALA  HN          4.50    (#    555:10  Unique    3.29, 3.42 A)
 &rst
  ixpk= 555, nxpk= 10, iat= 933, 966, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   61 ALA  HA           61 ALA  HN          3.50    (#    556:10  Unique    2.85, 2.86 A)
 &rst
  ixpk= 556, nxpk= 10, iat= 968, 966, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   60 ALA  MB           61 ALA  HN          3.50    (#    557:10  Unique    2.64, 3.46 A)
 &rst
  ixpk= 557, nxpk= 10, iat=  -1, 966, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 960, 961, 962,
 &end
#
#    0 AMB  10-2:558     28 LEU  HN          4.50    (#    558:10  Single Ambig)
 &rst
  ixpk= 558, nxpk= 10, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 418, 419, 418, 419,
 &end
#
#   29 PHE  HB-          28 LEU  HN          5.50    (#    559:10  Unique    4.77, 5.62 A)
 &rst
  ixpk= 559, nxpk= 10, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 451, 452,
 &end
#
#    0 AMB  10-2:560     28 LEU  HN          4.50    (#    560:10  Single Ambig)
 &rst
  ixpk= 560, nxpk= 10, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 422, 423, 424, 368, 369,
 &end
#
#   28 LEU  HB-          28 LEU  HN          3.50    (#    561:10  Unique    2.35, 3.01 A)
 &rst
  ixpk= 561, nxpk= 10, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 432, 433,
 &end
#
#   28 LEU  HG           28 LEU  HN          3.50    (#    562:10  Unique    2.53, 2.59 A)
 &rst
  ixpk= 562, nxpk= 10, iat= 435, 428, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   28 LEU  HB+          28 LEU  HN          3.50    (#    563:10  Unique    2.35, 3.01 A)
 &rst
  ixpk= 563, nxpk= 10, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 432, 433,
 &end
#
#   25 LEU  MDX          28 LEU  HN          5.50    (#    564:10  Unique    4.86, 6.65 A)
 &rst
  ixpk= 564, nxpk= 10, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 390, 391, 392, 394, 395, 396,
 &end
#
#   28 LEU  MDY          28 LEU  HN          4.50    (#    565:10  Unique    3.89, 4.58 A)
 &rst
  ixpk= 565, nxpk= 10, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 437, 438, 439, 441, 442, 443,
 &end
#
#   28 LEU  MDX          28 LEU  HN          3.50    (#    566:10  Unique    3.89, 4.58 A)
 &rst
  ixpk= 566, nxpk= 10, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 437, 438, 439, 441, 442, 443,
 &end
#
#   63 GLU  HG+          59 ASN  HD2-        4.50    (#    568:10  Unique    3.04, 4.31 A)
 &rst
  ixpk= 568, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1005,1006,
 igr2= 951, 952,
 &end
#
#   63 GLU  HG-          59 ASN  HD2-        5.50    (#    569:10  Unique    3.04, 4.31 A)
 &rst
  ixpk= 569, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1005,1006,
 igr2= 951, 952,
 &end
#
#    0 AMB  10-2:570     59 ASN  HD2-        3.50    (#    570:10  Single Ambig)
 &rst
  ixpk= 570, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 946, 947, 946, 947,
 igr2= 951, 952,
 &end
#
#    0 AMB  10-2:571     59 ASN  HD2-        5.50    (#    571:10  Single Ambig)
 &rst
  ixpk= 571, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 960, 961, 962,  98,  99,
 igr2= 951, 952,
 &end
#
#    0 AMB  10-2:572     31 GLN  HN          5.50    (#    572:10  Single Ambig)
 &rst
  ixpk= 572, nxpk= 10, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 502, 503, 543, 544,
 &end
#
#   31 GLN  HB-          31 GLN  HN          3.50    (#    573:10  Unique    2.33, 2.96 A)
 &rst
  ixpk= 573, nxpk= 10, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 485, 486,
 &end
#
#   30 ASN  HB+          31 GLN  HN          5.50    (#    574:10  Unique    3.12, 3.87 A)
 &rst
  ixpk= 574, nxpk= 10, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 471, 472,
 &end
#
#   30 ASN  HB-          31 GLN  HN          4.50    (#    575:10  Unique    3.12, 3.87 A)
 &rst
  ixpk= 575, nxpk= 10, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 471, 472,
 &end
#
#    0 AMB  10-2:576     31 GLN  HN          3.50    (#    576:10  Single Ambig)
 &rst
  ixpk= 576, nxpk= 10, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 488, 489, 488, 489,
 &end
#
#   31 GLN  HB+          31 GLN  HN          3.50    (#    577:10  Unique    2.33, 2.96 A)
 &rst
  ixpk= 577, nxpk= 10, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 485, 486,
 &end
#
#   41 VAL  HB           43 ASN  HD2-        5.50    (#    578:10  Unique    5.38, 6.90 A)
 &rst
  ixpk= 578, nxpk= 10, iat= 659,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 694, 695,
 &end
#
#    0 AMB  10-2:580     43 ASN  HD2-        3.50    (#    580:10  Single Ambig)
 &rst
  ixpk= 580, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 689, 690, 689, 690,
 igr2= 694, 695,
 &end
#
#   42 PRO  HB-          43 ASN  HD2-        5.50    (#    581:10  Unique    3.85, 7.99 A)
 &rst
  ixpk= 581, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 678, 679,
 igr2= 694, 695,
 &end
#
#    5 GLN  HB+           5 GLN  HE2-        4.50    (#    582:10  Unique    3.68, 4.47 A)
 &rst
  ixpk= 582, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  64,  65,
 igr2=  72,  73,
 &end
#
#    5 GLN  HG+           5 GLN  HE2-        3.50    (#    583:10  Unique    2.34, 3.38 A)
 &rst
  ixpk= 583, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  67,  68,
 igr2=  72,  73,
 &end
#
#    5 GLN  HG-           5 GLN  HE2-        4.50    (#    584:10  Unique    2.34, 3.38 A)
 &rst
  ixpk= 584, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  67,  68,
 igr2=  72,  73,
 &end
#
#    0 AMB  10-2:585      5 GLN  HE2-        4.50    (#    585:10  Single Ambig)
 &rst
  ixpk= 585, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1308,1309,1308,1309,
 igr2=  72,  73,
 &end
#
#   21 ASN  HB+          21 ASN  HD2-        4.50    (#    587:10  Unique    2.24, 3.30 A)
 &rst
  ixpk= 587, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 322, 323,
 igr2= 327, 328,
 &end
#
#   21 ASN  HB-          21 ASN  HD2-        3.50    (#    588:10  Unique    2.24, 3.30 A)
 &rst
  ixpk= 588, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 322, 323,
 igr2= 327, 328,
 &end
#
#    2 GLN  HG+           2 GLN  HE2-        4.50    (#    589:10  Unique    2.23, 3.44 A)
 &rst
  ixpk= 589, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  21,  22,
 igr2=  26,  27,
 &end
#
#    8 ASN  HB-           8 ASN  HD2-        4.50    (#    590:10  Unique    2.24, 3.20 A)
 &rst
  ixpk= 590, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 109, 110,
 igr2= 114, 115,
 &end
#
#   10 ILE  MD1           8 ASN  HD2-        4.50    (#    591:10  Unique    2.92, 5.14 A)
 &rst
  ixpk= 591, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 149, 150, 151,
 igr2= 114, 115,
 &end
#
#    0 AMB  10-2:592      8 ASN  HD2-        4.50    (#    592:10  Single Ambig)
 &rst
  ixpk= 592, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 109, 110,1272,1273,
 igr2= 114, 115,
 &end
#
#    0 AMB  10-2:593      8 ASN  HD2-        4.50    (#    593:10  Single Ambig)
 &rst
  ixpk= 593, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 140,1324,1325,1324,1325,
 igr2= 114, 115,
 &end
#
#    0 AMB  10-2:594      8 ASN  HD2-        3.50    (#    594:10  Single Ambig)
 &rst
  ixpk= 594, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1=1327,1328,1327,1328,1292,1293,1294,
 igr2= 114, 115,
 &end
#
#   10 ILE  MG2           8 ASN  HD2-        5.50    (#    595:10  Unique    3.91, 5.08 A)
 &rst
  ixpk= 595, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 142, 143, 144,
 igr2= 114, 115,
 &end
#
#   82 LYS  HG+           8 ASN  HD2-        5.50    (#    596:10  Unique    5.38, 6.86 A)
 &rst
  ixpk= 596, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1305,1306,
 igr2= 114, 115,
 &end
#
#    0 AMB  10-2:597      2 GLN  HE2-        4.50    (#    597:10  Single Ambig)
 &rst
  ixpk= 597, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
 igr1=1220,1221,1220,1221,1260,1261,1262,
 igr2=  26,  27,
 &end
#
#   14 THR  MG2           2 GLN  HE2-        5.50    (#    598:10  Unique    2.07, 4.92 A)
 &rst
  ixpk= 598, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 219, 220, 221,
 igr2=  26,  27,
 &end
#
#    0 AMB  10-2:600      0 AMB  10-1:600    5.50    (#    600:10  Double Ambig)
 &rst
  ixpk= 600, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1223,1224,1223,1224, 485, 486,
 igr2=  26,  27, 493, 494,
 &end
#
#    0 AMB  10-2:601     31 GLN  HE2-        4.50    (#    601:10  Single Ambig)
 &rst
  ixpk= 601, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 488, 489, 488, 489,
 igr2= 493, 494,
 &end
#
#   31 GLN  HB+          31 GLN  HE2-        5.50    (#    602:10  Unique    2.52, 3.61 A)
 &rst
  ixpk= 602, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 485, 486,
 igr2= 493, 494,
 &end
#
#   28 LEU  MDY          31 GLN  HE2-        5.50    (#    603:10  Unique    3.32, 5.32 A)
 &rst
  ixpk= 603, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 437, 438, 439, 441, 442, 443,
 igr2= 493, 494,
 &end
#
#    0 AMB  10-2:604     31 GLN  HE2-        4.50    (#    604:10  Single Ambig)
 &rst
  ixpk= 604, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1032,1033,1034,1036,1037,1038, 437, 438, 439, 441,
       442, 443,
 igr2= 493, 494,
 &end
#
#    9 GLN  HB-           9 GLN  HE2-        5.50    (#    607:10  Unique    2.29, 3.40 A)
 &rst
  ixpk= 607, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 123, 124,
 igr2= 131, 132,
 &end
#
#    0 AMB  10-2:608      9 GLN  HE2-        3.50    (#    608:10  Single Ambig)
 &rst
  ixpk= 608, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 126, 127, 126, 127,
 igr2= 131, 132,
 &end
#
#    9 GLN  HB+           9 GLN  HE2-        5.50    (#    609:10  Unique    2.29, 3.40 A)
 &rst
  ixpk= 609, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 123, 124,
 igr2= 131, 132,
 &end
#
#    0 AMB  10-2:610      9 GLN  HE2-        5.50    (#    610:10  Single Ambig)
 &rst
  ixpk= 610, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 563, 564, 858, 859, 860,
 igr2= 131, 132,
 &end
#
#    0 AMB  10-2:611      9 GLN  HE2-        5.50    (#    611:10  Single Ambig)
 &rst
  ixpk= 611, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 149, 150, 151, 146, 147,
 igr2= 131, 132,
 &end
#
#   15 ASN  HB-          15 ASN  HD2-        4.50    (#    612:10  Unique    2.21, 3.26 A)
 &rst
  ixpk= 612, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 231, 232,
 igr2= 236, 237,
 &end
#
#   75 ALA  MB           15 ASN  HD2-        4.50    (#    613:10  Unique    3.01, 4.42 A)
 &rst
  ixpk= 613, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1190,1191,1192,
 igr2= 236, 237,
 &end
#
#   74 HIS  HB-          15 ASN  HD2-        5.50    (#    614:10  Unique    3.93, 4.95 A)
 &rst
  ixpk= 614, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1173,1174,
 igr2= 236, 237,
 &end
#
#   46 ASP  HB-          47 ILE  HN          5.50    (#    615:10  Unique    2.70, 4.17 A)
 &rst
  ixpk= 615, nxpk= 10, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 744, 745,
 &end
#
#   44 ARG  HB+          47 ILE  HN          4.50    (#    616:10  Unique    2.40, 3.78 A)
 &rst
  ixpk= 616, nxpk= 10, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 703, 704,
 &end
#
#   47 ILE  MD1          47 ILE  HN          3.50    (#    617:10  Unique    2.11, 3.46 A)
 &rst
  ixpk= 617, nxpk= 10, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 765, 766, 767,
 &end
#
#   44 ARG  HB-          47 ILE  HN          4.50    (#    618:10  Unique    2.40, 3.78 A)
 &rst
  ixpk= 618, nxpk= 10, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 703, 704,
 &end
#
#    0 AMB  10-2:619     47 ILE  HN          4.50    (#    619:10  Single Ambig)
 &rst
  ixpk= 619, nxpk= 10, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 706, 707, 706, 707, 245, 246,
 &end
#
#   47 ILE  HG1-         47 ILE  HN          3.50    (#    620:10  Unique    1.98, 3.59 A)
 &rst
  ixpk= 620, nxpk= 10, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 762, 763,
 &end
#
#    0 AMB  10-2:621     47 ILE  HN          4.50    (#    621:10  Single Ambig)
 &rst
  ixpk= 621, nxpk= 10, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 661, 662, 663, 665, 666, 667, 661, 662, 663, 665,
       666, 667,
 &end
#
#   53 THR  MG2          57 GLN  HE2-        5.50    (#    624:10  Unique    2.63, 3.92 A)
 &rst
  ixpk= 624, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 858, 859, 860,
 igr2= 926, 927,
 &end
#
#   33 PRO  HB-          57 GLN  HE2-        5.50    (#    625:10  Unique    4.17, 6.06 A)
 &rst
  ixpk= 625, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 525, 526,
 igr2= 926, 927,
 &end
#
#   54 THR  MG2          57 GLN  HE2-        4.50    (#    626:10  Unique    3.89, 5.28 A)
 &rst
  ixpk= 626, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 872, 873, 874,
 igr2= 926, 927,
 &end
#
#   60 ALA  HA           61 ALA  HN          4.50    (#    627:10  Unique    3.55, 3.55 A)
 &rst
  ixpk= 627, nxpk= 10, iat= 958, 966, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   25 LEU  HA           28 LEU  HN          4.50    (#    628:10  Unique    2.99, 3.16 A)
 &rst
  ixpk= 628, nxpk= 10, iat= 383, 428, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:629     28 LEU  HN          3.50    (#    629:10  Single Ambig)
 &rst
  ixpk= 629, nxpk= 10, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 430, 413, 366,
 &end
#
#   31 GLN  HA           31 GLN  HN          2.80    (#    630:10  Unique    2.82, 2.82 A)
 &rst
  ixpk= 630, nxpk= 10, iat= 483, 481, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:632      8 ASN  HD2-        4.50    (#    632:10  Single Ambig)
 &rst
  ixpk= 632, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1300,1322, 121,
 igr2= 114, 115,
 &end
#
#   28 LEU  HA           31 GLN  HE2-        4.50    (#    634:10  Unique    2.72, 3.39 A)
 &rst
  ixpk= 634, nxpk= 10, iat= 430,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 493, 494,
 &end
#
#   74 HIS  HA           15 ASN  HD2-        3.50    (#    636:10  Unique    2.61, 3.14 A)
 &rst
  ixpk= 636, nxpk= 10, iat=1171,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 236, 237,
 &end
#
#   15 ASN  HB+          15 ASN  HD2-        3.50    (#    637:10  Unique    2.21, 3.26 A)
 &rst
  ixpk= 637, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 231, 232,
 igr2= 236, 237,
 &end
#
#   47 ILE  HA           47 ILE  HN          4.50    (#    638:10  Unique    2.91, 2.93 A)
 &rst
  ixpk= 638, nxpk= 10, iat= 754, 752, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   53 THR  HB           57 GLN  HE2-        5.50    (#    640:10  Unique    2.53, 3.17 A)
 &rst
  ixpk= 640, nxpk= 10, iat= 856,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 926, 927,
 &end
#
#   50 VAL  HA           37 GLU  HN          5.50    (#    641:10  Unique    4.51, 4.54 A)
 &rst
  ixpk= 641, nxpk= 10, iat= 803, 581, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:642     37 GLU  HN          5.50    (#    642:10  Single Ambig)
 &rst
  ixpk= 642, nxpk= 10, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 834, 541,
 &end
#
#    0 AMB  10-2:643     37 GLU  HN          3.50    (#    643:10  Single Ambig)
 &rst
  ixpk= 643, nxpk= 10, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 583, 561,
 &end
#
#    0 AMB  10-2:644      0 AMB  10-1:644    4.50    (#    644:10  Double Ambig)
 &rst
  ixpk= 644, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 469, 413, 483,
 igr2= 476, 477, 476, 477, 476, 477,
 &end
#
#    0 AMB  10-2:648     73 THR  HN          5.50    (#    648:10  Single Ambig)
 &rst
  ixpk= 648, nxpk= 10, iat=  -1,1155, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1157,1159,
 &end
#
#   65 LEU  HA           66 GLN  HN          4.50    (#    649:10  Unique    3.35, 3.37 A)
 &rst
  ixpk= 649, nxpk= 10, iat=1025,1042, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   66 GLN  HA           66 GLN  HN          3.50    (#    650:10  Unique    2.83, 2.86 A)
 &rst
  ixpk= 650, nxpk= 10, iat=1044,1042, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   35 PHE  HA           35 PHE  HN          5.50    (#    651:10  Unique    2.88, 2.91 A)
 &rst
  ixpk= 651, nxpk= 10, iat= 541, 539, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   34 GLY  HA-          35 PHE  HN          4.50    (#    652:10  Unique    3.07, 3.34 A)
 &rst
  ixpk= 652, nxpk= 10, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 534, 535,
 &end
#
#   33 PRO  HA           35 PHE  HN          4.50    (#    653:10  Unique    4.02, 4.19 A)
 &rst
  ixpk= 653, nxpk= 10, iat= 528, 539, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:654     35 PHE  HN          4.50    (#    654:10  Single Ambig)
 &rst
  ixpk= 654, nxpk= 10, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 469, 519, 520,
 &end
#
#   32 PHE  HB+          35 PHE  HN          4.50    (#    655:10  Unique    2.91, 3.66 A)
 &rst
  ixpk= 655, nxpk= 10, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 502, 503,
 &end
#
#   21 ASN  HA           21 ASN  HN          3.50    (#    656:10  Unique    2.87, 2.90 A)
 &rst
  ixpk= 656, nxpk= 10, iat= 320, 318, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:657     21 ASN  HN          4.50    (#    657:10  Single Ambig)
 &rst
  ixpk= 657, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 308, 366,
 &end
#
#   20 THR  HA           21 ASN  HN          2.80    (#    658:10  Unique    2.25, 2.31 A)
 &rst
  ixpk= 658, nxpk= 10, iat= 306, 318, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   54 THR  HB           57 GLN  HN          5.50    (#    659:10  Unique    3.01, 3.10 A)
 &rst
  ixpk= 659, nxpk= 10, iat= 870, 914, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:660     57 GLN  HN          3.50    (#    660:10  Single Ambig)
 &rst
  ixpk= 660, nxpk= 10, iat=  -1, 914, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 897, 935, 936,
 &end
#
#   57 GLN  HA           57 GLN  HN          3.50    (#    661:10  Unique    2.89, 2.91 A)
 &rst
  ixpk= 661, nxpk= 10, iat= 916, 914, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   59 ASN  HA           60 ALA  HN          4.50    (#    663:10  Unique    3.56, 3.57 A)
 &rst
  ixpk= 663, nxpk= 10, iat= 944, 956, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   56 LEU  HA           60 ALA  HN          4.50    (#    664:10  Unique    3.87, 3.99 A)
 &rst
  ixpk= 664, nxpk= 10, iat= 897, 956, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   60 ALA  HA           60 ALA  HN          3.50    (#    665:10  Unique    2.84, 2.84 A)
 &rst
  ixpk= 665, nxpk= 10, iat= 958, 956, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   64 ALA  HA           64 ALA  HN          3.50    (#    666:10  Unique    2.83, 2.83 A)
 &rst
  ixpk= 666, nxpk= 10, iat=1015,1013, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   63 GLU  HA           64 ALA  HN          3.50    (#    667:10  Unique    3.52, 3.54 A)
 &rst
  ixpk= 667, nxpk= 10, iat=1000,1013, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   20 THR  HA           20 THR  HN          3.50    (#    668:10  Unique    2.85, 2.87 A)
 &rst
  ixpk= 668, nxpk= 10, iat= 306, 304, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:671     20 THR  HN          3.50    (#    671:10  Single Ambig)
 &rst
  ixpk= 671, nxpk= 10, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 308, 291,
 &end
#
#   18 GLU  HA           20 THR  HN          4.50    (#    672:10  Unique    3.18, 3.45 A)
 &rst
  ixpk= 672, nxpk= 10, iat= 276, 304, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   25 LEU  HA           25 LEU  HN          3.50    (#    673:10  Unique    2.89, 2.90 A)
 &rst
  ixpk= 673, nxpk= 10, iat= 383, 381, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   24 MET  HA           25 LEU  HN          3.50    (#    674:10  Unique    3.54, 3.55 A)
 &rst
  ixpk= 674, nxpk= 10, iat= 366, 381, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   22 GLU  HA           25 LEU  HN          4.50    (#    675:10  Unique    3.51, 3.66 A)
 &rst
  ixpk= 675, nxpk= 10, iat= 334, 381, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   43 ASN  HA           43 ASN  HD2+        4.50    (#    677:10  Unique    2.48, 4.51 A)
 &rst
  ixpk= 677, nxpk= 10, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 694, 695,
 &end
#
#    5 GLN  HA            5 GLN  HE2+        4.50    (#    678:10  Unique    2.29, 3.21 A)
 &rst
  ixpk= 678, nxpk= 10, iat=  62,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  72,  73,
 &end
#
#    0 AMB  10-2:679      0 AMB  10-1:679    5.50    (#    679:10  Double Ambig)
 &rst
  ixpk= 679, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1258,  16,
 igr2=  26,  27,  26,  27,
 &end
#
#    8 ASN  HA            8 ASN  HD2+        4.50    (#    681:10  Unique    4.30, 4.73 A)
 &rst
  ixpk= 681, nxpk= 10, iat= 107,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 114, 115,
 &end
#
#    0 AMB  10-2:682      0 AMB  10-1:682    5.50    (#    682:10  Double Ambig)
 &rst
  ixpk= 682, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1300,1322, 121,
 igr2= 114, 115, 114, 115, 114, 115,
 &end
#
#   54 THR  HA            9 GLN  HE2+        5.50    (#    683:10  Unique    4.12, 4.34 A)
 &rst
  ixpk= 683, nxpk= 10, iat= 868,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 131, 132,
 &end
#
#    0 AMB  10-2:685      0 AMB  10-1:685    4.50    (#    685:10  Double Ambig)
 &rst
  ixpk= 685, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 854, 121,
 igr2= 131, 132, 131, 132,
 &end
#
#    0 AMB  10-2:686     30 ASN  HD2-        4.50    (#    686:10  Single Ambig)
 &rst
  ixpk= 686, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 469, 413, 483,
 igr2= 476, 477,
 &end
#
#   53 THR  HB           57 GLN  HE2+        5.50    (#    687:10  Unique    2.53, 3.17 A)
 &rst
  ixpk= 687, nxpk= 10, iat= 856,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 926, 927,
 &end
#
#   34 GLY  HA-          57 GLN  HE2+        4.50    (#    688:10  Unique    2.21, 3.67 A)
 &rst
  ixpk= 688, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 534, 535,
 igr2= 926, 927,
 &end
#
#    0 AMB  10-2:690     70 ILE  HN          2.80    (#    690:10  Single Ambig)
 &rst
  ixpk= 690, nxpk= 10, iat=  -1,1108, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1088,1188,
 &end
#
#   70 ILE  HA           70 ILE  HN          3.50    (#    691:10  Unique    2.89, 2.90 A)
 &rst
  ixpk= 691, nxpk= 10, iat=1110,1108, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   69 LYS  HA           69 LYS  HN          3.50    (#    692:10  Unique    2.88, 2.89 A)
 &rst
  ixpk= 692, nxpk= 10, iat=1088,1086, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   68 PHE  HA           69 LYS  HN          3.50    (#    693:10  Unique    2.15, 2.19 A)
 &rst
  ixpk= 693, nxpk= 10, iat=1068,1086, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:694     36 LYS  HN          3.50    (#    694:10  Single Ambig)
 &rst
  ixpk= 694, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 541, 834,
 &end
#
#   36 LYS  HA           36 LYS  HN          3.50    (#    695:10  Unique    2.97, 2.99 A)
 &rst
  ixpk= 695, nxpk= 10, iat= 561, 559, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:697     75 ALA  HN          5.50    (#    697:10  Single Ambig)
 &rst
  ixpk= 697, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1157,1159,
 &end
#
#   77 LYS  HA           77 LYS  HN          3.50    (#    698:10  Unique    2.97, 2.98 A)
 &rst
  ixpk= 698, nxpk= 10, iat=1215,1213, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   76 MET  HA           77 LYS  HN          2.80    (#    699:10  Unique    2.21, 2.25 A)
 &rst
  ixpk= 699, nxpk= 10, iat=1198,1213, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   15 ASN  HB+          77 LYS  HN          4.50    (#    700:10  Unique    3.04, 3.86 A)
 &rst
  ixpk= 700, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 231, 232,
 &end
#
#   74 HIS  HA           74 HIS  HN          3.50    (#    707:10  Unique    2.97, 2.98 A)
 &rst
  ixpk= 707, nxpk= 10, iat=1171,1169, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:708     74 HIS  HN          4.50    (#    708:10  Single Ambig)
 &rst
  ixpk= 708, nxpk= 10, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1157,1159,
 &end
#
#    0 AMB  10-2:709     74 HIS  HN          3.50    (#    709:10  Single Ambig)
 &rst
  ixpk= 709, nxpk= 10, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1131,1088,1188,
 &end
#
#   58 SER  HB-          59 ASN  HN          5.50    (#    710:10  Unique    2.48, 3.73 A)
 &rst
  ixpk= 710, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 935, 936,
 &end
#
#   58 SER  HG           59 ASN  HN          4.50    (#    711:10  Unique    3.23, 3.38 A)
 &rst
  ixpk= 711, nxpk= 10, iat= 938, 942, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   54 THR  HB           56 LEU  HN          3.50    (#    712:10  Unique    2.31, 2.48 A)
 &rst
  ixpk= 712, nxpk= 10, iat= 870, 895, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   54 THR  HA           56 LEU  HN          4.50    (#    713:10  Unique    4.07, 4.13 A)
 &rst
  ixpk= 713, nxpk= 10, iat= 868, 895, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:715     56 LEU  HN          3.50    (#    715:10  Single Ambig)
 &rst
  ixpk= 715, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 897, 882,
 &end
#
#   59 ASN  HA           59 ASN  HN          3.50    (#    716:10  Unique    2.80, 2.81 A)
 &rst
  ixpk= 716, nxpk= 10, iat= 944, 942, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:717     59 ASN  HN          3.50    (#    717:10  Single Ambig)
 &rst
  ixpk= 717, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 897, 882,
 &end
#
#    0 AMB  10-2:718     59 ASN  HN          4.50    (#    718:10  Single Ambig)
 &rst
  ixpk= 718, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 916, 958,
 &end
#
#   32 PHE  HA           32 PHE  HN          4.50    (#    719:10  Unique    2.97, 2.98 A)
 &rst
  ixpk= 719, nxpk= 10, iat= 500, 498, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   29 PHE  HA           32 PHE  HN          4.50    (#    720:10  Unique    3.89, 3.96 A)
 &rst
  ixpk= 720, nxpk= 10, iat= 449, 498, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:721     32 PHE  HN          3.50    (#    721:10  Single Ambig)
 &rst
  ixpk= 721, nxpk= 10, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 469, 483, 519, 520,
 &end
#
#   32 PHE  HB+          32 PHE  HN          3.50    (#    722:10  Unique    2.60, 3.19 A)
 &rst
  ixpk= 722, nxpk= 10, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 502, 503,
 &end
#
#    0 AMB  10-2:723     10 ILE  HN          3.50    (#    723:10  Single Ambig)
 &rst
  ixpk= 723, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 138, 938,
 &end
#
#    8 ASN  HA           10 ILE  HN          4.50    (#    724:10  Unique    3.74, 4.11 A)
 &rst
  ixpk= 724, nxpk= 10, iat= 107, 136, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:725     10 ILE  HN          4.50    (#    725:10  Single Ambig)
 &rst
  ixpk= 725, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 121, 935, 936,
 &end
#
#    0 AMB  10-2:726     48 ALA  HN          4.50    (#    726:10  Single Ambig)
 &rst
  ixpk= 726, nxpk= 10, iat=  -1, 771, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 176, 196,
 &end
#
#   47 ILE  HA           48 ALA  HN          3.50    (#    727:10  Unique    2.33, 2.41 A)
 &rst
  ixpk= 727, nxpk= 10, iat= 754, 771, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   14 THR  HA           48 ALA  HN          5.50    (#    728:10  Unique    3.82, 3.95 A)
 &rst
  ixpk= 728, nxpk= 10, iat= 215, 771, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:729      0 AMB  10-1:729    3.50    (#    729:10  Double Ambig)
 &rst
  ixpk= 729, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 773, 944,
 igr2= 771, 976,
 &end
#
#   42 PRO  HA           44 ARG  HN          4.50    (#    731:10  Unique    3.41, 4.11 A)
 &rst
  ixpk= 731, nxpk= 10, iat= 681, 699, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   43 ASN  HA           44 ARG  HN          3.50    (#    734:10  Unique    3.30, 3.47 A)
 &rst
  ixpk= 734, nxpk= 10, iat= 687, 699, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 LYS  HA           62 LYS  HN          4.50    (#    735:10  Unique    2.83, 2.84 A)
 &rst
  ixpk= 735, nxpk= 10, iat= 978, 976, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:736     27 MET  HN          2.80    (#    736:10  Single Ambig)
 &rst
  ixpk= 736, nxpk= 10, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 413, 366,
 &end
#
#    0 AMB  10-2:737     27 MET  HN          4.50    (#    737:10  Single Ambig)
 &rst
  ixpk= 737, nxpk= 10, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 349, 383,
 &end
#
#   26 SER  HA           27 MET  HN          4.50    (#    738:10  Unique    3.60, 3.64 A)
 &rst
  ixpk= 738, nxpk= 10, iat= 402, 411, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   58 SER  HG           58 SER  HN          4.50    (#    739:10  Unique    1.81, 3.18 A)
 &rst
  ixpk= 739, nxpk= 10, iat= 938, 931, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   58 SER  HB+          58 SER  HN          2.80    (#    740:10  Unique    2.69, 3.16 A)
 &rst
  ixpk= 740, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 935, 936,
 &end
#
#    3 THR  HB            3 THR  HN          5.50    (#    743:10  Unique    2.62, 3.25 A)
 &rst
  ixpk= 743, nxpk= 10, iat=  35,  31, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    2 GLN  HA            3 THR  HN          3.50    (#    747:10  Unique    2.21, 2.39 A)
 &rst
  ixpk= 747, nxpk= 10, iat=  16,  31, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   14 THR  HB           16 LEU  HN          5.50    (#    748:10  Unique    4.81, 4.87 A)
 &rst
  ixpk= 748, nxpk= 10, iat= 217, 241, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   14 THR  HA           16 LEU  HN          4.50    (#    749:10  Unique    3.34, 3.39 A)
 &rst
  ixpk= 749, nxpk= 10, iat= 215, 241, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   46 ASP  HA           16 LEU  HN          4.50    (#    751:10  Unique    2.71, 3.04 A)
 &rst
  ixpk= 751, nxpk= 10, iat= 742, 241, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:752     16 LEU  HN          3.50    (#    752:10  Single Ambig)
 &rst
  ixpk= 752, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 229, 243,
 &end
#
#   60 ALA  HA           59 ASN  HD2+        5.50    (#    753:10  Unique    3.53, 4.31 A)
 &rst
  ixpk= 753, nxpk= 10, iat= 958,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 951, 952,
 &end
#
#    0 AMB  10-2:754      0 AMB  10-1:754    4.50    (#    754:10  Double Ambig)
 &rst
  ixpk= 754, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 897,1015,
 igr2= 951, 952,1023,
 &end
#
#   65 LEU  HA           65 LEU  HN          3.50    (#    755:10  Unique    2.97, 2.98 A)
 &rst
  ixpk= 755, nxpk= 10, iat=1025,1023, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:756      0 AMB  10-1:756    4.50    (#    756:10  Double Ambig)
 &rst
  ixpk= 756, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1000,1044,
 igr2=1023, 951, 952,
 &end
#
#   62 LYS  HA           63 GLU  HN          5.50    (#    757:10  Unique    3.61, 3.64 A)
 &rst
  ixpk= 757, nxpk= 10, iat= 978, 998, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   64 ALA  HA           63 GLU  HN          5.50    (#    758:10  Unique    5.34, 5.37 A)
 &rst
  ixpk= 758, nxpk= 10, iat=1015, 998, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   60 ALA  HA           63 GLU  HN          3.50    (#    759:10  Unique    3.24, 3.38 A)
 &rst
  ixpk= 759, nxpk= 10, iat= 958, 998, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   63 GLU  HA           63 GLU  HN          3.50    (#    760:10  Unique    2.81, 2.82 A)
 &rst
  ixpk= 760, nxpk= 10, iat=1000, 998, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   59 ASN  HA           63 GLU  HN          5.50    (#    761:10  Unique    3.90, 3.98 A)
 &rst
  ixpk= 761, nxpk= 10, iat= 944, 998, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   28 LEU  HA           29 PHE  HN          3.50    (#    762:10  Unique    3.55, 3.56 A)
 &rst
  ixpk= 762, nxpk= 10, iat= 430, 447, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   26 SER  HA           29 PHE  HN          4.50    (#    763:10  Unique    3.62, 3.80 A)
 &rst
  ixpk= 763, nxpk= 10, iat= 402, 447, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   29 PHE  HA           29 PHE  HN          3.50    (#    764:10  Unique    2.88, 2.89 A)
 &rst
  ixpk= 764, nxpk= 10, iat= 449, 447, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   28 LEU  HA           31 GLN  HE2+        3.50    (#    765:10  Unique    2.72, 3.39 A)
 &rst
  ixpk= 765, nxpk= 10, iat= 430,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 493, 494,
 &end
#
#   77 LYS  HA           66 GLN  HE2+        5.50    (#    766:10  Unique    3.05, 4.68 A)
 &rst
  ixpk= 766, nxpk= 10, iat=1215,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1054,1055,
 &end
#
#   74 HIS  HA           15 ASN  HD2+        3.50    (#    768:10  Unique    2.61, 3.14 A)
 &rst
  ixpk= 768, nxpk= 10, iat=1171,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 236, 237,
 &end
#
#   76 MET  HA           15 ASN  HD2+        5.50    (#    769:10  Unique    4.19, 5.06 A)
 &rst
  ixpk= 769, nxpk= 10, iat=1198,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 236, 237,
 &end
#
#   15 ASN  HB+          15 ASN  HD2+        3.50    (#    770:10  Unique    2.21, 3.26 A)
 &rst
  ixpk= 770, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 231, 232,
 igr2= 236, 237,
 &end
#
#    0 AMB  10-2:772     71 THR  HN          4.50    (#    772:10  Single Ambig)
 &rst
  ixpk= 772, nxpk= 10, iat=  -1,1127, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1131,1129,1088,
 &end
#
#   70 ILE  HA           71 THR  HN          4.50    (#    773:10  Unique    3.51, 3.53 A)
 &rst
  ixpk= 773, nxpk= 10, iat=1110,1127, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   54 THR  HA           54 THR  HN          3.50    (#    774:10  Unique    2.95, 2.95 A)
 &rst
  ixpk= 774, nxpk= 10, iat= 868, 866, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   53 THR  HB           54 THR  HN          3.50    (#    775:10  Unique    2.38, 2.49 A)
 &rst
  ixpk= 775, nxpk= 10, iat= 856, 866, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   54 THR  HB           54 THR  HN          4.50    (#    776:10  Unique    3.55, 3.64 A)
 &rst
  ixpk= 776, nxpk= 10, iat= 870, 866, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:777     54 THR  HN          3.50    (#    777:10  Single Ambig)
 &rst
  ixpk= 777, nxpk= 10, iat=  -1, 866, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 854, 121,
 &end
#
#   62 LYS  HN           61 ALA  HN          3.50    (#    778:10  Unique    2.70, 2.72 A)
 &rst
  ixpk= 778, nxpk= 10, iat= 976, 966, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   27 MET  HN           28 LEU  HN          3.50    (#    779:10  Unique    2.68, 2.78 A)
 &rst
  ixpk= 779, nxpk= 10, iat= 411, 428, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   30 ASN  HN           28 LEU  HN          5.50    (#    780:10  Unique    3.81, 3.91 A)
 &rst
  ixpk= 780, nxpk= 10, iat= 467, 428, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:781     59 ASN  HD2-        5.50    (#    781:10  Single Ambig)
 &rst
  ixpk= 781, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 942, 998,
 igr2= 951, 952,
 &end
#
#   30 ASN  HN           31 GLN  HN          3.50    (#    782:10  Unique    2.91, 2.94 A)
 &rst
  ixpk= 782, nxpk= 10, iat= 467, 481, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:783      0 AMB  10-1:783    5.50    (#    783:10  Double Ambig)
 &rst
  ixpk= 783, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 347,  14, 213,
 igr2= 327, 328,  26,  27,
 &end
#
#   75 ALA  HN           15 ASN  HD2-        3.50    (#    784:10  Unique    2.79, 2.90 A)
 &rst
  ixpk= 784, nxpk= 10, iat=1186,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 236, 237,
 &end
#
#   51 GLU  HN           37 GLU  HN          3.50    (#    785:10  Unique    2.59, 2.66 A)
 &rst
  ixpk= 785, nxpk= 10, iat= 817, 581, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:786     37 GLU  HN          4.50    (#    786:10  Single Ambig)
 &rst
  ixpk= 786, nxpk= 10, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 596, 832,
 &end
#
#   36 LYS  HN           37 GLU  HN          3.50    (#    787:10  Unique    2.27, 2.33 A)
 &rst
  ixpk= 787, nxpk= 10, iat= 559, 581, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   46 ASP  HN           47 ILE  HN          3.50    (#    788:10  Unique    1.79, 2.45 A)
 &rst
  ixpk= 788, nxpk= 10, iat= 740, 752, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   48 ALA  HN           47 ILE  HN          5.50    (#    789:10  Unique    4.37, 4.42 A)
 &rst
  ixpk= 789, nxpk= 10, iat= 771, 752, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   60 ALA  HN           61 ALA  HN          3.50    (#    790:10  Unique    2.74, 2.77 A)
 &rst
  ixpk= 790, nxpk= 10, iat= 956, 966, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   29 PHE  HN           28 LEU  HN          3.50    (#    791:10  Unique    2.67, 2.76 A)
 &rst
  ixpk= 791, nxpk= 10, iat= 447, 428, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   32 PHE  HN           31 GLN  HN          3.50    (#    793:10  Unique    2.81, 2.84 A)
 &rst
  ixpk= 793, nxpk= 10, iat= 498, 481, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   80 PHE  HD            8 ASN  HN          3.50    (#    800:10  Unique    2.22, 3.75 A)
 &rst
  ixpk= 800, nxpk= 10, iat=  -1, 105, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1276,1284,
 &end
#
#    9 GLN  HN           10 ILE  HN          3.50    (#    801:10  Unique    2.58, 3.01 A)
 &rst
  ixpk= 801, nxpk= 10, iat= 119, 136, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   26 SER  HN           27 MET  HN          3.50    (#    802:10  Unique    2.69, 2.83 A)
 &rst
  ixpk= 802, nxpk= 10, iat= 400, 411, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   78 ILE  HN           66 GLN  HE2-        4.50    (#    803:10  Unique    2.24, 3.15 A)
 &rst
  ixpk= 803, nxpk= 10, iat=1235,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1054,1055,
 &end
#
#   34 GLY  HN           35 PHE  HN          3.50    (#    804:10  Unique    2.00, 2.22 A)
 &rst
  ixpk= 804, nxpk= 10, iat= 532, 539, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   13 LEU  HN           48 ALA  HN          3.50    (#    805:10  Unique    2.68, 2.78 A)
 &rst
  ixpk= 805, nxpk= 10, iat= 194, 771, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   43 ASN  HN           44 ARG  HN          3.50    (#    806:10  Unique    1.77, 2.21 A)
 &rst
  ixpk= 806, nxpk= 10, iat= 685, 699, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   18 GLU  HN           20 THR  HN          4.50    (#    807:10  Unique    4.33, 4.37 A)
 &rst
  ixpk= 807, nxpk= 10, iat= 274, 304, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   15 ASN  HN           16 LEU  HN          3.50    (#    808:10  Unique    2.73, 2.78 A)
 &rst
  ixpk= 808, nxpk= 10, iat= 227, 241, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   53 THR  HN           54 THR  HN          3.50    (#    809:10  Unique    2.71, 2.75 A)
 &rst
  ixpk= 809, nxpk= 10, iat= 852, 866, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   26 SER  HN           25 LEU  HN          3.50    (#    810:10  Unique    2.60, 2.63 A)
 &rst
  ixpk= 810, nxpk= 10, iat= 400, 381, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   55 GLU  HN           56 LEU  HN          4.50    (#    811:10  Unique    2.68, 2.72 A)
 &rst
  ixpk= 811, nxpk= 10, iat= 880, 895, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   76 MET  HN           70 ILE  HN          4.50    (#    812:10  Unique    3.05, 3.10 A)
 &rst
  ixpk= 812, nxpk= 10, iat=1196,1108, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   76 MET  HN           77 LYS  HN          5.50    (#    813:10  Unique    4.60, 4.64 A)
 &rst
  ixpk= 813, nxpk= 10, iat=1196,1213, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   78 ILE  HN           66 GLN  HE2+        4.50    (#    814:10  Unique    2.24, 3.15 A)
 &rst
  ixpk= 814, nxpk= 10, iat=1235,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1054,1055,
 &end
#
#   22 GLU  HN           21 ASN  HN          5.50    (#    815:10  Unique    4.29, 4.31 A)
 &rst
  ixpk= 815, nxpk= 10, iat= 332, 318, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   22 GLU  HN           21 ASN  HD2+        5.50    (#    816:10  Unique    3.27, 4.11 A)
 &rst
  ixpk= 816, nxpk= 10, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 327, 328,
 &end
#
#   68 PHE  HN           66 GLN  HN          5.50    (#    817:10  Unique    4.56, 4.63 A)
 &rst
  ixpk= 817, nxpk= 10, iat=1066,1042, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   67 GLY  HN           66 GLN  HN          5.50    (#    818:10  Unique    4.53, 4.57 A)
 &rst
  ixpk= 818, nxpk= 10, iat=1059,1042, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   66 GLN  HE2+         66 GLN  HN          5.50    (#    819:10  Unique    5.71, 6.15 A)
 &rst
  ixpk= 819, nxpk= 10, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1054,1055,
 &end
#
#   36 LYS  HN           35 PHE  HN          4.50    (#    820:10  Unique    4.53, 4.54 A)
 &rst
  ixpk= 820, nxpk= 10, iat= 559, 539, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 MET  HN           21 ASN  HN          4.50    (#    821:10  Unique    3.25, 3.43 A)
 &rst
  ixpk= 821, nxpk= 10, iat= 364, 318, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   58 SER  HN           57 GLN  HN          4.50    (#    822:10  Unique    2.56, 2.61 A)
 &rst
  ixpk= 822, nxpk= 10, iat= 931, 914, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   59 ASN  HN           57 GLN  HN          5.50    (#    823:10  Unique    3.88, 3.99 A)
 &rst
  ixpk= 823, nxpk= 10, iat= 942, 914, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   54 THR  HN           57 GLN  HN          4.50    (#    824:10  Unique    3.60, 3.79 A)
 &rst
  ixpk= 824, nxpk= 10, iat= 866, 914, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   58 SER  HN           60 ALA  HN          5.50    (#    825:10  Unique    4.23, 4.31 A)
 &rst
  ixpk= 825, nxpk= 10, iat= 931, 956, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   59 ASN  HN           60 ALA  HN          3.50    (#    826:10  Unique    2.82, 2.89 A)
 &rst
  ixpk= 826, nxpk= 10, iat= 942, 956, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   63 GLU  HN           64 ALA  HN          2.80    (#    827:10  Unique    2.75, 2.79 A)
 &rst
  ixpk= 827, nxpk= 10, iat= 998,1013, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   24 MET  HN           25 LEU  HN          3.50    (#    828:10  Unique    2.52, 2.60 A)
 &rst
  ixpk= 828, nxpk= 10, iat= 364, 381, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   27 MET  HN           25 LEU  HN          5.50    (#    829:10  Unique    4.18, 4.28 A)
 &rst
  ixpk= 829, nxpk= 10, iat= 411, 381, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    5 GLN  HN            5 GLN  HE2+        5.50    (#    830:10  Unique    3.95, 5.05 A)
 &rst
  ixpk= 830, nxpk= 10, iat=  60,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  72,  73,
 &end
#
#    0 AMB  10-2:831      0 AMB  10-1:831    5.50    (#    831:10  Double Ambig)
 &rst
  ixpk= 831, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 347,  14, 213,
 igr2= 327, 328,  26,  27,  26,  27,
 &end
#
#   30 ASN  HN           30 ASN  HD2-        5.50    (#    832:10  Unique    3.40, 5.18 A)
 &rst
  ixpk= 832, nxpk= 10, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 476, 477,
 &end
#
#   50 VAL  MGX          11 LEU  HN          5.50    (#    833:10  Unique    4.38, 5.47 A)
 &rst
  ixpk= 833, nxpk= 10, iat=  -1, 155, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 807, 808, 809, 811, 812, 813,
 &end
#
#    8 ASN  HD2+          9 GLN  HN          5.50    (#    835:10  Unique    3.65, 4.55 A)
 &rst
  ixpk= 835, nxpk= 10, iat=  -1, 119, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 114, 115,
 &end
#
#   55 GLU  HG-           9 GLN  HN          3.50    (#    836:10  Unique    2.20, 2.98 A)
 &rst
  ixpk= 836, nxpk= 10, iat=  -1, 119, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 887, 888,
 &end
#
#   49 PHE  HD           12 PHE  HN          5.50    (#    837:10  Unique    4.26, 6.33 A)
 &rst
  ixpk= 837, nxpk= 10, iat=  -1, 174, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 789, 797,
 &end
#
#    0 AMB  10-2:838     12 PHE  HN          5.50    (#    838:10  Single Ambig)
 &rst
  ixpk= 838, nxpk= 10, iat=  -1, 174, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 114, 115,1276,1284,
 &end
#
#   11 LEU  HN           12 PHE  HN          5.50    (#    839:10  Unique    4.35, 4.43 A)
 &rst
  ixpk= 839, nxpk= 10, iat= 155, 174, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   81 ALA  HA           12 PHE  HN          5.50    (#    840:10  Unique    3.61, 3.98 A)
 &rst
  ixpk= 840, nxpk= 10, iat=1290, 174, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:841     12 PHE  HN          5.50    (#    841:10  Single Ambig)
 &rst
  ixpk= 841, nxpk= 10, iat=  -1, 174, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 142, 143, 144,1245,1246,
 &end
#
#    0 AMB  10-2:842     12 PHE  HN          5.50    (#    842:10  Single Ambig)
 &rst
  ixpk= 842, nxpk= 10, iat=  -1, 174, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 805, 198, 199, 201,
 &end
#
#   21 ASN  HD2+         22 GLU  HN          5.50    (#    843:10  Unique    3.27, 4.11 A)
 &rst
  ixpk= 843, nxpk= 10, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 327, 328,
 &end
#
#   21 ASN  HN           22 GLU  HN          5.50    (#    844:10  Unique    4.29, 4.31 A)
 &rst
  ixpk= 844, nxpk= 10, iat= 318, 332, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   21 ASN  HD2-         22 GLU  HN          5.50    (#    845:10  Unique    3.27, 4.11 A)
 &rst
  ixpk= 845, nxpk= 10, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 327, 328,
 &end
#
#    0 AMB  10-2:846     22 GLU  HN          5.50    (#    846:10  Single Ambig)
 &rst
  ixpk= 846, nxpk= 10, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 310, 311, 312, 775, 776, 777,
 &end
#
#   49 PHE  HD           39 ARG  HN          7.00    (#    847:10  Unique    4.87, 6.04 A)
 &rst
  ixpk= 847, nxpk= 10, iat=  -1, 612, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 789, 797,
 &end
#
#   45 HIS  HN           46 ASP  HN          4.50    (#    848:10  Unique    1.84, 2.59 A)
 &rst
  ixpk= 848, nxpk= 10, iat= 723, 740, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   47 ILE  HG1-         46 ASP  HN          5.50    (#    851:10  Unique    3.54, 5.55 A)
 &rst
  ixpk= 851, nxpk= 10, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 762, 763,
 &end
#
#    0 AMB  10-2:852     46 ASP  HN          5.50    (#    852:10  Single Ambig)
 &rst
  ixpk= 852, nxpk= 10, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 661, 662, 663, 665, 666, 667, 661, 662, 663, 665,
       666, 667,
 &end
#
#   47 ILE  MD1          46 ASP  HN          4.50    (#    853:10  Unique    3.56, 4.86 A)
 &rst
  ixpk= 853, nxpk= 10, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 765, 766, 767,
 &end
#
#   12 PHE  HB-          79 THR  HN          5.50    (#    854:10  Unique    3.46, 4.46 A)
 &rst
  ixpk= 854, nxpk= 10, iat=  -1,1254, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 178, 179,
 &end
#
#   12 PHE  HB+          79 THR  HN          5.50    (#    855:10  Unique    3.46, 4.46 A)
 &rst
  ixpk= 855, nxpk= 10, iat=  -1,1254, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 178, 179,
 &end
#
#    0 AMB  10-2:856     79 THR  HN          5.50    (#    856:10  Single Ambig)
 &rst
  ixpk= 856, nxpk= 10, iat=  -1,1254, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 989, 990,  21,  22,
 &end
#
#    0 AMB  10-2:857     51 GLU  HN          5.50    (#    857:10  Single Ambig)
 &rst
  ixpk= 857, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 146, 147, 149, 150, 151,
 &end
#
#   36 LYS  HB+          51 GLU  HN          4.50    (#    858:10  Unique    4.14, 5.12 A)
 &rst
  ixpk= 858, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 563, 564,
 &end
#
#    0 AMB  10-2:859     51 GLU  HN          4.50    (#    859:10  Single Ambig)
 &rst
  ixpk= 859, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 602, 603, 604, 606, 607, 608, 563, 564,
 &end
#
#    0 AMB  10-2:860     51 GLU  HN          4.50    (#    860:10  Single Ambig)
 &rst
  ixpk= 860, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
 igr1= 602, 603, 604, 606, 607, 608, 142, 143, 144, 566,
       567,
 &end
#
#   50 VAL  HB           51 GLU  HN          4.50    (#    861:10  Unique    3.86, 3.92 A)
 &rst
  ixpk= 861, nxpk= 10, iat= 805, 817, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   51 GLU  HG+          51 GLU  HN          4.50    (#    862:10  Unique    4.32, 4.55 A)
 &rst
  ixpk= 862, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 824, 825,
 &end
#
#    0 AMB  10-2:863     51 GLU  HN          4.50    (#    863:10  Single Ambig)
 &rst
  ixpk= 863, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 600, 824, 825,
 &end
#
#   34 GLY  HA-          53 THR  HN          3.50    (#    864:10  Unique    3.42, 3.78 A)
 &rst
  ixpk= 864, nxpk= 10, iat=  -1, 852, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 534, 535,
 &end
#
#   34 GLY  HA+          53 THR  HN          5.50    (#    865:10  Unique    3.42, 3.78 A)
 &rst
  ixpk= 865, nxpk= 10, iat=  -1, 852, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 534, 535,
 &end
#
#    0 AMB  10-2:867     53 THR  HN          5.50    (#    867:10  Single Ambig)
 &rst
  ixpk= 867, nxpk= 10, iat=  -1, 852, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 921, 922, 921, 922,
 &end
#
#   50 VAL  MGY          50 VAL  HN          4.50    (#    868:10  Unique    3.00, 4.27 A)
 &rst
  ixpk= 868, nxpk= 10, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 807, 808, 809, 811, 812, 813,
 &end
#
#   38 VAL  MGX          50 VAL  HN          5.50    (#    870:10  Unique    5.00, 6.84 A)
 &rst
  ixpk= 870, nxpk= 10, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 602, 603, 604, 606, 607, 608,
 &end
#
#   11 LEU  HB-          50 VAL  HN          4.50    (#    871:10  Unique    3.10, 3.85 A)
 &rst
  ixpk= 871, nxpk= 10, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 159, 160,
 &end
#
#   11 LEU  HB+          50 VAL  HN          3.50    (#    872:10  Unique    3.10, 3.85 A)
 &rst
  ixpk= 872, nxpk= 10, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 159, 160,
 &end
#
#   49 PHE  HB-          50 VAL  HN          4.50    (#    873:10  Unique    2.52, 3.22 A)
 &rst
  ixpk= 873, nxpk= 10, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 785, 786,
 &end
#
#    8 ASN  HD2-         81 ALA  HN          5.50    (#    874:10  Unique    2.11, 3.37 A)
 &rst
  ixpk= 874, nxpk= 10, iat=  -1,1288, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 114, 115,
 &end
#
#   11 LEU  HA           81 ALA  HN          3.50    (#    875:10  Unique    2.15, 2.47 A)
 &rst
  ixpk= 875, nxpk= 10, iat= 157,1288, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    8 ASN  HB-          81 ALA  HN          4.50    (#    876:10  Unique    3.20, 4.59 A)
 &rst
  ixpk= 876, nxpk= 10, iat=  -1,1288, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 109, 110,
 &end
#
#   80 PHE  HB-          81 ALA  HN          4.50    (#    877:10  Unique    3.07, 3.80 A)
 &rst
  ixpk= 877, nxpk= 10, iat=  -1,1288, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1272,1273,
 &end
#
#   12 PHE  HB-          81 ALA  HN          5.50    (#    878:10  Unique    4.39, 4.71 A)
 &rst
  ixpk= 878, nxpk= 10, iat=  -1,1288, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 178, 179,
 &end
#
#    0 AMB  10-2:879     81 ALA  HN          4.50    (#    879:10  Single Ambig)
 &rst
  ixpk= 879, nxpk= 10, iat=  -1,1288, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 140,1324,1325,1324,1325,
 &end
#
#    0 AMB  10-2:881     81 ALA  HN          4.50    (#    881:10  Single Ambig)
 &rst
  ixpk= 881, nxpk= 10, iat=  -1,1288, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 159, 160,1260,1261,1262,1305,1306,
 &end
#
#   10 ILE  MG2          81 ALA  HN          4.50    (#    882:10  Unique    4.10, 5.24 A)
 &rst
  ixpk= 882, nxpk= 10, iat=  -1,1288, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 142, 143, 144,
 &end
#
#   11 LEU  MDX          81 ALA  HN          5.50    (#    883:10  Unique    3.08, 5.58 A)
 &rst
  ixpk= 883, nxpk= 10, iat=  -1,1288, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 164, 165, 166, 168, 169, 170,
 &end
#
#   39 ARG  HB-          49 PHE  HN          3.50    (#    884:10  Unique    3.22, 4.18 A)
 &rst
  ixpk= 884, nxpk= 10, iat=  -1, 781, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 616, 617,
 &end
#
#   14 THR  HN           13 LEU  HN          5.50    (#    885:10  Unique    4.37, 4.42 A)
 &rst
  ixpk= 885, nxpk= 10, iat= 213, 194, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:886     13 LEU  HN          5.50    (#    886:10  Single Ambig)
 &rst
  ixpk= 886, nxpk= 10, iat=  -1, 194, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 184, 188, 789, 797,
 &end
#
#   12 PHE  HZ           13 LEU  HN          5.50    (#    887:10  Unique    5.34, 5.46 A)
 &rst
  ixpk= 887, nxpk= 10, iat= 186, 194, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:888     13 LEU  HN          4.50    (#    888:10  Single Ambig)
 &rst
  ixpk= 888, nxpk= 10, iat=  -1, 194, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 178, 179, 785, 786,
 &end
#
#   12 PHE  HB-          13 LEU  HN          4.50    (#    889:10  Unique    4.08, 4.18 A)
 &rst
  ixpk= 889, nxpk= 10, iat=  -1, 194, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 178, 179,
 &end
#
#   48 ALA  MB           13 LEU  HN          4.50    (#    890:10  Unique    3.81, 4.84 A)
 &rst
  ixpk= 890, nxpk= 10, iat=  -1, 194, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 775, 776, 777,
 &end
#
#   14 THR  MG2          13 LEU  HN          4.50    (#    891:10  Unique    3.71, 4.74 A)
 &rst
  ixpk= 891, nxpk= 10, iat=  -1, 194, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 219, 220, 221,
 &end
#
#    0 AMB  10-2:892     13 LEU  HN          4.50    (#    892:10  Single Ambig)
 &rst
  ixpk= 892, nxpk= 10, iat=  -1, 194, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 807, 808, 809, 811, 812, 813, 248,
 &end
#
#   10 ILE  MG2          13 LEU  HN          7.00    (#    893:10  Unique    6.72, 7.91 A)
 &rst
  ixpk= 893, nxpk= 10, iat=  -1, 194, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 142, 143, 144,
 &end
#
#    0 AMB  10-2:894     13 LEU  HN          3.50    (#    894:10  Single Ambig)
 &rst
  ixpk= 894, nxpk= 10, iat=  -1, 194, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 203, 204, 205, 207, 208, 209, 250, 251, 252, 254,
       255, 256,
 &end
#
#   42 PRO  HG-          43 ASN  HN          4.50    (#    895:10  Unique    4.01, 4.95 A)
 &rst
  ixpk= 895, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 675, 676,
 &end
#
#    0 AMB  10-2:896     43 ASN  HN          4.50    (#    896:10  Single Ambig)
 &rst
  ixpk= 896, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 661, 662, 663, 665, 666, 667, 661, 662, 663, 665,
       666, 667,
 &end
#
#   17 PRO  HB-          19 GLU  HN          4.50    (#    897:10  Unique    2.30, 3.32 A)
 &rst
  ixpk= 897, nxpk= 10, iat=  -1, 289, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 267, 268,
 &end
#
#   45 HIS  HB-          19 GLU  HN          5.50    (#    898:10  Unique    4.99, 5.78 A)
 &rst
  ixpk= 898, nxpk= 10, iat=  -1, 289, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 727, 728,
 &end
#
#    0 AMB  10-2:900     40 LEU  HN          4.50    (#    900:10  Single Ambig)
 &rst
  ixpk= 900, nxpk= 10, iat=  -1, 636, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 339, 340, 339, 340,
 &end
#
#    0 AMB  10-2:901     52 PHE  HN          4.50    (#    901:10  Single Ambig)
 &rst
  ixpk= 901, nxpk= 10, iat=  -1, 832, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 146, 147, 149, 150, 151,
 &end
#
#    0 AMB  10-2:902     52 PHE  HN          5.50    (#    902:10  Single Ambig)
 &rst
  ixpk= 902, nxpk= 10, iat=  -1, 832, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 566, 567, 142, 143, 144,
 &end
#
#   51 GLU  HG-          52 PHE  HN          4.50    (#    903:10  Unique    2.44, 2.73 A)
 &rst
  ixpk= 903, nxpk= 10, iat=  -1, 832, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 824, 825,
 &end
#
#    0 AMB  10-2:904     52 PHE  HN          3.50    (#    904:10  Single Ambig)
 &rst
  ixpk= 904, nxpk= 10, iat=  -1, 832, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 821, 822, 821, 822,
 &end
#
#    5 GLN  HG-          83 LYS  HN          7.00    (#    905:10  Unique    3.95, 5.59 A)
 &rst
  ixpk= 905, nxpk= 10, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=  67,  68,
 &end
#
#    0 AMB  10-2:906     83 LYS  HN          5.50    (#    906:10  Single Ambig)
 &rst
  ixpk= 906, nxpk= 10, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1333,1334,1333,1334,1311,1312,1311,1312,
 &end
#
#    0 AMB  10-2:907     52 PHE  HN          4.50    (#    907:10  Single Ambig)
 &rst
  ixpk= 907, nxpk= 10, iat=  -1, 832, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 121, 935, 936, 854,
 &end
#
#   22 GLU  HN           23 MET  HN          3.50    (#    908:10  Unique    2.71, 2.78 A)
 &rst
  ixpk= 908, nxpk= 10, iat= 332, 347, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   25 LEU  HN           23 MET  HN          5.50    (#    909:10  Unique    4.18, 4.34 A)
 &rst
  ixpk= 909, nxpk= 10, iat= 381, 347, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   21 ASN  HD2-         23 MET  HN          5.50    (#    910:10  Unique    3.14, 4.05 A)
 &rst
  ixpk= 910, nxpk= 10, iat=  -1, 347, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 327, 328,
 &end
#
#   21 ASN  HN           23 MET  HN          5.50    (#    911:10  Unique    4.71, 4.83 A)
 &rst
  ixpk= 911, nxpk= 10, iat= 318, 347, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 MET  HA           23 MET  HN          5.50    (#    912:10  Unique    5.18, 5.31 A)
 &rst
  ixpk= 912, nxpk= 10, iat= 366, 347, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   21 ASN  HB+          23 MET  HN          5.50    (#    913:10  Unique    3.20, 4.01 A)
 &rst
  ixpk= 913, nxpk= 10, iat=  -1, 347, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 322, 323,
 &end
#
#   24 MET  HG+          23 MET  HN          5.50    (#    914:10  Unique    4.23, 5.14 A)
 &rst
  ixpk= 914, nxpk= 10, iat=  -1, 347, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 371, 372,
 &end
#
#   21 ASN  HB-          23 MET  HN          5.50    (#    915:10  Unique    3.20, 4.01 A)
 &rst
  ixpk= 915, nxpk= 10, iat=  -1, 347, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 322, 323,
 &end
#
#   20 THR  MG2          23 MET  HN          7.00    (#    916:10  Unique    6.00, 6.84 A)
 &rst
  ixpk= 916, nxpk= 10, iat=  -1, 347, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 310, 311, 312,
 &end
#
#   40 LEU  MDY          23 MET  HN          5.50    (#    917:10  Unique    4.82, 6.37 A)
 &rst
  ixpk= 917, nxpk= 10, iat=  -1, 347, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 645, 646, 647, 649, 650, 651,
 &end
#
#    0 AMB  10-2:918     23 MET  HN          5.50    (#    918:10  Single Ambig)
 &rst
  ixpk= 918, nxpk= 10, iat=  -1, 347, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 645, 646, 647, 649, 650, 651, 602, 603, 604, 606,
       607, 608,
 &end
#
#    1 ALA  MB            2 GLN  HN          5.50    (#    919:10  Unique    2.07, 3.24 A)
 &rst
  ixpk= 919, nxpk= 10, iat=  -1,  14, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=   8,   9,  10,
 &end
#
#    2 GLN  HG+           2 GLN  HN          5.50    (#    920:10  Unique    2.14, 3.41 A)
 &rst
  ixpk= 920, nxpk= 10, iat=  -1,  14, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  21,  22,
 &end
#
#    2 GLN  HB-           2 GLN  HN          5.50    (#    921:10  Unique    2.33, 3.25 A)
 &rst
  ixpk= 921, nxpk= 10, iat=  -1,  14, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  18,  19,
 &end
#
#    2 GLN  HB+           2 GLN  HN          5.50    (#    922:10  Unique    2.33, 3.25 A)
 &rst
  ixpk= 922, nxpk= 10, iat=  -1,  14, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  18,  19,
 &end
#
#    2 GLN  HA            2 GLN  HN          5.50    (#    923:10  Unique    2.83, 2.90 A)
 &rst
  ixpk= 923, nxpk= 10, iat=  16,  14, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   77 LYS  HA           67 GLY  HN          5.50    (#    924:10  Unique    3.17, 3.27 A)
 &rst
  ixpk= 924, nxpk= 10, iat=1215,1059, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 MET  HG+          67 GLY  HN          4.50    (#    925:10  Unique    4.31, 5.15 A)
 &rst
  ixpk= 925, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1203,1204,
 &end
#
#   66 GLN  HG+          67 GLY  HN          4.50    (#    926:10  Unique    3.34, 4.80 A)
 &rst
  ixpk= 926, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1049,1050,
 &end
#
#   78 ILE  HG1-         67 GLY  HN          5.50    (#    927:10  Unique    3.66, 4.95 A)
 &rst
  ixpk= 927, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1245,1246,
 &end
#
#   78 ILE  MD1          67 GLY  HN          4.50    (#    928:10  Unique    4.53, 5.44 A)
 &rst
  ixpk= 928, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1248,1249,1250,
 &end
#
#    0 AMB  10-2:929     67 GLY  HN          5.50    (#    929:10  Single Ambig)
 &rst
  ixpk= 929, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1220,1221,1220,1221,1027,1028,1027,1028,
 &end
#
#   25 LEU  HN           24 MET  HN          3.50    (#    930:10  Unique    2.52, 2.60 A)
 &rst
  ixpk= 930, nxpk= 10, iat= 381, 364, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   21 ASN  HN           24 MET  HN          4.50    (#    931:10  Unique    3.25, 3.43 A)
 &rst
  ixpk= 931, nxpk= 10, iat= 318, 364, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   21 ASN  HD2-         24 MET  HN          5.50    (#    932:10  Unique    3.75, 5.11 A)
 &rst
  ixpk= 932, nxpk= 10, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 327, 328,
 &end
#
#   69 LYS  HN           68 PHE  HN          4.50    (#    936:10  Unique    4.49, 4.51 A)
 &rst
  ixpk= 936, nxpk= 10, iat=1086,1066, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   68 PHE  HD           68 PHE  HN          4.50    (#    937:10  Unique    4.57, 4.71 A)
 &rst
  ixpk= 937, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1074,1082,
 &end
#
#   76 MET  HG+          68 PHE  HN          4.50    (#    938:10  Unique    4.71, 5.20 A)
 &rst
  ixpk= 938, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1203,1204,
 &end
#
#   76 MET  HB+          68 PHE  HN          4.50    (#    939:10  Unique    2.60, 3.36 A)
 &rst
  ixpk= 939, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1200,1201,
 &end
#
#   70 ILE  HG1-         68 PHE  HN          5.50    (#    940:10  Unique    5.35, 6.04 A)
 &rst
  ixpk= 940, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1118,1119,
 &end
#
#   75 ALA  MB           68 PHE  HN          5.50    (#    941:10  Unique    4.16, 5.32 A)
 &rst
  ixpk= 941, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1190,1191,1192,
 &end
#
#   78 ILE  MD1          68 PHE  HN          5.50    (#    942:10  Unique    4.55, 5.61 A)
 &rst
  ixpk= 942, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1248,1249,1250,
 &end
#
#   35 PHE  HD           30 ASN  HN          5.50    (#    946:10  Unique    3.90, 5.01 A)
 &rst
  ixpk= 946, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 547, 555,
 &end
#
#   32 PHE  HN           30 ASN  HN          4.50    (#    947:10  Unique    4.51, 4.52 A)
 &rst
  ixpk= 947, nxpk= 10, iat= 498, 467, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   29 PHE  HN           30 ASN  HN          3.50    (#    948:10  Unique    2.64, 2.69 A)
 &rst
  ixpk= 948, nxpk= 10, iat= 447, 467, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   29 PHE  HD           30 ASN  HN          5.50    (#    949:10  Unique    4.70, 5.37 A)
 &rst
  ixpk= 949, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 455, 463,
 &end
#
#   32 PHE  HD           30 ASN  HN          7.00    (#    950:10  Unique    5.15, 6.80 A)
 &rst
  ixpk= 950, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 506, 514,
 &end
#
#   28 LEU  HN           30 ASN  HN          4.50    (#    951:10  Unique    3.81, 3.91 A)
 &rst
  ixpk= 951, nxpk= 10, iat= 428, 467, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   31 GLN  HN           30 ASN  HN          3.50    (#    952:10  Unique    2.91, 2.94 A)
 &rst
  ixpk= 952, nxpk= 10, iat= 481, 467, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   30 ASN  HD2+         30 ASN  HN          5.50    (#    953:10  Unique    3.40, 5.18 A)
 &rst
  ixpk= 953, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 476, 477,
 &end
#
#    0 AMB  10-2:954     30 ASN  HN          5.50    (#    954:10  Single Ambig)
 &rst
  ixpk= 954, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 476, 477, 549, 553,
 &end
#
#   27 MET  HN           30 ASN  HN          5.50    (#    955:10  Unique    4.64, 4.71 A)
 &rst
  ixpk= 955, nxpk= 10, iat= 411, 467, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   29 PHE  HB+          30 ASN  HN          5.50    (#    957:10  Unique    3.08, 3.67 A)
 &rst
  ixpk= 957, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 451, 452,
 &end
#
#   29 PHE  HB-          30 ASN  HN          3.50    (#    958:10  Unique    3.08, 3.67 A)
 &rst
  ixpk= 958, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 451, 452,
 &end
#
#   28 LEU  HB-          30 ASN  HN          5.50    (#    959:10  Unique    4.74, 5.06 A)
 &rst
  ixpk= 959, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 432, 433,
 &end
#
#    0 AMB  10-2:960     30 ASN  HN          5.50    (#    960:10  Single Ambig)
 &rst
  ixpk= 960, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 432, 433, 602, 603, 604, 606, 607, 608,
 &end
#
#   59 ASN  HN           58 SER  HN          3.50    (#    961:10  Unique    2.68, 2.77 A)
 &rst
  ixpk= 961, nxpk= 10, iat= 942, 931, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   56 LEU  HN           58 SER  HN          4.50    (#    962:10  Unique    4.11, 4.24 A)
 &rst
  ixpk= 962, nxpk= 10, iat= 895, 931, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   54 THR  HN           58 SER  HN          4.50    (#    963:10  Unique    3.88, 3.97 A)
 &rst
  ixpk= 963, nxpk= 10, iat= 866, 931, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   57 GLN  HN           58 SER  HN          3.50    (#    964:10  Unique    2.56, 2.61 A)
 &rst
  ixpk= 964, nxpk= 10, iat= 914, 931, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:965     58 SER  HN          4.50    (#    965:10  Single Ambig)
 &rst
  ixpk= 965, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 956, 926, 927,
 &end
#
#   58 SER  HB-          58 SER  HN          4.50    (#    967:10  Unique    2.69, 3.16 A)
 &rst
  ixpk= 967, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 935, 936,
 &end
#
#    0 AMB  10-2:968     58 SER  HN          4.50    (#    968:10  Single Ambig)
 &rst
  ixpk= 968, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 836, 837, 836, 837,
 &end
#
#    0 AMB  10-2:969     58 SER  HN          4.50    (#    969:10  Single Ambig)
 &rst
  ixpk= 969, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 946, 947, 946, 947,
 &end
#
#   57 GLN  HB-          58 SER  HN          4.50    (#    970:10  Unique    2.50, 3.26 A)
 &rst
  ixpk= 970, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 918, 919,
 &end
#
#    0 AMB  10-2:971     58 SER  HN          5.50    (#    971:10  Single Ambig)
 &rst
  ixpk= 971, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1= 899, 900, 884, 885, 884, 885, 902,
 &end
#
#   76 MET  HN           75 ALA  HN          5.50    (#    972:10  Unique    4.45, 4.49 A)
 &rst
  ixpk= 972, nxpk= 10, iat=1196,1186, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 ASN  HD2+         75 ALA  HN          3.50    (#    973:10  Unique    2.79, 2.90 A)
 &rst
  ixpk= 973, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 236, 237,
 &end
#
#   74 HIS  HN           75 ALA  HN          4.50    (#    974:10  Unique    3.20, 3.72 A)
 &rst
  ixpk= 974, nxpk= 10, iat=1169,1186, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   15 ASN  HD2-         75 ALA  HN          3.50    (#    975:10  Unique    2.79, 2.90 A)
 &rst
  ixpk= 975, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 236, 237,
 &end
#
#   15 ASN  HB-          75 ALA  HN          5.50    (#    977:10  Unique    4.96, 5.62 A)
 &rst
  ixpk= 977, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 231, 232,
 &end
#
#    0 AMB  10-2:978     58 SER  HN          5.50    (#    978:10  Single Ambig)
 &rst
  ixpk= 978, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 899, 900, 101,
 &end
#
#    0 AMB  10-2:979     58 SER  HN          5.50    (#    979:10  Single Ambig)
 &rst
  ixpk= 979, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 960, 961, 962,  98,  99,
 &end
#
#   11 LEU  MDY          58 SER  HN          5.50    (#    980:10  Unique    4.92, 6.35 A)
 &rst
  ixpk= 980, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 164, 165, 166, 168, 169, 170,
 &end
#
#    0 AMB  10-2:981     58 SER  HN          5.50    (#    981:10  Single Ambig)
 &rst
  ixpk= 981, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 164, 165, 166, 168, 169, 170, 904, 905, 906, 908,
       909, 910,
 &end
#
#   46 ASP  HB+          16 LEU  HN          4.50    (#    982:10  Unique    3.19, 4.28 A)
 &rst
  ixpk= 982, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 744, 745,
 &end
#
#   15 ASN  HB-          16 LEU  HN          4.50    (#    983:10  Unique    4.22, 4.48 A)
 &rst
  ixpk= 983, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 231, 232,
 &end
#
#   46 ASP  HB-          16 LEU  HN          4.50    (#    984:10  Unique    3.19, 4.28 A)
 &rst
  ixpk= 984, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 744, 745,
 &end
#
#   16 LEU  HB-          16 LEU  HN          3.50    (#    985:10  Unique    2.58, 3.16 A)
 &rst
  ixpk= 985, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 245, 246,
 &end
#
#    0 AMB  10-2:986      3 THR  HN          5.50    (#    986:10  Single Ambig)
 &rst
  ixpk= 986, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  26,  27,  72,  73,
 &end
#
#    2 GLN  HG+           3 THR  HN          5.50    (#    987:10  Unique    3.59, 4.54 A)
 &rst
  ixpk= 987, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  21,  22,
 &end
#
#    3 THR  MG2           3 THR  HN          5.50    (#    988:10  Unique    2.51, 4.21 A)
 &rst
  ixpk= 988, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  37,  38,  39,
 &end
#
#    0 AMB  10-2:989     63 GLU  HN          5.50    (#    989:10  Single Ambig)
 &rst
  ixpk= 989, nxpk= 10, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1023, 951, 952,
 &end
#
#   64 ALA  HN           63 GLU  HN          3.50    (#    990:10  Unique    2.75, 2.79 A)
 &rst
  ixpk= 990, nxpk= 10, iat=1013, 998, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 ALA  HN           63 GLU  HN          5.50    (#    991:10  Unique    4.23, 4.27 A)
 &rst
  ixpk= 991, nxpk= 10, iat= 966, 998, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:992     63 GLU  HN          5.50    (#    992:10  Single Ambig)
 &rst
  ixpk= 992, nxpk= 10, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 983, 984, 983, 984,
 &end
#
#   78 ILE  HN           77 LYS  HN          5.50    (#    993:10  Unique    4.36, 4.39 A)
 &rst
  ixpk= 993, nxpk= 10, iat=1235,1213, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   14 THR  HN           77 LYS  HN          4.50    (#    994:10  Unique    2.83, 2.91 A)
 &rst
  ixpk= 994, nxpk= 10, iat= 213,1213, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13 LEU  HA           77 LYS  HN          5.50    (#    995:10  Unique    4.52, 4.59 A)
 &rst
  ixpk= 995, nxpk= 10, iat= 196,1213, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 MET  HB+          77 LYS  HN          4.50    (#    996:10  Unique    4.08, 4.24 A)
 &rst
  ixpk= 996, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1200,1201,
 &end
#
#   76 MET  HB-          77 LYS  HN          4.50    (#    997:10  Unique    4.08, 4.24 A)
 &rst
  ixpk= 997, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1200,1201,
 &end
#
#   16 LEU  MDX          77 LYS  HN          4.50    (#    998:10  Unique    3.40, 5.59 A)
 &rst
  ixpk= 998, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 250, 251, 252, 254, 255, 256,
 &end
#
#   71 THR  HN           70 ILE  HN          3.50    (#   1000:10  Unique    2.33, 2.40 A)
 &rst
  ixpk= 1000, nxpk= 10, iat=1127,1108, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   68 PHE  HD           70 ILE  HN          5.50    (#   1001:10  Unique    3.42, 5.19 A)
 &rst
  ixpk= 1001, nxpk= 10, iat=  -1,1108, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1074,1082,
 &end
#
#   74 HIS  HB-          70 ILE  HN          5.50    (#   1002:10  Unique    3.90, 4.52 A)
 &rst
  ixpk= 1002, nxpk= 10, iat=  -1,1108, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1173,1174,
 &end
#
#   76 MET  HB-          70 ILE  HN          5.50    (#   1003:10  Unique    3.88, 4.49 A)
 &rst
  ixpk= 1003, nxpk= 10, iat=  -1,1108, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1200,1201,
 &end
#
#   76 MET  ME           70 ILE  HN          5.50    (#   1004:10  Unique    4.75, 5.77 A)
 &rst
  ixpk= 1004, nxpk= 10, iat=  -1,1108, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1207,1208,1209,
 &end
#
#   69 LYS  HD+          70 ILE  HN          4.50    (#   1005:10  Unique    4.20, 4.42 A)
 &rst
  ixpk= 1005, nxpk= 10, iat=  -1,1108, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1096,1097,
 &end
#
#   70 ILE  MD1          70 ILE  HN          4.50    (#   1006:10  Unique    3.58, 4.22 A)
 &rst
  ixpk= 1006, nxpk= 10, iat=  -1,1108, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1121,1122,1123,
 &end
#
#   70 ILE  MG2          70 ILE  HN          4.50    (#   1007:10  Unique    4.41, 4.55 A)
 &rst
  ixpk= 1007, nxpk= 10, iat=  -1,1108, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1114,1115,1116,
 &end
#
#   58 SER  HN           59 ASN  HN          3.50    (#   1010:10  Unique    2.68, 2.77 A)
 &rst
  ixpk= 1010, nxpk= 10, iat= 931, 942, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1011    59 ASN  HN          4.50    (#   1011:10  Single Ambig)
 &rst
  ixpk= 1011, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 951, 952, 895,
 &end
#
#    0 AMB  10-2:1012    59 ASN  HN          4.50    (#   1012:10  Single Ambig)
 &rst
  ixpk= 1012, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 914,1276,1284,
 &end
#
#   60 ALA  HN           59 ASN  HN          3.50    (#   1013:10  Unique    2.82, 2.89 A)
 &rst
  ixpk= 1013, nxpk= 10, iat= 956, 942, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 ALA  HN           59 ASN  HN          5.50    (#   1015:10  Unique    4.24, 4.29 A)
 &rst
  ixpk= 1015, nxpk= 10, iat= 966, 942, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1016    59 ASN  HN          5.50    (#   1016:10  Single Ambig)
 &rst
  ixpk= 1016, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1278,1282,1280, 951, 952,
 &end
#
#   58 SER  HA           59 ASN  HN          4.50    (#   1017:10  Unique    3.61, 3.63 A)
 &rst
  ixpk= 1017, nxpk= 10, iat= 933, 942, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1018    59 ASN  HN          5.50    (#   1018:10  Single Ambig)
 &rst
  ixpk= 1018, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 980, 981, 162,
 &end
#
#    0 AMB  10-2:1019    59 ASN  HN          5.50    (#   1019:10  Single Ambig)
 &rst
  ixpk= 1019, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1= 884, 885, 884, 885, 899, 900, 902,
 &end
#
#    0 AMB  10-2:1020    59 ASN  HN          5.50    (#   1020:10  Single Ambig)
 &rst
  ixpk= 1020, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 921, 922, 921, 922,1005,1006,
 &end
#
#   11 LEU  MDY          59 ASN  HN          5.50    (#   1021:10  Unique    4.39, 5.80 A)
 &rst
  ixpk= 1021, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 164, 165, 166, 168, 169, 170,
 &end
#
#    0 AMB  10-2:1022    59 ASN  HN          4.50    (#   1022:10  Single Ambig)
 &rst
  ixpk= 1022, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 164, 165, 166, 168, 169, 170, 904, 905, 906, 908,
       909, 910,
 &end
#
#    0 AMB  10-2:1023     0 AMB  10-1:1023   5.50    (#   1023:10  Double Ambig)
 &rst
  ixpk= 1023, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 250, 251, 252, 254, 255, 256, 844,1278,1282,1280,
       842, 846,
 igr2= 771, 976,
 &end
#
#   61 ALA  HN           62 LYS  HN          3.50    (#   1024:10  Unique    2.70, 2.72 A)
 &rst
  ixpk= 1024, nxpk= 10, iat= 966, 976, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1025    62 LYS  HN          4.50    (#   1025:10  Single Ambig)
 &rst
  ixpk= 1025, nxpk= 10, iat=  -1, 976, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1013, 956,1042,
 &end
#
#   12 PHE  HD           48 ALA  HN          5.50    (#   1026:10  Unique    3.80, 5.22 A)
 &rst
  ixpk= 1026, nxpk= 10, iat=  -1, 771, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 182, 190,
 &end
#
#   61 ALA  HA           62 LYS  HN          4.50    (#   1028:10  Unique    3.57, 3.59 A)
 &rst
  ixpk= 1028, nxpk= 10, iat= 968, 976, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   53 THR  HN           36 LYS  HN          5.50    (#   1029:10  Unique    4.03, 4.25 A)
 &rst
  ixpk= 1029, nxpk= 10, iat= 852, 559, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1030    36 LYS  HN          5.50    (#   1030:10  Single Ambig)
 &rst
  ixpk= 1030, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 832, 596,
 &end
#
#   35 PHE  HN           36 LYS  HN          4.50    (#   1031:10  Unique    4.53, 4.54 A)
 &rst
  ixpk= 1031, nxpk= 10, iat= 539, 559, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   52 PHE  HD           36 LYS  HN          4.50    (#   1032:10  Unique    4.29, 4.70 A)
 &rst
  ixpk= 1032, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 840, 848,
 &end
#
#    0 AMB  10-2:1033    36 LYS  HN          5.50    (#   1033:10  Single Ambig)
 &rst
  ixpk= 1033, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 842, 846, 551, 844,
 &end
#
#   35 PHE  HD           36 LYS  HN          4.50    (#   1034:10  Unique    2.73, 3.92 A)
 &rst
  ixpk= 1034, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 547, 555,
 &end
#
#   37 GLU  HN           36 LYS  HN          3.50    (#   1035:10  Unique    2.27, 2.33 A)
 &rst
  ixpk= 1035, nxpk= 10, iat= 581, 559, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   28 LEU  HN           27 MET  HN          3.50    (#   1036:10  Unique    2.68, 2.78 A)
 &rst
  ixpk= 1036, nxpk= 10, iat= 428, 411, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   25 LEU  HN           27 MET  HN          5.50    (#   1037:10  Unique    4.18, 4.28 A)
 &rst
  ixpk= 1037, nxpk= 10, iat= 381, 411, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   29 PHE  HN           27 MET  HN          5.50    (#   1038:10  Unique    4.46, 4.57 A)
 &rst
  ixpk= 1038, nxpk= 10, iat= 447, 411, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1039    27 MET  HN          5.50    (#   1039:10  Single Ambig)
 &rst
  ixpk= 1039, nxpk= 10, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 549, 553, 318,
 &end
#
#   28 LEU  HG           27 MET  HN          5.50    (#   1043:10  Unique    4.75, 4.88 A)
 &rst
  ixpk= 1043, nxpk= 10, iat= 435, 411, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   28 LEU  HB-          27 MET  HN          5.50    (#   1044:10  Unique    4.88, 5.66 A)
 &rst
  ixpk= 1044, nxpk= 10, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 432, 433,
 &end
#
#    0 AMB  10-2:1045    34 GLY  HN          4.50    (#   1045:10  Single Ambig)
 &rst
  ixpk= 1045, nxpk= 10, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 840, 848, 926, 927,
 &end
#
#   57 GLN  HE2-         34 GLY  HN          5.50    (#   1046:10  Unique    3.93, 4.67 A)
 &rst
  ixpk= 1046, nxpk= 10, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 926, 927,
 &end
#
#   33 PRO  HD+          34 GLY  HN          5.50    (#   1047:10  Unique    3.10, 3.76 A)
 &rst
  ixpk= 1047, nxpk= 10, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 519, 520,
 &end
#
#    0 AMB  10-2:1048    34 GLY  HN          5.50    (#   1048:10  Single Ambig)
 &rst
  ixpk= 1048, nxpk= 10, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 502, 503, 543, 544,
 &end
#
#   33 PRO  HG+          34 GLY  HN          4.50    (#   1050:10  Unique    3.22, 4.33 A)
 &rst
  ixpk= 1050, nxpk= 10, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 522, 523,
 &end
#
#   33 PRO  HG-          34 GLY  HN          4.50    (#   1051:10  Unique    3.22, 4.33 A)
 &rst
  ixpk= 1051, nxpk= 10, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 522, 523,
 &end
#
#   33 PRO  HB-          34 GLY  HN          4.50    (#   1052:10  Unique    3.28, 4.17 A)
 &rst
  ixpk= 1052, nxpk= 10, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 525, 526,
 &end
#
#   53 THR  MG2          34 GLY  HN          7.00    (#   1053:10  Unique    6.07, 6.81 A)
 &rst
  ixpk= 1053, nxpk= 10, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 858, 859, 860,
 &end
#
#    0 AMB  10-2:1054    14 THR  HN          5.50    (#   1054:10  Single Ambig)
 &rst
  ixpk= 1054, nxpk= 10, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  26,  27, 236, 237,
 &end
#
#   47 ILE  HA           14 THR  HN          5.50    (#   1055:10  Unique    4.36, 4.49 A)
 &rst
  ixpk= 1055, nxpk= 10, iat= 754, 213, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1056    14 THR  HN          5.50    (#   1056:10  Single Ambig)
 &rst
  ixpk= 1056, nxpk= 10, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 243, 229,1258, 773,
 &end
#
#   76 MET  HG-          14 THR  HN          5.50    (#   1057:10  Unique    4.02, 4.22 A)
 &rst
  ixpk= 1057, nxpk= 10, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1203,1204,
 &end
#
#    0 AMB  10-2:1058    14 THR  HN          4.50    (#   1058:10  Single Ambig)
 &rst
  ixpk= 1058, nxpk= 10, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1217,1218,1226,1227,
 &end
#
#   14 THR  HA           14 THR  HN          3.50    (#   1059:10  Unique    2.94, 2.95 A)
 &rst
  ixpk= 1059, nxpk= 10, iat= 215, 213, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 GLN  HN           66 GLN  HE2+        5.50    (#   1060:10  Unique    5.71, 6.15 A)
 &rst
  ixpk= 1060, nxpk= 10, iat=1042,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1054,1055,
 &end
#
#    0 AMB  10-2:1061     0 AMB  10-1:1061   4.50    (#   1061:10  Double Ambig)
 &rst
  ixpk= 1061, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 989, 990,1046,1047,
 igr2=1054,1055,1054,1055,
 &end
#
#   62 LYS  HE-          66 GLN  HE2+        5.50    (#   1062:10  Unique    2.22, 3.62 A)
 &rst
  ixpk= 1062, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 989, 990,
 igr2=1054,1055,
 &end
#
#   66 GLN  HB-          66 GLN  HE2+        5.50    (#   1063:10  Unique    3.30, 4.50 A)
 &rst
  ixpk= 1063, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1046,1047,
 igr2=1054,1055,
 &end
#
#   66 GLN  HG+          66 GLN  HE2+        4.50    (#   1064:10  Unique    2.19, 3.20 A)
 &rst
  ixpk= 1064, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1049,1050,
 igr2=1054,1055,
 &end
#
#    0 AMB  10-2:1065     0 AMB  10-1:1065   4.50    (#   1065:10  Double Ambig)
 &rst
  ixpk= 1065, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.80, r4= 9.30,
 igr1=1239,1223,1224,1223,1224,1245,1246,
 igr2=1054,1055,1054,1055,1054,1055,1054,1055,
 &end
#
#    0 AMB  10-2:1066     0 AMB  10-1:1066   5.50    (#   1066:10  Double Ambig)
 &rst
  ixpk= 1066, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1220,1221,1220,1221,
 igr2=1054,1055,1054,1055,
 &end
#
#   78 ILE  MD1          66 GLN  HE2+        5.50    (#   1067:10  Unique    5.01, 6.34 A)
 &rst
  ixpk= 1067, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1248,1249,1250,
 igr2=1054,1055,
 &end
#
#   78 ILE  MG2          66 GLN  HE2+        4.50    (#   1068:10  Unique    4.32, 5.62 A)
 &rst
  ixpk= 1068, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1241,1242,1243,
 igr2=1054,1055,
 &end
#
#   66 GLN  HG-          66 GLN  HE2+        4.50    (#   1069:10  Unique    2.19, 3.20 A)
 &rst
  ixpk= 1069, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1049,1050,
 igr2=1054,1055,
 &end
#
#   58 SER  HN           54 THR  HN          5.50    (#   1071:10  Unique    3.88, 3.97 A)
 &rst
  ixpk= 1071, nxpk= 10, iat= 931, 866, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   56 LEU  HN           54 THR  HN          5.50    (#   1072:10  Unique    4.82, 4.99 A)
 &rst
  ixpk= 1072, nxpk= 10, iat= 895, 866, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   57 GLN  HN           54 THR  HN          4.50    (#   1073:10  Unique    3.60, 3.79 A)
 &rst
  ixpk= 1073, nxpk= 10, iat= 914, 866, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1074    54 THR  HN          4.50    (#   1074:10  Single Ambig)
 &rst
  ixpk= 1074, nxpk= 10, iat=  -1, 866, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 926, 927, 840, 848,
 &end
#
#   57 GLN  HB-          54 THR  HN          4.50    (#   1075:10  Unique    2.62, 3.54 A)
 &rst
  ixpk= 1075, nxpk= 10, iat=  -1, 866, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 918, 919,
 &end
#
#    0 AMB  10-2:1076    54 THR  HN          5.50    (#   1076:10  Single Ambig)
 &rst
  ixpk= 1076, nxpk= 10, iat=  -1, 866, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 899, 900, 884, 885, 884, 885,
 &end
#
#    0 AMB  10-2:1077    54 THR  HN          5.50    (#   1077:10  Single Ambig)
 &rst
  ixpk= 1077, nxpk= 10, iat=  -1, 866, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 887, 888, 824, 825,
 &end
#
#   36 LYS  HD+          54 THR  HN          5.50    (#   1078:10  Unique    5.35, 6.14 A)
 &rst
  ixpk= 1078, nxpk= 10, iat=  -1, 866, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 569, 570,
 &end
#
#   34 GLY  HA+          54 THR  HN          5.50    (#   1079:10  Unique    3.99, 4.99 A)
 &rst
  ixpk= 1079, nxpk= 10, iat=  -1, 866, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 534, 535,
 &end
#
#   66 GLN  HN           66 GLN  HE2-        5.50    (#   1080:10  Unique    5.71, 6.15 A)
 &rst
  ixpk= 1080, nxpk= 10, iat=1042,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1054,1055,
 &end
#
#   77 LYS  HA           66 GLN  HE2-        5.50    (#   1081:10  Unique    3.05, 4.68 A)
 &rst
  ixpk= 1081, nxpk= 10, iat=1215,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1054,1055,
 &end
#
#   66 GLN  HA           66 GLN  HE2-        5.50    (#   1082:10  Unique    4.35, 4.79 A)
 &rst
  ixpk= 1082, nxpk= 10, iat=1044,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1054,1055,
 &end
#
#    0 AMB  10-2:1083    66 GLN  HE2-        3.50    (#   1083:10  Single Ambig)
 &rst
  ixpk= 1083, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 989, 990,1046,1047,
 igr2=1054,1055,
 &end
#
#   62 LYS  HE-          66 GLN  HE2-        5.50    (#   1084:10  Unique    2.22, 3.62 A)
 &rst
  ixpk= 1084, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 989, 990,
 igr2=1054,1055,
 &end
#
#   66 GLN  HB-          66 GLN  HE2-        4.50    (#   1085:10  Unique    3.30, 4.50 A)
 &rst
  ixpk= 1085, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1046,1047,
 igr2=1054,1055,
 &end
#
#    0 AMB  10-2:1086    66 GLN  HE2-        5.50    (#   1086:10  Single Ambig)
 &rst
  ixpk= 1086, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1220,1221,1220,1221,
 igr2=1054,1055,
 &end
#
#   78 ILE  MD1          66 GLN  HE2-        4.50    (#   1087:10  Unique    5.01, 6.34 A)
 &rst
  ixpk= 1087, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1248,1249,1250,
 igr2=1054,1055,
 &end
#
#   76 MET  HN           71 THR  HN          5.50    (#   1088:10  Unique    5.15, 5.24 A)
 &rst
  ixpk= 1088, nxpk= 10, iat=1196,1127, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   75 ALA  HN           71 THR  HN          7.00    (#   1089:10  Unique    5.19, 5.39 A)
 &rst
  ixpk= 1089, nxpk= 10, iat=1186,1127, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   76 MET  ME           71 THR  HN          7.00    (#   1090:10  Unique    6.79, 7.65 A)
 &rst
  ixpk= 1090, nxpk= 10, iat=  -1,1127, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1207,1208,1209,
 &end
#
#   28 LEU  MDY          31 GLN  HE2+        5.50    (#   1091:10  Unique    3.32, 5.32 A)
 &rst
  ixpk= 1091, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 437, 438, 439, 441, 442, 443,
 igr2= 493, 494,
 &end
#
#   65 LEU  MDX          31 GLN  HE2+        5.50    (#   1092:10  Unique    2.19, 3.97 A)
 &rst
  ixpk= 1092, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1032,1033,1034,1036,1037,1038,
 igr2= 493, 494,
 &end
#
#   64 ALA  MB           31 GLN  HE2+        5.50    (#   1093:10  Unique    5.22, 6.46 A)
 &rst
  ixpk= 1093, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1017,1018,1019,
 igr2= 493, 494,
 &end
#
#    0 AMB  10-2:1095     0 AMB  10-1:1095   5.50    (#   1095:10  Double Ambig)
 &rst
  ixpk= 1095, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 821, 822, 821, 822,
 igr2= 131, 132, 131, 132,
 &end
#
#    0 AMB  10-2:1096     0 AMB  10-1:1096   5.50    (#   1096:10  Double Ambig)
 &rst
  ixpk= 1096, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 563, 564, 858, 859, 860,
 igr2= 131, 132, 131, 132,
 &end
#
#    0 AMB  10-2:1097     0 AMB  10-1:1097   5.50    (#   1097:10  Double Ambig)
 &rst
  ixpk= 1097, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.25, r4=10.75,
 igr1= 569, 570, 566, 567, 872, 873, 874,
 igr2= 131, 132, 131, 132, 131, 132,
 &end
#
#   47 ILE  HN           44 ARG  HE          5.50    (#   1098:10  Unique    3.60, 4.24 A)
 &rst
  ixpk= 1098, nxpk= 10, iat= 752, 712, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   44 ARG  HD-          44 ARG  HE          4.50    (#   1099:10  Unique    2.29, 2.80 A)
 &rst
  ixpk= 1099, nxpk= 10, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 709, 710,
 &end
#
#   44 ARG  HD+          44 ARG  HE          4.50    (#   1100:10  Unique    2.29, 2.80 A)
 &rst
  ixpk= 1100, nxpk= 10, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 709, 710,
 &end
#
#   44 ARG  HB+          44 ARG  HE          5.50    (#   1101:10  Unique    1.96, 2.87 A)
 &rst
  ixpk= 1101, nxpk= 10, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 703, 704,
 &end
#
#   44 ARG  HB-          44 ARG  HE          5.50    (#   1102:10  Unique    1.96, 2.87 A)
 &rst
  ixpk= 1102, nxpk= 10, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 703, 704,
 &end
#
#    0 AMB  10-2:1103    44 ARG  HE          4.50    (#   1103:10  Single Ambig)
 &rst
  ixpk= 1103, nxpk= 10, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 706, 707, 706, 707,
 &end
#
#   47 ILE  MD1          44 ARG  HE          4.50    (#   1104:10  Unique    2.50, 4.02 A)
 &rst
  ixpk= 1104, nxpk= 10, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 765, 766, 767,
 &end
#
#   11 LEU  HN           10 ILE  HN          5.50    (#   1105:10  Unique    4.08, 4.20 A)
 &rst
  ixpk= 1105, nxpk= 10, iat= 155, 136, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   81 ALA  HN           10 ILE  HN          5.50    (#   1106:10  Unique    3.92, 4.05 A)
 &rst
  ixpk= 1106, nxpk= 10, iat=1288, 136, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   52 PHE  HN           10 ILE  HN          5.50    (#   1107:10  Unique    4.97, 5.04 A)
 &rst
  ixpk= 1107, nxpk= 10, iat= 832, 136, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    8 ASN  HD2+         10 ILE  HN          4.50    (#   1108:10  Unique    2.57, 3.19 A)
 &rst
  ixpk= 1108, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 114, 115,
 &end
#
#    8 ASN  HD2-         10 ILE  HN          5.50    (#   1109:10  Unique    2.57, 3.19 A)
 &rst
  ixpk= 1109, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 114, 115,
 &end
#
#    8 ASN  HB-          10 ILE  HN          5.50    (#   1110:10  Unique    3.02, 3.87 A)
 &rst
  ixpk= 1110, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 109, 110,
 &end
#
#    8 ASN  HB+          10 ILE  HN          4.50    (#   1111:10  Unique    3.02, 3.87 A)
 &rst
  ixpk= 1111, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 109, 110,
 &end
#
#   55 GLU  HG+          10 ILE  HN          7.00    (#   1112:10  Unique    4.76, 5.73 A)
 &rst
  ixpk= 1112, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 887, 888,
 &end
#
#    9 GLN  HB-          10 ILE  HN          4.50    (#   1113:10  Unique    4.36, 4.60 A)
 &rst
  ixpk= 1113, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 123, 124,
 &end
#
#    9 GLN  HB+          10 ILE  HN          4.50    (#   1114:10  Unique    4.36, 4.60 A)
 &rst
  ixpk= 1114, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 123, 124,
 &end
#
#   76 MET  HN           69 LYS  HN          5.50    (#   1115:10  Unique    4.64, 4.69 A)
 &rst
  ixpk= 1115, nxpk= 10, iat=1196,1086, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   68 PHE  HN           69 LYS  HN          4.50    (#   1116:10  Unique    4.49, 4.51 A)
 &rst
  ixpk= 1116, nxpk= 10, iat=1066,1086, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   70 ILE  HN           69 LYS  HN          4.50    (#   1117:10  Unique    4.19, 4.27 A)
 &rst
  ixpk= 1117, nxpk= 10, iat=1108,1086, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   68 PHE  HD           69 LYS  HN          4.50    (#   1118:10  Unique    4.07, 4.35 A)
 &rst
  ixpk= 1118, nxpk= 10, iat=  -1,1086, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1074,1082,
 &end
#
#   76 MET  ME           69 LYS  HN          7.00    (#   1119:10  Unique    6.59, 7.81 A)
 &rst
  ixpk= 1119, nxpk= 10, iat=  -1,1086, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1207,1208,1209,
 &end
#
#    0 AMB  10-2:1120    69 LYS  HN          5.50    (#   1120:10  Single Ambig)
 &rst
  ixpk= 1120, nxpk= 10, iat=  -1,1086, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1118,1119,1112,
 &end
#
#   69 LYS  HB+          69 LYS  HN          3.50    (#   1121:10  Unique    2.42, 3.05 A)
 &rst
  ixpk= 1121, nxpk= 10, iat=  -1,1086, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1090,1091,
 &end
#
#   30 ASN  HN           32 PHE  HN          5.50    (#   1123:10  Unique    4.51, 4.52 A)
 &rst
  ixpk= 1123, nxpk= 10, iat= 467, 498, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   32 PHE  HZ           32 PHE  HN          7.00    (#   1126:10  Unique    5.64, 5.72 A)
 &rst
  ixpk= 1126, nxpk= 10, iat= 510, 498, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   31 GLN  HN           32 PHE  HN          3.50    (#   1128:10  Unique    2.81, 2.84 A)
 &rst
  ixpk= 1128, nxpk= 10, iat= 481, 498, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   44 ARG  HD+          44 ARG  HN          5.50    (#   1129:10  Unique    3.90, 5.13 A)
 &rst
  ixpk= 1129, nxpk= 10, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 709, 710,
 &end
#
#   44 ARG  HE           44 ARG  HN          5.50    (#   1130:10  Unique    4.78, 5.43 A)
 &rst
  ixpk= 1130, nxpk= 10, iat= 712, 699, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   46 ASP  HN           44 ARG  HN          5.50    (#   1131:10  Unique    4.66, 5.16 A)
 &rst
  ixpk= 1131, nxpk= 10, iat= 740, 699, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   41 VAL  HN           44 ARG  HN          5.50    (#   1132:10  Unique    4.05, 4.55 A)
 &rst
  ixpk= 1132, nxpk= 10, iat= 655, 699, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   58 SER  HN           56 LEU  HN          5.50    (#   1133:10  Unique    4.11, 4.24 A)
 &rst
  ixpk= 1133, nxpk= 10, iat= 931, 895, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   54 THR  HN           56 LEU  HN          5.50    (#   1134:10  Unique    4.82, 4.99 A)
 &rst
  ixpk= 1134, nxpk= 10, iat= 866, 895, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   57 GLN  HN           56 LEU  HN          3.50    (#   1135:10  Unique    2.51, 2.59 A)
 &rst
  ixpk= 1135, nxpk= 10, iat= 914, 895, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   54 THR  HG1          56 LEU  HN          5.50    (#   1136:10  Unique    4.08, 4.20 A)
 &rst
  ixpk= 1136, nxpk= 10, iat= 876, 895, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   75 ALA  HN           74 HIS  HN          4.50    (#   1137:10  Unique    3.20, 3.72 A)
 &rst
  ixpk= 1137, nxpk= 10, iat=1186,1169, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   70 ILE  HN           74 HIS  HN          5.50    (#   1138:10  Unique    4.37, 4.54 A)
 &rst
  ixpk= 1138, nxpk= 10, iat=1108,1169, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   73 THR  HN           74 HIS  HN          4.50    (#   1139:10  Unique    2.41, 2.61 A)
 &rst
  ixpk= 1139, nxpk= 10, iat=1155,1169, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1140    74 HIS  HN          5.50    (#   1140:10  Single Ambig)
 &rst
  ixpk= 1140, nxpk= 10, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1142,1143,1142,1143,
 &end
#
#    0 AMB  10-2:1141    74 HIS  HN          5.50    (#   1141:10  Single Ambig)
 &rst
  ixpk= 1141, nxpk= 10, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=1112,1148,1149,1145,1146,1145,1146,
 &end
#
#   69 LYS  HD-          74 HIS  HN          5.50    (#   1142:10  Unique    3.04, 4.19 A)
 &rst
  ixpk= 1142, nxpk= 10, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1096,1097,
 &end
#
#   56 LEU  HN           57 GLN  HN          3.50    (#   1143:10  Unique    2.51, 2.59 A)
 &rst
  ixpk= 1143, nxpk= 10, iat= 895, 914, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1144    57 GLN  HN          5.50    (#   1144:10  Single Ambig)
 &rst
  ixpk= 1144, nxpk= 10, iat=  -1, 914, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 926, 927, 840, 848, 956,
 &end
#
#   54 THR  HG1          57 GLN  HN          5.50    (#   1145:10  Unique    3.39, 3.54 A)
 &rst
  ixpk= 1145, nxpk= 10, iat= 876, 914, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   54 THR  HA           57 GLN  HN          5.50    (#   1146:10  Unique    4.60, 4.64 A)
 &rst
  ixpk= 1146, nxpk= 10, iat= 868, 914, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   56 LEU  MDX          57 GLN  HN          5.50    (#   1147:10  Unique    4.67, 5.61 A)
 &rst
  ixpk= 1147, nxpk= 10, iat=  -1, 914, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 904, 905, 906, 908, 909, 910,
 &end
#
#   35 PHE  HD           35 PHE  HN          4.50    (#   1149:10  Unique    3.72, 4.43 A)
 &rst
  ixpk= 1149, nxpk= 10, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 547, 555,
 &end
#
#    0 AMB  10-2:1152    35 PHE  HN          5.50    (#   1152:10  Single Ambig)
 &rst
  ixpk= 1152, nxpk= 10, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 918, 919, 525, 526,
 &end
#
#   20 THR  HG1          20 THR  HN          5.50    (#   1153:10  Unique    1.97, 2.04 A)
 &rst
  ixpk= 1153, nxpk= 10, iat= 314, 304, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   21 ASN  HN           20 THR  HN          5.50    (#   1154:10  Unique    4.59, 4.62 A)
 &rst
  ixpk= 1154, nxpk= 10, iat= 318, 304, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   45 HIS  HB-          20 THR  HN          5.50    (#   1155:10  Unique    3.50, 4.46 A)
 &rst
  ixpk= 1155, nxpk= 10, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 727, 728,
 &end
#
#   45 HIS  HB+          20 THR  HN          5.50    (#   1156:10  Unique    3.50, 4.46 A)
 &rst
  ixpk= 1156, nxpk= 10, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 727, 728,
 &end
#
#   17 PRO  HA           20 THR  HN          5.50    (#   1157:10  Unique    4.85, 4.92 A)
 &rst
  ixpk= 1157, nxpk= 10, iat= 270, 304, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   64 ALA  HA           66 GLN  HN          5.50    (#   1159:10  Unique    4.65, 4.68 A)
 &rst
  ixpk= 1159, nxpk= 10, iat=1015,1042, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1160    66 GLN  HN          4.50    (#   1160:10  Single Ambig)
 &rst
  ixpk= 1160, nxpk= 10, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1245,1246,1239,
 &end
#
#   64 ALA  MB           66 GLN  HN          4.50    (#   1161:10  Unique    4.96, 5.55 A)
 &rst
  ixpk= 1161, nxpk= 10, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1017,1018,1019,
 &end
#
#    0 AMB  10-2:1162    66 GLN  HN          4.50    (#   1162:10  Single Ambig)
 &rst
  ixpk= 1162, nxpk= 10, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1027,1028,1027,1028,
 &end
#
#   65 LEU  HG           66 GLN  HN          5.50    (#   1163:10  Unique    4.86, 4.90 A)
 &rst
  ixpk= 1163, nxpk= 10, iat=1030,1042, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   21 ASN  HD2-         21 ASN  HN          5.50    (#   1164:10  Unique    4.15, 5.43 A)
 &rst
  ixpk= 1164, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 327, 328,
 &end
#
#   25 LEU  MDY          21 ASN  HN          5.50    (#   1165:10  Unique    4.65, 5.78 A)
 &rst
  ixpk= 1165, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 390, 391, 392, 394, 395, 396,
 &end
#
#   21 ASN  HD2+         21 ASN  HN          5.50    (#   1166:10  Unique    4.15, 5.43 A)
 &rst
  ixpk= 1166, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 327, 328,
 &end
#
#    0 AMB  10-2:1167    21 ASN  HN          4.50    (#   1167:10  Single Ambig)
 &rst
  ixpk= 1167, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 381, 304,
 &end
#
#   26 SER  HN           28 LEU  HN          5.50    (#   1168:10  Unique    4.11, 4.15 A)
 &rst
  ixpk= 1168, nxpk= 10, iat= 400, 428, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   29 PHE  HD           28 LEU  HN          5.50    (#   1169:10  Unique    4.02, 5.94 A)
 &rst
  ixpk= 1169, nxpk= 10, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 455, 463,
 &end
#
#   65 LEU  MDX          28 LEU  HN          5.50    (#   1170:10  Unique    5.93, 7.21 A)
 &rst
  ixpk= 1170, nxpk= 10, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1032,1033,1034,1036,1037,1038,
 &end
#
#   59 ASN  HA           61 ALA  HN          5.50    (#   1171:10  Unique    4.40, 4.47 A)
 &rst
  ixpk= 1171, nxpk= 10, iat= 944, 966, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   62 LYS  HA           61 ALA  HN          5.50    (#   1172:10  Unique    5.34, 5.36 A)
 &rst
  ixpk= 1172, nxpk= 10, iat= 978, 966, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   74 HIS  HA           73 THR  HN          5.50    (#   1173:10  Unique    4.99, 5.24 A)
 &rst
  ixpk= 1173, nxpk= 10, iat=1171,1155, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   72 PRO  HD+          73 THR  HN          5.50    (#   1174:10  Unique    2.81, 3.61 A)
 &rst
  ixpk= 1174, nxpk= 10, iat=  -1,1155, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1142,1143,
 &end
#
#    0 AMB  10-2:1175    73 THR  HN          5.50    (#   1175:10  Single Ambig)
 &rst
  ixpk= 1175, nxpk= 10, iat=  -1,1155, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1148,1149,1145,1146,1145,1146,
 &end
#
#   74 HIS  HN           73 THR  HN          3.50    (#   1176:10  Unique    2.41, 2.61 A)
 &rst
  ixpk= 1176, nxpk= 10, iat=1169,1155, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   21 ASN  HN           25 LEU  HN          4.50    (#   1177:10  Unique    3.78, 3.92 A)
 &rst
  ixpk= 1177, nxpk= 10, iat= 318, 381, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1178    25 LEU  HN          5.50    (#   1178:10  Single Ambig)
 &rst
  ixpk= 1178, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 428, 375, 376, 377, 250, 251, 252, 254, 255, 256,
      
 &end
#
#   24 MET  HG+          25 LEU  HN          5.50    (#   1179:10  Unique    3.96, 4.48 A)
 &rst
  ixpk= 1179, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 371, 372,
 &end
#
#   34 GLY  HN           57 GLN  HE2+        5.50    (#   1180:10  Unique    3.93, 4.67 A)
 &rst
  ixpk= 1180, nxpk= 10, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 926, 927,
 &end
#
#   54 THR  HN           57 GLN  HE2+        5.50    (#   1181:10  Unique    3.13, 4.21 A)
 &rst
  ixpk= 1181, nxpk= 10, iat= 866,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 926, 927,
 &end
#
#    0 AMB  10-2:1182     0 AMB  10-1:1182   5.50    (#   1182:10  Double Ambig)
 &rst
  ixpk= 1182, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 519, 520, 916,
 igr2= 926, 927, 926, 927,
 &end
#
#   32 PHE  HB+          57 GLN  HE2+        5.50    (#   1183:10  Unique    5.42, 6.99 A)
 &rst
  ixpk= 1183, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 502, 503,
 igr2= 926, 927,
 &end
#
#   33 PRO  HB-          57 GLN  HE2+        5.50    (#   1184:10  Unique    4.17, 6.06 A)
 &rst
  ixpk= 1184, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 525, 526,
 igr2= 926, 927,
 &end
#
#   54 THR  MG2          57 GLN  HE2+        4.50    (#   1185:10  Unique    3.89, 5.28 A)
 &rst
  ixpk= 1185, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 872, 873, 874,
 igr2= 926, 927,
 &end
#
#   53 THR  MG2          57 GLN  HE2+        5.50    (#   1186:10  Unique    2.63, 3.92 A)
 &rst
  ixpk= 1186, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 858, 859, 860,
 igr2= 926, 927,
 &end
#
#   60 ALA  HN           59 ASN  HD2-        4.50    (#   1187:10  Unique    3.02, 4.22 A)
 &rst
  ixpk= 1187, nxpk= 10, iat= 956,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 951, 952,
 &end
#
#   59 ASN  HA           59 ASN  HD2-        5.50    (#   1189:10  Unique    4.30, 4.56 A)
 &rst
  ixpk= 1189, nxpk= 10, iat= 944,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 951, 952,
 &end
#
#   56 LEU  HA           59 ASN  HD2-        5.50    (#   1190:10  Unique    3.25, 4.41 A)
 &rst
  ixpk= 1190, nxpk= 10, iat= 897,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 951, 952,
 &end
#
#   60 ALA  HA           59 ASN  HD2-        5.50    (#   1191:10  Unique    3.53, 4.31 A)
 &rst
  ixpk= 1191, nxpk= 10, iat= 958,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 951, 952,
 &end
#
#    0 AMB  10-2:1192    59 ASN  HD2-        5.50    (#   1192:10  Single Ambig)
 &rst
  ixpk= 1192, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1002,1003, 980, 981,
 igr2= 951, 952,
 &end
#
#   56 LEU  MDY          59 ASN  HD2-        7.00    (#   1193:10  Unique    3.32, 6.58 A)
 &rst
  ixpk= 1193, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 904, 905, 906, 908, 909, 910,
 igr2= 951, 952,
 &end
#
#   63 GLU  HB-          59 ASN  HD2-        5.50    (#   1194:10  Unique    4.03, 5.86 A)
 &rst
  ixpk= 1194, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1002,1003,
 igr2= 951, 952,
 &end
#
#   10 ILE  HN            8 ASN  HD2-        5.50    (#   1195:10  Unique    2.57, 3.19 A)
 &rst
  ixpk= 1195, nxpk= 10, iat= 136,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 114, 115,
 &end
#
#   81 ALA  HN            8 ASN  HD2-        5.50    (#   1196:10  Unique    2.11, 3.37 A)
 &rst
  ixpk= 1196, nxpk= 10, iat=1288,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 114, 115,
 &end
#
#    0 AMB  10-2:1197     8 ASN  HD2-        5.50    (#   1197:10  Single Ambig)
 &rst
  ixpk= 1197, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 119, 174,
 igr2= 114, 115,
 &end
#
#    5 GLN  HA            5 GLN  HE2-        5.50    (#   1199:10  Unique    2.29, 3.21 A)
 &rst
  ixpk= 1199, nxpk= 10, iat=  62,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  72,  73,
 &end
#
#   34 GLY  HN           57 GLN  HE2-        5.50    (#   1200:10  Unique    3.93, 4.67 A)
 &rst
  ixpk= 1200, nxpk= 10, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 926, 927,
 &end
#
#   34 GLY  HA-          57 GLN  HE2-        4.50    (#   1201:10  Unique    2.21, 3.67 A)
 &rst
  ixpk= 1201, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 534, 535,
 igr2= 926, 927,
 &end
#
#    0 AMB  10-2:1202    57 GLN  HE2-        5.50    (#   1202:10  Single Ambig)
 &rst
  ixpk= 1202, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 916, 854,
 igr2= 926, 927,
 &end
#
#   32 PHE  HB+          57 GLN  HE2-        5.50    (#   1203:10  Unique    5.42, 6.99 A)
 &rst
  ixpk= 1203, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 502, 503,
 igr2= 926, 927,
 &end
#
#    0 AMB  10-2:1204    31 GLN  HN          3.50    (#   1204:10  Single Ambig)
 &rst
  ixpk= 1204, nxpk= 10, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 493, 494, 447,
 &end
#
#   32 PHE  HD           31 GLN  HN          4.50    (#   1205:10  Unique    4.24, 5.24 A)
 &rst
  ixpk= 1205, nxpk= 10, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 506, 514,
 &end
#
#   29 PHE  HA           31 GLN  HN          5.50    (#   1206:10  Unique    3.19, 3.26 A)
 &rst
  ixpk= 1206, nxpk= 10, iat= 449, 481, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   54 THR  HA            9 GLN  HE2-        5.50    (#   1207:10  Unique    4.12, 4.34 A)
 &rst
  ixpk= 1207, nxpk= 10, iat= 868,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 131, 132,
 &end
#
#    0 AMB  10-2:1208     9 GLN  HE2-        5.50    (#   1208:10  Single Ambig)
 &rst
  ixpk= 1208, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 854, 121,
 igr2= 131, 132,
 &end
#
#   22 GLU  HN           21 ASN  HD2-        5.50    (#   1209:10  Unique    3.27, 4.11 A)
 &rst
  ixpk= 1209, nxpk= 10, iat= 332,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 327, 328,
 &end
#
#   46 ASP  HA           47 ILE  HN          4.50    (#   1210:10  Unique    3.35, 3.43 A)
 &rst
  ixpk= 1210, nxpk= 10, iat= 742, 752, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   76 MET  HA           15 ASN  HD2-        5.50    (#   1212:10  Unique    4.19, 5.06 A)
 &rst
  ixpk= 1212, nxpk= 10, iat=1198,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 236, 237,
 &end
#
#   74 HIS  HB+          15 ASN  HD2-        5.50    (#   1214:10  Unique    3.93, 4.95 A)
 &rst
  ixpk= 1214, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1173,1174,
 igr2= 236, 237,
 &end
#
#    0 AMB  10-2:1215    15 ASN  HD2-        5.50    (#   1215:10  Single Ambig)
 &rst
  ixpk= 1215, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1226,1227,1223,1224,1223,1224,
 igr2= 236, 237,
 &end
#
#    0 AMB  10-2:1216    15 ASN  HD2-        5.50    (#   1216:10  Single Ambig)
 &rst
  ixpk= 1216, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1220,1221,1220,1221,
 igr2= 236, 237,
 &end
#
#   63 GLU  HN           65 LEU  HN          5.50    (#   1217:10  Unique    4.39, 4.43 A)
 &rst
  ixpk= 1217, nxpk= 10, iat= 998,1023, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1219    65 LEU  HN          2.80    (#   1219:10  Single Ambig)
 &rst
  ixpk= 1219, nxpk= 10, iat=  -1,1023, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1042,1013,
 &end
#
#   39 ARG  HG+          39 ARG  HE          5.50    (#   1221:10  Unique    2.38, 3.26 A)
 &rst
  ixpk= 1221, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 619, 620,
 &end
#
#   39 ARG  HG-          39 ARG  HE          5.50    (#   1222:10  Unique    2.38, 3.26 A)
 &rst
  ixpk= 1222, nxpk= 10, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 619, 620,
 &end
#
#   63 GLU  HG+          59 ASN  HD2+        5.50    (#   1223:10  Unique    3.04, 4.31 A)
 &rst
  ixpk= 1223, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1005,1006,
 igr2= 951, 952,
 &end
#
#   63 GLU  HG-          59 ASN  HD2+        5.50    (#   1224:10  Unique    3.04, 4.31 A)
 &rst
  ixpk= 1224, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1005,1006,
 igr2= 951, 952,
 &end
#
#   30 ASN  HN           29 PHE  HN          3.50    (#   1225:10  Unique    2.64, 2.69 A)
 &rst
  ixpk= 1225, nxpk= 10, iat= 467, 447, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   27 MET  HN           29 PHE  HN          5.50    (#   1226:10  Unique    4.46, 4.57 A)
 &rst
  ixpk= 1226, nxpk= 10, iat= 411, 447, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   29 PHE  HD           29 PHE  HN          3.50    (#   1227:10  Unique    2.13, 3.60 A)
 &rst
  ixpk= 1227, nxpk= 10, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 455, 463,
 &end
#
#   28 LEU  HN           29 PHE  HN          2.80    (#   1228:10  Unique    2.67, 2.76 A)
 &rst
  ixpk= 1228, nxpk= 10, iat= 428, 447, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   30 ASN  HN           30 ASN  HD2+        5.50    (#   1229:10  Unique    3.40, 5.18 A)
 &rst
  ixpk= 1229, nxpk= 10, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 476, 477,
 &end
#
#    0 AMB  10-2:1230    37 GLU  HN          7.00    (#   1230:10  Single Ambig)
 &rst
  ixpk= 1230, nxpk= 10, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 842, 846, 844,
 &end
#
#    0 AMB  10-2:1232     8 ASN  HN          5.50    (#   1232:10  Single Ambig)
 &rst
  ixpk= 1232, nxpk= 10, iat=  -1, 105, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1288,1268,
 &end
#
#    9 GLN  HN            8 ASN  HN          5.50    (#   1233:10  Unique    4.27, 4.33 A)
 &rst
  ixpk= 1233, nxpk= 10, iat= 119, 105, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   56 LEU  HN            8 ASN  HN          7.00    (#   1234:10  Unique    6.50, 6.73 A)
 &rst
  ixpk= 1234, nxpk= 10, iat= 895, 105, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   58 SER  HG            8 ASN  HN          5.50    (#   1235:10  Unique    3.13, 3.45 A)
 &rst
  ixpk= 1235, nxpk= 10, iat= 938, 105, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    8 ASN  HA            8 ASN  HN          4.50    (#   1236:10  Unique    2.91, 2.94 A)
 &rst
  ixpk= 1236, nxpk= 10, iat= 107, 105, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 GLN  HB-           8 ASN  HN          5.50    (#   1237:10  Unique    5.29, 5.96 A)
 &rst
  ixpk= 1237, nxpk= 10, iat=  -1, 105, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  64,  65,
 &end
#
#   11 LEU  MDY           8 ASN  HN          5.50    (#   1238:10  Unique    4.03, 6.09 A)
 &rst
  ixpk= 1238, nxpk= 10, iat=  -1, 105, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 164, 165, 166, 168, 169, 170,
 &end
#
#   80 PHE  HB-           8 ASN  HN          5.50    (#   1239:10  Unique    3.47, 4.28 A)
 &rst
  ixpk= 1239, nxpk= 10, iat=  -1, 105, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1272,1273,
 &end
#
#    7 PRO  HG+           8 ASN  HN          5.50    (#   1240:10  Unique    4.78, 5.24 A)
 &rst
  ixpk= 1240, nxpk= 10, iat=  -1, 105, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  95,  96,
 &end
#
#   65 LEU  MDY          68 PHE  HN          5.50    (#   1241:10  Unique    5.19, 6.52 A)
 &rst
  ixpk= 1241, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1032,1033,1034,1036,1037,1038,
 &end
#
#   68 PHE  HE           70 ILE  HN          5.50    (#   1242:10  Unique    4.53, 6.05 A)
 &rst
  ixpk= 1242, nxpk= 10, iat=  -1,1108, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1076,1080,
 &end
#
#   47 ILE  HB           13 LEU  HN          5.50    (#   1243:10  Unique    4.11, 4.30 A)
 &rst
  ixpk= 1243, nxpk= 10, iat= 756, 194, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 VAL  MGX          13 LEU  HN          5.50    (#   1245:10  Unique    4.35, 7.12 A)
 &rst
  ixpk= 1245, nxpk= 10, iat=  -1, 194, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 807, 808, 809, 811, 812, 813,
 &end
#
#   51 GLU  HG-          36 LYS  HN          4.50    (#   1247:10  Unique    4.52, 5.33 A)
 &rst
  ixpk= 1247, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 824, 825,
 &end
#
#    0 AMB  10-2:1248    36 LYS  HN          4.50    (#   1248:10  Single Ambig)
 &rst
  ixpk= 1248, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 821, 822, 821, 822, 588, 589,
 &end
#
#   36 LYS  HD+          36 LYS  HN          5.50    (#   1249:10  Unique    3.97, 5.13 A)
 &rst
  ixpk= 1249, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 569, 570,
 &end
#
#    0 AMB  10-2:1250    51 GLU  HN          5.50    (#   1250:10  Single Ambig)
 &rst
  ixpk= 1250, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 840, 848, 625,
 &end
#
#    0 AMB  10-2:1251    51 GLU  HN          5.50    (#   1251:10  Single Ambig)
 &rst
  ixpk= 1251, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 842, 846, 844,
 &end
#
#    0 AMB  10-2:1253    51 GLU  HN          5.50    (#   1253:10  Single Ambig)
 &rst
  ixpk= 1253, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 583, 561, 935, 936,
 &end
#
#   37 GLU  HB+          51 GLU  HN          4.50    (#   1254:10  Unique    3.53, 4.34 A)
 &rst
  ixpk= 1254, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 585, 586,
 &end
#
#   67 GLY  HN           76 MET  HN          5.50    (#   1255:10  Unique    4.32, 4.38 A)
 &rst
  ixpk= 1255, nxpk= 10, iat=1059,1196, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   67 GLY  HA+          76 MET  HN          5.50    (#   1257:10  Unique    4.17, 4.92 A)
 &rst
  ixpk= 1257, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1061,1062,
 &end
#
#   68 PHE  HA           76 MET  HN          5.50    (#   1258:10  Unique    4.58, 4.62 A)
 &rst
  ixpk= 1258, nxpk= 10, iat=1068,1196, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1259    76 MET  HN          5.50    (#   1259:10  Single Ambig)
 &rst
  ixpk= 1259, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1110,1044,
 &end
#
#   15 ASN  HB+          76 MET  HN          5.50    (#   1260:10  Unique    5.48, 6.43 A)
 &rst
  ixpk= 1260, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 231, 232,
 &end
#
#   68 PHE  HB-          76 MET  HN          5.50    (#   1261:10  Unique    3.52, 4.32 A)
 &rst
  ixpk= 1261, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1070,1071,
 &end
#
#    0 AMB  10-2:1262    76 MET  HN          5.50    (#   1262:10  Single Ambig)
 &rst
  ixpk= 1262, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1096,1097,1245,1246,
 &end
#
#   16 LEU  MDX          76 MET  HN          5.50    (#   1264:10  Unique    5.02, 7.37 A)
 &rst
  ixpk= 1264, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 250, 251, 252, 254, 255, 256,
 &end
#
#   75 ALA  HA           75 ALA  HN          3.50    (#   1267:10  Unique    2.90, 2.92 A)
 &rst
  ixpk= 1267, nxpk= 10, iat=1188,1186, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   74 HIS  HA           75 ALA  HN          2.80    (#   1268:10  Unique    2.13, 2.20 A)
 &rst
  ixpk= 1268, nxpk= 10, iat=1171,1186, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   15 ASN  HB+          75 ALA  HN          5.50    (#   1269:10  Unique    4.96, 5.62 A)
 &rst
  ixpk= 1269, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 231, 232,
 &end
#
#   74 HIS  HB+          75 ALA  HN          4.50    (#   1270:10  Unique    3.83, 4.25 A)
 &rst
  ixpk= 1270, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1173,1174,
 &end
#
#    0 AMB  10-2:1271    75 ALA  HN          4.50    (#   1271:10  Single Ambig)
 &rst
  ixpk= 1271, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1099,1100,1173,1174,
 &end
#
#   69 LYS  HD+          75 ALA  HN          5.50    (#   1272:10  Unique    3.53, 3.94 A)
 &rst
  ixpk= 1272, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1096,1097,
 &end
#
#   69 LYS  HD-          75 ALA  HN          4.50    (#   1273:10  Unique    3.53, 3.94 A)
 &rst
  ixpk= 1273, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1096,1097,
 &end
#
#   75 ALA  MB           75 ALA  HN          2.80    (#   1274:10  Unique    2.40, 2.91 A)
 &rst
  ixpk= 1274, nxpk= 10, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1190,1191,1192,
 &end
#
#    0 AMB  10-2:1275    77 LYS  HN          5.50    (#   1275:10  Single Ambig)
 &rst
  ixpk= 1275, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 243, 229,
 &end
#
#    0 AMB  10-2:1276    77 LYS  HN          3.50    (#   1276:10  Single Ambig)
 &rst
  ixpk= 1276, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1220,1221,1220,1221,
 &end
#
#    0 AMB  10-2:1277    77 LYS  HN          5.50    (#   1277:10  Single Ambig)
 &rst
  ixpk= 1277, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1245,1246,1121,1122,1123,
 &end
#
#   13 LEU  MDX          77 LYS  HN          5.50    (#   1278:10  Unique    5.56, 6.59 A)
 &rst
  ixpk= 1278, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 203, 204, 205, 207, 208, 209,
 &end
#
#   14 THR  MG2          77 LYS  HN          5.50    (#   1279:10  Unique    5.82, 6.38 A)
 &rst
  ixpk= 1279, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 219, 220, 221,
 &end
#
#   15 ASN  HN           77 LYS  HN          5.50    (#   1280:10  Unique    4.94, 5.01 A)
 &rst
  ixpk= 1280, nxpk= 10, iat= 227,1213, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   72 PRO  HA           73 THR  HN          5.50    (#   1282:10  Unique    2.21, 3.48 A)
 &rst
  ixpk= 1282, nxpk= 10, iat=1151,1155, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   72 PRO  HB+          73 THR  HN          5.50    (#   1283:10  Unique    2.65, 3.69 A)
 &rst
  ixpk= 1283, nxpk= 10, iat=  -1,1155, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1148,1149,
 &end
#
#    9 GLN  HE2+          9 GLN  HN          7.00    (#   1284:10  Unique    5.21, 5.60 A)
 &rst
  ixpk= 1284, nxpk= 10, iat=  -1, 119, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 131, 132,
 &end
#
#    8 ASN  HD2-          9 GLN  HN          5.50    (#   1285:10  Unique    3.65, 4.55 A)
 &rst
  ixpk= 1285, nxpk= 10, iat=  -1, 119, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 114, 115,
 &end
#
#    0 AMB  10-2:1286     9 GLN  HN          7.00    (#   1286:10  Single Ambig)
 &rst
  ixpk= 1286, nxpk= 10, iat=  -1, 119, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr1=1327,1328,1327,1328,  98,  99,1292,1293,1294,
 &end
#
#   54 THR  HN           52 PHE  HN          5.50    (#   1288:10  Unique    5.25, 5.33 A)
 &rst
  ixpk= 1288, nxpk= 10, iat= 866, 832, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 LEU  HN           52 PHE  HN          5.50    (#   1289:10  Unique    5.03, 5.20 A)
 &rst
  ixpk= 1289, nxpk= 10, iat= 155, 832, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    8 ASN  HD2+         83 LYS  HN          5.50    (#   1290:10  Unique    2.67, 3.60 A)
 &rst
  ixpk= 1290, nxpk= 10, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 114, 115,
 &end
#
#    8 ASN  HD2-         83 LYS  HN          5.50    (#   1291:10  Unique    2.67, 3.60 A)
 &rst
  ixpk= 1291, nxpk= 10, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 114, 115,
 &end
#
#    5 GLN  HB+          83 LYS  HN          7.00    (#   1292:10  Unique    5.38, 6.31 A)
 &rst
  ixpk= 1292, nxpk= 10, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=  64,  65,
 &end
#
#    0 AMB  10-2:1293    83 LYS  HN          5.50    (#   1293:10  Single Ambig)
 &rst
  ixpk= 1293, nxpk= 10, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 149, 150, 151, 146, 147,
 &end
#
#   82 LYS  HG+          83 LYS  HN          4.50    (#   1294:10  Unique    3.94, 4.93 A)
 &rst
  ixpk= 1294, nxpk= 10, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1305,1306,
 &end
#
#   12 PHE  HN           11 LEU  HN          5.50    (#   1295:10  Unique    4.35, 4.43 A)
 &rst
  ixpk= 1295, nxpk= 10, iat= 174, 155, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   49 PHE  HD           11 LEU  HN          5.50    (#   1296:10  Unique    4.07, 6.18 A)
 &rst
  ixpk= 1296, nxpk= 10, iat=  -1, 155, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 789, 797,
 &end
#
#   48 ALA  HA           39 ARG  HN          5.50    (#   1298:10  Unique    4.75, 5.01 A)
 &rst
  ixpk= 1298, nxpk= 10, iat= 773, 612, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   66 GLN  HB-          78 ILE  HN          5.50    (#   1300:10  Unique    4.47, 5.33 A)
 &rst
  ixpk= 1300, nxpk= 10, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1046,1047,
 &end
#
#   10 ILE  HN           81 ALA  HN          5.50    (#   1302:10  Unique    3.92, 4.05 A)
 &rst
  ixpk= 1302, nxpk= 10, iat= 136,1288, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   49 PHE  HD           81 ALA  HN          5.50    (#   1303:10  Unique    5.14, 7.53 A)
 &rst
  ixpk= 1303, nxpk= 10, iat=  -1,1288, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 789, 797,
 &end
#
#    0 AMB  10-2:1305    81 ALA  HN          5.50    (#   1305:10  Single Ambig)
 &rst
  ixpk= 1305, nxpk= 10, iat=  -1,1288, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1258,  47,
 &end
#
#   11 LEU  HG           81 ALA  HN          5.50    (#   1306:10  Unique    4.61, 5.00 A)
 &rst
  ixpk= 1306, nxpk= 10, iat= 162,1288, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   49 PHE  HN           41 VAL  HN          5.50    (#   1308:10  Unique    4.24, 5.17 A)
 &rst
  ixpk= 1308, nxpk= 10, iat= 781, 655, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   48 ALA  HA           41 VAL  HN          4.50    (#   1309:10  Unique    2.50, 3.28 A)
 &rst
  ixpk= 1309, nxpk= 10, iat= 773, 655, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   42 PRO  HD-          41 VAL  HN          5.50    (#   1310:10  Unique    3.78, 4.78 A)
 &rst
  ixpk= 1310, nxpk= 10, iat=  -1, 655, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 672, 673,
 &end
#
#   48 ALA  MB           41 VAL  HN          4.50    (#   1311:10  Unique    4.02, 5.05 A)
 &rst
  ixpk= 1311, nxpk= 10, iat=  -1, 655, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 775, 776, 777,
 &end
#
#   72 PRO  HA           74 HIS  HN          4.50    (#   1319:10  Unique    3.56, 4.03 A)
 &rst
  ixpk= 1319, nxpk= 10, iat=1151,1169, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   17 PRO  HD-          74 HIS  HN          5.50    (#   1320:10  Unique    4.76, 5.80 A)
 &rst
  ixpk= 1320, nxpk= 10, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 261, 262,
 &end
#
#   69 LYS  HB-          74 HIS  HN          5.50    (#   1321:10  Unique    3.80, 5.36 A)
 &rst
  ixpk= 1321, nxpk= 10, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1090,1091,
 &end
#
#    4 GLU  HB+           4 GLU  HN          4.50    (#   1322:10  Unique    2.24, 3.21 A)
 &rst
  ixpk= 1322, nxpk= 10, iat=  -1,  45, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  49,  50,
 &end
#
#    5 GLN  HE2-          5 GLN  HN          5.50    (#   1323:10  Unique    3.95, 5.05 A)
 &rst
  ixpk= 1323, nxpk= 10, iat=  -1,  60, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  72,  73,
 &end
#
#   80 PHE  HB+           5 GLN  HN          5.50    (#   1324:10  Unique    2.12, 3.74 A)
 &rst
  ixpk= 1324, nxpk= 10, iat=  -1,  60, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1272,1273,
 &end
#
#   80 PHE  HB-           5 GLN  HN          5.50    (#   1325:10  Unique    2.12, 3.74 A)
 &rst
  ixpk= 1325, nxpk= 10, iat=  -1,  60, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1272,1273,
 &end
#
#   79 THR  MG2           5 GLN  HN          5.50    (#   1326:10  Unique    3.95, 5.59 A)
 &rst
  ixpk= 1326, nxpk= 10, iat=  -1,  60, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1260,1261,1262,
 &end
#
#    0 AMB  10-2:1327     0 AMB  10-1:1327   5.50    (#   1327:10  Double Ambig)
 &rst
  ixpk= 1327, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1288, 781,
 igr2=1298, 636,
 &end
#
#   49 PHE  HD            0 AMB  10-1:1328   5.50    (#   1328:10  Single Ambig)
 &rst
  ixpk= 1328, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 789, 797,
 igr2=1298, 636,
 &end
#
#   81 ALA  HA           82 LYS  HN          2.80    (#   1329:10  Unique    2.19, 2.36 A)
 &rst
  ixpk= 1329, nxpk= 10, iat=1290,1298, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   82 LYS  HA           82 LYS  HN          3.50    (#   1330:10  Unique    2.93, 2.97 A)
 &rst
  ixpk= 1330, nxpk= 10, iat=1300,1298, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   42 PRO  HD-          40 LEU  HN          5.50    (#   1331:10  Unique    4.40, 6.14 A)
 &rst
  ixpk= 1331, nxpk= 10, iat=  -1, 636, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 672, 673,
 &end
#
#    0 AMB  10-2:1332    82 LYS  HN          4.50    (#   1332:10  Single Ambig)
 &rst
  ixpk= 1332, nxpk= 10, iat=  -1,1298, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1311,1312,1311,1312, 178, 179,1333,1334,1333,1334,
      
 &end
#
#    0 AMB  10-2:1333    82 LYS  HN          4.50    (#   1333:10  Single Ambig)
 &rst
  ixpk= 1333, nxpk= 10, iat=  -1,1298, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  67,  68, 178, 179,
 &end
#
#    0 AMB  10-2:1335    40 LEU  HN          2.80    (#   1335:10  Single Ambig)
 &rst
  ixpk= 1335, nxpk= 10, iat=  -1, 636, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 640, 641, 616, 617,
 &end
#
#   66 GLN  HN           68 PHE  HN          5.50    (#   1343:10  Unique    4.56, 4.63 A)
 &rst
  ixpk= 1343, nxpk= 10, iat=1042,1066, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   67 GLY  HA+          68 PHE  HN          3.50    (#   1346:10  Unique    3.26, 3.38 A)
 &rst
  ixpk= 1346, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1061,1062,
 &end
#
#    0 AMB  10-2:1347    68 PHE  HN          5.50    (#   1347:10  Single Ambig)
 &rst
  ixpk= 1347, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1027,1028,1027,1028,1118,1119,
 &end
#
#   65 LEU  HN           66 GLN  HN          3.50    (#   1351:10  Unique    2.34, 2.39 A)
 &rst
  ixpk= 1351, nxpk= 10, iat=1023,1042, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 LYS  HA           66 GLN  HN          5.50    (#   1352:10  Unique    3.47, 3.74 A)
 &rst
  ixpk= 1352, nxpk= 10, iat= 978,1042, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   65 LEU  MDX          66 GLN  HN          5.50    (#   1353:10  Unique    5.30, 6.29 A)
 &rst
  ixpk= 1353, nxpk= 10, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1032,1033,1034,1036,1037,1038,
 &end
#
#   59 ASN  HN           56 LEU  HN          5.50    (#   1354:10  Unique    4.53, 4.65 A)
 &rst
  ixpk= 1354, nxpk= 10, iat= 942, 895, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   60 ALA  HN           56 LEU  HN          7.00    (#   1355:10  Unique    5.89, 5.95 A)
 &rst
  ixpk= 1355, nxpk= 10, iat= 956, 895, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   57 GLN  HB-          56 LEU  HN          5.50    (#   1357:10  Unique    4.76, 5.51 A)
 &rst
  ixpk= 1357, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 918, 919,
 &end
#
#    0 AMB  10-2:1358    38 VAL  HN          4.50    (#   1358:10  Single Ambig)
 &rst
  ixpk= 1358, nxpk= 10, iat=  -1, 596, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 339, 340, 339, 340,
 &end
#
#   38 VAL  HB           38 VAL  HN          4.50    (#   1359:10  Unique    2.59, 3.01 A)
 &rst
  ixpk= 1359, nxpk= 10, iat= 600, 596, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   37 GLU  HB+          38 VAL  HN          3.50    (#   1360:10  Unique    2.40, 3.64 A)
 &rst
  ixpk= 1360, nxpk= 10, iat=  -1, 596, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 585, 586,
 &end
#
#   50 VAL  MGX          38 VAL  HN          5.50    (#   1361:10  Unique    5.00, 6.45 A)
 &rst
  ixpk= 1361, nxpk= 10, iat=  -1, 596, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 807, 808, 809, 811, 812, 813,
 &end
#
#    9 GLN  HN           55 GLU  HN          5.50    (#   1362:10  Unique    4.52, 4.67 A)
 &rst
  ixpk= 1362, nxpk= 10, iat= 119, 880, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   58 SER  HN           55 GLU  HN          5.50    (#   1363:10  Unique    4.84, 4.93 A)
 &rst
  ixpk= 1363, nxpk= 10, iat= 931, 880, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   54 THR  HN           55 GLU  HN          5.50    (#   1364:10  Unique    4.31, 4.33 A)
 &rst
  ixpk= 1364, nxpk= 10, iat= 866, 880, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    9 GLN  HE2+         55 GLU  HN          5.50    (#   1365:10  Unique    5.62, 5.84 A)
 &rst
  ixpk= 1365, nxpk= 10, iat=  -1, 880, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 131, 132,
 &end
#
#   57 GLN  HN           55 GLU  HN          5.50    (#   1366:10  Unique    4.18, 4.24 A)
 &rst
  ixpk= 1366, nxpk= 10, iat= 914, 880, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    7 PRO  HB-          55 GLU  HN          5.50    (#   1368:10  Unique    5.68, 6.23 A)
 &rst
  ixpk= 1368, nxpk= 10, iat=  -1, 880, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  98,  99,
 &end
#
#   53 THR  MG2          55 GLU  HN          5.50    (#   1369:10  Unique    5.93, 6.94 A)
 &rst
  ixpk= 1369, nxpk= 10, iat=  -1, 880, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 858, 859, 860,
 &end
#
#   56 LEU  MDX          55 GLU  HN          5.50    (#   1370:10  Unique    4.08, 5.96 A)
 &rst
  ixpk= 1370, nxpk= 10, iat=  -1, 880, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 904, 905, 906, 908, 909, 910,
 &end
#
#    0 AMB  10-2:1371    79 THR  HN          4.50    (#   1371:10  Single Ambig)
 &rst
  ixpk= 1371, nxpk= 10, iat=  -1,1254, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1268,1288,
 &end
#
#    0 AMB  10-2:1373    79 THR  HN          5.50    (#   1373:10  Single Ambig)
 &rst
  ixpk= 1373, nxpk= 10, iat=  -1,1254, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 980, 981,1292,1293,1294,
 &end
#
#    0 AMB  10-2:1374    79 THR  HN          5.50    (#   1374:10  Single Ambig)
 &rst
  ixpk= 1374, nxpk= 10, iat=  -1,1254, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 983, 984, 983, 984,
 &end
#
#   19 GLU  HA           18 GLU  HN          5.50    (#   1378:10  Unique    5.25, 5.30 A)
 &rst
  ixpk= 1378, nxpk= 10, iat= 291, 274, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 PRO  HD-          18 GLU  HN          5.50    (#   1379:10  Unique    5.52, 5.63 A)
 &rst
  ixpk= 1379, nxpk= 10, iat=  -1, 274, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 261, 262,
 &end
#
#   45 HIS  HB+          18 GLU  HN          5.50    (#   1380:10  Unique    4.79, 5.83 A)
 &rst
  ixpk= 1380, nxpk= 10, iat=  -1, 274, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 727, 728,
 &end
#
#   24 MET  HB-          21 ASN  HN          3.50    (#   1382:10  Unique    2.21, 3.16 A)
 &rst
  ixpk= 1382, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 368, 369,
 &end
#
#   20 THR  MG2          21 ASN  HN          3.50    (#   1383:10  Unique    2.21, 2.83 A)
 &rst
  ixpk= 1383, nxpk= 10, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 310, 311, 312,
 &end
#
#   32 PHE  HD           32 PHE  HN          3.50    (#   1384:10  Unique    3.02, 3.72 A)
 &rst
  ixpk= 1384, nxpk= 10, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 506, 514,
 &end
#
#   35 PHE  HB-          32 PHE  HN          5.50    (#   1385:10  Unique    3.34, 3.77 A)
 &rst
  ixpk= 1385, nxpk= 10, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 543, 544,
 &end
#
#    0 AMB  10-2:1386    32 PHE  HN          5.50    (#   1386:10  Single Ambig)
 &rst
  ixpk= 1386, nxpk= 10, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 471, 472, 522, 523,
 &end
#
#   31 GLN  HB-          32 PHE  HN          4.50    (#   1387:10  Unique    3.38, 3.92 A)
 &rst
  ixpk= 1387, nxpk= 10, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 485, 486,
 &end
#
#   79 THR  HN           80 PHE  HN          5.50    (#   1388:10  Unique    4.33, 4.37 A)
 &rst
  ixpk= 1388, nxpk= 10, iat=1254,1268, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   12 PHE  HN           80 PHE  HN          5.50    (#   1389:10  Unique    4.76, 4.87 A)
 &rst
  ixpk= 1389, nxpk= 10, iat= 174,1268, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1394    80 PHE  HN          5.50    (#   1394:10  Single Ambig)
 &rst
  ixpk= 1394, nxpk= 10, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  67,  68, 178, 179,
 &end
#
#   62 LYS  HE+          80 PHE  HN          5.50    (#   1395:10  Unique    3.36, 5.02 A)
 &rst
  ixpk= 1395, nxpk= 10, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 989, 990,
 &end
#
#   62 LYS  HE-          80 PHE  HN          4.50    (#   1396:10  Unique    3.36, 5.02 A)
 &rst
  ixpk= 1396, nxpk= 10, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 989, 990,
 &end
#
#    5 GLN  HB-          80 PHE  HN          4.50    (#   1397:10  Unique    4.21, 5.32 A)
 &rst
  ixpk= 1397, nxpk= 10, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  64,  65,
 &end
#
#    0 AMB  10-2:1398    80 PHE  HN          7.00    (#   1398:10  Single Ambig)
 &rst
  ixpk= 1398, nxpk= 10, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 9.15, r4= 9.65,
 igr1= 980, 981,1292,1293,1294,
 &end
#
#   58 SER  HN           61 ALA  HN          5.50    (#   1399:10  Unique    4.72, 4.76 A)
 &rst
  ixpk= 1399, nxpk= 10, iat= 931, 966, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1400    61 ALA  HN          5.50    (#   1400:10  Single Ambig)
 &rst
  ixpk= 1400, nxpk= 10, iat=  -1, 966, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 951, 952,1023, 895,
 &end
#
#    0 AMB  10-2:1402    61 ALA  HN          5.50    (#   1402:10  Single Ambig)
 &rst
  ixpk= 1402, nxpk= 10, iat=  -1, 966, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1005,1006, 921, 922, 921, 922,
 &end
#
#   63 GLU  HG-          61 ALA  HN          5.50    (#   1403:10  Unique    5.05, 6.28 A)
 &rst
  ixpk= 1403, nxpk= 10, iat=  -1, 966, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1005,1006,
 &end
#
#    0 AMB  10-2:1404    61 ALA  HN          5.50    (#   1404:10  Single Ambig)
 &rst
  ixpk= 1404, nxpk= 10, iat=  -1, 966, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 946, 947, 946, 947,
 &end
#
#   45 HIS  HB-          45 HIS  HN          5.50    (#   1411:10  Unique    2.30, 3.35 A)
 &rst
  ixpk= 1411, nxpk= 10, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 727, 728,
 &end
#
#   45 HIS  HB+          45 HIS  HN          5.50    (#   1412:10  Unique    2.30, 3.35 A)
 &rst
  ixpk= 1412, nxpk= 10, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 727, 728,
 &end
#
#   44 ARG  HB-          45 HIS  HN          5.50    (#   1413:10  Unique    2.28, 3.47 A)
 &rst
  ixpk= 1413, nxpk= 10, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 703, 704,
 &end
#
#   40 LEU  HB-          45 HIS  HN          5.50    (#   1414:10  Unique    4.09, 6.17 A)
 &rst
  ixpk= 1414, nxpk= 10, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 640, 641,
 &end
#
#   44 ARG  HN           45 HIS  HN          5.50    (#   1415:10  Unique    1.90, 3.47 A)
 &rst
  ixpk= 1415, nxpk= 10, iat= 699, 723, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1416    57 GLN  HN          5.50    (#   1416:10  Single Ambig)
 &rst
  ixpk= 1416, nxpk= 10, iat=  -1, 914, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 836, 837, 836, 837,
 &end
#
#   58 SER  HA           57 GLN  HN          5.50    (#   1417:10  Unique    5.19, 5.24 A)
 &rst
  ixpk= 1417, nxpk= 10, iat= 933, 914, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1418    10 ILE  HN          3.50    (#   1418:10  Single Ambig)
 &rst
  ixpk= 1418, nxpk= 10, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 146, 147, 149, 150, 151,
 &end
#
#    0 AMB  10-2:1419    22 GLU  HN          5.50    (#   1419:10  Single Ambig)
 &rst
  ixpk= 1419, nxpk= 10, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 349, 383,
 &end
#
#   20 THR  HA           22 GLU  HN          7.00    (#   1420:10  Unique    6.37, 6.43 A)
 &rst
  ixpk= 1420, nxpk= 10, iat= 306, 332, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   22 GLU  HB-          22 GLU  HN          3.50    (#   1421:10  Unique    2.17, 2.41 A)
 &rst
  ixpk= 1421, nxpk= 10, iat=  -1, 332, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 336, 337,
 &end
#
#   25 LEU  HG           22 GLU  HN          7.00    (#   1422:10  Unique    5.42, 5.50 A)
 &rst
  ixpk= 1422, nxpk= 10, iat= 388, 332, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   59 ASN  HD2+         60 ALA  HN          4.50    (#   1423:10  Unique    3.02, 4.22 A)
 &rst
  ixpk= 1423, nxpk= 10, iat=  -1, 956, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 951, 952,
 &end
#
#   57 GLN  HN           60 ALA  HN          5.50    (#   1424:10  Unique    4.55, 4.61 A)
 &rst
  ixpk= 1424, nxpk= 10, iat= 914, 956, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   59 ASN  HD2-         60 ALA  HN          4.50    (#   1425:10  Unique    3.02, 4.22 A)
 &rst
  ixpk= 1425, nxpk= 10, iat=  -1, 956, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 951, 952,
 &end
#
#   61 ALA  HN           60 ALA  HN          3.50    (#   1426:10  Unique    2.74, 2.77 A)
 &rst
  ixpk= 1426, nxpk= 10, iat= 966, 956, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   58 SER  HA           60 ALA  HN          5.50    (#   1427:10  Unique    4.47, 4.57 A)
 &rst
  ixpk= 1427, nxpk= 10, iat= 933, 956, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   61 ALA  HA           60 ALA  HN          5.50    (#   1428:10  Unique    5.38, 5.41 A)
 &rst
  ixpk= 1428, nxpk= 10, iat= 968, 956, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1429    60 ALA  HN          5.50    (#   1429:10  Single Ambig)
 &rst
  ixpk= 1429, nxpk= 10, iat=  -1, 956, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1005,1006, 921, 922, 921, 922,
 &end
#
#   63 GLU  HG-          60 ALA  HN          5.50    (#   1430:10  Unique    4.81, 5.53 A)
 &rst
  ixpk= 1430, nxpk= 10, iat=  -1, 956, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1005,1006,
 &end
#
#    0 AMB  10-2:1431    60 ALA  HN          5.50    (#   1431:10  Single Ambig)
 &rst
  ixpk= 1431, nxpk= 10, iat=  -1, 956, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 980, 981,1002,1003,
 &end
#
#    0 AMB  10-2:1432    60 ALA  HN          4.50    (#   1432:10  Single Ambig)
 &rst
  ixpk= 1432, nxpk= 10, iat=  -1, 956, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 899, 900, 902,
 &end
#
#    0 AMB  10-2:1433    60 ALA  HN          4.50    (#   1433:10  Single Ambig)
 &rst
  ixpk= 1433, nxpk= 10, iat=  -1, 956, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 970, 971, 972, 986, 987,
 &end
#
#   39 ARG  HN           50 VAL  HN          5.50    (#   1434:10  Unique    4.78, 4.84 A)
 &rst
  ixpk= 1434, nxpk= 10, iat= 612, 801, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   81 ALA  MB           50 VAL  HN          5.50    (#   1437:10  Unique    4.54, 5.76 A)
 &rst
  ixpk= 1437, nxpk= 10, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1292,1293,1294,
 &end
#
#   22 GLU  HN           24 MET  HN          5.50    (#   1438:10  Unique    4.23, 4.30 A)
 &rst
  ixpk= 1438, nxpk= 10, iat= 332, 364, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   27 MET  HN           24 MET  HN          5.50    (#   1439:10  Unique    4.62, 4.71 A)
 &rst
  ixpk= 1439, nxpk= 10, iat= 411, 364, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1440    24 MET  HN          7.00    (#   1440:10  Single Ambig)
 &rst
  ixpk= 1440, nxpk= 10, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 375, 376, 377, 358, 359, 360,
 &end
#
#   21 ASN  HB-          24 MET  HN          5.50    (#   1441:10  Unique    2.81, 3.98 A)
 &rst
  ixpk= 1441, nxpk= 10, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 322, 323,
 &end
#
#   25 LEU  MDY          24 MET  HN          5.50    (#   1442:10  Unique    5.07, 6.54 A)
 &rst
  ixpk= 1442, nxpk= 10, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 390, 391, 392, 394, 395, 396,
 &end
#
#   23 MET  HB+          24 MET  HN          2.80    (#   1443:10  Unique    2.77, 3.38 A)
 &rst
  ixpk= 1443, nxpk= 10, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 351, 352,
 &end
#
#   25 LEU  HB-          24 MET  HN          5.50    (#   1444:10  Unique    4.68, 5.51 A)
 &rst
  ixpk= 1444, nxpk= 10, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 385, 386,
 &end
#
#   20 THR  MG2          24 MET  HN          5.50    (#   1445:10  Unique    4.62, 5.27 A)
 &rst
  ixpk= 1445, nxpk= 10, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 310, 311, 312,
 &end
#
#    0 AMB  10-2:1446    24 MET  HN          5.50    (#   1446:10  Single Ambig)
 &rst
  ixpk= 1446, nxpk= 10, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 602, 603, 604, 606, 607, 608, 432, 433,
 &end
#
#   25 LEU  MDX          24 MET  HN          5.50    (#   1447:10  Unique    5.07, 6.54 A)
 &rst
  ixpk= 1447, nxpk= 10, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 390, 391, 392, 394, 395, 396,
 &end
#
#   25 LEU  HG           24 MET  HN          5.50    (#   1448:10  Unique    4.40, 4.51 A)
 &rst
  ixpk= 1448, nxpk= 10, iat= 388, 364, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   78 ILE  HN           67 GLY  HN          5.50    (#   1449:10  Unique    4.44, 4.70 A)
 &rst
  ixpk= 1449, nxpk= 10, iat=1235,1059, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   66 GLN  HE2+         67 GLY  HN          5.50    (#   1450:10  Unique    4.99, 5.97 A)
 &rst
  ixpk= 1450, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1054,1055,
 &end
#
#    0 AMB  10-2:1451    67 GLY  HN          5.50    (#   1451:10  Single Ambig)
 &rst
  ixpk= 1451, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1054,1055,1086,
 &end
#
#   66 GLN  HN           67 GLY  HN          5.50    (#   1452:10  Unique    4.53, 4.57 A)
 &rst
  ixpk= 1452, nxpk= 10, iat=1042,1059, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 MET  HB+          67 GLY  HN          5.50    (#   1455:10  Unique    3.37, 4.29 A)
 &rst
  ixpk= 1455, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1200,1201,
 &end
#
#   78 ILE  HG1+         67 GLY  HN          5.50    (#   1456:10  Unique    3.66, 4.95 A)
 &rst
  ixpk= 1456, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1245,1246,
 &end
#
#   78 ILE  MG2          67 GLY  HN          7.00    (#   1457:10  Unique    6.81, 7.69 A)
 &rst
  ixpk= 1457, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1241,1242,1243,
 &end
#
#   65 LEU  HN           64 ALA  HN          3.50    (#   1458:10  Unique    2.67, 2.70 A)
 &rst
  ixpk= 1458, nxpk= 10, iat=1023,1013, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   65 LEU  HA           64 ALA  HN          5.50    (#   1462:10  Unique    5.31, 5.33 A)
 &rst
  ixpk= 1462, nxpk= 10, iat=1025,1013, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   60 ALA  HA           64 ALA  HN          5.50    (#   1463:10  Unique    3.96, 4.09 A)
 &rst
  ixpk= 1463, nxpk= 10, iat= 958,1013, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   64 ALA  MB           64 ALA  HN          2.80    (#   1464:10  Unique    2.38, 2.82 A)
 &rst
  ixpk= 1464, nxpk= 10, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1017,1018,1019,
 &end
#
#   65 LEU  HG           64 ALA  HN          5.50    (#   1465:10  Unique    4.52, 4.53 A)
 &rst
  ixpk= 1465, nxpk= 10, iat=1030,1013, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1466    64 ALA  HN          4.50    (#   1466:10  Single Ambig)
 &rst
  ixpk= 1466, nxpk= 10, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 986, 987, 970, 971, 972,
 &end
#
#   65 LEU  MDY          64 ALA  HN          5.50    (#   1467:10  Unique    5.86, 6.69 A)
 &rst
  ixpk= 1467, nxpk= 10, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1032,1033,1034,1036,1037,1038,
 &end
#
#    0 AMB  10-2:1468     0 AMB  10-1:1468   5.50    (#   1468:10  Double Ambig)
 &rst
  ixpk= 1468, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 789, 797, 510,
 igr2= 771, 976,
 &end
#
#   42 PRO  HB+          44 ARG  HN          7.00    (#   1470:10  Unique    4.66, 5.87 A)
 &rst
  ixpk= 1470, nxpk= 10, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 678, 679,
 &end
#
#   24 MET  HN           27 MET  HN          5.50    (#   1472:10  Unique    4.62, 4.71 A)
 &rst
  ixpk= 1472, nxpk= 10, iat= 364, 411, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   30 ASN  HN           27 MET  HN          5.50    (#   1473:10  Unique    4.64, 4.71 A)
 &rst
  ixpk= 1473, nxpk= 10, iat= 467, 411, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   28 LEU  MDX          27 MET  HN          5.50    (#   1476:10  Unique    5.97, 6.95 A)
 &rst
  ixpk= 1476, nxpk= 10, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 437, 438, 439, 441, 442, 443,
 &end
#
#   29 PHE  HN           26 SER  HN          5.50    (#   1477:10  Unique    4.84, 4.88 A)
 &rst
  ixpk= 1477, nxpk= 10, iat= 447, 400, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   29 PHE  HD           26 SER  HN          5.50    (#   1478:10  Unique    4.57, 6.98 A)
 &rst
  ixpk= 1478, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 455, 463,
 &end
#
#    0 AMB  10-2:1479    26 SER  HN          7.00    (#   1479:10  Single Ambig)
 &rst
  ixpk= 1479, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 549, 553, 318,
 &end
#
#    0 AMB  10-2:1480    26 SER  HN          5.50    (#   1480:10  Single Ambig)
 &rst
  ixpk= 1480, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 354, 355, 371, 372, 471, 472,
 &end
#
#    0 AMB  10-2:1481    26 SER  HN          4.50    (#   1481:10  Single Ambig)
 &rst
  ixpk= 1481, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 415, 416, 415, 416, 351, 352, 336, 337,
 &end
#
#   10 ILE  HN            8 ASN  HN          5.50    (#   1482:10  Unique    4.20, 4.34 A)
 &rst
  ixpk= 1482, nxpk= 10, iat= 136, 105, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   19 GLU  HN           20 THR  HN          3.50    (#   1483:10  Unique    2.67, 2.79 A)
 &rst
  ixpk= 1483, nxpk= 10, iat= 289, 304, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   21 ASN  HA           20 THR  HN          5.50    (#   1484:10  Unique    5.52, 5.54 A)
 &rst
  ixpk= 1484, nxpk= 10, iat= 320, 304, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 LEU  HA           20 THR  HN          7.00    (#   1486:10  Unique    5.98, 6.13 A)
 &rst
  ixpk= 1486, nxpk= 10, iat= 243, 304, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   20 THR  MG2          20 THR  HN          4.50    (#   1488:10  Unique    4.40, 4.56 A)
 &rst
  ixpk= 1488, nxpk= 10, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 310, 311, 312,
 &end
#
#    0 AMB  10-2:1489    20 THR  HN          5.50    (#   1489:10  Single Ambig)
 &rst
  ixpk= 1489, nxpk= 10, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 250, 251, 252, 254, 255, 256, 645, 646, 647, 649,
       650, 651,
 &end
#
#   61 ALA  HN           58 SER  HN          5.50    (#   1491:10  Unique    4.72, 4.76 A)
 &rst
  ixpk= 1491, nxpk= 10, iat= 966, 931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   54 THR  HB           58 SER  HN          5.50    (#   1492:10  Unique    4.82, 5.02 A)
 &rst
  ixpk= 1492, nxpk= 10, iat= 870, 931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   59 ASN  HA           58 SER  HN          5.50    (#   1493:10  Unique    5.28, 5.35 A)
 &rst
  ixpk= 1493, nxpk= 10, iat= 944, 931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   54 THR  MG2          58 SER  HN          7.00    (#   1494:10  Unique    6.84, 7.09 A)
 &rst
  ixpk= 1494, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 872, 873, 874,
 &end
#
#   61 ALA  MB           58 SER  HN          5.50    (#   1495:10  Unique    5.13, 5.86 A)
 &rst
  ixpk= 1495, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 970, 971, 972,
 &end
#
#   26 SER  HA           28 LEU  HN          4.50    (#   1497:10  Unique    4.33, 4.47 A)
 &rst
  ixpk= 1497, nxpk= 10, iat= 402, 428, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1498    28 LEU  HN          3.50    (#   1498:10  Single Ambig)
 &rst
  ixpk= 1498, nxpk= 10, iat=  -1, 428, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 415, 416, 415, 416,
 &end
#
#   35 PHE  HB+          30 ASN  HN          5.50    (#   1500:10  Unique    4.79, 5.29 A)
 &rst
  ixpk= 1500, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 543, 544,
 &end
#
#   38 VAL  MGX          30 ASN  HN          5.50    (#   1501:10  Unique    5.91, 7.79 A)
 &rst
  ixpk= 1501, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 602, 603, 604, 606, 607, 608,
 &end
#
#    0 AMB  10-2:1504    30 ASN  HN          5.50    (#   1504:10  Single Ambig)
 &rst
  ixpk= 1504, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1032,1033,1034,1036,1037,1038, 437, 438, 439, 441,
       442, 443,
 &end
#
#    0 AMB  10-2:1505     3 THR  HN          5.50    (#   1505:10  Single Ambig)
 &rst
  ixpk= 1505, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  45,  14,
 &end
#
#    2 GLN  HB+           3 THR  HN          5.50    (#   1508:10  Unique    2.28, 3.23 A)
 &rst
  ixpk= 1508, nxpk= 10, iat=  -1,  31, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  18,  19,
 &end
#
#    0 AMB  10-2:1509    16 LEU  HN          5.50    (#   1509:10  Single Ambig)
 &rst
  ixpk= 1509, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 752, 236, 237,
 &end
#
#   47 ILE  HA           16 LEU  HN          5.50    (#   1510:10  Unique    3.78, 3.85 A)
 &rst
  ixpk= 1510, nxpk= 10, iat= 754, 241, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 ASN  HB+          16 LEU  HN          5.50    (#   1511:10  Unique    4.22, 4.48 A)
 &rst
  ixpk= 1511, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 231, 232,
 &end
#
#   17 PRO  HD+          16 LEU  HN          5.50    (#   1512:10  Unique    4.95, 5.07 A)
 &rst
  ixpk= 1512, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 261, 262,
 &end
#
#   14 THR  HN           15 ASN  HN          5.50    (#   1513:10  Unique    4.38, 4.40 A)
 &rst
  ixpk= 1513, nxpk= 10, iat= 213, 227, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   47 ILE  HA           15 ASN  HN          5.50    (#   1514:10  Unique    4.09, 4.18 A)
 &rst
  ixpk= 1514, nxpk= 10, iat= 754, 227, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 ASN  HB+          15 ASN  HN          4.50    (#   1515:10  Unique    3.01, 3.36 A)
 &rst
  ixpk= 1515, nxpk= 10, iat=  -1, 227, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 231, 232,
 &end
#
#    0 AMB  10-2:1516     0 AMB  10-1:1516   4.50    (#   1516:10  Double Ambig)
 &rst
  ixpk= 1516, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 198, 199, 198, 199,
 igr2= 781, 227,
 &end
#
#   26 SER  HA           25 LEU  HN          5.50    (#   1518:10  Unique    5.22, 5.24 A)
 &rst
  ixpk= 1518, nxpk= 10, iat= 402, 381, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   58 SER  HN           53 THR  HN          5.50    (#   1519:10  Unique    5.50, 5.52 A)
 &rst
  ixpk= 1519, nxpk= 10, iat= 931, 852, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   35 PHE  HN           53 THR  HN          5.50    (#   1520:10  Unique    4.85, 4.89 A)
 &rst
  ixpk= 1520, nxpk= 10, iat= 539, 852, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1521    53 THR  HN          5.50    (#   1521:10  Single Ambig)
 &rst
  ixpk= 1521, nxpk= 10, iat=  -1, 852, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 572, 573, 572, 573,
 &end
#
#   57 GLN  HB-          53 THR  HN          5.50    (#   1522:10  Unique    3.78, 4.50 A)
 &rst
  ixpk= 1522, nxpk= 10, iat=  -1, 852, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 918, 919,
 &end
#
#   36 LYS  HG-          53 THR  HN          4.50    (#   1523:10  Unique    2.51, 3.81 A)
 &rst
  ixpk= 1523, nxpk= 10, iat=  -1, 852, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 566, 567,
 &end
#
#   36 LYS  HD+          53 THR  HN          5.50    (#   1524:10  Unique    3.32, 4.10 A)
 &rst
  ixpk= 1524, nxpk= 10, iat=  -1, 852, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 569, 570,
 &end
#
#   18 GLU  HA           19 GLU  HN          3.50    (#   1526:10  Unique    3.37, 3.47 A)
 &rst
  ixpk= 1526, nxpk= 10, iat= 276, 289, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   45 HIS  HB+          19 GLU  HN          5.50    (#   1527:10  Unique    4.99, 5.78 A)
 &rst
  ixpk= 1527, nxpk= 10, iat=  -1, 289, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 727, 728,
 &end
#
#   19 GLU  HB+          19 GLU  HN          2.80    (#   1528:10  Unique    2.40, 3.00 A)
 &rst
  ixpk= 1528, nxpk= 10, iat=  -1, 289, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 293, 294,
 &end
#
#   62 LYS  HA           65 LEU  HN          5.50    (#   1529:10  Unique    3.38, 3.51 A)
 &rst
  ixpk= 1529, nxpk= 10, iat= 978,1023, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   61 ALA  HA           65 LEU  HN          5.50    (#   1530:10  Unique    3.96, 4.02 A)
 &rst
  ixpk= 1530, nxpk= 10, iat= 968,1023, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   66 GLN  HB+          65 LEU  HN          5.50    (#   1531:10  Unique    4.35, 5.11 A)
 &rst
  ixpk= 1531, nxpk= 10, iat=  -1,1023, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1046,1047,
 &end
#
#    0 AMB  10-2:1532    65 LEU  HN          5.50    (#   1532:10  Single Ambig)
 &rst
  ixpk= 1532, nxpk= 10, iat=  -1,1023, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1049,1050,1002,1003,
 &end
#
#    0 AMB  10-2:1533    65 LEU  HN          5.50    (#   1533:10  Single Ambig)
 &rst
  ixpk= 1533, nxpk= 10, iat=  -1,1023, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1002,1003, 980, 981,
 &end
#
#   63 GLU  HB-          63 GLU  HN          3.50    (#   1537:10  Unique    2.19, 3.03 A)
 &rst
  ixpk= 1537, nxpk= 10, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1002,1003,
 &end
#
#   32 PHE  HA           31 GLN  HN          5.50    (#   1538:10  Unique    5.34, 5.38 A)
 &rst
  ixpk= 1538, nxpk= 10, iat= 500, 481, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   32 PHE  HB+          31 GLN  HN          5.50    (#   1539:10  Unique    5.10, 5.75 A)
 &rst
  ixpk= 1539, nxpk= 10, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 502, 503,
 &end
#
#   35 PHE  HB-          31 GLN  HN          5.50    (#   1540:10  Unique    5.30, 5.61 A)
 &rst
  ixpk= 1540, nxpk= 10, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 543, 544,
 &end
#
#   42 PRO  HD+          43 ASN  HN          5.50    (#   1543:10  Unique    3.71, 4.68 A)
 &rst
  ixpk= 1543, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 672, 673,
 &end
#
#   42 PRO  HD-          43 ASN  HN          5.50    (#   1544:10  Unique    3.71, 4.68 A)
 &rst
  ixpk= 1544, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 672, 673,
 &end
#
#    0 AMB  10-2:1545    43 ASN  HN          5.50    (#   1545:10  Single Ambig)
 &rst
  ixpk= 1545, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 706, 707, 706, 707,
 &end
#
#    0 AMB  10-2:1547     0 AMB  10-1:1547   5.50    (#   1547:10  Double Ambig)
 &rst
  ixpk= 1547, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 703, 704, 678, 679,
 igr2= 694, 695, 694, 695,
 &end
#
#    3 THR  HB            5 GLN  HE2+        5.50    (#   1548:10  Unique    2.22, 4.73 A)
 &rst
  ixpk= 1548, nxpk= 10, iat=  35,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  72,  73,
 &end
#
#   43 ASN  HA           43 ASN  HD2-        5.50    (#   1549:10  Unique    2.48, 4.51 A)
 &rst
  ixpk= 1549, nxpk= 10, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 694, 695,
 &end
#
#    3 THR  HB            5 GLN  HE2-        5.50    (#   1550:10  Unique    2.22, 4.73 A)
 &rst
  ixpk= 1550, nxpk= 10, iat=  35,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  72,  73,
 &end
#
#    4 GLU  HA            5 GLN  HE2-        5.50    (#   1551:10  Unique    4.26, 5.62 A)
 &rst
  ixpk= 1551, nxpk= 10, iat=  47,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  72,  73,
 &end
#
#    3 THR  MG2           5 GLN  HE2-        5.50    (#   1552:10  Unique    2.82, 5.46 A)
 &rst
  ixpk= 1552, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  37,  38,  39,
 igr2=  72,  73,
 &end
#
#   30 ASN  HB+          29 PHE  HN          5.50    (#   1554:10  Unique    4.62, 5.05 A)
 &rst
  ixpk= 1554, nxpk= 10, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 471, 472,
 &end
#
#   38 VAL  MGX          29 PHE  HN          5.50    (#   1555:10  Unique    4.67, 6.51 A)
 &rst
  ixpk= 1555, nxpk= 10, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 602, 603, 604, 606, 607, 608,
 &end
#
#   25 LEU  MDX          29 PHE  HN          4.50    (#   1556:10  Unique    5.16, 6.59 A)
 &rst
  ixpk= 1556, nxpk= 10, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 390, 391, 392, 394, 395, 396,
 &end
#
#   50 VAL  MGY          29 PHE  HN          5.50    (#   1557:10  Unique    5.52, 6.62 A)
 &rst
  ixpk= 1557, nxpk= 10, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 807, 808, 809, 811, 812, 813,
 &end
#
#   28 LEU  MDY          29 PHE  HN          4.50    (#   1558:10  Unique    4.74, 5.60 A)
 &rst
  ixpk= 1558, nxpk= 10, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 437, 438, 439, 441, 442, 443,
 &end
#
#   65 LEU  MDX          29 PHE  HN          5.50    (#   1559:10  Unique    4.35, 5.97 A)
 &rst
  ixpk= 1559, nxpk= 10, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1032,1033,1034,1036,1037,1038,
 &end
#
#    3 THR  HB            5 GLN  HE2+        5.50    (#   1560:10  Unique    2.22, 4.73 A)
 &rst
  ixpk= 1560, nxpk= 10, iat=  35,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  72,  73,
 &end
#
#    0 AMB  10-2:1561     0 AMB  10-1:1561   5.50    (#   1561:10  Double Ambig)
 &rst
  ixpk= 1561, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=  78,  79, 672, 673,
 igr2=  72,  73, 694, 695,
 &end
#
#    3 THR  MG2           5 GLN  HE2+        5.50    (#   1563:10  Unique    2.82, 5.46 A)
 &rst
  ixpk= 1563, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  37,  38,  39,
 igr2=  72,  73,
 &end
#
#   16 LEU  HN           46 ASP  HN          5.50    (#   1564:10  Unique    4.85, 5.50 A)
 &rst
  ixpk= 1564, nxpk= 10, iat= 241, 740, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   44 ARG  HN           46 ASP  HN          5.50    (#   1565:10  Unique    4.66, 5.16 A)
 &rst
  ixpk= 1565, nxpk= 10, iat= 699, 740, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   47 ILE  HA           46 ASP  HN          5.50    (#   1566:10  Unique    4.10, 5.09 A)
 &rst
  ixpk= 1566, nxpk= 10, iat= 754, 740, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1567    46 ASP  HN          7.00    (#   1567:10  Single Ambig)
 &rst
  ixpk= 1567, nxpk= 10, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 773, 243, 229,
 &end
#
#   16 LEU  HG           46 ASP  HN          7.00    (#   1568:10  Unique    4.43, 5.82 A)
 &rst
  ixpk= 1568, nxpk= 10, iat= 248, 740, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:1570     8 ASN  HD2-        4.50    (#   1570:10  Single Ambig)
 &rst
  ixpk= 1570, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1330,1331,1330,1331,
 igr2= 114, 115,
 &end
#
#   79 THR  HN            2 GLN  HE2+        5.50    (#   1571:10  Unique    3.99, 4.72 A)
 &rst
  ixpk= 1571, nxpk= 10, iat=1254,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  26,  27,
 &end
#
#   40 LEU  MDY          21 ASN  HD2+        5.50    (#   1572:10  Unique    4.32, 7.36 A)
 &rst
  ixpk= 1572, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 645, 646, 647, 649, 650, 651,
 igr2= 327, 328,
 &end
#
#   14 THR  MG2           2 GLN  HE2+        5.50    (#   1573:10  Unique    2.07, 4.92 A)
 &rst
  ixpk= 1573, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 219, 220, 221,
 igr2=  26,  27,
 &end
#
#   10 ILE  MD1           8 ASN  HD2+        5.50    (#   1574:10  Unique    2.92, 5.14 A)
 &rst
  ixpk= 1574, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 149, 150, 151,
 igr2= 114, 115,
 &end
#
#   10 ILE  MG2           8 ASN  HD2+        5.50    (#   1575:10  Unique    3.91, 5.08 A)
 &rst
  ixpk= 1575, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 142, 143, 144,
 igr2= 114, 115,
 &end
#
#    0 AMB  10-2:1576     0 AMB  10-1:1576   4.50    (#   1576:10  Double Ambig)
 &rst
  ixpk= 1576, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 140,1324,1325,1324,1325,
 igr2= 114, 115, 114, 115, 114, 115,
 &end
#
#   10 ILE  HN            8 ASN  HD2+        5.50    (#   1578:10  Unique    2.57, 3.19 A)
 &rst
  ixpk= 1578, nxpk= 10, iat= 136,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 114, 115,
 &end
#
#   83 LYS  HN            8 ASN  HD2+        5.50    (#   1579:10  Unique    2.67, 3.60 A)
 &rst
  ixpk= 1579, nxpk= 10, iat=1320,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 114, 115,
 &end
#
#   81 ALA  HN            8 ASN  HD2+        5.50    (#   1580:10  Unique    2.11, 3.37 A)
 &rst
  ixpk= 1580, nxpk= 10, iat=1288,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 114, 115,
 &end
#
#    0 AMB  10-2:1581     0 AMB  10-1:1581   5.50    (#   1581:10  Double Ambig)
 &rst
  ixpk= 1581, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 119, 174,
 igr2= 114, 115, 114, 115,
 &end
#
#   64 ALA  MB           31 GLN  HE2-        5.50    (#   1583:10  Unique    5.22, 6.46 A)
 &rst
  ixpk= 1583, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1017,1018,1019,
 igr2= 493, 494,
 &end
#
#   28 LEU  HB+          31 GLN  HE2-        5.50    (#   1584:10  Unique    3.34, 4.53 A)
 &rst
  ixpk= 1584, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 432, 433,
 igr2= 493, 494,
 &end
#
#   28 LEU  HB+          31 GLN  HE2+        5.50    (#   1585:10  Unique    3.34, 4.53 A)
 &rst
  ixpk= 1585, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 432, 433,
 igr2= 493, 494,
 &end
#
#   54 THR  HN            9 GLN  HE2-        5.50    (#   1586:10  Unique    4.54, 5.02 A)
 &rst
  ixpk= 1586, nxpk= 10, iat= 866,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 131, 132,
 &end
#
#   10 ILE  HB            9 GLN  HE2-        7.00    (#   1587:10  Unique    7.18, 7.91 A)
 &rst
  ixpk= 1587, nxpk= 10, iat= 140,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 131, 132,
 &end
#
#    0 AMB  10-2:1589     9 GLN  HE2-        5.50    (#   1589:10  Single Ambig)
 &rst
  ixpk= 1589, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.54, r4= 9.04,
 igr1= 569, 570, 566, 567, 872, 873, 874,
 igr2= 131, 132,
 &end
#
#   67 GLY  HN           66 GLN  HE2+        5.50    (#   1590:10  Unique    4.99, 5.97 A)
 &rst
  ixpk= 1590, nxpk= 10, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1054,1055,
 &end
#
#   67 GLY  HN           66 GLN  HE2-        5.50    (#   1591:10  Unique    4.99, 5.97 A)
 &rst
  ixpk= 1591, nxpk= 10, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1054,1055,
 &end
#
#   66 GLN  HA           66 GLN  HE2+        5.50    (#   1592:10  Unique    4.35, 4.79 A)
 &rst
  ixpk= 1592, nxpk= 10, iat=1044,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1054,1055,
 &end
#
#    0 AMB  10-2:1593     0 AMB  10-1:1593   5.50    (#   1593:10  Double Ambig)
 &rst
  ixpk= 1593, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1188,1088,
 igr2= 236, 237, 236, 237,
 &end
#
#   74 HIS  HB+          15 ASN  HD2+        5.50    (#   1594:10  Unique    3.93, 4.95 A)
 &rst
  ixpk= 1594, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1173,1174,
 igr2= 236, 237,
 &end
#
#   74 HIS  HB-          15 ASN  HD2+        5.50    (#   1595:10  Unique    3.93, 4.95 A)
 &rst
  ixpk= 1595, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1173,1174,
 igr2= 236, 237,
 &end
#
#   77 LYS  HE+          15 ASN  HD2+        5.50    (#   1596:10  Unique    3.57, 6.03 A)
 &rst
  ixpk= 1596, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1226,1227,
 igr2= 236, 237,
 &end
#
#    0 AMB  10-2:1597     0 AMB  10-1:1597   5.50    (#   1597:10  Double Ambig)
 &rst
  ixpk= 1597, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1220,1221,1220,1221,
 igr2= 236, 237, 236, 237,
 &end
#
#    0 AMB  10-2:1599    15 ASN  HD2-        5.50    (#   1599:10  Single Ambig)
 &rst
  ixpk= 1599, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1188,1088,
 igr2= 236, 237,
 &end
#
#    0 AMB  10-2:1600    15 ASN  HD2-        5.50    (#   1600:10  Single Ambig)
 &rst
  ixpk= 1600, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1217,1218,1226,1227,
 igr2= 236, 237,
 &end
#
#   51 GLU  HG+          37 GLU  HN          5.50    (#   1601:10  Unique    3.96, 4.80 A)
 &rst
  ixpk= 1601, nxpk= 10, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 824, 825,
 &end
#
#   37 GLU  HB+          37 GLU  HN          4.50    (#   1602:10  Unique    2.80, 3.17 A)
 &rst
  ixpk= 1602, nxpk= 10, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 585, 586,
 &end
#
#    0 AMB  10-2:1603    37 GLU  HN          4.50    (#   1603:10  Single Ambig)
 &rst
  ixpk= 1603, nxpk= 10, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 566, 567, 569, 570,
 &end
#
#   50 VAL  MGY          37 GLU  HN          5.50    (#   1604:10  Unique    3.89, 5.72 A)
 &rst
  ixpk= 1604, nxpk= 10, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 807, 808, 809, 811, 812, 813,
 &end
#
#   41 VAL  HB           47 ILE  HN          5.50    (#   1606:10  Unique    3.86, 4.52 A)
 &rst
  ixpk= 1606, nxpk= 10, iat= 659, 752, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   47 ILE  MG2          47 ILE  HN          2.80    (#   1607:10  Unique    2.94, 3.72 A)
 &rst
  ixpk= 1607, nxpk= 10, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 758, 759, 760,
 &end
#
#   14 THR  MG2          47 ILE  HN          5.50    (#   1608:10  Unique    5.58, 6.84 A)
 &rst
  ixpk= 1608, nxpk= 10, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 219, 220, 221,
 &end
#
#   16 LEU  HG           47 ILE  HN          4.50    (#   1609:10  Unique    4.43, 4.51 A)
 &rst
  ixpk= 1609, nxpk= 10, iat= 248, 752, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   54 THR  HN           57 GLN  HE2-        5.50    (#   1610:10  Unique    3.13, 4.21 A)
 &rst
  ixpk= 1610, nxpk= 10, iat= 866,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 926, 927,
 &end
#
#    0 AMB  10-2:1611    44 ARG  HE          5.50    (#   1611:10  Single Ambig)
 &rst
  ixpk= 1611, nxpk= 10, iat=  -1, 712, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 661, 662, 663, 665, 666, 667, 661, 662, 663, 665,
       666, 667,
 &end
#
#   70 ILE  HN           71 THR  HN          3.50    (#   1612:10  Unique    2.33, 2.40 A)
 &rst
  ixpk= 1612, nxpk= 10, iat=1108,1127, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   72 PRO  HA           71 THR  HN          5.50    (#   1614:10  Unique    4.70, 4.80 A)
 &rst
  ixpk= 1614, nxpk= 10, iat=1151,1127, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 PRO  HD-          71 THR  HN          5.50    (#   1615:10  Unique    3.93, 4.66 A)
 &rst
  ixpk= 1615, nxpk= 10, iat=  -1,1127, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 261, 262,
 &end
#
#   69 LYS  HD+          71 THR  HN          5.50    (#   1616:10  Unique    4.16, 4.78 A)
 &rst
  ixpk= 1616, nxpk= 10, iat=  -1,1127, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1096,1097,
 &end
#
#   70 ILE  MG2          71 THR  HN          3.50    (#   1617:10  Unique    3.68, 4.39 A)
 &rst
  ixpk= 1617, nxpk= 10, iat=  -1,1127, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1114,1115,1116,
 &end
#
#   55 GLU  HN           54 THR  HN          5.50    (#   1618:10  Unique    4.31, 4.33 A)
 &rst
  ixpk= 1618, nxpk= 10, iat= 880, 866, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   52 PHE  HN           54 THR  HN          5.50    (#   1619:10  Unique    5.25, 5.33 A)
 &rst
  ixpk= 1619, nxpk= 10, iat= 832, 866, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   30 ASN  HN           31 GLN  HE2-        5.50    (#   1622:10  Unique    4.99, 5.96 A)
 &rst
  ixpk= 1622, nxpk= 10, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 493, 494,
 &end
#
#   79 THR  HN            2 GLN  HE2-        5.50    (#   1623:10  Unique    3.99, 4.72 A)
 &rst
  ixpk= 1623, nxpk= 10, iat=1254,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  26,  27,
 &end
#
#   26 SER  HB+          27 MET  HN          4.50    (#   1625:10  Unique    2.52, 3.21 A)
 &rst
  ixpk= 1625, nxpk= 10, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 404, 405,
 &end
#
#   31 GLN  HB+          30 ASN  HN          5.50    (#   1626:10  Unique    5.03, 5.79 A)
 &rst
  ixpk= 1626, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 485, 486,
 &end
#
#   55 GLU  HG-          59 ASN  HN          7.00    (#   1628:10  Unique    6.38, 6.75 A)
 &rst
  ixpk= 1628, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 887, 888,
 &end
#
#   62 LYS  HB-          63 GLU  HN          4.50    (#   1629:10  Unique    2.53, 3.34 A)
 &rst
  ixpk= 1629, nxpk= 10, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 980, 981,
 &end
#
#    0 AMB  10-2:1630     0 AMB  10-1:1630   3.50    (#   1630:10  Double Ambig)
 &rst
  ixpk= 1630, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 918, 919, 525, 526,
 igr2= 926, 927, 926, 927,
 &end
#
#    0 AMB  10-2:1631    57 GLN  HE2-        3.50    (#   1631:10  Single Ambig)
 &rst
  ixpk= 1631, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 918, 919, 525, 526,
 igr2= 926, 927,
 &end
#
#    5 GLN  HN            5 GLN  HE2-        5.50    (#   1632:10  Unique    3.95, 5.05 A)
 &rst
  ixpk= 1632, nxpk= 10, iat=  60,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  72,  73,
 &end
#
#   65 LEU  MDX          31 GLN  HE2-        5.50    (#   1633:10  Unique    2.19, 3.97 A)
 &rst
  ixpk= 1633, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1032,1033,1034,1036,1037,1038,
 igr2= 493, 494,
 &end
#
#    8 ASN  HN           81 ALA  HN          5.50    (#   1635:10  Unique    4.97, 5.32 A)
 &rst
  ixpk= 1635, nxpk= 10, iat= 105,1288, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   55 GLU  HG+          55 GLU  HN          3.50    (#   1636:10  Unique    1.90, 2.85 A)
 &rst
  ixpk= 1636, nxpk= 10, iat=  -1, 880, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 887, 888,
 &end
#
#   66 GLN  HG-          66 GLN  HN          4.50    (#   1637:10  Unique    2.78, 3.61 A)
 &rst
  ixpk= 1637, nxpk= 10, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1049,1050,
 &end
#
#   55 GLU  HG-          56 LEU  HN          5.50    (#   1638:10  Unique    4.09, 4.81 A)
 &rst
  ixpk= 1638, nxpk= 10, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 887, 888,
 &end
#
#    0 AMB  10-2:1640    11 LEU  HN          3.50    (#   1640:10  Single Ambig)
 &rst
  ixpk= 1640, nxpk= 10, iat=  -1, 155, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 157, 819,
 &end
#
#   55 GLU  HA            9 GLN  HN          3.50    (#   1641:10  Unique    3.44, 3.50 A)
 &rst
  ixpk= 1641, nxpk= 10, iat= 882, 119, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 LYS  HB-          62 LYS  HN          3.50    (#   1642:10  Unique    2.15, 2.48 A)
 &rst
  ixpk= 1642, nxpk= 10, iat=  -1, 976, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 980, 981,
 &end
#
#    0 AMB  10-2:1643     0 AMB  10-1:1643   4.50    (#   1643:10  Double Ambig)
 &rst
  ixpk= 1643, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 351, 352, 336, 337,
 igr2= 327, 328, 327, 328,
 &end
#
#    0 AMB  10-2:1644    21 ASN  HD2-        4.50    (#   1644:10  Single Ambig)
 &rst
  ixpk= 1644, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 351, 352, 336, 337,
 igr2= 327, 328,
 &end
#
#   54 THR  HG1          54 THR  HN          5.50    (#   1645:10  Unique    3.51, 3.64 A)
 &rst
  ixpk= 1645, nxpk= 10, iat= 876, 866, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   57 GLN  HE2-         54 THR  HN          5.50    (#   1646:10  Unique    3.13, 4.21 A)
 &rst
  ixpk= 1646, nxpk= 10, iat=  -1, 866, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 926, 927,
 &end
#
#    0 AMB  10-2:1648    35 PHE  HN          5.50    (#   1648:10  Single Ambig)
 &rst
  ixpk= 1648, nxpk= 10, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 561, 854,
 &end
#
#   49 PHE  HA           11 LEU  HN          5.50    (#   1649:10  Unique    4.51, 4.60 A)
 &rst
  ixpk= 1649, nxpk= 10, iat= 783, 155, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   49 PHE  HA           39 ARG  HN          5.50    (#   1650:10  Unique    4.70, 4.77 A)
 &rst
  ixpk= 1650, nxpk= 10, iat= 783, 612, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1651     0 AMB  10-1:1651   5.50    (#   1651:10  Double Ambig)
 &rst
  ixpk= 1651, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 785, 786, 178, 179, 785, 786,
 igr2= 155, 655,
 &end
#
#   39 ARG  HD-          39 ARG  HN          5.50    (#   1653:10  Unique    2.88, 5.24 A)
 &rst
  ixpk= 1653, nxpk= 10, iat=  -1, 612, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 622, 623,
 &end
#
#    0 AMB  10-2:1654    39 ARG  HN          5.50    (#   1654:10  Single Ambig)
 &rst
  ixpk= 1654, nxpk= 10, iat=  -1, 612, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 339, 340, 339, 340,
 &end
#
#   20 THR  MG2          25 LEU  HN          5.50    (#   1655:10  Unique    3.83, 4.26 A)
 &rst
  ixpk= 1655, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 310, 311, 312,
 &end
#
#   12 PHE  HA           50 VAL  HN          5.50    (#   1656:10  Unique    3.84, 3.91 A)
 &rst
  ixpk= 1656, nxpk= 10, iat= 176, 801, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   42 PRO  HG+          43 ASN  HN          5.50    (#   1657:10  Unique    4.01, 4.95 A)
 &rst
  ixpk= 1657, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 675, 676,
 &end
#
#   76 MET  HA           14 THR  HN          5.50    (#   1658:10  Unique    4.48, 4.63 A)
 &rst
  ixpk= 1658, nxpk= 10, iat=1198, 213, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1659    20 THR  HN          4.50    (#   1659:10  Single Ambig)
 &rst
  ixpk= 1659, nxpk= 10, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 296, 297, 296, 297,
 &end
#
#   17 PRO  HD-          16 LEU  HN          5.50    (#   1661:10  Unique    4.95, 5.07 A)
 &rst
  ixpk= 1661, nxpk= 10, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 261, 262,
 &end
#
#   35 PHE  HD           34 GLY  HN          5.50    (#   1662:10  Unique    5.80, 6.38 A)
 &rst
  ixpk= 1662, nxpk= 10, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 547, 555,
 &end
#
#   36 LYS  HB+          35 PHE  HN          7.00    (#   1665:10  Unique    5.38, 6.72 A)
 &rst
  ixpk= 1665, nxpk= 10, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 563, 564,
 &end
#
#   11 LEU  HB+          79 THR  HN          5.50    (#   1666:10  Unique    3.19, 4.54 A)
 &rst
  ixpk= 1666, nxpk= 10, iat=  -1,1254, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 159, 160,
 &end
#
#   30 ASN  HB+          32 PHE  HN          5.50    (#   1668:10  Unique    5.06, 5.32 A)
 &rst
  ixpk= 1668, nxpk= 10, iat=  -1, 498, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 471, 472,
 &end
#
#   73 THR  HA           70 ILE  HN          7.00    (#   1669:10  Unique    7.34, 7.90 A)
 &rst
  ixpk= 1669, nxpk= 10, iat=1157,1108, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:1671    71 THR  HN          5.50    (#   1671:10  Single Ambig)
 &rst
  ixpk= 1671, nxpk= 10, iat=  -1,1127, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1155,1182,
 &end
#
#   68 PHE  HD           71 THR  HN          7.00    (#   1672:10  Unique    5.55, 7.16 A)
 &rst
  ixpk= 1672, nxpk= 10, iat=  -1,1127, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1074,1082,
 &end
#
#   74 HIS  HA           71 THR  HN          5.50    (#   1674:10  Unique    4.93, 5.04 A)
 &rst
  ixpk= 1674, nxpk= 10, iat=1171,1127, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1675    71 THR  HN          4.50    (#   1675:10  Single Ambig)
 &rst
  ixpk= 1675, nxpk= 10, iat=  -1,1127, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1142,1143, 270,
 &end
#
#    0 AMB  10-2:1677    73 THR  HN          5.50    (#   1677:10  Single Ambig)
 &rst
  ixpk= 1677, nxpk= 10, iat=  -1,1155, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1173,1174,1099,1100,
 &end
#
#    0 AMB  10-2:1678    73 THR  HN          3.50    (#   1678:10  Single Ambig)
 &rst
  ixpk= 1678, nxpk= 10, iat=  -1,1155, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1131,1129,
 &end
#
#   75 ALA  HN           73 THR  HN          5.50    (#   1680:10  Unique    5.16, 6.04 A)
 &rst
  ixpk= 1680, nxpk= 10, iat=1186,1155, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 ASN  HD2-         74 HIS  HN          5.50    (#   1681:10  Unique    5.34, 5.87 A)
 &rst
  ixpk= 1681, nxpk= 10, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 236, 237,
 &end
#
#   70 ILE  MD1          76 MET  HN          4.50    (#   1685:10  Unique    3.79, 4.36 A)
 &rst
  ixpk= 1685, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1121,1122,1123,
 &end
#
#   76 MET  ME           76 MET  HN          4.50    (#   1686:10  Unique    4.26, 5.26 A)
 &rst
  ixpk= 1686, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1207,1208,1209,
 &end
#
#    0 AMB  10-2:1687    76 MET  HN          5.50    (#   1687:10  Single Ambig)
 &rst
  ixpk= 1687, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1171,1025,
 &end
#
#   15 ASN  HD2-         76 MET  HN          5.50    (#   1688:10  Unique    4.83, 5.56 A)
 &rst
  ixpk= 1688, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 236, 237,
 &end
#
#    0 AMB  10-2:1689    76 MET  HN          5.50    (#   1689:10  Single Ambig)
 &rst
  ixpk= 1689, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1074,1082, 250, 251, 252, 254, 255, 256,
 &end
#
#   15 ASN  HD2+         76 MET  HN          5.50    (#   1690:10  Unique    4.83, 5.56 A)
 &rst
  ixpk= 1690, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 236, 237,
 &end
#
#   76 MET  HN           67 GLY  HN          5.50    (#   1691:10  Unique    4.32, 4.38 A)
 &rst
  ixpk= 1691, nxpk= 10, iat=1196,1059, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1693    67 GLY  HN          5.50    (#   1693:10  Single Ambig)
 &rst
  ixpk= 1693, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1188,1088,
 &end
#
#   65 LEU  HA           67 GLY  HN          5.50    (#   1694:10  Unique    5.38, 5.48 A)
 &rst
  ixpk= 1694, nxpk= 10, iat=1025,1059, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   68 PHE  HB+          67 GLY  HN          5.50    (#   1695:10  Unique    4.62, 4.89 A)
 &rst
  ixpk= 1695, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1070,1071,
 &end
#
#   68 PHE  HB-          67 GLY  HN          5.50    (#   1696:10  Unique    4.62, 4.89 A)
 &rst
  ixpk= 1696, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1070,1071,
 &end
#
#   42 PRO  HA           41 VAL  HN          5.50    (#   1697:10  Unique    4.19, 5.01 A)
 &rst
  ixpk= 1697, nxpk= 10, iat= 681, 655, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   44 ARG  HN           41 VAL  HN          5.50    (#   1698:10  Unique    4.05, 4.55 A)
 &rst
  ixpk= 1698, nxpk= 10, iat= 699, 655, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   47 ILE  HN           41 VAL  HN          5.50    (#   1699:10  Unique    4.23, 4.92 A)
 &rst
  ixpk= 1699, nxpk= 10, iat= 752, 655, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   43 ASN  HD2+         43 ASN  HN          5.50    (#   1702:10  Unique    4.08, 5.51 A)
 &rst
  ixpk= 1702, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 694, 695,
 &end
#
#    0 AMB  10-2:1709     0 AMB  10-1:1709   3.50    (#   1709:10  Double Ambig)
 &rst
  ixpk= 1709, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=  64,  65,  49,  50,
 igr2=  72,  73,  72,  73,
 &end
#
#   47 ILE  HN           44 ARG  HN          5.50    (#   1711:10  Unique    5.02, 5.60 A)
 &rst
  ixpk= 1711, nxpk= 10, iat= 752, 699, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 LEU  HA           44 ARG  HN          7.00    (#   1712:10  Unique    5.95, 6.77 A)
 &rst
  ixpk= 1712, nxpk= 10, iat= 638, 699, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   41 VAL  HA           44 ARG  HN          4.50    (#   1713:10  Unique    4.60, 4.95 A)
 &rst
  ixpk= 1713, nxpk= 10, iat= 657, 699, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1714    80 PHE  HN          4.50    (#   1714:10  Single Ambig)
 &rst
  ixpk= 1714, nxpk= 10, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
 igr1= 986, 987, 164, 165, 166, 168, 169, 170,1241,1242,
      1243,
 &end
#
#   46 ASP  HN           45 HIS  HN          5.50    (#   1715:10  Unique    1.84, 2.59 A)
 &rst
  ixpk= 1715, nxpk= 10, iat= 740, 723, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1716    47 ILE  HN          5.50    (#   1716:10  Single Ambig)
 &rst
  ixpk= 1716, nxpk= 10, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 773, 229, 243,
 &end
#
#   14 THR  HA           47 ILE  HN          5.50    (#   1717:10  Unique    4.74, 4.86 A)
 &rst
  ixpk= 1717, nxpk= 10, iat= 215, 752, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 LEU  MDY          47 ILE  HN          5.50    (#   1719:10  Unique    3.35, 5.79 A)
 &rst
  ixpk= 1719, nxpk= 10, iat=  -1, 752, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 250, 251, 252, 254, 255, 256,
 &end
#
#   44 ARG  HE           47 ILE  HN          5.50    (#   1720:10  Unique    3.60, 4.24 A)
 &rst
  ixpk= 1720, nxpk= 10, iat= 712, 752, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   41 VAL  HN           47 ILE  HN          5.50    (#   1721:10  Unique    4.23, 4.92 A)
 &rst
  ixpk= 1721, nxpk= 10, iat= 655, 752, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1723     0 AMB  10-1:1723   5.50    (#   1723:10  Double Ambig)
 &rst
  ixpk= 1723, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 935, 936, 217,
 igr2= 976, 771,
 &end
#
#    0 AMB  10-2:1724    62 LYS  HN          5.50    (#   1724:10  Single Ambig)
 &rst
  ixpk= 1724, nxpk= 10, iat=  -1, 976, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 935, 936,1000,
 &end
#
#   60 ALA  HA           62 LYS  HN          5.50    (#   1725:10  Unique    4.39, 4.48 A)
 &rst
  ixpk= 1725, nxpk= 10, iat= 958, 976, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   78 ILE  HA           13 LEU  HN          5.50    (#   1726:10  Unique    4.93, 4.99 A)
 &rst
  ixpk= 1726, nxpk= 10, iat=1237, 194, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   47 ILE  HA           13 LEU  HN          5.50    (#   1727:10  Unique    4.55, 4.63 A)
 &rst
  ixpk= 1727, nxpk= 10, iat= 754, 194, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1728    13 LEU  HN          5.50    (#   1728:10  Single Ambig)
 &rst
  ixpk= 1728, nxpk= 10, iat=  -1, 194, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 250, 251, 252, 254, 255, 256, 791, 795, 793,
 &end
#
#   78 ILE  HN           14 THR  HN          5.50    (#   1729:10  Unique    4.74, 4.86 A)
 &rst
  ixpk= 1729, nxpk= 10, iat=1235, 213, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   12 PHE  HD           14 THR  HN          5.50    (#   1730:10  Unique    6.15, 6.59 A)
 &rst
  ixpk= 1730, nxpk= 10, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 182, 190,
 &end
#
#   15 ASN  HB+          14 THR  HN          5.50    (#   1731:10  Unique    4.80, 5.18 A)
 &rst
  ixpk= 1731, nxpk= 10, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 231, 232,
 &end
#
#   48 ALA  MB           14 THR  HN          5.50    (#   1732:10  Unique    5.51, 6.81 A)
 &rst
  ixpk= 1732, nxpk= 10, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 775, 776, 777,
 &end
#
#    0 AMB  10-2:1733    14 THR  HN          5.50    (#   1733:10  Single Ambig)
 &rst
  ixpk= 1733, nxpk= 10, iat=  -1, 213, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1245,1246,1121,1122,1123,
 &end
#
#    0 AMB  10-2:1734     0 AMB  10-1:1734   5.50    (#   1734:10  Double Ambig)
 &rst
  ixpk= 1734, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 752, 236, 237,
 igr2= 227, 781,
 &end
#
#   12 PHE  HZ           15 ASN  HN          7.00    (#   1735:10  Unique    6.62, 6.78 A)
 &rst
  ixpk= 1735, nxpk= 10, iat= 186, 227, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   41 VAL  HN           49 PHE  HN          5.50    (#   1736:10  Unique    4.24, 5.17 A)
 &rst
  ixpk= 1736, nxpk= 10, iat= 655, 781, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   46 ASP  HN           16 LEU  HN          5.50    (#   1737:10  Unique    4.85, 5.50 A)
 &rst
  ixpk= 1737, nxpk= 10, iat= 740, 241, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   46 ASP  HA           18 GLU  HN          5.50    (#   1738:10  Unique    4.53, 4.85 A)
 &rst
  ixpk= 1738, nxpk= 10, iat= 742, 274, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   20 THR  HN           18 GLU  HN          4.50    (#   1743:10  Unique    4.33, 4.37 A)
 &rst
  ixpk= 1743, nxpk= 10, iat= 304, 274, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   46 ASP  HN           18 GLU  HN          7.00    (#   1744:10  Unique    5.36, 6.23 A)
 &rst
  ixpk= 1744, nxpk= 10, iat= 740, 274, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   21 ASN  HN           19 GLU  HN          7.00    (#   1747:10  Unique    7.08, 7.19 A)
 &rst
  ixpk= 1747, nxpk= 10, iat= 318, 289, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:1750    20 THR  HN          3.50    (#   1750:10  Single Ambig)
 &rst
  ixpk= 1750, nxpk= 10, iat=  -1, 304, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 293, 294, 267, 268,
 &end
#
#   46 ASP  HA           20 THR  HN          5.50    (#   1751:10  Unique    5.09, 5.58 A)
 &rst
  ixpk= 1751, nxpk= 10, iat= 742, 304, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   35 PHE  HD           29 PHE  HN          4.50    (#   1754:10  Unique         5.51, 5.96 A)
 &rst
  ixpk= 1754, nxpk= 10, iat=  -1, 447, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 547, 555,
 &end
#
#    0 AMB  10-2:1755    30 ASN  HN          4.50    (#   1755:10  Single Ambig)
 &rst
  ixpk= 1755, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 488, 489, 488, 489,
 &end
#
#   65 LEU  MDX          30 ASN  HN          5.50    (#   1756:10  Unique         5.94, 7.57 A)
 &rst
  ixpk= 1756, nxpk= 10, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1032,1033,1034,1036,1037,1038,
 &end
#
#   61 ALA  MB           35 PHE  HN          5.50    (#   1757:10  Unique         6.19, 7.19 A)
 &rst
  ixpk= 1757, nxpk= 10, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 970, 971, 972,
 &end
#
#    0 AMB  10-2:1758    35 PHE  HN          5.50    (#   1758:10  Single Ambig)
 &rst
  ixpk= 1758, nxpk= 10, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 522, 523, 471, 472,
 &end
#
#   30 ASN  HB+          35 PHE  HN          5.50    (#   1759:10  Unique         6.76, 7.67 A)
 &rst
  ixpk= 1759, nxpk= 10, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 471, 472,
 &end
#
#    0 AMB  10-2:1760    35 PHE  HN          5.50    (#   1760:10  Single Ambig)
 &rst
  ixpk= 1760, nxpk= 10, iat=  -1, 539, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 842, 846, 844,
 &end
#
#   37 GLU  HN           35 PHE  HN          7.00    (#   1761:10  Unique         6.57, 6.71 A)
 &rst
  ixpk= 1761, nxpk= 10, iat= 581, 539, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   32 PHE  HN           35 PHE  HN          5.50    (#   1762:10  Unique         4.41, 4.48 A)
 &rst
  ixpk= 1762, nxpk= 10, iat= 498, 539, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   30 ASN  HA           36 LYS  HN          5.50    (#   1763:10  Unique         6.42, 7.04 A)
 &rst
  ixpk= 1763, nxpk= 10, iat= 469, 559, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1764    36 LYS  HN          4.50    (#   1764:10  Single Ambig)
 &rst
  ixpk= 1764, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 572, 573, 572, 573,
 &end
#
#   36 LYS  HG-          36 LYS  HN          4.50    (#   1765:10  Unique         2.69, 3.68 A)
 &rst
  ixpk= 1765, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 566, 567,
 &end
#
#   50 VAL  MGY          36 LYS  HN          5.50    (#   1766:10  Unique         4.16, 6.37 A)
 &rst
  ixpk= 1766, nxpk= 10, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 807, 808, 809, 811, 812, 813,
 &end
#
#   35 PHE  HE           37 GLU  HN          4.50    (#   1768:10  Unique         3.23, 4.68 A)
 &rst
  ixpk= 1768, nxpk= 10, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 549, 553,
 &end
#
#   35 PHE  HN           37 GLU  HN          7.00    (#   1769:10  Unique         6.57, 6.71 A)
 &rst
  ixpk= 1769, nxpk= 10, iat= 539, 581, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end



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