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
476153 1dgq 4553 cing 1-original 1 AMBER distance NOE ambi


#
#  162 PHE  HD        161 GLU  HB2           3.50    (#   6040:20   Manualy assigned)
 &rst
  ixpk= 6040, iat=  -1,2552, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,

      rk2=20.0, rk3=20.0, ir6=1,
 igr1=2571,2579,
 &end
#
#  162 PHE  HE        161 GLU  HB2           4.50    (#   6041:20   Manualy assigned)
 &rst
  ixpk= 6041, iat=  -1,2552, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2573,2577,
 &end
#
#    0 AMB  20-2:9      125 ILE  HG1-        4.50    (#      9:20   Single Ambig)
 &rst
  ixpk= 9, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1971,1957,
 igr2=1979,1980,
 &end
#
#    0 AMB  20-2:12      92 VAL  MG2         3.50    (#     12:20   Single Ambig)
 &rst
  ixpk= 12, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1= 179, 180, 181, 183, 184, 185,1545,1546,1547,
 igr2=1494,1495,1496,
 &end
#
#  142 PHE  HB2         148 GLN  HB-         6.00    (#     18:20   Unique)
 &rst
  ixpk= 18, iat=2251,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=2350,2351,
 &end
#
#    0 AMB  20-2:19     148 GLN  HB-         3.50    (#     19:20   Single Ambig)
 &rst
  ixpk= 19, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2353,2354,2353,2354,2370,2371,
 igr2=2350,2351,
 &end
#
#    0 AMB  20-2:23       0 AMB  20-1:23     2.70    (#     23:20   Double Ambig)
 &rst
  ixpk= 23, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.91, r4= 5.66,
 igr1=3005,3006,3007,3012,3013,3014,1767,1768,1769,1809,
      1810,1811,
 igr2=3009,3010, 122,
 &end
#
#    0 AMB  20-2:59       0 AMB  20-1:59     4.50    (#     59:20   Double Ambig)
 &rst
  ixpk= 59, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2909,2910,2886,2887,2746,2747,2867,2868,2867,2868,
      
 igr2=2966,2967,2818,2819,
 &end
#
#  176 PHE  HB-         175 LEU  HB3         4.50    (#     60:20   Unique)
 &rst
  ixpk= 60, iat=  -1,2800, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2818,2819,
 &end
#
#   66 TRP  HB3          66 TRP  HB2         3.50    (#     75:20   Unique)
 &rst
  ixpk= 75, iat=1054,1053, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  168 THR  MG2         171 LYS  HG+         4.50    (#     76:20   Unique)
 &rst
  ixpk= 76, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2677,2678,2679,
 igr2=2727,2728,
 &end
#
#  168 THR  MG2         171 LYS  HG-         4.50    (#     77:20   Unique)
 &rst
  ixpk= 77, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2677,2678,2679,
 igr2=2727,2728,
 &end
#
#   30 PHE  QB            0 AMB  20-1:81     3.50    (#     81:20   Single Ambig)
 &rst
  ixpk= 81, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 459, 460,
 igr2= 447, 448, 447, 448,
 &end
#
#  105 PRO  QG          106 ASP  HB-         3.50    (#     82:20   Unique)
 &rst
  ixpk= 82, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1693,1694,
 igr2=1707,1708,
 &end
#
#    0 AMB  20-2:92       0 AMB  20-1:92     3.50    (#     92:20   Double Ambig)
 &rst
  ixpk= 92, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.47, r4= 7.22,
 igr1=2804,2805,2806,2808,2809,2810,2906,2907,2953,2954,
      
 igr2=2606,2607,2928,2929,
 &end
#
#    0 AMB  20-2:95       0 AMB  20-1:95     3.50    (#     95:20   Double Ambig)
 &rst
  ixpk= 95, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.85, r4= 7.60,
 igr1=2804,2805,2806,2808,2809,2810,2906,2907,2649,2650,
      2651,2653,2654,2655,
 igr2=2606,2607,2928,2929,
 &end
#
#  158 PRO  HB3         161 GLU  QG          4.50    (#    102:20   Unique)
 &rst
  ixpk= 102, iat=2521,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2555,2556,
 &end
#
#    0 AMB  20-2:118     47 ALA  MB          3.50    (#    118:20   Single Ambig)
 &rst
  ixpk= 118, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1171,1172,1173,1175,1176,1177, 482, 483,
 igr2= 748, 749, 750,
 &end
#
#    0 AMB  20-2:119      0 AMB  20-1:119    2.70    (#    119:20   Double Ambig)
 &rst
  ixpk= 119, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.59, r4= 5.34,
 igr1=1606,1607,1606,1607,2855,2856,
 igr2=1603,1604,2852,2853,
 &end
#
#    0 AMB  20-2:130     17 MET  HG-         3.50    (#    130:20   Single Ambig)
 &rst
  ixpk= 130, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 243, 244, 252, 253, 254,
 igr2= 246, 247,
 &end
#
#    0 AMB  20-2:138      0 AMB  20-1:138    2.70    (#    138:20   Double Ambig)
 &rst
  ixpk= 138, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.78, r4= 6.53,
 igr1= 501, 502,2906,2907,2150,2151,2152,1188,1189,1821,
      1822,1823,
 igr2= 504, 505,2909,2910,2147,2148,1191,1192,
 &end
#
#    0 AMB  20-2:141    135 ILE  HG1-        3.50    (#    141:20   Single Ambig)
 &rst
  ixpk= 141, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1821,1822,1823,2589,2590,2591,
 igr2=2147,2148,
 &end
#
#   19 LEU  HB-          19 LEU  MDY         3.50    (#    145:20   Unique)
 &rst
  ixpk= 145, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 273, 274,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#    0 AMB  20-2:161      9 LEU  MDX         3.50    (#    161:20   Single Ambig)
 &rst
  ixpk= 161, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1806,1807, 120,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#  164 LYS  HA          164 LYS  QD          3.50    (#    162:20   Unique)
 &rst
  ixpk= 162, iat=2601,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2609,2610,
 &end
#
#    0 AMB  20-2:163      0 AMB  20-1:163    3.50    (#    163:20   Double Ambig)
 &rst
  ixpk= 163, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=2162,2163,2164,2649,2650,2651,2653,2654,2655,2956,
      2957,2958,
 igr2=2166,2167,2886,2887,
 &end
#
#  175 LEU  HB2         175 LEU  HB3         3.50    (#    201:20   Unique)
 &rst
  ixpk= 201, iat=2799,2800, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  175 LEU  HB3         175 LEU  HB2         3.50    (#    202:20   Unique)
 &rst
  ixpk= 202, iat=2800,2799, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:205     17 MET  HG-         3.50    (#    205:20   Single Ambig)
 &rst
  ixpk= 205, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 243, 244, 252, 253, 254,
 igr2= 246, 247,
 &end
#
#    0 AMB  20-2:206      0 AMB  20-1:206    2.70    (#    206:20   Double Ambig)
 &rst
  ixpk= 206, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.81, r4= 5.56,
 igr1= 549, 570, 571, 501, 502, 573, 574,1636,
 igr2=1111,1112,1618,1619,
 &end
#
#    0 AMB  20-2:207      0 AMB  20-1:207    3.50    (#    207:20   Double Ambig)
 &rst
  ixpk= 207, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 570, 571,1579,1580,
 igr2=1111,1112,1618,1619,
 &end
#
#    0 AMB  20-2:209      0 AMB  20-1:209    3.50    (#    209:20   Double Ambig)
 &rst
  ixpk= 209, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2906,2907,1188,1189,
 igr2=2903,2904,1185,1186,
 &end
#
#    5 GLY  HN            5 GLY  HA+         4.50    (#    215:20   Unique)
 &rst
  ixpk= 215, iat=  66,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=  68,  69,
 &end
#
#    5 GLY  HN            5 GLY  HA-         4.50    (#    216:20   Unique)
 &rst
  ixpk= 216, iat=  66,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=  68,  69,
 &end
#
#    0 AMB  20-2:218      7 VAL  HA          3.50    (#    218:20   Single Ambig)
 &rst
  ixpk= 218, iat=  -1,  89, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=  87, 709, 710,
 &end
#
#    0 AMB  20-2:220      9 LEU  HA          4.50    (#    220:20   Single Ambig)
 &rst
  ixpk= 220, iat=  -1, 117, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 115, 103,
 &end
#
#   10 VAL  HN           10 VAL  HA          4.50    (#    221:20   Unique)
 &rst
  ixpk= 221, iat= 134, 136, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   11 PHE  HN           11 PHE  HA          4.50    (#    222:20   Unique)
 &rst
  ixpk= 222, iat= 150, 152, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   12 LEU  HN           12 LEU  HA          4.50    (#    223:20   Unique)
 &rst
  ixpk= 223, iat= 170, 172, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   13 PHE  HN           13 PHE  HA          6.00    (#    224:20   Unique)
 &rst
  ixpk= 224, iat= 189, 191, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:225     15 GLY  HA+         4.50    (#    225:20   Single Ambig)
 &rst
  ixpk= 225, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 221,1294,
 igr2= 223, 224,
 &end
#
#    0 AMB  20-2:226     15 GLY  HA-         3.50    (#    226:20   Single Ambig)
 &rst
  ixpk= 226, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 221,1294,
 igr2= 223, 224,
 &end
#
#   16 SER  HN           16 SER  HA          4.50    (#    227:20   Unique)
 &rst
  ixpk= 227, iat= 228, 230, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   17 MET  HN           17 MET  HA          3.50    (#    228:20   Unique)
 &rst
  ixpk= 228, iat= 239, 241, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:229      0 AMB  20-1:229    3.50    (#    229:20   Double Ambig)
 &rst
  ixpk= 229, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 269,2450, 300, 301,2470,
 igr2= 271,2394,
 &end
#
#   22 ASP  HN           22 ASP  HA          3.50    (#    230:20   Unique)
 &rst
  ixpk= 230, iat= 319, 321, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:231      0 AMB  20-1:231    3.50    (#    231:20   Double Ambig)
 &rst
  ixpk= 231, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1095, 331,
 igr2=1075, 333,
 &end
#
#    0 AMB  20-2:232     24 PHE  HA          3.50    (#    232:20   Single Ambig)
 &rst
  ixpk= 232, iat=  -1, 348, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 346, 366,
 &end
#
#   25 GLN  HN           25 GLN  HA          3.50    (#    233:20   Unique)
 &rst
  ixpk= 233, iat= 366, 368, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:234     26 LYS  HA          3.50    (#    234:20   Single Ambig)
 &rst
  ixpk= 234, iat=  -1, 385, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 383, 405,
 &end
#
#   27 ILE  HN           27 ILE  HA          3.50    (#    235:20   Unique)
 &rst
  ixpk= 235, iat= 405, 407, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:236     28 LEU  HA          3.50    (#    236:20   Single Ambig)
 &rst
  ixpk= 236, iat=  -1, 426, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 424, 475,
 &end
#
#   29 ASP  HN           29 ASP  HA          3.50    (#    237:20   Unique)
 &rst
  ixpk= 237, iat= 443, 445, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:238     30 PHE  HA          3.50    (#    238:20   Single Ambig)
 &rst
  ixpk= 238, iat=  -1, 457, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 455, 528,
 &end
#
#    0 AMB  20-2:239     31 MET  HA          3.50    (#    239:20   Single Ambig)
 &rst
  ixpk= 239, iat=  -1, 477, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 475, 463, 471, 544,
 &end
#
#   32 LYS  HN           32 LYS  HA          3.50    (#    240:20   Unique)
 &rst
  ixpk= 240, iat= 494, 496, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:241     33 ASP  HA          3.50    (#    241:20   Single Ambig)
 &rst
  ixpk= 241, iat=  -1, 518, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 516, 585,
 &end
#
#   34 VAL  HN           34 VAL  HA          3.50    (#    242:20   Unique)
 &rst
  ixpk= 242, iat= 528, 530, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   35 MET  HN           35 MET  HA          3.50    (#    243:20   Unique)
 &rst
  ixpk= 243, iat= 544, 546, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   36 LYS  HN           36 LYS  HA          3.50    (#    244:20   Unique)
 &rst
  ixpk= 244, iat= 563, 565, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   37 LYS  HN           37 LYS  HA          3.50    (#    245:20   Unique)
 &rst
  ixpk= 245, iat= 585, 587, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   39 SER  HN           39 SER  HA          3.50    (#    247:20   Unique)
 &rst
  ixpk= 247, iat= 626, 628, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   40 ASN  HN           40 ASN  HA          4.50    (#    248:20   Unique)
 &rst
  ixpk= 248, iat= 637, 639, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   43 TYR  HN           43 TYR  HA          4.50    (#    250:20   Unique)
 &rst
  ixpk= 250, iat= 676, 678, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   44 GLN  HN           44 GLN  HA          4.50    (#    251:20   Unique)
 &rst
  ixpk= 251, iat= 697, 699, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   45 PHE  HN           45 PHE  HA          4.50    (#    252:20   Preassigned)
 &rst
  ixpk= 252, iat= 714, 716, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   46 ALA  HN           46 ALA  HA          4.50    (#    253:20   Unique)
 &rst
  ixpk= 253, iat= 734, 736, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   47 ALA  HN           47 ALA  HA          3.50    (#    254:20   Unique)
 &rst
  ixpk= 254, iat= 744, 746, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   48 VAL  HN           48 VAL  HA          4.50    (#    255:20   Unique)
 &rst
  ixpk= 255, iat= 754, 756, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:256     50 PHE  HA          4.50    (#    256:20   Single Ambig)
 &rst
  ixpk= 256, iat=  -1, 789, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 787, 832,
 &end
#
#    0 AMB  20-2:257     51 SER  HA          3.50    (#    257:20   Single Ambig)
 &rst
  ixpk= 257, iat=  -1, 809, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 807, 221,
 &end
#
#   52 THR  HN           52 THR  HA          4.50    (#    258:20   Unique)
 &rst
  ixpk= 258, iat= 818, 820, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   53 SER  HN           53 SER  HA          3.50    (#    259:20   Unique)
 &rst
  ixpk= 259, iat= 832, 834, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   54 TYR  HN           54 TYR  HA          4.50    (#    260:20   Unique)
 &rst
  ixpk= 260, iat= 843, 845, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:261      0 AMB  20-1:261    3.50    (#    261:20   Double Ambig)
 &rst
  ixpk= 261, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 864, 239, 665,
 igr2= 866,1334, 699,
 &end
#
#    0 AMB  20-2:262     56 THR  HA          3.50    (#    262:20   Single Ambig)
 &rst
  ixpk= 262, iat=  -1, 888, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 900, 886,
 &end
#
#   57 GLU  HN           57 GLU  HA          3.50    (#    263:20   Preassigned)
 &rst
  ixpk= 263, iat= 900, 902, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:264     58 PHE  HA          3.50    (#    264:20   Single Ambig)
 &rst
  ixpk= 264, iat=  -1, 917, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 915, 744,
 &end
#
#   59 ASP  HN           59 ASP  HA          4.50    (#    265:20   Unique)
 &rst
  ixpk= 265, iat= 935, 937, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   62 ASP  HN           62 ASP  HA          3.50    (#    266:20   Unique)
 &rst
  ixpk= 266, iat= 978, 980, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   63 TYR  HN           63 TYR  HA          3.50    (#    267:20   Unique)
 &rst
  ixpk= 267, iat= 990, 992, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   64 VAL  HN           64 VAL  HA          3.50    (#    268:20   Unique)
 &rst
  ixpk= 268, iat=1011,1013, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   65 LYS  HN           65 LYS  HA          3.50    (#    269:20   Unique)
 &rst
  ixpk= 269, iat=1027,1029, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   66 TRP  HN           66 TRP  HA          3.50    (#    270:20   Unique)
 &rst
  ixpk= 270, iat=1049,1051, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   67 LYS  HN           67 LYS  HA          3.50    (#    271:20   Unique)
 &rst
  ixpk= 271, iat=1073,1075, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   68 ASP  HN           68 ASP  HA          3.50    (#    272:20   Unique)
 &rst
  ixpk= 272, iat=1095,1097, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   71 ALA  HN           71 ALA  HA          3.50    (#    273:20   Unique)
 &rst
  ixpk= 273, iat=1133,1135, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   72 LEU  HN           72 LEU  HA          3.50    (#    274:20   Unique)
 &rst
  ixpk= 274, iat=1143,1145, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:275     73 LEU  HA          3.50    (#    275:20   Single Ambig)
 &rst
  ixpk= 275, iat=  -1,1164, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1162,1181,1220,
 &end
#
#    0 AMB  20-2:276     74 LYS  HA          3.50    (#    276:20   Single Ambig)
 &rst
  ixpk= 276, iat=  -1,1183, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1181,1220,
 &end
#
#    0 AMB  20-2:278     76 VAL  HA          3.50    (#    278:20   Single Ambig)
 &rst
  ixpk= 278, iat=  -1,1222, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1220, 201,
 &end
#
#    0 AMB  20-2:279      0 AMB  20-1:279    3.50    (#    279:20   Double Ambig)
 &rst
  ixpk= 279, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1599,1236,
 igr2=1577,1238,
 &end
#
#   78 HIS  HN           78 HIS  HA          3.50    (#    280:20   Unique)
 &rst
  ixpk= 280, iat=1258,1260, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   79 MET  HN           79 MET  HA          3.50    (#    281:20   Unique)
 &rst
  ixpk= 281, iat=1275,1277, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   80 LEU  HN           80 LEU  HA          3.50    (#    282:20   Unique)
 &rst
  ixpk= 282, iat=1294,1296, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   81 LEU  HN           81 LEU  HA          4.50    (#    283:20   Unique)
 &rst
  ixpk= 283, iat=1313,1315, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   82 LEU  HN           82 LEU  HA          3.50    (#    284:20   Unique)
 &rst
  ixpk= 284, iat=1332,1334, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:285      0 AMB  20-1:285    3.50    (#    285:20   Double Ambig)
 &rst
  ixpk= 285, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1911,1365,
 igr2=1903,1367,
 &end
#
#   85 THR  HN           85 THR  HA          3.50    (#    286:20   Unique)
 &rst
  ixpk= 286, iat=1379,1381, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   86 PHE  HN           86 PHE  HA          3.50    (#    287:20   Unique)
 &rst
  ixpk= 287, iat=1393,1395, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   87 GLY  HN           87 GLY  HA+         3.50    (#    288:20   Unique)
 &rst
  ixpk= 288, iat=1413,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1415,1416,
 &end
#
#   87 GLY  HN           87 GLY  HA-         3.50    (#    289:20   Unique)
 &rst
  ixpk= 289, iat=1413,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1415,1416,
 &end
#
#    0 AMB  20-2:290     88 ALA  HA          3.50    (#    290:20   Single Ambig)
 &rst
  ixpk= 290, iat=  -1,1422, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1420,1430,
 &end
#
#   89 ILE  HN           89 ILE  HA          3.50    (#    291:20   Unique)
 &rst
  ixpk= 291, iat=1430,1432, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   90 ASN  HN           90 ASN  HA          3.50    (#    292:20   Unique)
 &rst
  ixpk= 292, iat=1449,1451, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:293     91 TYR  HA          3.50    (#    293:20   Single Ambig)
 &rst
  ixpk= 293, iat=  -1,1465, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1463,1484,
 &end
#
#    0 AMB  20-2:294     92 VAL  HA          3.50    (#    294:20   Single Ambig)
 &rst
  ixpk= 294, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1484,1500,
 &end
#
#    0 AMB  20-2:295      0 AMB  20-1:295    3.50    (#    295:20   Double Ambig)
 &rst
  ixpk= 295, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1500,2537,
 igr2=1502,2529,
 &end
#
#   94 THR  HN           94 THR  HA          3.50    (#    296:20   Unique)
 &rst
  ixpk= 296, iat=1510,1512, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   95 GLU  HN           95 GLU  HA          3.50    (#    297:20   Unique)
 &rst
  ixpk= 297, iat=1524,1526, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:298     97 PHE  HA          3.50    (#    298:20   Single Ambig)
 &rst
  ixpk= 298, iat=  -1,1557, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1555, 955, 963,1565,1569,
 &end
#
#    0 AMB  20-2:299      0 AMB  20-1:299    3.50    (#    299:20   Double Ambig)
 &rst
  ixpk= 299, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1575,1143,
 igr2=1577,1164,
 &end
#
#  100 GLU  HN          100 GLU  HA          4.50    (#    300:20   Unique)
 &rst
  ixpk= 300, iat=1614,1616, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  101 LEU  HN            0 AMB  20-1:301    3.50    (#    301:20   Single Ambig)
 &rst
  ixpk= 301, iat=1629,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1631,1577,
 &end
#
#  102 GLY  HN          102 GLY  HA+         3.50    (#    302:20   Unique)
 &rst
  ixpk= 302, iat=1648,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1650,1651,
 &end
#
#  102 GLY  HN          102 GLY  HA-         3.50    (#    303:20   Unique)
 &rst
  ixpk= 303, iat=1648,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1650,1651,
 &end
#
#  103 ALA  HN          103 ALA  HA          3.50    (#    304:20   Unique)
 &rst
  ixpk= 304, iat=1655,1657, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  104 ARG  HN          104 ARG  HA          4.50    (#    305:20   Unique)
 &rst
  ixpk= 305, iat=1665,1667, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  106 ASP  HN          106 ASP  HA          3.50    (#    306:20   Unique)
 &rst
  ixpk= 306, iat=1703,1705, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  107 ALA  HN          107 ALA  HA          3.50    (#    307:20   Unique)
 &rst
  ixpk= 307, iat=1715,1717, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  108 THR  HN          108 THR  HA          3.50    (#    308:20   Unique)
 &rst
  ixpk= 308, iat=1725,1727, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:310      0 AMB  20-1:310    3.50    (#    310:20   Double Ambig)
 &rst
  ixpk= 310, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1761,1969,1988,
 igr2=1763,1971,
 &end
#
#    0 AMB  20-2:311    111 LEU  HA          4.50    (#    311:20   Single Ambig)
 &rst
  ixpk= 311, iat=  -1,1779, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1777, 170,
 &end
#
#    0 AMB  20-2:312    112 ILE  HA          3.50    (#    312:20   Single Ambig)
 &rst
  ixpk= 312, iat=  -1,1798, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1796,2137,
 &end
#
#  113 ILE  HN          113 ILE  HA          6.00    (#    313:20   Unique)
 &rst
  ixpk= 313, iat=1815,1817, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  114 ILE  HN          114 ILE  HA          4.50    (#    314:20   Unique)
 &rst
  ixpk= 314, iat=1834,1836, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  116 ASP  HN          116 ASP  HA          4.50    (#    315:20   Unique)
 &rst
  ixpk= 315, iat=1867,1869, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  117 GLY  HN          117 GLY  HA+         3.50    (#    316:20   Unique)
 &rst
  ixpk= 316, iat=1879,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1881,1882,
 &end
#
#    0 AMB  20-2:317      0 AMB  20-1:317    4.50    (#    317:20   Double Ambig)
 &rst
  ixpk= 317, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1879,1374,1375,
 igr2=1881,1882,1415,1416,
 &end
#
#  118 GLU  HN          118 GLU  HA          3.50    (#    318:20   Unique)
 &rst
  ixpk= 318, iat=1886,1888, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:319      0 AMB  20-1:319    3.50    (#    319:20   Double Ambig)
 &rst
  ixpk= 319, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1379,1901,
 igr2=1903,1367,
 &end
#
#  120 THR  HN          120 THR  HA          3.50    (#    320:20   Unique)
 &rst
  ixpk= 320, iat=1911,1913, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  121 ASP  HN          121 ASP  HA          3.50    (#    321:20   Unique)
 &rst
  ixpk= 321, iat=1925,1927, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  122 SER  HN          122 SER  HA          3.50    (#    322:20   Unique)
 &rst
  ixpk= 322, iat=1937,1939, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  123 GLY  HN          123 GLY  HA+         4.50    (#    323:20   Unique)
 &rst
  ixpk= 323, iat=1948,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1950,1951,
 &end
#
#  123 GLY  HN          123 GLY  HA-         3.50    (#    324:20   Unique)
 &rst
  ixpk= 324, iat=1948,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1950,1951,
 &end
#
#  124 ASN  HN          124 ASN  HA          4.50    (#    325:20   Unique)
 &rst
  ixpk= 325, iat=1955,1957, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:326      0 AMB  20-1:326    3.50    (#    326:20   Double Ambig)
 &rst
  ixpk= 326, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1969,2000, 134,
 igr2=1971,1763,
 &end
#
#    0 AMB  20-2:327      0 AMB  20-1:327    3.50    (#    327:20   Double Ambig)
 &rst
  ixpk= 327, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1988,2814,1969,
 igr2=1990,2763,
 &end
#
#  127 ALA  HN          127 ALA  HA          3.50    (#    328:20   Unique)
 &rst
  ixpk= 328, iat=2000,2002, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  128 ALA  HN          128 ALA  HA          3.50    (#    329:20   Unique)
 &rst
  ixpk= 329, iat=2010,2012, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  129 LYS  HN          129 LYS  HA          3.50    (#    330:20   Unique)
 &rst
  ixpk= 330, iat=2020,2022, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:331      0 AMB  20-1:331    3.50    (#    331:20   Double Ambig)
 &rst
  ixpk= 331, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1258,2042,
 igr2=1238,2044,
 &end
#
#  131 ILE  HN          131 ILE  HA          3.50    (#    332:20   Unique)
 &rst
  ixpk= 332, iat=2054,2056, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:333      0 AMB  20-1:333    3.50    (#    333:20   Double Ambig)
 &rst
  ixpk= 333, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1= 235,2073,1294,
 igr2= 262, 263,2075, 811, 812,
 &end
#
#    0 AMB  20-2:334    133 ARG  HA          3.50    (#    334:20   Single Ambig)
 &rst
  ixpk= 334, iat=  -1,2094, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2116,2092,
 &end
#
#  134 TYR  HN          134 TYR  HA          4.50    (#    335:20   Unique)
 &rst
  ixpk= 335, iat=2116,2118, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:336    135 ILE  HA          4.50    (#    336:20   Single Ambig)
 &rst
  ixpk= 336, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1815,2137,
 &end
#
#    0 AMB  20-2:337      0 AMB  20-1:337    3.50    (#    337:20   Double Ambig)
 &rst
  ixpk= 337, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 900,2156,
 igr2= 756,2158,
 &end
#
#  137 GLY  HN          137 GLY  HA+         4.50    (#    338:20   Unique)
 &rst
  ixpk= 338, iat=2175,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2177,2178,
 &end
#
#  137 GLY  HN          137 GLY  HA-         3.50    (#    339:20   Unique)
 &rst
  ixpk= 339, iat=2175,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2177,2178,
 &end
#
#  138 ILE  HN          138 ILE  HA          3.50    (#    340:20   Unique)
 &rst
  ixpk= 340, iat=2182,2184, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:341      0 AMB  20-1:341    3.50    (#    341:20   Double Ambig)
 &rst
  ixpk= 341, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2201, 967,
 igr2=2203,2204,1650,1651,
 &end
#
#  140 LYS  HN          140 LYS  HA          3.50    (#    342:20   Unique)
 &rst
  ixpk= 342, iat=2208,2210, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  141 HIS  HN          141 HIS  HA          3.50    (#    343:20   Unique)
 &rst
  ixpk= 343, iat=2230,2232, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:344    142 PHE  HA          3.50    (#    344:20   Single Ambig)
 &rst
  ixpk= 344, iat=  -1,2249, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2247,2346,
 &end
#
#    0 AMB  20-2:345      0 AMB  20-1:345    3.50    (#    345:20   Double Ambig)
 &rst
  ixpk= 345, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2267,1458,1459,2921,
 igr2=2269,1451,2850,
 &end
#
#  144 THR  HN          144 THR  HA          3.50    (#    346:20   Unique)
 &rst
  ixpk= 346, iat=2284,2286, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  146 GLU  HN          146 GLU  HA          3.50    (#    347:20   Unique)
 &rst
  ixpk= 347, iat=2320,2322, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:348    147 SER  HA          3.50    (#    348:20   Single Ambig)
 &rst
  ixpk= 348, iat=  -1,2337, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2335,2363,
 &end
#
#    0 AMB  20-2:349      0 AMB  20-1:349    3.50    (#    349:20   Double Ambig)
 &rst
  ixpk= 349, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2346,2943,
 igr2=2348,2923,
 &end
#
#  149 GLU  HN          149 GLU  HA          3.50    (#    350:20   Unique)
 &rst
  ixpk= 350, iat=2363,2365, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  151 LEU  HN          151 LEU  HA          3.50    (#    351:20   Unique)
 &rst
  ixpk= 351, iat=2392,2394, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:352      0 AMB  20-1:352    3.50    (#    352:20   Double Ambig)
 &rst
  ixpk= 352, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2358,2359,2411,
 igr2=2269,2413,
 &end
#
#  153 LYS  HN          153 LYS  HA          3.50    (#    353:20   Unique)
 &rst
  ixpk= 353, iat=2428,2430, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:354      0 AMB  20-1:354    3.50    (#    354:20   Double Ambig)
 &rst
  ixpk= 354, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2470,  87, 709, 710,
 igr2=2472,1717,
 &end
#
#  159 ALA  HN          159 ALA  HA          4.50    (#    355:20   Unique)
 &rst
  ixpk= 355, iat=2527,2529, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  160 SER  HN          160 SER  HA          3.50    (#    356:20   Unique)
 &rst
  ixpk= 356, iat=2537,2539, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:357      0 AMB  20-1:357    3.50    (#    357:20   Double Ambig)
 &rst
  ixpk= 357, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.10, r4= 6.85,
 igr1=2783,2921,2548,2983,2761,2742,2378,
 igr2=2722,2923,2550,2348,
 &end
#
#  165 ILE  HN          165 ILE  HA          4.50    (#    359:20   Unique)
 &rst
  ixpk= 359, iat=2621,2623, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:360      0 AMB  20-1:360    4.50    (#    360:20   Double Ambig)
 &rst
  ixpk= 360, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2671, 955, 963, 925, 929,2720,
 igr2=2642, 937,
 &end
#
#    0 AMB  20-2:361      0 AMB  20-1:361    3.50    (#    361:20   Double Ambig)
 &rst
  ixpk= 361, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 288,2659,
 igr2= 271,2661,
 &end
#
#  170 GLU  HN          170 GLU  HA          4.50    (#    363:20   Unique)
 &rst
  ixpk= 363, iat=2705,2707, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  171 LYS  HN          171 LYS  HA          3.50    (#    364:20   Unique)
 &rst
  ixpk= 364, iat=2720,2722, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:365    172 LEU  HA          3.50    (#    365:20   Single Ambig)
 &rst
  ixpk= 365, iat=  -1,2744, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2742,2761,2783,
 &end
#
#    0 AMB  20-2:366    173 LYS  HA          3.50    (#    366:20   Single Ambig)
 &rst
  ixpk= 366, iat=  -1,2763, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2761,2783,2795,
 &end
#
#  174 ASP  HN          174 ASP  HA          3.50    (#    367:20   Unique)
 &rst
  ixpk= 367, iat=2783,2785, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  176 PHE  HN          176 PHE  HA          4.50    (#    368:20   Unique)
 &rst
  ixpk= 368, iat=2814,2816, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:369    177 THR  HA          3.50    (#    369:20   Single Ambig)
 &rst
  ixpk= 369, iat=  -1,2836, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2834,2863,
 &end
#
#    0 AMB  20-2:370      0 AMB  20-1:370    3.50    (#    370:20   Double Ambig)
 &rst
  ixpk= 370, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2848, 300, 301,2279,2280,2428,
 igr2=2850, 260,2269,2413,
 &end
#
#  179 LEU  HN          179 LEU  HA          3.50    (#    371:20   Unique)
 &rst
  ixpk= 371, iat=2863,2865, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:372    186 ILE  HA          3.50    (#    372:20   Single Ambig)
 &rst
  ixpk= 372, iat=  -1,3001, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2999,3033,
 &end
#
#    0 AMB  20-2:373      0 AMB  20-1:373    3.50    (#    373:20   Double Ambig)
 &rst
  ixpk= 373, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=3018,2358,2359,
 igr2=3020,2348,
 &end
#
#    0 AMB  20-2:374      0 AMB  20-1:374    3.50    (#    374:20   Double Ambig)
 &rst
  ixpk= 374, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=3033,1458,1459,
 igr2=3035,3036,1415,1416,
 &end
#
#    3 SER  QB            3 SER  HA          3.50    (#    375:20   Preassigned)
 &rst
  ixpk= 375, iat=  -1,  35, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=  37,  38,
 &end
#
#    7 VAL  HB            7 VAL  HA          3.50    (#    379:20   Unique)
 &rst
  ixpk= 379, iat=  91,  89, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:381      9 LEU  HA          4.50    (#    381:20   Single Ambig)
 &rst
  ixpk= 381, iat=  -1, 117, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 120,1806,1807,
 &end
#
#    9 LEU  HB2           9 LEU  HA          3.50    (#    382:20   Unique)
 &rst
  ixpk= 382, iat= 119, 117, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   10 VAL  HB           10 VAL  HA          4.50    (#    383:20   Unique)
 &rst
  ixpk= 383, iat= 138, 136, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   11 PHE  QB           11 PHE  HA          3.50    (#    384:20   Unique)
 &rst
  ixpk= 384, iat=  -1, 152, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 154, 155,
 &end
#
#   12 LEU  HB3          12 LEU  HA          4.50    (#    385:20   Unique)
 &rst
  ixpk= 385, iat= 175, 172, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   12 LEU  HB2          12 LEU  HA          3.50    (#    386:20   Unique)
 &rst
  ixpk= 386, iat= 174, 172, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:387     13 PHE  HA          3.50    (#    387:20   Single Ambig)
 &rst
  ixpk= 387, iat=  -1, 191, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 193, 194, 193, 194,
 &end
#
#    0 AMB  20-2:388     13 PHE  HA          3.50    (#    388:20   Single Ambig)
 &rst
  ixpk= 388, iat=  -1, 191, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 193, 194, 193, 194,
 &end
#
#    0 AMB  20-2:389      0 AMB  20-1:389    3.50    (#    389:20   Double Ambig)
 &rst
  ixpk= 389, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 232, 233,2203,2204,
 igr2= 230,2269,
 &end
#
#    0 AMB  20-2:390     17 MET  HA          3.50    (#    390:20   Single Ambig)
 &rst
  ixpk= 390, iat=  -1, 241, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 243, 244, 252, 253, 254,
 &end
#
#   17 MET  HB-          17 MET  HA          3.50    (#    391:20   Unique)
 &rst
  ixpk= 391, iat=  -1, 241, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 243, 244,
 &end
#
#   18 SER  HB-          18 SER  HA          3.50    (#    392:20   Unique)
 &rst
  ixpk= 392, iat=  -1, 260, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 262, 263,
 &end
#
#    0 AMB  20-2:393      0 AMB  20-1:393    3.50    (#    393:20   Double Ambig)
 &rst
  ixpk= 393, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 273, 274,2147,2148,
 igr2= 271,2394,
 &end
#
#   21 PRO  HB3          21 PRO  HA          3.50    (#    394:20   Unique)
 &rst
  ixpk= 394, iat= 313, 315, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:395     21 PRO  HA          3.50    (#    395:20   Single Ambig)
 &rst
  ixpk= 395, iat=  -1, 315, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 312,1262,
 &end
#
#    0 AMB  20-2:396      0 AMB  20-1:396    2.70    (#    396:20   Double Ambig)
 &rst
  ixpk= 396, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.09, r4= 4.84,
 igr1= 323, 324, 323, 324,1893,1894,
 igr2= 321,1888,
 &end
#
#    0 AMB  20-2:397     23 GLU  HA          3.50    (#    397:20   Single Ambig)
 &rst
  ixpk= 397, iat=  -1, 333, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 335, 336, 338, 339,
 &end
#
#   23 GLU  HB-          23 GLU  HA          3.50    (#    398:20   Unique)
 &rst
  ixpk= 398, iat=  -1, 333, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 335, 336,
 &end
#
#   24 PHE  HB3          24 PHE  HA          3.50    (#    399:20   Unique)
 &rst
  ixpk= 399, iat= 351, 348, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   24 PHE  HB2          24 PHE  HA          3.50    (#    400:20   Unique)
 &rst
  ixpk= 400, iat= 350, 348, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:401     25 GLN  HA          3.50    (#    401:20   Single Ambig)
 &rst
  ixpk= 401, iat=  -1, 368, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 370, 371, 370, 371,
 &end
#
#    0 AMB  20-2:402     26 LYS  HA          3.50    (#    402:20   Single Ambig)
 &rst
  ixpk= 402, iat=  -1, 385, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 387, 388, 387, 388,
 &end
#
#   26 LYS  HB-          26 LYS  HA          3.50    (#    403:20   Unique)
 &rst
  ixpk= 403, iat=  -1, 385, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 387, 388,
 &end
#
#   27 ILE  HB           27 ILE  HA          3.50    (#    404:20   Unique)
 &rst
  ixpk= 404, iat= 409, 407, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   28 LEU  HB+          28 LEU  HA          3.50    (#    405:20   Unique)
 &rst
  ixpk= 405, iat=  -1, 426, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 428, 429,
 &end
#
#    0 AMB  20-2:406     28 LEU  HA          3.50    (#    406:20   Single Ambig)
 &rst
  ixpk= 406, iat=  -1, 426, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 428, 429,1171,1172,1173,1175,1176,1177, 482, 483,
      
 &end
#
#    0 AMB  20-2:407      0 AMB  20-1:407    2.70    (#    407:20   Double Ambig)
 &rst
  ixpk= 407, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.29, r4= 5.04,
 igr1=1125,1126, 447, 448, 447, 448, 507, 508,
 igr2=1123, 445,
 &end
#
#    0 AMB  20-2:408     30 PHE  HA          3.50    (#    408:20   Single Ambig)
 &rst
  ixpk= 408, iat=  -1, 457, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 459, 460,2818,2819,
 &end
#
#    0 AMB  20-2:409     31 MET  HA          3.50    (#    409:20   Single Ambig)
 &rst
  ixpk= 409, iat=  -1, 477, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 479, 480, 532,
 &end
#
#   31 MET  HB-          31 MET  HA          3.50    (#    410:20   Unique)
 &rst
  ixpk= 410, iat=  -1, 477, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 479, 480,
 &end
#
#    0 AMB  20-2:411     32 LYS  HA          3.50    (#    411:20   Single Ambig)
 &rst
  ixpk= 411, iat=  -1, 496, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 498, 499, 548,1111,1112,
 &end
#
#    0 AMB  20-2:412     32 LYS  HA          3.50    (#    412:20   Single Ambig)
 &rst
  ixpk= 412, iat=  -1, 496, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 498, 499, 501, 502, 504, 505,
 &end
#
#   33 ASP  QB           33 ASP  HA          3.50    (#    413:20   Unique)
 &rst
  ixpk= 413, iat=  -1, 518, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 520, 521,
 &end
#
#   33 ASP  QB           33 ASP  HA          3.50    (#    414:20   Unique)
 &rst
  ixpk= 414, iat=  -1, 518, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 520, 521,
 &end
#
#    0 AMB  20-2:415      0 AMB  20-1:415    3.50    (#    415:20   Double Ambig)
 &rst
  ixpk= 415, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 532, 614,1434,
 igr2= 530,1381,
 &end
#
#    0 AMB  20-2:416     35 MET  HA          3.50    (#    416:20   Single Ambig)
 &rst
  ixpk= 416, iat=  -1, 546, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 548,1111,1112,
 &end
#
#    0 AMB  20-2:417     35 MET  HA          3.50    (#    417:20   Single Ambig)
 &rst
  ixpk= 417, iat=  -1, 546, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 549, 611, 612,
 &end
#
#    0 AMB  20-2:418     36 LYS  HA          2.70    (#    418:20   Single Ambig)
 &rst
  ixpk= 418, iat=  -1, 565, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1= 567, 568,1111,1112,
 &end
#
#   37 LYS  HB+          37 LYS  HA          3.50    (#    419:20   Unique)
 &rst
  ixpk= 419, iat=  -1, 587, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 589, 590,
 &end
#
#    0 AMB  20-2:420      0 AMB  20-1:420    3.50    (#    420:20   Double Ambig)
 &rst
  ixpk= 420, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2215,2216, 589, 590, 589, 590,
 igr2=2210, 587,
 &end
#
#   39 SER  QB           39 SER  HA          3.50    (#    421:20   Unique)
 &rst
  ixpk= 421, iat=  -1, 628, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 630, 631,
 &end
#
#   40 ASN  QB           40 ASN  HA          3.50    (#    422:20   Unique)
 &rst
  ixpk= 422, iat=  -1, 639, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 641, 642,
 &end
#
#   43 TYR  HB2          43 TYR  HA          3.50    (#    426:20   Unique)
 &rst
  ixpk= 426, iat= 680, 678, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   43 TYR  HB3          43 TYR  HA          3.50    (#    427:20   Unique)
 &rst
  ixpk= 427, iat= 681, 678, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:428     44 GLN  HA          3.50    (#    428:20   Single Ambig)
 &rst
  ixpk= 428, iat=  -1, 699, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 701, 702, 701, 702,
 &end
#
#   45 PHE  HB3          45 PHE  HA          3.50    (#    429:20   Preassigned)
 &rst
  ixpk= 429, iat= 719, 716, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:430     45 PHE  HA          3.50    (#    430:20   Preassigned)
 &rst
  ixpk= 430, iat=  -1, 716, r1= 0.00, r2= 1.80, r3= 4.84, r4= 5.59,
 igr1= 718, 701, 702, 704, 705, 551, 552,
 &end
#
#    0 AMB  20-2:431      0 AMB  20-1:431    3.50    (#    431:20   Double Ambig)
 &rst
  ixpk= 431, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.60, r4= 7.35,
 igr1= 738, 739, 740,1152,1153,1154,1156,1157,1158,
 igr2= 736,1108,1109,1108,1109,
 &end
#
#   47 ALA  MB           47 ALA  HA          3.50    (#    432:20   Unique)
 &rst
  ixpk= 432, iat=  -1, 746, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 748, 749, 750,
 &end
#
#   48 VAL  HB           48 VAL  HA          3.50    (#    433:20   Unique)
 &rst
  ixpk= 433, iat= 758, 756, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   49 GLN  QB           49 GLN  HA          3.50    (#    434:20   Unique)
 &rst
  ixpk= 434, iat=  -1, 772, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 774, 775,
 &end
#
#    0 AMB  20-2:435     49 GLN  HA          4.50    (#    435:20   Single Ambig)
 &rst
  ixpk= 435, iat=  -1, 772, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1288,1289,1290,1279,
 &end
#
#   50 PHE  HB2          50 PHE  HA          3.50    (#    436:20   Unique)
 &rst
  ixpk= 436, iat= 791, 789, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   50 PHE  HB3          50 PHE  HA          3.50    (#    437:20   Unique)
 &rst
  ixpk= 437, iat= 792, 789, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   51 SER  HB+          51 SER  HA          3.50    (#    438:20   Unique)
 &rst
  ixpk= 438, iat=  -1, 809, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 811, 812,
 &end
#
#   51 SER  HB-          51 SER  HA          3.50    (#    439:20   Unique)
 &rst
  ixpk= 439, iat=  -1, 809, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 811, 812,
 &end
#
#   52 THR  HB           52 THR  HA          4.50    (#    440:20   Unique)
 &rst
  ixpk= 440, iat= 822, 820, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   54 TYR  HB+          54 TYR  HA          3.50    (#    441:20   Unique)
 &rst
  ixpk= 441, iat=  -1, 845, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 847, 848,
 &end
#
#   54 TYR  HB-          54 TYR  HA          3.50    (#    442:20   Unique)
 &rst
  ixpk= 442, iat=  -1, 845, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 847, 848,
 &end
#
#    0 AMB  20-2:443      0 AMB  20-1:443    3.50    (#    443:20   Double Ambig)
 &rst
  ixpk= 443, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 868,1917,1918,1919,
 igr2= 866,1334,
 &end
#
#   57 GLU  HB3          57 GLU  HA          3.50    (#    444:20   Unique)
 &rst
  ixpk= 444, iat= 905, 902, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:445      0 AMB  20-1:445    3.50    (#    445:20   Preassigned)
 &rst
  ixpk= 445, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 904, 874, 875,2603,2604, 869,2609,2610,
 igr2= 902,2623,
 &end
#
#    0 AMB  20-2:446     58 PHE  HA          3.50    (#    446:20   Single Ambig)
 &rst
  ixpk= 446, iat=  -1, 917, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 919, 920, 982,
 &end
#
#   58 PHE  HB-          58 PHE  HA          3.50    (#    447:20   Unique)
 &rst
  ixpk= 447, iat=  -1, 917, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 919, 920,
 &end
#
#   59 ASP  HB+          59 ASP  HA          3.50    (#    448:20   Unique)
 &rst
  ixpk= 448, iat=  -1, 937, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 939, 940,
 &end
#
#   59 ASP  HB-          59 ASP  HA          3.50    (#    449:20   Unique)
 &rst
  ixpk= 449, iat=  -1, 937, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 939, 940,
 &end
#
#    0 AMB  20-2:450     60 PHE  HA          3.50    (#    450:20   Single Ambig)
 &rst
  ixpk= 450, iat=  -1, 949, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 951, 952, 951, 952,
 &end
#
#    0 AMB  20-2:451     60 PHE  HA          3.50    (#    451:20   Single Ambig)
 &rst
  ixpk= 451, iat=  -1, 949, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 951, 952, 951, 952,
 &end
#
#    0 AMB  20-2:452      0 AMB  20-1:452    3.50    (#    452:20   Double Ambig)
 &rst
  ixpk= 452, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 971, 972,2339,2340,
 igr2= 969,2337,
 &end
#
#    0 AMB  20-2:453     62 ASP  HA          3.50    (#    453:20   Single Ambig)
 &rst
  ixpk= 453, iat=  -1, 980, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 982, 919, 920,
 &end
#
#   62 ASP  HB3          62 ASP  HA          3.50    (#    454:20   Unique)
 &rst
  ixpk= 454, iat= 983, 980, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:455      0 AMB  20-1:455    3.50    (#    455:20   Double Ambig)
 &rst
  ixpk= 455, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 994, 995,3035,3036,  68,  69,
 igr2= 992,2985, 669, 670,
 &end
#
#    0 AMB  20-2:456     64 VAL  HA          3.50    (#    456:20   Single Ambig)
 &rst
  ixpk= 456, iat=  -1,1013, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1015, 704, 705, 701, 702,
 &end
#
#   65 LYS  HB+          65 LYS  HA          3.50    (#    457:20   Unique)
 &rst
  ixpk= 457, iat=  -1,1029, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1031,1032,
 &end
#
#    0 AMB  20-2:458      0 AMB  20-1:458    3.50    (#    458:20   Double Ambig)
 &rst
  ixpk= 458, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1185,1186,1031,1032,
 igr2=1183,1029,
 &end
#
#   66 TRP  HB3          66 TRP  HA          3.50    (#    459:20   Preassigned)
 &rst
  ixpk= 459, iat=1054,1051, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:461      0 AMB  20-1:461    3.50    (#    461:20   Double Ambig)
 &rst
  ixpk= 461, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1077,1078, 387, 388, 387, 388,
 igr2=1075, 333,
 &end
#
#   68 ASP  QB           68 ASP  HA          3.50    (#    462:20   Unique)
 &rst
  ixpk= 462, iat=  -1,1097, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1099,1100,
 &end
#
#   69 PRO  HB2          69 PRO  HA          3.50    (#    463:20   Unique)
 &rst
  ixpk= 463, iat=1114,1117, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:464     69 PRO  HA          3.50    (#    464:20   Single Ambig)
 &rst
  ixpk= 464, iat=  -1,1117, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1115, 557, 558, 559,
 &end
#
#   70 ASP  HB-          70 ASP  HA          3.50    (#    465:20   Unique)
 &rst
  ixpk= 465, iat=  -1,1123, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1125,1126,
 &end
#
#   71 ALA  MB           71 ALA  HA          2.70    (#    466:20   Unique)
 &rst
  ixpk= 466, iat=  -1,1135, r1= 0.00, r2= 1.80, r3= 3.24, r4= 3.99,
 igr1=1137,1138,1139,
 &end
#
#    0 AMB  20-2:467     72 LEU  HA          3.50    (#    467:20   Single Ambig)
 &rst
  ixpk= 467, iat=  -1,1145, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1147,1188,1189,
 &end
#
#   72 LEU  HB3          72 LEU  HA          3.50    (#    468:20   Unique)
 &rst
  ixpk= 468, iat=1148,1145, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:469      0 AMB  20-1:469    3.50    (#    469:20   Double Ambig)
 &rst
  ixpk= 469, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1582,1583,1243,1244,1243,1244,1579,1580,1167,1169,
      
 igr2=1577,1238,1164,
 &end
#
#    0 AMB  20-2:470      0 AMB  20-1:470    3.50    (#    470:20   Double Ambig)
 &rst
  ixpk= 470, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1185,1186,1031,1032,
 igr2=1183,1029,
 &end
#
#   76 VAL  HB           76 VAL  HA          3.50    (#    473:20   Preassigned)
 &rst
  ixpk= 473, iat=1224,1222, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:474      0 AMB  20-1:474    2.70    (#    474:20   Double Ambig)
 &rst
  ixpk= 474, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.48, r4= 5.23,
 igr1=1240,1241,1246,1247,1669,1670,1166,
 igr2=1238,1667,1164,
 &end
#
#   78 HIS  HB3          78 HIS  HA          3.50    (#    475:20   Unique)
 &rst
  ixpk= 475, iat=1263,1260, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   78 HIS  HB2          78 HIS  HA          3.50    (#    476:20   Unique)
 &rst
  ixpk= 476, iat=1262,1260, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:477     79 MET  HA          3.50    (#    477:20   Single Ambig)
 &rst
  ixpk= 477, iat=  -1,1277, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1280,1279,
 &end
#
#    0 AMB  20-2:478     79 MET  HA          3.50    (#    478:20   Single Ambig)
 &rst
  ixpk= 478, iat=  -1,1277, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1280,1279,
 &end
#
#   80 LEU  QB           80 LEU  HA          3.50    (#    479:20   Unique)
 &rst
  ixpk= 479, iat=  -1,1296, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1298,1299,
 &end
#
#   81 LEU  HB3          81 LEU  HA          3.50    (#    480:20   Unique)
 &rst
  ixpk= 480, iat=1318,1315, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:481     81 LEU  HA          3.50    (#    481:20   Single Ambig)
 &rst
  ixpk= 481, iat=  -1,1315, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1317,1320,1339,
 &end
#
#   82 LEU  HB+          82 LEU  HA          3.50    (#    482:20   Unique)
 &rst
  ixpk= 482, iat=  -1,1334, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1336,1337,
 &end
#
#    0 AMB  20-2:483      0 AMB  20-1:483    3.50    (#    483:20   Double Ambig)
 &rst
  ixpk= 483, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1336,1337,1339, 869,
 igr2=1334, 866,
 &end
#
#    0 AMB  20-2:484      0 AMB  20-1:484    3.50    (#    484:20   Double Ambig)
 &rst
  ixpk= 484, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1369,1383,
 igr2=1367,1903,
 &end
#
#    0 AMB  20-2:485     84 ASN  HA          3.50    (#    485:20   Single Ambig)
 &rst
  ixpk= 485, iat=  -1,1367, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1370,1397,
 &end
#
#    0 AMB  20-2:486      0 AMB  20-1:486    3.50    (#    486:20   Double Ambig)
 &rst
  ixpk= 486, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1383,2818,2819,
 igr2=1381, 530,
 &end
#
#   86 PHE  HB2          86 PHE  HA          3.50    (#    487:20   Unique)
 &rst
  ixpk= 487, iat=1397,1395, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   86 PHE  HB3          86 PHE  HA          3.50    (#    488:20   Unique)
 &rst
  ixpk= 488, iat=1398,1395, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   88 ALA  MB           88 ALA  HA          3.50    (#    489:20   Unique)
 &rst
  ixpk= 489, iat=  -1,1422, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1424,1425,1426,
 &end
#
#    0 AMB  20-2:490     89 ILE  HA          3.50    (#    490:20   Single Ambig)
 &rst
  ixpk= 490, iat=  -1,1432, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1434,1784,
 &end
#
#    0 AMB  20-2:491      0 AMB  20-1:491    3.50    (#    491:20   Double Ambig)
 &rst
  ixpk= 491, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1992,1993,1453,1454,
 igr2=1990,1451,
 &end
#
#    0 AMB  20-2:492      0 AMB  20-1:492    3.50    (#    492:20   Double Ambig)
 &rst
  ixpk= 492, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1992,1993,1453,1454,
 igr2=1990,1451,
 &end
#
#    0 AMB  20-2:493      0 AMB  20-1:493    3.50    (#    493:20   Double Ambig)
 &rst
  ixpk= 493, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 351,1468,
 igr2= 348,1465,
 &end
#
#   91 TYR  HB2          91 TYR  HA          3.50    (#    494:20   Unique)
 &rst
  ixpk= 494, iat=1467,1465, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   92 VAL  HB           92 VAL  HA          4.50    (#    495:20   Unique)
 &rst
  ixpk= 495, iat=1488,1486, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   94 THR  HB           94 THR  HA          3.50    (#    496:20   Unique)
 &rst
  ixpk= 496, iat=1514,1512, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:497     96 VAL  HA          3.50    (#    497:20   Single Ambig)
 &rst
  ixpk= 497, iat=  -1,1541, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1543,1579,1580,
 &end
#
#   97 PHE  HB+          97 PHE  HA          3.50    (#    498:20   Unique)
 &rst
  ixpk= 498, iat=  -1,1557, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1559,1560,
 &end
#
#   97 PHE  HB-          97 PHE  HA          3.50    (#    499:20   Unique)
 &rst
  ixpk= 499, iat=  -1,1557, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1559,1560,
 &end
#
#    0 AMB  20-2:500     98 ARG  HA          3.50    (#    500:20   Single Ambig)
 &rst
  ixpk= 500, iat=  -1,1577, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1579,1580,1603,1604,
 &end
#
#   99 GLU  QB           99 GLU  HA          3.50    (#    502:20   Unique)
 &rst
  ixpk= 502, iat=  -1,1601, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1603,1604,
 &end
#
#    0 AMB  20-2:503    100 GLU  HA          2.70    (#    503:20   Single Ambig)
 &rst
  ixpk= 503, iat=  -1,1616, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=1618,1619,1618,1619,
 &end
#
#    0 AMB  20-2:504      0 AMB  20-1:504    3.50    (#    504:20   Double Ambig)
 &rst
  ixpk= 504, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1634,1606,1607,1606,1607,
 igr2=1631,1577,
 &end
#
#  101 LEU  HB2           0 AMB  20-1:505    3.50    (#    505:20   Single Ambig)
 &rst
  ixpk= 505, iat=1633,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1631,1577,
 &end
#
#  103 ALA  MB          103 ALA  HA          3.50    (#    506:20   Unique)
 &rst
  ixpk= 506, iat=  -1,1657, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1659,1660,1661,
 &end
#
#    0 AMB  20-2:507      0 AMB  20-1:507    3.50    (#    507:20   Double Ambig)
 &rst
  ixpk= 507, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1669,1670, 614,2495,
 igr2=1667, 609,2493,
 &end
#
#  105 PRO  HB3         105 PRO  HA          3.50    (#    508:20   Unique)
 &rst
  ixpk= 508, iat=1697,1699, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:509    105 PRO  HA          3.50    (#    509:20   Single Ambig)
 &rst
  ixpk= 509, iat=  -1,1699, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1696,1693,1694,
 &end
#
#  106 ASP  HB+         106 ASP  HA          3.50    (#    510:20   Unique)
 &rst
  ixpk= 510, iat=  -1,1705, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1707,1708,
 &end
#
#    0 AMB  20-2:511      0 AMB  20-1:511    3.50    (#    511:20   Double Ambig)
 &rst
  ixpk= 511, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1707,1708,2567,2568,
 igr2=1705,2493,
 &end
#
#    0 AMB  20-2:512      0 AMB  20-1:512    3.50    (#    512:20   Double Ambig)
 &rst
  ixpk= 512, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1719,1720,1721,2143,2144,2145,
 igr2=1717,2472,
 &end
#
#    0 AMB  20-2:516      0 AMB  20-1:516    3.50    (#    516:20   Double Ambig)
 &rst
  ixpk= 516, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1765,2083,2084,1434,
 igr2=1763,1971,
 &end
#
#    0 AMB  20-2:517    111 LEU  HA          3.50    (#    517:20   Single Ambig)
 &rst
  ixpk= 517, iat=  -1,1779, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 138,1782,
 &end
#
#  111 LEU  HB2         111 LEU  HA          3.50    (#    518:20   Unique)
 &rst
  ixpk= 518, iat=1781,1779, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  112 ILE  HB          112 ILE  HA          6.00    (#    519:20   Unique)
 &rst
  ixpk= 519, iat=1800,1798, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:520    113 ILE  HA          4.50    (#    520:20   Single Ambig)
 &rst
  ixpk= 520, iat=  -1,1817, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=1825,1826,1819,1844,1845,
 &end
#
#  115 THR  HB          115 THR  HA          6.00    (#    521:20   Unique)
 &rst
  ixpk= 521, iat=1857,1855, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  116 ASP  HB3         116 ASP  HA          3.50    (#    522:20   Unique)
 &rst
  ixpk= 522, iat=1872,1869, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  116 ASP  HB2         116 ASP  HA          3.50    (#    523:20   Unique)
 &rst
  ixpk= 523, iat=1871,1869, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:524      0 AMB  20-1:524    2.70    (#    524:20   Double Ambig)
 &rst
  ixpk= 524, iat=  -1,1888, r1= 0.00, r2= 1.80, r3= 3.24, r4= 3.99,
 igr1=1891,1893,1894,
 &end
#
#    0 AMB  20-2:525      0 AMB  20-1:525    3.50    (#    525:20   Double Ambig)
 &rst
  ixpk= 525, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=  48,  49,2799,1890,2802,
 igr2=  46,2797,1888,
 &end
#
#  119 ALA  MB          119 ALA  HA          3.50    (#    526:20   Unique)
 &rst
  ixpk= 526, iat=  -1,1903, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1905,1906,1907,
 &end
#
#  120 THR  HB          120 THR  HA          3.50    (#    527:20   Unique)
 &rst
  ixpk= 527, iat=1915,1913, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:528    121 ASP  HA          2.70    (#    528:20   Single Ambig)
 &rst
  ixpk= 528, iat=  -1,1927, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=1929,1930,1929,1930,
 &end
#
#  122 SER  QB          122 SER  HA          3.50    (#    530:20   Unique)
 &rst
  ixpk= 530, iat=  -1,1939, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1941,1942,
 &end
#
#  124 ASN  HB+         124 ASN  HA          3.50    (#    531:20   Unique)
 &rst
  ixpk= 531, iat=  -1,1957, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1959,1960,
 &end
#
#  124 ASN  HB-         124 ASN  HA          3.50    (#    532:20   Unique)
 &rst
  ixpk= 532, iat=  -1,1957, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1959,1960,
 &end
#
#  125 ILE  HB          125 ILE  HA          3.50    (#    533:20   Unique)
 &rst
  ixpk= 533, iat=1973,1971, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:534      0 AMB  20-1:534    2.70    (#    534:20   Double Ambig)
 &rst
  ixpk= 534, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.82, r4= 4.57,
 igr1=1992,1993,1453,1454,
 igr2=1990,1451,
 &end
#
#  127 ALA  MB          127 ALA  HA          2.70    (#    535:20   Unique)
 &rst
  ixpk= 535, iat=  -1,2002, r1= 0.00, r2= 1.80, r3= 3.24, r4= 3.99,
 igr1=2004,2005,2006,
 &end
#
#  128 ALA  MB          128 ALA  HA          3.50    (#    536:20   Unique)
 &rst
  ixpk= 536, iat=  -1,2012, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2014,2015,2016,
 &end
#
#    0 AMB  20-2:537      0 AMB  20-1:537    3.50    (#    537:20   Double Ambig)
 &rst
  ixpk= 537, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2046,2047, 907, 908,
 igr2=2044,1164,
 &end
#
#    0 AMB  20-2:538      0 AMB  20-1:538    3.50    (#    538:20   Double Ambig)
 &rst
  ixpk= 538, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2046,2047, 907, 908,
 igr2=2044,1164,
 &end
#
#    0 AMB  20-2:539    131 ILE  HA          3.50    (#    539:20   Single Ambig)
 &rst
  ixpk= 539, iat=  -1,2056, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2058,2083,2084,
 &end
#
#    0 AMB  20-2:540      0 AMB  20-1:540    3.50    (#    540:20   Double Ambig)
 &rst
  ixpk= 540, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1=2077, 273, 274, 243, 244, 243, 244,
 igr2=2075, 262, 263,
 &end
#
#    0 AMB  20-2:541    133 ARG  HA          3.50    (#    541:20   Single Ambig)
 &rst
  ixpk= 541, iat=  -1,2094, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2097,1782,1825,1826,
 &end
#
#    0 AMB  20-2:542    133 ARG  HA          3.50    (#    542:20   Single Ambig)
 &rst
  ixpk= 542, iat=  -1,2094, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1784,2096,
 &end
#
#  134 TYR  HB2         134 TYR  HA          3.50    (#    543:20   Unique)
 &rst
  ixpk= 543, iat=2120,2118, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:544      0 AMB  20-1:544    3.50    (#    544:20   Double Ambig)
 &rst
  ixpk= 544, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2121,2234,2235,
 igr2=2118,2249,
 &end
#
#    0 AMB  20-2:545    135 ILE  HA          3.50    (#    545:20   Single Ambig)
 &rst
  ixpk= 545, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2141,1825,1826,
 &end
#
#    0 AMB  20-2:546      0 AMB  20-1:546    3.50    (#    546:20   Double Ambig)
 &rst
  ixpk= 546, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 758,2160,
 igr2= 756,2158,
 &end
#
#    0 AMB  20-2:547      0 AMB  20-1:547    2.70    (#    547:20   Double Ambig)
 &rst
  ixpk= 547, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.09, r4= 4.84,
 igr1=2218,2219,2212,2213,2771,2772,
 igr2=2210,2707,
 &end
#
#  141 HIS  HB+         141 HIS  HA          3.50    (#    548:20   Unique)
 &rst
  ixpk= 548, iat=  -1,2232, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2234,2235,
 &end
#
#  141 HIS  HB-         141 HIS  HA          3.50    (#    549:20   Unique)
 &rst
  ixpk= 549, iat=  -1,2232, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2234,2235,
 &end
#
#  142 PHE  HB3         142 PHE  HA          3.50    (#    550:20   Unique)
 &rst
  ixpk= 550, iat=2252,2249, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:551    142 PHE  HA          3.50    (#    551:20   Single Ambig)
 &rst
  ixpk= 551, iat=  -1,2249, r1= 0.00, r2= 1.80, r3= 4.84, r4= 5.59,
 igr1=2251,2274,2275,2274,2275,2271,2272,
 &end
#
#    0 AMB  20-2:552    143 GLN  HA          3.50    (#    552:20   Single Ambig)
 &rst
  ixpk= 552, iat=  -1,2269, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2274,2275,2271,2272,
 &end
#
#  144 THR  HB          144 THR  HA          3.50    (#    553:20   Unique)
 &rst
  ixpk= 553, iat=2288,2286, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:554    145 LYS  HA          3.50    (#    554:20   Single Ambig)
 &rst
  ixpk= 554, iat=  -1,2300, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2350,2351,2302,2303,
 &end
#
#    0 AMB  20-2:555    145 LYS  HA          3.50    (#    555:20   Single Ambig)
 &rst
  ixpk= 555, iat=  -1,2300, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2308,2309,2302,2303,
 &end
#
#    0 AMB  20-2:556    146 GLU  HA          2.70    (#    556:20   Single Ambig)
 &rst
  ixpk= 556, iat=  -1,2322, r1= 0.00, r2= 1.80, r3= 3.64, r4= 4.39,
 igr1=2324,2325,2370,2371,2367,2368,
 &end
#
#    0 AMB  20-2:557    146 GLU  HA          3.50    (#    557:20   Single Ambig)
 &rst
  ixpk= 557, iat=  -1,2322, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2367,2368,2302,2303,
 &end
#
#    0 AMB  20-2:558    149 GLU  HA          3.50    (#    558:20   Single Ambig)
 &rst
  ixpk= 558, iat=  -1,2365, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2367,2368,2370,2371,
 &end
#
#  149 GLU  HB-         149 GLU  HA          3.50    (#    559:20   Unique)
 &rst
  ixpk= 559, iat=  -1,2365, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2367,2368,
 &end
#
#    0 AMB  20-2:560      0 AMB  20-1:560    3.50    (#    560:20   Double Ambig)
 &rst
  ixpk= 560, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=2396, 335, 336, 338, 339,
 igr2=2394, 271,
 &end
#
#    0 AMB  20-2:561      0 AMB  20-1:561    3.50    (#    561:20   Double Ambig)
 &rst
  ixpk= 561, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 276,2397,
 igr2= 271,2394,
 &end
#
#  152 HIS  HB2         152 HIS  HA          3.50    (#    562:20   Unique)
 &rst
  ixpk= 562, iat=2415,2413, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:563    152 HIS  HA          3.50    (#    563:20   Single Ambig)
 &rst
  ixpk= 563, iat=  -1,2413, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2416,2504,2505,
 &end
#
#    0 AMB  20-2:564      0 AMB  20-1:564    2.70    (#    564:20   Double Ambig)
 &rst
  ixpk= 564, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.70, r4= 5.45,
 igr1=2432,2433,1166, 504, 505, 570, 571,
 igr2=2430,1123, 518, 445,
 &end
#
#    0 AMB  20-2:565      0 AMB  20-1:565    2.70    (#    565:20   Double Ambig)
 &rst
  ixpk= 565, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.81, r4= 5.56,
 igr1= 498, 499,2432,2433, 504, 505, 501, 502,
 igr2= 445,2430, 518,1123,
 &end
#
#  154 PHE  HB+         154 PHE  HA          3.50    (#    566:20   Unique)
 &rst
  ixpk= 566, iat=  -1,2452, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2454,2455,
 &end
#
#  154 PHE  HB-         154 PHE  HA          3.50    (#    567:20   Unique)
 &rst
  ixpk= 567, iat=  -1,2452, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2454,2455,
 &end
#
#  155 ALA  MB          155 ALA  HA          3.50    (#    568:20   Unique)
 &rst
  ixpk= 568, iat=  -1,2472, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2474,2475,2476,
 &end
#
#  158 PRO  HB3         158 PRO  HA          3.50    (#    569:20   Unique)
 &rst
  ixpk= 569, iat=2521,2523, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  158 PRO  HB2         158 PRO  HA          3.50    (#    570:20   Unique)
 &rst
  ixpk= 570, iat=2520,2523, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:571      0 AMB  20-1:571    3.50    (#    571:20   Double Ambig)
 &rst
  ixpk= 571, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=2531,2532,2533,2064,2065,
 igr2=2529,1502,
 &end
#
#  165 ILE  HB          165 ILE  HA          3.50    (#    574:20   Preassigned)
 &rst
  ixpk= 574, iat=2625,2623, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:575    166 LEU  HA          3.50    (#    575:20   Single Ambig)
 &rst
  ixpk= 575, iat=  -1,2642, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=2644,2645,2647,2606,2607,
 &end
#
#    0 AMB  20-2:576    166 LEU  HA          3.50    (#    576:20   Single Ambig)
 &rst
  ixpk= 576, iat=  -1,2642, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=2644,2645,2647,2606,2607,
 &end
#
#    0 AMB  20-2:577      0 AMB  20-1:577    2.70    (#    577:20   Double Ambig)
 &rst
  ixpk= 577, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.09, r4= 4.84,
 igr1=2663,2664,2663,2664,2454,2455,
 igr2=2661,2394,
 &end
#
#  169 PHE  HB2         169 PHE  HA          3.50    (#    579:20   Unique)
 &rst
  ixpk= 579, iat=2689,2687, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  169 PHE  HB3         169 PHE  HA          3.50    (#    580:20   Unique)
 &rst
  ixpk= 580, iat=2690,2687, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:581      0 AMB  20-1:581    2.70    (#    581:20   Double Ambig)
 &rst
  ixpk= 581, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.82, r4= 4.57,
 igr1=2709,2710, 370, 371,
 igr2=2707, 385,
 &end
#
#  171 LYS  HB-         171 LYS  HA          2.70    (#    582:20   Unique)
 &rst
  ixpk= 582, iat=  -1,2722, r1= 0.00, r2= 1.80, r3= 3.03, r4= 3.78,
 igr1=2724,2725,
 &end
#
#    0 AMB  20-2:583    172 LEU  HA          3.50    (#    583:20   Single Ambig)
 &rst
  ixpk= 583, iat=  -1,2744, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2800,2746,2747,
 &end
#
#    0 AMB  20-2:584    172 LEU  HA          3.50    (#    584:20   Single Ambig)
 &rst
  ixpk= 584, iat=  -1,2744, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2746,2747,2647,
 &end
#
#    0 AMB  20-2:585    173 LYS  HA          2.70    (#    585:20   Single Ambig)
 &rst
  ixpk= 585, iat=  -1,2763, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=2765,2766,2765,2766,
 &end
#
#  174 ASP  HB2         174 ASP  HA          3.50    (#    587:20   Unique)
 &rst
  ixpk= 587, iat=2787,2785, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  174 ASP  HB3         174 ASP  HA          3.50    (#    588:20   Unique)
 &rst
  ixpk= 588, iat=2788,2785, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:589      0 AMB  20-1:589    3.50    (#    589:20   Double Ambig)
 &rst
  ixpk= 589, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=  48,  49,2799,1890,
 igr2=  46,2797,1888,
 &end
#
#    0 AMB  20-2:590      0 AMB  20-1:590    3.50    (#    590:20   Double Ambig)
 &rst
  ixpk= 590, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=  54,  55,  48,  49,2800,
 igr2=  46,2797,
 &end
#
#  176 PHE  HB+         176 PHE  HA          3.50    (#    591:20   Preassigned)
 &rst
  ixpk= 591, iat=  -1,2816, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2818,2819,
 &end
#
#  176 PHE  HB-         176 PHE  HA          3.50    (#    592:20   Preassigned)
 &rst
  ixpk= 592, iat=  -1,2816, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2818,2819,
 &end
#
#  177 THR  HB          177 THR  HA          3.50    (#    593:20   Preassigned)
 &rst
  ixpk= 593, iat=2838,2836, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:594      0 AMB  20-1:594    2.70    (#    594:20   Double Ambig)
 &rst
  ixpk= 594, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.37, r4= 5.12,
 igr1=2852,2853, 252, 253, 254,2396,
 igr2=2850, 260,2413,
 &end
#
#    0 AMB  20-2:595    179 LEU  HA          3.50    (#    595:20   Single Ambig)
 &rst
  ixpk= 595, iat=  -1,2865, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2928,2929,2867,2868,2867,2868,2931,2932,2870,
 &end
#
#   74 LYS  HB+          74 LYS  HA          3.50    (#    597:20   Unique)
 &rst
  ixpk= 597, iat=  -1,1183, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1185,1186,
 &end
#
#  183 ILE  MD1         183 ILE  HA          4.50    (#    598:20   Unique)
 &rst
  ixpk= 598, iat=  -1,2945, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2956,2957,2958,
 &end
#
#    0 AMB  20-2:599    183 ILE  HA          3.50    (#    599:20   Single Ambig)
 &rst
  ixpk= 599, iat=  -1,2945, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2947,2925,2926,
 &end
#
#  185 VAL  HB          185 VAL  HA          3.50    (#    600:20   Preassigned)
 &rst
  ixpk= 600, iat=2987,2985, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  186 ILE  HB          186 ILE  HA          3.50    (#    601:20   Unique)
 &rst
  ixpk= 601, iat=3003,3001, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:602      0 AMB  20-1:602    3.50    (#    602:20   Double Ambig)
 &rst
  ixpk= 602, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=3022,3023,3025,3026,2353,2354,
 igr2=3020,2348,
 &end
#
#    0 AMB  20-2:603      0 AMB  20-1:603    3.50    (#    603:20   Double Ambig)
 &rst
  ixpk= 603, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=3022,3023,3025,3026,2353,2354,
 igr2=3020,2348,
 &end
#
#    3 SER  HA            3 SER  QB          3.50    (#    604:20   Unique)
 &rst
  ixpk= 604, iat=  35,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  37,  38,
 &end
#
#    4 LYS  HA            4 LYS  HB+         3.50    (#    605:20   Unique)
 &rst
  ixpk= 605, iat=  46,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  48,  49,
 &end
#
#    0 AMB  20-2:606      0 AMB  20-1:606    3.50    (#    606:20   Double Ambig)
 &rst
  ixpk= 606, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=  46,2722,
 igr2=  48,  49,2724,2725,
 &end
#
#    0 AMB  20-2:609      9 LEU  HB3         4.50    (#    609:20   Single Ambig)
 &rst
  ixpk= 609, iat=  -1, 120, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 117, 714,
 &end
#
#    9 LEU  HA            9 LEU  HB2         3.50    (#    610:20   Unique)
 &rst
  ixpk= 610, iat= 117, 119, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   10 VAL  HA           10 VAL  HB          3.50    (#    611:20   Unique)
 &rst
  ixpk= 611, iat= 136, 138, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   11 PHE  HA           11 PHE  QB          3.50    (#    612:20   Unique)
 &rst
  ixpk= 612, iat= 152,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 154, 155,
 &end
#
#   12 LEU  HA           12 LEU  HB3         6.00    (#    613:20   Unique)
 &rst
  ixpk= 613, iat= 172, 175, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   12 LEU  HA           12 LEU  HB2         4.50    (#    614:20   Unique)
 &rst
  ixpk= 614, iat= 172, 174, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   13 PHE  HA            0 AMB  20-1:615    3.50    (#    615:20   Single Ambig)
 &rst
  ixpk= 615, iat= 191,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 193, 194, 193, 194,
 &end
#
#   13 PHE  HA            0 AMB  20-1:616    3.50    (#    616:20   Single Ambig)
 &rst
  ixpk= 616, iat= 191,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 193, 194, 193, 194,
 &end
#
#    0 AMB  20-2:617     16 SER  QB          3.50    (#    617:20   Single Ambig)
 &rst
  ixpk= 617, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 230, 262, 263,
 igr2= 232, 233,
 &end
#
#    0 AMB  20-2:618     16 SER  QB          3.50    (#    618:20   Single Ambig)
 &rst
  ixpk= 618, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 230, 262, 263,
 igr2= 232, 233,
 &end
#
#    0 AMB  20-2:619      0 AMB  20-1:619    3.50    (#    619:20   Double Ambig)
 &rst
  ixpk= 619, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 241,2836,
 igr2= 243, 244,2889,2890,
 &end
#
#   17 MET  HA           17 MET  HB-         3.50    (#    620:20   Unique)
 &rst
  ixpk= 620, iat= 241,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 243, 244,
 &end
#
#    0 AMB  20-2:622     19 LEU  HB+         3.50    (#    622:20   Single Ambig)
 &rst
  ixpk= 622, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 271, 223, 224,
 igr2= 273, 274,
 &end
#
#    0 AMB  20-2:623     19 LEU  HB-         4.50    (#    623:20   Single Ambig)
 &rst
  ixpk= 623, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 271, 223, 224,
 igr2= 273, 274,
 &end
#
#   21 PRO  HA           21 PRO  HB3         3.50    (#    624:20   Unique)
 &rst
  ixpk= 624, iat= 315, 313, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:625      0 AMB  20-1:625    3.50    (#    625:20   Double Ambig)
 &rst
  ixpk= 625, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 315, 321,
 igr2= 312,1262,
 &end
#
#    0 AMB  20-2:626      0 AMB  20-1:626    3.50    (#    626:20   Double Ambig)
 &rst
  ixpk= 626, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 321, 457,
 igr2= 323, 324, 447, 448,
 &end
#
#   22 ASP  HA           22 ASP  HB-         3.50    (#    627:20   Unique)
 &rst
  ixpk= 627, iat= 321,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 323, 324,
 &end
#
#    0 AMB  20-2:628     23 GLU  HB+         4.50    (#    628:20   Single Ambig)
 &rst
  ixpk= 628, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 333,2689,
 igr2= 335, 336,
 &end
#
#    0 AMB  20-2:629     23 GLU  HB-         4.50    (#    629:20   Single Ambig)
 &rst
  ixpk= 629, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 333,2689,
 igr2= 335, 336,
 &end
#
#    0 AMB  20-2:630     24 PHE  HB3         4.50    (#    630:20   Single Ambig)
 &rst
  ixpk= 630, iat=  -1, 351, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 348, 306, 307,
 &end
#
#   24 PHE  HA           24 PHE  HB2         3.50    (#    631:20   Unique)
 &rst
  ixpk= 631, iat= 348, 350, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   25 GLN  HA            0 AMB  20-1:632    3.50    (#    632:20   Single Ambig)
 &rst
  ixpk= 632, iat= 368,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 370, 371, 370, 371,
 &end
#
#   25 GLN  HA           25 GLN  HB-         3.50    (#    633:20   Unique)
 &rst
  ixpk= 633, iat= 368,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 370, 371,
 &end
#
#    0 AMB  20-2:634      0 AMB  20-1:634    3.50    (#    634:20   Double Ambig)
 &rst
  ixpk= 634, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.80, r4= 7.55,
 igr1=2901, 385, 587,2413,  68,  69,
 igr2=2903,2904, 387, 388, 567, 568,2587,  48,  49,
 &end
#
#    0 AMB  20-2:635      0 AMB  20-1:635    3.50    (#    635:20   Double Ambig)
 &rst
  ixpk= 635, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1= 445,2850, 385, 518,
 igr2= 498, 499,2903,2904, 387, 388, 567, 568,
 &end
#
#    0 AMB  20-2:636     27 ILE  HB          3.50    (#    636:20   Single Ambig)
 &rst
  ixpk= 636, iat=  -1, 409, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 407, 426,
 &end
#
#   28 LEU  HA           28 LEU  HB+         4.50    (#    637:20   Unique)
 &rst
  ixpk= 637, iat= 426,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 428, 429,
 &end
#
#   28 LEU  HA           28 LEU  HB-         4.50    (#    638:20   Unique)
 &rst
  ixpk= 638, iat= 426,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 428, 429,
 &end
#
#    0 AMB  20-2:639      0 AMB  20-1:639    3.50    (#    639:20   Double Ambig)
 &rst
  ixpk= 639, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 385,1123, 445,
 igr2= 447, 448, 447, 448,1125,1126,
 &end
#
#    0 AMB  20-2:640      0 AMB  20-1:640    3.50    (#    640:20   Double Ambig)
 &rst
  ixpk= 640, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 385,1123, 445,
 igr2= 447, 448, 447, 448,1125,1126,
 &end
#
#   30 PHE  HA           30 PHE  QB          3.50    (#    641:20   Unique)
 &rst
  ixpk= 641, iat= 457,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 459, 460,
 &end
#
#    0 AMB  20-2:642      0 AMB  20-1:642    3.50    (#    642:20   Double Ambig)
 &rst
  ixpk= 642, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=  77,  78,2788, 477,2663,2664,2663,2664,
 igr2=  48,  49,2724,2725, 479, 480,
 &end
#
#   31 MET  HA           31 MET  HB-         4.50    (#    643:20   Unique)
 &rst
  ixpk= 643, iat= 477,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 479, 480,
 &end
#
#   32 LYS  HA            0 AMB  20-1:644    3.50    (#    644:20   Single Ambig)
 &rst
  ixpk= 644, iat= 496,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1115, 498, 499,
 &end
#
#   32 LYS  HA           32 LYS  HB-         4.50    (#    645:20   Unique)
 &rst
  ixpk= 645, iat= 496,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 498, 499,
 &end
#
#   33 ASP  HA           33 ASP  QB          3.50    (#    646:20   Unique)
 &rst
  ixpk= 646, iat= 518,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 520, 521,
 &end
#
#   34 VAL  HA           34 VAL  HB          3.50    (#    647:20   Unique)
 &rst
  ixpk= 647, iat= 530, 532, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   35 MET  HA           35 MET  HB2         4.50    (#    648:20   Unique)
 &rst
  ixpk= 648, iat= 546, 548, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   35 MET  HA           35 MET  HB3         3.50    (#    649:20   Unique)
 &rst
  ixpk= 649, iat= 546, 549, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   45 PHE  HN           44 GLN  HB-         4.50    (#    650:20   Unique)
 &rst
  ixpk= 650, iat= 714,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 701, 702,
 &end
#
#    0 AMB  20-2:651      0 AMB  20-1:651    3.50    (#    651:20   Double Ambig)
 &rst
  ixpk= 651, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 445, 587,
 igr2= 498, 499, 589, 590, 589, 590,
 &end
#
#   37 LYS  HA            0 AMB  20-1:652    3.50    (#    652:20   Single Ambig)
 &rst
  ixpk= 652, iat= 587,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 589, 590, 589, 590,
 &end
#
#   39 SER  HA           39 SER  QB          3.50    (#    653:20   Unique)
 &rst
  ixpk= 653, iat= 628,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 630, 631,
 &end
#
#   40 ASN  HA           40 ASN  QB          3.50    (#    654:20   Unique)
 &rst
  ixpk= 654, iat= 639,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 641, 642,
 &end
#
#   40 ASN  HA           40 ASN  QB          3.50    (#    655:20   Unique)
 &rst
  ixpk= 655, iat= 639,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 641, 642,
 &end
#
#   43 TYR  HA           43 TYR  HB2         4.50    (#    657:20   Unique)
 &rst
  ixpk= 657, iat= 678, 680, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   44 GLN  HA            0 AMB  20-1:658    3.50    (#    658:20   Single Ambig)
 &rst
  ixpk= 658, iat= 699,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 701, 702, 701, 702,
 &end
#
#   44 GLN  HA            0 AMB  20-1:659    3.50    (#    659:20   Single Ambig)
 &rst
  ixpk= 659, iat= 699,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 701, 702, 701, 702,
 &end
#
#   45 PHE  HA           45 PHE  HB3         3.50    (#    660:20   Unique)
 &rst
  ixpk= 660, iat= 716, 719, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   45 PHE  HA           45 PHE  HB2         4.50    (#    661:20   Unique)
 &rst
  ixpk= 661, iat= 716, 718, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   47 ALA  HA           47 ALA  MB          3.50    (#    662:20   Preassigned)
 &rst
  ixpk= 662, iat= 746,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 748, 749, 750,
 &end
#
#    0 AMB  20-2:664      0 AMB  20-1:664    3.50    (#    664:20   Double Ambig)
 &rst
  ixpk= 664, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 772,1690,1691,
 igr2= 774, 775,1669,1670,
 &end
#
#   50 PHE  HA           50 PHE  HB2         4.50    (#    665:20   Unique)
 &rst
  ixpk= 665, iat= 789, 791, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   50 PHE  HA           50 PHE  HB3         4.50    (#    666:20   Unique)
 &rst
  ixpk= 666, iat= 789, 792, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   51 SER  HA           51 SER  HB+         4.50    (#    667:20   Unique)
 &rst
  ixpk= 667, iat= 809,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 811, 812,
 &end
#
#   51 SER  HA           51 SER  HB-         4.50    (#    668:20   Unique)
 &rst
  ixpk= 668, iat= 809,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 811, 812,
 &end
#
#   52 THR  HA           52 THR  HB          4.50    (#    669:20   Unique)
 &rst
  ixpk= 669, iat= 820, 822, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:670      0 AMB  20-1:670    3.50    (#    670:20   Double Ambig)
 &rst
  ixpk= 670, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 845,1798,
 igr2= 847, 848,1800,
 &end
#
#   54 TYR  HA           54 TYR  HB-         4.50    (#    671:20   Unique)
 &rst
  ixpk= 671, iat= 845,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 847, 848,
 &end
#
#   55 LYS  HA           55 LYS  HB3         4.50    (#    672:20   Unique)
 &rst
  ixpk= 672, iat= 866, 869, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   55 LYS  HA           55 LYS  HB2         4.50    (#    673:20   Unique)
 &rst
  ixpk= 673, iat= 866, 868, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   56 THR  HA           56 THR  HB          3.50    (#    674:20   Unique)
 &rst
  ixpk= 674, iat= 888, 890, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   57 GLU  HA           57 GLU  HB3         3.50    (#    675:20   Unique)
 &rst
  ixpk= 675, iat= 902, 905, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:676      0 AMB  20-1:676    3.50    (#    676:20   Double Ambig)
 &rst
  ixpk= 676, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.10, r4= 6.85,
 igr1= 639, 902, 756,1097,
 igr2=1083,1084, 904, 573, 574, 874, 875,
 &end
#
#   58 PHE  HA           58 PHE  HB+         3.50    (#    677:20   Unique)
 &rst
  ixpk= 677, iat= 917,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 919, 920,
 &end
#
#   58 PHE  HA           58 PHE  HB-         3.50    (#    678:20   Unique)
 &rst
  ixpk= 678, iat= 917,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 919, 920,
 &end
#
#   59 ASP  HA           59 ASP  HB+         3.50    (#    679:20   Unique)
 &rst
  ixpk= 679, iat= 937,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 939, 940,
 &end
#
#   59 ASP  HA           59 ASP  HB-         4.50    (#    680:20   Unique)
 &rst
  ixpk= 680, iat= 937,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 939, 940,
 &end
#
#   60 PHE  HA           60 PHE  HB+         3.50    (#    681:20   Unique)
 &rst
  ixpk= 681, iat= 949,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 951, 952,
 &end
#
#   60 PHE  HA           60 PHE  HB-         3.50    (#    682:20   Unique)
 &rst
  ixpk= 682, iat= 949,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 951, 952,
 &end
#
#    0 AMB  20-2:683      0 AMB  20-1:683    3.50    (#    683:20   Double Ambig)
 &rst
  ixpk= 683, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 969,2337,1650,1651,
 igr2= 971, 972,2339,2340,
 &end
#
#   62 ASP  HA           62 ASP  HB2         4.50    (#    684:20   Unique)
 &rst
  ixpk= 684, iat= 980, 982, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:685      0 AMB  20-1:685    3.50    (#    685:20   Double Ambig)
 &rst
  ixpk= 685, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1= 980,2675,2044,
 igr2= 983,2221,2222,2033,2034,
 &end
#
#   63 TYR  HA           63 TYR  HB+         3.50    (#    686:20   Unique)
 &rst
  ixpk= 686, iat= 992,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 994, 995,
 &end
#
#   63 TYR  HA           63 TYR  HB-         3.50    (#    687:20   Unique)
 &rst
  ixpk= 687, iat= 992,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 994, 995,
 &end
#
#    0 AMB  20-2:688      0 AMB  20-1:688    3.50    (#    688:20   Double Ambig)
 &rst
  ixpk= 688, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1013, 496,1657,
 igr2=1015, 551, 552, 701, 702,
 &end
#
#   65 LYS  HA           65 LYS  HB+         3.50    (#    689:20   Unique)
 &rst
  ixpk= 689, iat=1029,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1031,1032,
 &end
#
#   65 LYS  HA           65 LYS  HB-         3.50    (#    690:20   Unique)
 &rst
  ixpk= 690, iat=1029,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1031,1032,
 &end
#
#   66 TRP  HA           66 TRP  HB3         3.50    (#    691:20   Preassigned)
 &rst
  ixpk= 691, iat=1051,1054, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   66 TRP  HA           66 TRP  HB2         3.50    (#    692:20   Preassigned)
 &rst
  ixpk= 692, iat=1051,1053, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   67 LYS  HA           67 LYS  QB          3.50    (#    693:20   Unique)
 &rst
  ixpk= 693, iat=1075,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1077,1078,
 &end
#
#   68 ASP  HA           68 ASP  QB          3.50    (#    694:20   Unique)
 &rst
  ixpk= 694, iat=1097,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1099,1100,
 &end
#
#    0 AMB  20-2:695     69 PRO  HB2         3.50    (#    695:20   Single Ambig)
 &rst
  ixpk= 695, iat=  -1,1114, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1108,1109,1117,
 &end
#
#    0 AMB  20-2:696     69 PRO  HB3         3.50    (#    696:20   Single Ambig)
 &rst
  ixpk= 696, iat=  -1,1115, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1117,1108,1109,
 &end
#
#   70 ASP  HA           70 ASP  HB-         3.50    (#    697:20   Unique)
 &rst
  ixpk= 697, iat=1123,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1125,1126,
 &end
#
#   71 ALA  HA           71 ALA  MB          3.50    (#    698:20   Preassigned)
 &rst
  ixpk= 698, iat=1135,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1137,1138,1139,
 &end
#
#    0 AMB  20-2:699     72 LEU  HB2         3.50    (#    699:20   Single Ambig)
 &rst
  ixpk= 699, iat=  -1,1147, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1117,1145,
 &end
#
#    0 AMB  20-2:700     72 LEU  HB3         3.50    (#    700:20   Single Ambig)
 &rst
  ixpk= 700, iat=  -1,1148, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1145,1117,
 &end
#
#   73 LEU  HA           73 LEU  HB2         4.50    (#    701:20   Unique)
 &rst
  ixpk= 701, iat=1164,1166, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   73 LEU  HA           73 LEU  HB3         4.50    (#    702:20   Unique)
 &rst
  ixpk= 702, iat=1164,1167, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:703      0 AMB  20-1:703    2.70    (#    703:20   Double Ambig)
 &rst
  ixpk= 703, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.59, r4= 5.34,
 igr1=2901,1183, 565,1135,
 igr2=2903,2904,1185,1186, 567, 568,
 &end
#
#    0 AMB  20-2:704      0 AMB  20-1:704    3.50    (#    704:20   Double Ambig)
 &rst
  ixpk= 704, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1183,1029,1135,
 igr2=1185,1186,1031,1032,
 &end
#
#    0 AMB  20-2:706      0 AMB  20-1:706    3.50    (#    706:20   Double Ambig)
 &rst
  ixpk= 706, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1222,2744,
 igr2=1224,2765,2766,
 &end
#
#    0 AMB  20-2:707      0 AMB  20-1:707    3.50    (#    707:20   Double Ambig)
 &rst
  ixpk= 707, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1238,2601,
 igr2=1240,1241,2603,2604,2603,2604,
 &end
#
#   78 HIS  HA           78 HIS  HB3         3.50    (#    708:20   Unique)
 &rst
  ixpk= 708, iat=1260,1263, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:709      0 AMB  20-1:709    4.50    (#    709:20   Double Ambig)
 &rst
  ixpk= 709, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1260,2722,
 igr2=1262,2765,2766,
 &end
#
#    0 AMB  20-2:710     79 MET  HB2         3.50    (#    710:20   Single Ambig)
 &rst
  ixpk= 710, iat=  -1,1279, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 811, 812,1277,
 &end
#
#    0 AMB  20-2:711     79 MET  HB3         3.50    (#    711:20   Single Ambig)
 &rst
  ixpk= 711, iat=  -1,1280, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 811, 812,1277,
 &end
#
#   80 LEU  HA           80 LEU  QB          3.50    (#    712:20   Unique)
 &rst
  ixpk= 712, iat=1296,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1298,1299,
 &end
#
#   81 LEU  HA           81 LEU  HB3         4.50    (#    713:20   Unique)
 &rst
  ixpk= 713, iat=1315,1318, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   81 LEU  HA           81 LEU  HB2         4.50    (#    714:20   Unique)
 &rst
  ixpk= 714, iat=1315,1317, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   82 LEU  HA           82 LEU  HB+         4.50    (#    715:20   Unique)
 &rst
  ixpk= 715, iat=1334,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1336,1337,
 &end
#
#   82 LEU  HA           82 LEU  HB-         4.50    (#    716:20   Unique)
 &rst
  ixpk= 716, iat=1334,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1336,1337,
 &end
#
#   84 ASN  HA           84 ASN  HB2         4.50    (#    717:20   Unique)
 &rst
  ixpk= 717, iat=1367,1369, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   84 ASN  HA           84 ASN  HB3         4.50    (#    718:20   Unique)
 &rst
  ixpk= 718, iat=1367,1370, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:719     85 THR  HB          4.50    (#    719:20   Single Ambig)
 &rst
  ixpk= 719, iat=  -1,1383, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=1381,2454,2455,1929,1930,
 &end
#
#    0 AMB  20-2:720     86 PHE  HB2         3.50    (#    720:20   Single Ambig)
 &rst
  ixpk= 720, iat=  -1,1397, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1395,1415,1416,
 &end
#
#    0 AMB  20-2:721     86 PHE  HB3         3.50    (#    721:20   Single Ambig)
 &rst
  ixpk= 721, iat=  -1,1398, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1395,1415,1416,
 &end
#
#   88 ALA  HA           88 ALA  MB          3.50    (#    722:20   Preassigned)
 &rst
  ixpk= 722, iat=1422,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1424,1425,1426,
 &end
#
#   89 ILE  HA           89 ILE  HB          3.50    (#    723:20   Unique)
 &rst
  ixpk= 723, iat=1432,1434, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:724     90 ASN  QB          3.50    (#    724:20   Single Ambig)
 &rst
  ixpk= 724, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1451,1415,1416,
 igr2=1453,1454,
 &end
#
#   91 TYR  HA           91 TYR  HB3         4.50    (#    725:20   Unique)
 &rst
  ixpk= 725, iat=1465,1468, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   91 TYR  HA           91 TYR  HB2         3.50    (#    726:20   Unique)
 &rst
  ixpk= 726, iat=1465,1467, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   92 VAL  HA           92 VAL  HB          3.50    (#    727:20   Unique)
 &rst
  ixpk= 727, iat=1486,1488, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:728     93 ALA  MB          3.50    (#    728:20   Single Ambig)
 &rst
  ixpk= 728, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1502,1451,
 igr2=1504,1505,1506,
 &end
#
#   94 THR  HA           94 THR  HB          3.50    (#    729:20   Unique)
 &rst
  ixpk= 729, iat=1512,1514, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:730      0 AMB  20-1:730    3.50    (#    730:20   Double Ambig)
 &rst
  ixpk= 730, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2923,1541,
 igr2=2987,1543,
 &end
#
#   97 PHE  HA           97 PHE  HB+         3.50    (#    731:20   Unique)
 &rst
  ixpk= 731, iat=1557,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1559,1560,
 &end
#
#   97 PHE  HA           97 PHE  HB-         4.50    (#    732:20   Unique)
 &rst
  ixpk= 732, iat=1557,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1559,1560,
 &end
#
#   98 ARG  HA           98 ARG  HB+         3.50    (#    733:20   Unique)
 &rst
  ixpk= 733, iat=1577,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1579,1580,
 &end
#
#    0 AMB  20-2:734      0 AMB  20-1:734    3.50    (#    734:20   Double Ambig)
 &rst
  ixpk= 734, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1577,1741,
 igr2=1579,1580,1743,
 &end
#
#   99 GLU  HA           99 GLU  QB          3.50    (#    735:20   Unique)
 &rst
  ixpk= 735, iat=1601,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1603,1604,
 &end
#
#  100 GLU  HA          100 GLU  HB+         3.50    (#    736:20   Unique)
 &rst
  ixpk= 736, iat=1616,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1618,1619,
 &end
#
#  100 GLU  HA          100 GLU  HB-         3.50    (#    737:20   Unique)
 &rst
  ixpk= 737, iat=1616,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1618,1619,
 &end
#
#    0 AMB  20-2:738    101 LEU  HB2         3.50    (#    738:20   Single Ambig)
 &rst
  ixpk= 738, iat=  -1,1633, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1631,1557,1577,
 &end
#
#    0 AMB  20-2:739      0 AMB  20-1:739    3.50    (#    739:20   Double Ambig)
 &rst
  ixpk= 739, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1667,2565,
 igr2=1669,1670,2552,
 &end
#
#    0 AMB  20-2:740      0 AMB  20-1:740    3.50    (#    740:20   Double Ambig)
 &rst
  ixpk= 740, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2722,2763,1699,
 igr2=2730,2731,2765,2766,1696,
 &end
#
#    0 AMB  20-2:741      0 AMB  20-1:741    3.50    (#    741:20   Double Ambig)
 &rst
  ixpk= 741, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2452,1705,
 igr2=2454,2455,1707,1708,
 &end
#
#    0 AMB  20-2:742      0 AMB  20-1:742    3.50    (#    742:20   Double Ambig)
 &rst
  ixpk= 742, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1705,2565,
 igr2=1707,1708,2567,2568,
 &end
#
#  107 ALA  HA          107 ALA  MB          3.50    (#    743:20   Preassigned)
 &rst
  ixpk= 743, iat=1717,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1719,1720,1721,
 &end
#
#  108 THR  HA          108 THR  HB          3.50    (#    744:20   Unique)
 &rst
  ixpk= 744, iat=1727,1729, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  110 VAL  HA          110 VAL  HB          4.50    (#    747:20   Unique)
 &rst
  ixpk= 747, iat=1763,1765, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  111 LEU  HA          111 LEU  HB3         4.50    (#    748:20   Unique)
 &rst
  ixpk= 748, iat=1779,1782, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  111 LEU  HA          111 LEU  HB2         4.50    (#    749:20   Unique)
 &rst
  ixpk= 749, iat=1779,1781, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:750      0 AMB  20-1:750    3.50    (#    750:20   Double Ambig)
 &rst
  ixpk= 750, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 845, 678,1798,
 igr2= 847, 848, 681,1800,
 &end
#
#  113 ILE  HA          113 ILE  HB          4.50    (#    751:20   Unique)
 &rst
  ixpk= 751, iat=1817,1819, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  114 ILE  HA          114 ILE  HB          4.50    (#    752:20   Unique)
 &rst
  ixpk= 752, iat=1836,1838, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  115 THR  HA          115 THR  HB          4.50    (#    753:20   Unique)
 &rst
  ixpk= 753, iat=1855,1857, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  116 ASP  HA          116 ASP  HB3         3.50    (#    754:20   Unique)
 &rst
  ixpk= 754, iat=1869,1872, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  116 ASP  HA          116 ASP  HB2         3.50    (#    755:20   Unique)
 &rst
  ixpk= 755, iat=1869,1871, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:756    118 GLU  HB2         3.50    (#    756:20   Single Ambig)
 &rst
  ixpk= 756, iat=  -1,1890, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1888,2337,
 &end
#
#  119 ALA  HA          119 ALA  MB          3.50    (#    757:20   Unique)
 &rst
  ixpk= 757, iat=1903,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1905,1906,1907,
 &end
#
#  120 THR  HA          120 THR  HB          3.50    (#    758:20   Unique)
 &rst
  ixpk= 758, iat=1913,1915, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  121 ASP  HA          121 ASP  HB+         3.50    (#    759:20   Unique)
 &rst
  ixpk= 759, iat=1927,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1929,1930,
 &end
#
#  121 ASP  HA          121 ASP  HB-         3.50    (#    760:20   Unique)
 &rst
  ixpk= 760, iat=1927,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1929,1930,
 &end
#
#  122 SER  HA          122 SER  QB          3.50    (#    761:20   Unique)
 &rst
  ixpk= 761, iat=1939,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1941,1942,
 &end
#
#  124 ASN  HA          124 ASN  HB+         3.50    (#    762:20   Unique)
 &rst
  ixpk= 762, iat=1957,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1959,1960,
 &end
#
#    0 AMB  20-2:763      0 AMB  20-1:763    3.50    (#    763:20   Double Ambig)
 &rst
  ixpk= 763, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1957,1097,
 igr2=1959,1960,1099,1100,
 &end
#
#  125 ILE  HA          125 ILE  HB          3.50    (#    764:20   Unique)
 &rst
  ixpk= 764, iat=1971,1973, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  126 ASP  HA          126 ASP  QB          3.50    (#    765:20   Unique)
 &rst
  ixpk= 765, iat=1990,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1992,1993,
 &end
#
#  126 ASP  HA          126 ASP  QB          3.50    (#    766:20   Unique)
 &rst
  ixpk= 766, iat=1990,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1992,1993,
 &end
#
#  130 ASP  HA          130 ASP  HB+         3.50    (#    767:20   Unique)
 &rst
  ixpk= 767, iat=2044,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2046,2047,
 &end
#
#  130 ASP  HA          130 ASP  HB-         3.50    (#    768:20   Unique)
 &rst
  ixpk= 768, iat=2044,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2046,2047,
 &end
#
#    0 AMB  20-2:769    131 ILE  HB          3.50    (#    769:20   Single Ambig)
 &rst
  ixpk= 769, iat=  -1,2058, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2056,2075,
 &end
#
#    0 AMB  20-2:770    132 ILE  HB          3.50    (#    770:20   Single Ambig)
 &rst
  ixpk= 770, iat=  -1,2077, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2075,2056,
 &end
#
#  133 ARG  HA          133 ARG  HB3         4.50    (#    771:20   Unique)
 &rst
  ixpk= 771, iat=2094,2097, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  133 ARG  HA          133 ARG  HB2         4.50    (#    772:20   Unique)
 &rst
  ixpk= 772, iat=2094,2096, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  134 TYR  HA          134 TYR  HB2         3.50    (#    773:20   Unique)
 &rst
  ixpk= 773, iat=2118,2120, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  134 TYR  HA          134 TYR  HB3         4.50    (#    774:20   Unique)
 &rst
  ixpk= 774, iat=2118,2121, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  135 ILE  HA          135 ILE  HB          3.50    (#    775:20   Unique)
 &rst
  ixpk= 775, iat=2139,2141, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:776    136 ILE  HB          4.50    (#    776:20   Single Ambig)
 &rst
  ixpk= 776, iat=  -1,2160, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2158,2177,2178,
 &end
#
#    0 AMB  20-2:777    138 ILE  HB          4.50    (#    777:20   Single Ambig)
 &rst
  ixpk= 777, iat=  -1,2186, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2184,2177,2178,
 &end
#
#    0 AMB  20-2:778      0 AMB  20-1:778    3.50    (#    778:20   Double Ambig)
 &rst
  ixpk= 778, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 445,2210, 385,
 igr2= 498, 499,2212,2213, 387, 388, 387, 388,
 &end
#
#  141 HIS  HA          141 HIS  HB+         3.50    (#    779:20   Unique)
 &rst
  ixpk= 779, iat=2232,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2234,2235,
 &end
#
#  141 HIS  HA          141 HIS  HB-         3.50    (#    780:20   Unique)
 &rst
  ixpk= 780, iat=2232,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2234,2235,
 &end
#
#  142 PHE  HA          142 PHE  HB3         4.50    (#    781:20   Unique)
 &rst
  ixpk= 781, iat=2249,2252, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  142 PHE  HA          142 PHE  HB2         4.50    (#    782:20   Unique)
 &rst
  ixpk= 782, iat=2249,2251, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:783      0 AMB  20-1:783    4.50    (#    783:20   Double Ambig)
 &rst
  ixpk= 783, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.14, r4= 7.89,
 igr1=2269, 260, 262, 263,
 igr2=2271,2272, 246, 247,
 &end
#
#  143 GLN  HA          143 GLN  HB-         6.00    (#    784:20   Unique)
 &rst
  ixpk= 784, iat=2269,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=2271,2272,
 &end
#
#  144 THR  HA          144 THR  HB          3.50    (#    785:20   Unique)
 &rst
  ixpk= 785, iat=2286,2288, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:786      0 AMB  20-1:786    3.50    (#    786:20   Double Ambig)
 &rst
  ixpk= 786, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2865,2300,1135,
 igr2=2925,2926,2302,2303,1185,1186,
 &end
#
#    0 AMB  20-2:787      0 AMB  20-1:787    3.50    (#    787:20   Double Ambig)
 &rst
  ixpk= 787, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2865,2300,
 igr2=2925,2926,2302,2303,
 &end
#
#    0 AMB  20-2:788      0 AMB  20-1:788    3.50    (#    788:20   Double Ambig)
 &rst
  ixpk= 788, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2322,1108,1109,
 igr2=2324,2325,1111,1112,2367,2368,
 &end
#
#    0 AMB  20-2:790      0 AMB  20-1:790    3.50    (#    790:20   Double Ambig)
 &rst
  ixpk= 790, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 576, 577,2365, 193, 194,
 igr2=1111,1112,2367,2368,1844,1845,
 &end
#
#    0 AMB  20-2:791      0 AMB  20-1:791    3.50    (#    791:20   Double Ambig)
 &rst
  ixpk= 791, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=2221,2222,2365,2441,2442,
 igr2=2218,2219,2367,2368,
 &end
#
#  151 LEU  HA          151 LEU  HB2         4.50    (#    792:20   Unique)
 &rst
  ixpk= 792, iat=2394,2396, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  151 LEU  HA          151 LEU  HB3         4.50    (#    793:20   Unique)
 &rst
  ixpk= 793, iat=2394,2397, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:794    152 HIS  HB2         3.50    (#    794:20   Single Ambig)
 &rst
  ixpk= 794, iat=  -1,2415, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2413,2430,2380,
 &end
#
#  152 HIS  HA          152 HIS  HB3         3.50    (#    795:20   Unique)
 &rst
  ixpk= 795, iat=2413,2416, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:796      0 AMB  20-1:796    3.50    (#    796:20   Double Ambig)
 &rst
  ixpk= 796, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2472,2430,2380,
 igr2=2096,2432,2433,
 &end
#
#    0 AMB  20-2:797    153 LYS  HB-         3.50    (#    797:20   Single Ambig)
 &rst
  ixpk= 797, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2430,2380,
 igr2=2432,2433,
 &end
#
#  154 PHE  HA          154 PHE  HB+         3.50    (#    798:20   Unique)
 &rst
  ixpk= 798, iat=2452,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2454,2455,
 &end
#
#  155 ALA  HA          155 ALA  MB          3.50    (#    799:20   Unique)
 &rst
  ixpk= 799, iat=2472,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2474,2475,2476,
 &end
#
#  158 PRO  HA          158 PRO  HB3         3.50    (#    800:20   Unique)
 &rst
  ixpk= 800, iat=2523,2521, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:801      0 AMB  20-1:801    3.50    (#    801:20   Double Ambig)
 &rst
  ixpk= 801, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 105,2523,
 igr2= 704, 705,2520,
 &end
#
#  159 ALA  HA          159 ALA  MB          2.70    (#    802:20   Preassigned)
 &rst
  ixpk= 802, iat=2529,  -1, r1= 0.00, r2= 1.80, r3= 3.24, r4= 3.99,
 igr2=2531,2532,2533,
 &end
#
#  148 GLN  HA          148 GLN  HB+         3.50    (#    803:20   Unique)
 &rst
  ixpk= 803, iat=2348,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2350,2351,
 &end
#
#  148 GLN  HA          148 GLN  HB-         3.50    (#    804:20   Unique)
 &rst
  ixpk= 804, iat=2348,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2350,2351,
 &end
#
#    0 AMB  20-2:805    163 VAL  HB          4.50    (#    805:20   Single Ambig)
 &rst
  ixpk= 805, iat=  -1,2587, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2585,2601,
 &end
#
#    0 AMB  20-2:806      0 AMB  20-1:806    3.50    (#    806:20   Double Ambig)
 &rst
  ixpk= 806, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 756,2623,
 igr2= 758,2625,
 &end
#
#  166 LEU  HA          166 LEU  QB          3.50    (#    807:20   Unique)
 &rst
  ixpk= 807, iat=2642,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2644,2645,
 &end
#
#  166 LEU  HA          166 LEU  QB          3.50    (#    808:20   Unique)
 &rst
  ixpk= 808, iat=2642,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2644,2645,
 &end
#
#    0 AMB  20-2:809      0 AMB  20-1:809    3.50    (#    809:20   Double Ambig)
 &rst
  ixpk= 809, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2661,2394,
 igr2=2663,2664,2663,2664,2454,2455,
 &end
#
#    0 AMB  20-2:810      0 AMB  20-1:810    3.50    (#    810:20   Double Ambig)
 &rst
  ixpk= 810, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2661,2394,
 igr2=2663,2664,2663,2664,2454,2455,
 &end
#
#  169 PHE  HA          169 PHE  HB2         3.50    (#    812:20   Unique)
 &rst
  ixpk= 812, iat=2687,2689, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  169 PHE  HA          169 PHE  HB3         3.50    (#    813:20   Unique)
 &rst
  ixpk= 813, iat=2687,2690, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:814      0 AMB  20-1:814    3.50    (#    814:20   Double Ambig)
 &rst
  ixpk= 814, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2850,2707,
 igr2=2852,2853,2709,2710,
 &end
#
#  172 LEU  HA          172 LEU  HB+         3.50    (#    815:20   Preassigned)
 &rst
  ixpk= 815, iat=2744,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2746,2747,
 &end
#
#  172 LEU  HA          172 LEU  HB-         4.50    (#    816:20   Preassigned)
 &rst
  ixpk= 816, iat=2744,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2746,2747,
 &end
#
#    0 AMB  20-2:819      0 AMB  20-1:819    3.50    (#    819:20   Double Ambig)
 &rst
  ixpk= 819, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2785, 917,
 igr2=2787, 983,
 &end
#
#  174 ASP  HA          174 ASP  HB3         3.50    (#    820:20   Unique)
 &rst
  ixpk= 820, iat=2785,2788, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  175 LEU  HA          175 LEU  HB2         3.50    (#    821:20   Unique)
 &rst
  ixpk= 821, iat=2797,2799, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  175 LEU  HA          175 LEU  HB3         3.50    (#    822:20   Preassigned)
 &rst
  ixpk= 822, iat=2797,2800, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  176 PHE  HA          176 PHE  HB+         3.50    (#    823:20   Preassigned)
 &rst
  ixpk= 823, iat=2816,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2818,2819,
 &end
#
#  176 PHE  HA          176 PHE  HB-         3.50    (#    824:20   Unique)
 &rst
  ixpk= 824, iat=2816,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2818,2819,
 &end
#
#  177 THR  HA          177 THR  HB          3.50    (#    825:20   Unique)
 &rst
  ixpk= 825, iat=2836,2838, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  179 LEU  HA            0 AMB  20-1:826    3.50    (#    826:20   Single Ambig)
 &rst
  ixpk= 826, iat=2865,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2=2867,2868,2867,2868,
 &end
#
#  179 LEU  HA            0 AMB  20-1:827    3.50    (#    827:20   Single Ambig)
 &rst
  ixpk= 827, iat=2865,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2=2867,2868,2867,2868,
 &end
#
#    0 AMB  20-2:828      0 AMB  20-1:828    3.50    (#    828:20   Double Ambig)
 &rst
  ixpk= 828, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2884,1872,
 igr2=2886,2887, 276,
 &end
#
#  180 GLN  HA            0 AMB  20-1:829    3.50    (#    829:20   Single Ambig)
 &rst
  ixpk= 829, iat=2884,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2=2886,2887,2953,2954,
 &end
#
#  183 ILE  HA          183 ILE  HB          3.50    (#    831:20   Unique)
 &rst
  ixpk= 831, iat=2945,2947, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  183 ILE  HA          183 ILE  HB          3.50    (#    832:20   Unique)
 &rst
  ixpk= 832, iat=2945,2947, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:833      0 AMB  20-1:833    3.50    (#    833:20   Double Ambig)
 &rst
  ixpk= 833, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=2985, 994, 995,3001,
 igr2=2987, 701, 702, 701, 702,
 &end
#
#    0 AMB  20-2:834    186 ILE  HB          3.50    (#    834:20   Single Ambig)
 &rst
  ixpk= 834, iat=  -1,3003, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=3001,3020,
 &end
#
#    0 AMB  20-2:836      0 AMB  20-1:836    3.50    (#    836:20   Double Ambig)
 &rst
  ixpk= 836, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=  51,  52,2606,2607,2606,2607, 390, 391,
 igr2=  46,2797, 321,
 &end
#
#    9 LEU  HG            9 LEU  HA          3.50    (#    837:20   Unique)
 &rst
  ixpk= 837, iat= 122, 117, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:838     10 VAL  HA          3.50    (#    838:20   Single Ambig)
 &rst
  ixpk= 838, iat=  -1, 136, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 738, 739, 740, 144, 145, 146,
 &end
#
#    0 AMB  20-2:839     10 VAL  HA          3.50    (#    839:20   Single Ambig)
 &rst
  ixpk= 839, iat=  -1, 136, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 140, 141, 142, 124, 125, 126, 128, 129, 130,
 &end
#
#   12 LEU  HG           12 LEU  HA          4.50    (#    840:20   Unique)
 &rst
  ixpk= 840, iat= 177, 172, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   17 MET  HG+          17 MET  HA          4.50    (#    841:20   Unique)
 &rst
  ixpk= 841, iat=  -1, 241, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 246, 247,
 &end
#
#    0 AMB  20-2:842      0 AMB  20-1:842    3.50    (#    842:20   Double Ambig)
 &rst
  ixpk= 842, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 246, 247,2855,2856,
 igr2= 241,2865,
 &end
#
#   21 PRO  QG           21 PRO  HA          3.50    (#    843:20   Unique)
 &rst
  ixpk= 843, iat=  -1, 315, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 309, 310,
 &end
#
#    0 AMB  20-2:844     23 GLU  HA          3.50    (#    844:20   Single Ambig)
 &rst
  ixpk= 844, iat=  -1, 333, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 338, 339, 390, 391,
 &end
#
#   27 ILE  MG2          27 ILE  HA          3.50    (#    846:20   Unique)
 &rst
  ixpk= 846, iat=  -1, 407, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 411, 412, 413,
 &end
#
#    0 AMB  20-2:847     31 MET  HA          3.50    (#    847:20   Single Ambig)
 &rst
  ixpk= 847, iat=  -1, 477, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 482, 483, 551, 552,
 &end
#
#   31 MET  HG-          31 MET  HA          3.50    (#    848:20   Unique)
 &rst
  ixpk= 848, iat=  -1, 477, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 482, 483,
 &end
#
#    0 AMB  20-2:849     32 LYS  HA          3.50    (#    849:20   Single Ambig)
 &rst
  ixpk= 849, iat=  -1, 496, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 501, 502,1171,1172,1173,1175,1176,1177,
 &end
#
#    0 AMB  20-2:850      0 AMB  20-1:850    3.50    (#    850:20   Double Ambig)
 &rst
  ixpk= 850, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 538, 539, 540,1440,1441,
 igr2= 530,1381,
 &end
#
#    0 AMB  20-2:851      0 AMB  20-1:851    3.50    (#    851:20   Double Ambig)
 &rst
  ixpk= 851, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 534, 535, 536, 179, 180, 181, 183, 184, 185, 616,
       617, 618, 620, 621, 622,
 igr2= 530,1381,
 &end
#
#   35 MET  HG+          35 MET  HA          3.50    (#    852:20   Unique)
 &rst
  ixpk= 852, iat=  -1, 546, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 551, 552,
 &end
#
#   35 MET  HG-          35 MET  HA          3.50    (#    853:20   Unique)
 &rst
  ixpk= 853, iat=  -1, 546, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 551, 552,
 &end
#
#    0 AMB  20-2:854     36 LYS  HA          3.50    (#    854:20   Single Ambig)
 &rst
  ixpk= 854, iat=  -1, 565, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 573, 574, 570, 571,
 &end
#
#   36 LYS  HG-          36 LYS  HA          3.50    (#    855:20   Unique)
 &rst
  ixpk= 855, iat=  -1, 565, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 570, 571,
 &end
#
#   37 LYS  QG           37 LYS  HA          3.50    (#    856:20   Unique)
 &rst
  ixpk= 856, iat=  -1, 587, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 592, 593,
 &end
#
#   44 GLN  HG+          44 GLN  HA          3.50    (#    857:20   Unique)
 &rst
  ixpk= 857, iat=  -1, 699, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 704, 705,
 &end
#
#    0 AMB  20-2:858     44 GLN  HA          3.50    (#    858:20   Single Ambig)
 &rst
  ixpk= 858, iat=  -1, 699, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 701, 702, 704, 705,
 &end
#
#    0 AMB  20-2:859      0 AMB  20-1:859    2.70    (#    859:20   Double Ambig)
 &rst
  ixpk= 859, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.52, r4= 5.27,
 igr1=1975,1976,1977, 760, 761, 762, 764, 765, 766,1979,
      1980,
 igr2=1971, 756,
 &end
#
#    0 AMB  20-2:860      0 AMB  20-1:860    3.50    (#    860:20   Double Ambig)
 &rst
  ixpk= 860, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 760, 761, 762, 764, 765, 766,2649,2650,2651,2653,
      2654,2655,
 igr2= 756,2184,
 &end
#
#   49 GLN  QG           49 GLN  HA          3.50    (#    861:20   Unique)
 &rst
  ixpk= 861, iat=  -1, 772, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 777, 778,
 &end
#
#   49 GLN  QG           49 GLN  HA          3.50    (#    862:20   Unique)
 &rst
  ixpk= 862, iat=  -1, 772, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 777, 778,
 &end
#
#   52 THR  MG2          52 THR  HA          3.50    (#    863:20   Unique)
 &rst
  ixpk= 863, iat=  -1, 820, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 824, 825, 826,
 &end
#
#    0 AMB  20-2:864     56 THR  HA          3.50    (#    864:20   Single Ambig)
 &rst
  ixpk= 864, iat=  -1, 888, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 760, 761, 762, 764, 765, 766, 892, 893, 894,
 &end
#
#   57 GLU  HG+          57 GLU  HA          3.50    (#    865:20   Unique)
 &rst
  ixpk= 865, iat=  -1, 902, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 907, 908,
 &end
#
#   57 GLU  HG-          57 GLU  HA          3.50    (#    866:20   Unique)
 &rst
  ixpk= 866, iat=  -1, 902, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 907, 908,
 &end
#
#   64 VAL  MG2          64 VAL  HA          3.50    (#    867:20   Unique)
 &rst
  ixpk= 867, iat=  -1,1013, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1021,1022,1023,
 &end
#
#    0 AMB  20-2:868     64 VAL  HA          3.50    (#    868:20   Single Ambig)
 &rst
  ixpk= 868, iat=  -1,1013, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1080,1081,1017,1018,1019,
 &end
#
#   67 LYS  HG+          67 LYS  HA          3.50    (#    869:20   Unique)
 &rst
  ixpk= 869, iat=  -1,1075, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1080,1081,
 &end
#
#   67 LYS  HG-          67 LYS  HA          3.50    (#    870:20   Unique)
 &rst
  ixpk= 870, iat=  -1,1075, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1080,1081,
 &end
#
#   69 PRO  HG+          69 PRO  HA          4.50    (#    871:20   Unique)
 &rst
  ixpk= 871, iat=  -1,1117, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1111,1112,
 &end
#
#    0 AMB  20-2:872     69 PRO  HA          3.50    (#    872:20   Single Ambig)
 &rst
  ixpk= 872, iat=  -1,1117, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1111,1112, 548,
 &end
#
#    0 AMB  20-2:873     72 LEU  HA          3.50    (#    873:20   Single Ambig)
 &rst
  ixpk= 873, iat=  -1,1145, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1150,1191,1192,
 &end
#
#    0 AMB  20-2:874      0 AMB  20-1:874    3.50    (#    874:20   Double Ambig)
 &rst
  ixpk= 874, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1188,1189,1017,1018,1019,
 igr2=1183,1029,
 &end
#
#   74 LYS  HG-          74 LYS  HA          3.50    (#    875:20   Unique)
 &rst
  ixpk= 875, iat=  -1,1183, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1188,1189,
 &end
#
#   76 VAL  MG2          76 VAL  HA          3.50    (#    876:20   Preassigned)
 &rst
  ixpk= 876, iat=  -1,1222, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1230,1231,1232,
 &end
#
#   79 MET  HG+          79 MET  HA          3.50    (#    877:20   Unique)
 &rst
  ixpk= 877, iat=  -1,1277, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1282,1283,
 &end
#
#   79 MET  HG-          79 MET  HA          3.50    (#    878:20   Unique)
 &rst
  ixpk= 878, iat=  -1,1277, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1282,1283,
 &end
#
#   80 LEU  HG           80 LEU  HA          3.50    (#    879:20   Unique)
 &rst
  ixpk= 879, iat=1301,1296, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   85 THR  MG2          85 THR  HA          3.50    (#    880:20   Unique)
 &rst
  ixpk= 880, iat=  -1,1381, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1385,1386,1387,
 &end
#
#   89 ILE  HG1+         89 ILE  HA          3.50    (#    881:20   Unique)
 &rst
  ixpk= 881, iat=  -1,1432, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1440,1441,
 &end
#
#    0 AMB  20-2:882     89 ILE  HA          3.50    (#    882:20   Single Ambig)
 &rst
  ixpk= 882, iat=  -1,1432, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1440,1441, 179, 180, 181, 183, 184, 185,
 &end
#
#   89 ILE  MG2          89 ILE  HA          3.50    (#    883:20   Unique)
 &rst
  ixpk= 883, iat=  -1,1432, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1436,1437,1438,
 &end
#
#   92 VAL  MG2          92 VAL  HA          3.50    (#    884:20   Unique)
 &rst
  ixpk= 884, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1494,1495,1496,
 &end
#
#    0 AMB  20-2:885     92 VAL  HA          3.50    (#    885:20   Single Ambig)
 &rst
  ixpk= 885, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1490,1491,1492, 760, 761, 762, 764, 765, 766,
 &end
#
#   94 THR  MG2          94 THR  HA          3.50    (#    886:20   Unique)
 &rst
  ixpk= 886, iat=  -1,1512, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1516,1517,1518,
 &end
#
#   95 GLU  QG           95 GLU  HA          3.50    (#    887:20   Unique)
 &rst
  ixpk= 887, iat=  -1,1526, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1531,1532,
 &end
#
#   95 GLU  QG           95 GLU  HA          3.50    (#    888:20   Unique)
 &rst
  ixpk= 888, iat=  -1,1526, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1531,1532,
 &end
#
#   96 VAL  MG2          96 VAL  HA          3.50    (#    889:20   Unique)
 &rst
  ixpk= 889, iat=  -1,1541, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1549,1550,1551,
 &end
#
#   96 VAL  MG1          96 VAL  HA          3.50    (#    890:20   Unique)
 &rst
  ixpk= 890, iat=  -1,1541, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1545,1546,1547,
 &end
#
#    0 AMB  20-2:892     99 GLU  HA          3.50    (#    892:20   Single Ambig)
 &rst
  ixpk= 892, iat=  -1,1601, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1606,1607,1606,1607,
 &end
#
#  100 GLU  QG          100 GLU  HA          3.50    (#    893:20   Unique)
 &rst
  ixpk= 893, iat=  -1,1616, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1621,1622,
 &end
#
#    0 AMB  20-2:894      0 AMB  20-1:894    3.50    (#    894:20   Double Ambig)
 &rst
  ixpk= 894, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1636,2058,
 igr2=1631,1577,2044,
 &end
#
#    0 AMB  20-2:896    108 THR  HA          3.50    (#    896:20   Single Ambig)
 &rst
  ixpk= 896, iat=  -1,1727, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1731,1732,1733,1746,1747,
 &end
#
#    0 AMB  20-2:899    110 VAL  HA          2.70    (#    899:20   Single Ambig)
 &rst
  ixpk= 899, iat=  -1,1763, r1= 0.00, r2= 1.80, r3= 3.89, r4= 4.64,
 igr1=1771,1772,1773,1767,1768,1769,2079,2080,2081,
 &end
#
#  111 LEU  HG          111 LEU  HA          4.50    (#    900:20   Unique)
 &rst
  ixpk= 900, iat=1784,1779, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  112 ILE  HG1+        112 ILE  HA          4.50    (#    901:20   Unique)
 &rst
  ixpk= 901, iat=  -1,1798, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1806,1807,
 &end
#
#  112 ILE  HG1-        112 ILE  HA          3.50    (#    902:20   Unique)
 &rst
  ixpk= 902, iat=  -1,1798, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1806,1807,
 &end
#
#  112 ILE  MG2         112 ILE  HA          3.50    (#    903:20   Unique)
 &rst
  ixpk= 903, iat=  -1,1798, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1802,1803,1804,
 &end
#
#    0 AMB  20-2:904    113 ILE  HA          4.50    (#    904:20   Single Ambig)
 &rst
  ixpk= 904, iat=  -1,1817, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1825,1826,1844,1845,
 &end
#
#    0 AMB  20-2:905    113 ILE  HA          4.50    (#    905:20   Single Ambig)
 &rst
  ixpk= 905, iat=  -1,1817, r1= 0.00, r2= 1.80, r3= 6.99, r4= 7.74,
 igr1=1825,1826,1786,1787,1788,1790,1791,1792,1786,1787,
      1788,1790,1791,1792,
 &end
#
#    0 AMB  20-2:906    113 ILE  HA          3.50    (#    906:20   Single Ambig)
 &rst
  ixpk= 906, iat=  -1,1817, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1821,1822,1823, 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:907    114 ILE  HA          3.50    (#    907:20   Single Ambig)
 &rst
  ixpk= 907, iat=  -1,1836, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2160,1844,1845,1838,
 &end
#
#    0 AMB  20-2:908    114 ILE  HA          3.50    (#    908:20   Single Ambig)
 &rst
  ixpk= 908, iat=  -1,1836, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1840,1841,1842,1844,1845,
 &end
#
#    0 AMB  20-2:909    114 ILE  HA          3.50    (#    909:20   Single Ambig)
 &rst
  ixpk= 909, iat=  -1,1836, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1840,1841,1842,1844,1845,
 &end
#
#    0 AMB  20-2:910    115 THR  HA          4.50    (#    910:20   Single Ambig)
 &rst
  ixpk= 910, iat=  -1,1855, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1859,1860,1861,2192,2193,1357,1358,1359,
 &end
#
#  120 THR  MG2         120 THR  HA          3.50    (#    911:20   Unique)
 &rst
  ixpk= 911, iat=  -1,1913, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1917,1918,1919,
 &end
#
#    0 AMB  20-2:912      0 AMB  20-1:912    3.50    (#    912:20   Double Ambig)
 &rst
  ixpk= 912, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.43, r4= 6.18,
 igr1=2083,2084,1979,1980,1731,1732,1733,
 igr2=1763,1971,
 &end
#
#    0 AMB  20-2:913    129 LYS  HA          3.50    (#    913:20   Single Ambig)
 &rst
  ixpk= 913, iat=  -1,2022, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2027,2028,1979,1980,2064,2065,
 &end
#
#    0 AMB  20-2:914    131 ILE  HA          3.50    (#    914:20   Single Ambig)
 &rst
  ixpk= 914, iat=  -1,2056, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2064,2065,1743,
 &end
#
#    0 AMB  20-2:916      0 AMB  20-1:916    3.50    (#    916:20   Double Ambig)
 &rst
  ixpk= 916, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 276,2083,2084,2096,1336,1337,
 igr2= 262, 263,2075, 811, 812,
 &end
#
#  132 ILE  HG1-        132 ILE  HA          3.50    (#    917:20   Unique)
 &rst
  ixpk= 917, iat=  -1,2075, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2083,2084,
 &end
#
#    0 AMB  20-2:918      0 AMB  20-1:918    3.50    (#    918:20   Double Ambig)
 &rst
  ixpk= 918, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.77, r4= 8.52,
 igr1=2086,2087,2088,2079,2080,2081, 278, 279, 280, 282,
       283, 284,1322,1323,1324,1326,1327,1328,1322,1323,
      1324,1326,1327,1328,
 igr2=2075, 262, 263, 811, 812,
 &end
#
#  135 ILE  HG1+        135 ILE  HA          3.50    (#    919:20   Unique)
 &rst
  ixpk= 919, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2147,2148,
 &end
#
#  135 ILE  HG1-        135 ILE  HA          4.50    (#    920:20   Unique)
 &rst
  ixpk= 920, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2147,2148,
 &end
#
#    0 AMB  20-2:921    135 ILE  HA          3.50    (#    921:20   Single Ambig)
 &rst
  ixpk= 921, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2143,2144,2145,1802,1803,1804,1844,1845,
 &end
#
#    0 AMB  20-2:922      0 AMB  20-1:922    3.50    (#    922:20   Double Ambig)
 &rst
  ixpk= 922, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2166,2167, 904,
 igr2=2158, 756,
 &end
#
#    0 AMB  20-2:923      0 AMB  20-1:923    3.50    (#    923:20   Double Ambig)
 &rst
  ixpk= 923, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2166,2167,2186,2804,2805,2806,2808,2809,2810,
 igr2=2158,2184,
 &end
#
#    0 AMB  20-2:924      0 AMB  20-1:924    3.50    (#    924:20   Double Ambig)
 &rst
  ixpk= 924, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2162,2163,2164,2649,2650,2651,2653,2654,2655,
 igr2=2158,2184,
 &end
#
#    0 AMB  20-2:925      0 AMB  20-1:925    3.50    (#    925:20   Double Ambig)
 &rst
  ixpk= 925, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2192,2193,2644,2645,1979,1980,
 igr2=2184,1971,
 &end
#
#  138 ILE  HG1-        138 ILE  HA          3.50    (#    926:20   Unique)
 &rst
  ixpk= 926, iat=  -1,2184, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2192,2193,
 &end
#
#  138 ILE  MG2         138 ILE  HA          3.50    (#    927:20   Unique)
 &rst
  ixpk= 927, iat=  -1,2184, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2188,2189,2190,
 &end
#
#    0 AMB  20-2:928      0 AMB  20-1:928    3.50    (#    928:20   Double Ambig)
 &rst
  ixpk= 928, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.58, r4= 7.33,
 igr1=2215,2216, 589, 590, 589, 590, 390, 391,2474,2475,
      2476,
 igr2=2210, 587,2707,2413,
 &end
#
#    0 AMB  20-2:929    143 GLN  HA          3.50    (#    929:20   Single Ambig)
 &rst
  ixpk= 929, iat=  -1,2269, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2274,2275,2271,2272,
 &end
#
#  144 THR  MG2         144 THR  HA          3.50    (#    930:20   Unique)
 &rst
  ixpk= 930, iat=  -1,2286, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2290,2291,2292,
 &end
#
#    0 AMB  20-2:931      0 AMB  20-1:931    3.50    (#    931:20   Double Ambig)
 &rst
  ixpk= 931, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2305,2306,1031,1032,
 igr2=2300,1029,
 &end
#
#    0 AMB  20-2:932      0 AMB  20-1:932    3.50    (#    932:20   Double Ambig)
 &rst
  ixpk= 932, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2305,2306,1031,1032,
 igr2=2300,1029,
 &end
#
#  146 GLU  HG+         146 GLU  HA          3.50    (#    933:20   Unique)
 &rst
  ixpk= 933, iat=  -1,2322, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2327,2328,
 &end
#
#    0 AMB  20-2:934    146 GLU  HA          3.50    (#    934:20   Single Ambig)
 &rst
  ixpk= 934, iat=  -1,2322, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2370,2371,2327,2328,
 &end
#
#  149 GLU  HG+         149 GLU  HA          3.50    (#    935:20   Unique)
 &rst
  ixpk= 935, iat=  -1,2365, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2370,2371,
 &end
#
#  151 LEU  HG          151 LEU  HA          3.50    (#    936:20   Unique)
 &rst
  ixpk= 936, iat=2399,2394, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  153 LYS  HG+         153 LYS  HA          3.50    (#    937:20   Unique)
 &rst
  ixpk= 937, iat=  -1,2430, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2435,2436,
 &end
#
#  153 LYS  HG-         153 LYS  HA          3.50    (#    938:20   Unique)
 &rst
  ixpk= 938, iat=  -1,2430, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2435,2436,
 &end
#
#    0 AMB  20-2:939    158 PRO  HA          4.50    (#    939:20   Single Ambig)
 &rst
  ixpk= 939, iat=  -1,2523, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2517,2518,2517,2518,
 &end
#
#    0 AMB  20-2:942    165 ILE  HA          3.50    (#    942:20   Single Ambig)
 &rst
  ixpk= 942, iat=  -1,2623, r1= 0.00, r2= 1.80, r3= 4.84, r4= 5.59,
 igr1=2631,2632,2644,2645,2606,2607,2647,
 &end
#
#  165 ILE  MG2         165 ILE  HA          3.50    (#    943:20   Unique)
 &rst
  ixpk= 943, iat=  -1,2623, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2627,2628,2629,
 &end
#
#  170 GLU  HG+         170 GLU  HA          3.50    (#    945:20   Unique)
 &rst
  ixpk= 945, iat=  -1,2707, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2712,2713,
 &end
#
#  170 GLU  HG-         170 GLU  HA          3.50    (#    946:20   Unique)
 &rst
  ixpk= 946, iat=  -1,2707, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2712,2713,
 &end
#
#    0 AMB  20-2:947    171 LYS  HA          2.70    (#    947:20   Single Ambig)
 &rst
  ixpk= 947, iat=  -1,2722, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=2727,2728,2724,2725,
 &end
#
#  172 LEU  HG          172 LEU  HA          3.50    (#    948:20   Unique)
 &rst
  ixpk= 948, iat=2749,2744, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  173 LYS  QG          173 LYS  HA          3.50    (#    950:20   Unique)
 &rst
  ixpk= 950, iat=  -1,2763, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2768,2769,
 &end
#
#    0 AMB  20-2:951      0 AMB  20-1:951    3.50    (#    951:20   Double Ambig)
 &rst
  ixpk= 951, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=  48,  49,  48,  49,2802,
 igr2=  46,2797,
 &end
#
#  177 THR  MG2         177 THR  HA          3.50    (#    952:20   Preassigned)
 &rst
  ixpk= 952, iat=  -1,2836, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2840,2841,2842,
 &end
#
#    0 AMB  20-2:953      0 AMB  20-1:953    3.50    (#    953:20   Double Ambig)
 &rst
  ixpk= 953, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2855,2856, 246, 247,2353,2354,2353,2354,
 igr2=2850, 260,2269,
 &end
#
#    0 AMB  20-2:954    183 ILE  HA          3.50    (#    954:20   Single Ambig)
 &rst
  ixpk= 954, iat=  -1,2945, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2953,2954,2931,2932,2928,2929,
 &end
#
#  183 ILE  HG1-        183 ILE  HA          3.50    (#    955:20   Unique)
 &rst
  ixpk= 955, iat=  -1,2945, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2953,2954,
 &end
#
#  183 ILE  MG2         183 ILE  HA          3.50    (#    956:20   Unique)
 &rst
  ixpk= 956, iat=  -1,2945, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2949,2950,2951,
 &end
#
#    0 AMB  20-2:957    185 VAL  HA          3.50    (#    957:20   Single Ambig)
 &rst
  ixpk= 957, iat=  -1,2985, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2989,2990,2991,2993,2994,2995,2989,2990,2991,2993,
      2994,2995,
 &end
#
#  186 ILE  HG1+        186 ILE  HA          3.50    (#    958:20   Unique)
 &rst
  ixpk= 958, iat=  -1,3001, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=3009,3010,
 &end
#
#  186 ILE  HG1-        186 ILE  HA          3.50    (#    959:20   Unique)
 &rst
  ixpk= 959, iat=  -1,3001, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=3009,3010,
 &end
#
#    0 AMB  20-2:960    186 ILE  HA          3.50    (#    960:20   Single Ambig)
 &rst
  ixpk= 960, iat=  -1,3001, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=3012,3013,3014,3005,3006,3007,2989,2990,2991,2993,
      2994,2995,
 &end
#
#    4 LYS  HA            4 LYS  QG          3.50    (#    961:20   Unique)
 &rst
  ixpk= 961, iat=  46,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  51,  52,
 &end
#
#    4 LYS  HA            4 LYS  QG          3.50    (#    962:20   Unique)
 &rst
  ixpk= 962, iat=  46,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  51,  52,
 &end
#
#    7 VAL  HA            7 VAL  MG1         3.50    (#    963:20   Unique)
 &rst
  ixpk= 963, iat=  89,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=  93,  94,  95,
 &end
#
#    7 VAL  HA            7 VAL  MG2         3.50    (#    964:20   Preassigned)
 &rst
  ixpk= 964, iat=  89,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=  97,  98,  99,
 &end
#
#    9 LEU  HA            9 LEU  HG          3.50    (#    965:20   Unique)
 &rst
  ixpk= 965, iat= 117, 122, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   10 VAL  HA           10 VAL  MG2         3.50    (#    966:20   Preassigned)
 &rst
  ixpk= 966, iat= 136,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 144, 145, 146,
 &end
#
#   17 MET  HA           17 MET  HG+         4.50    (#    967:20   Preassigned)
 &rst
  ixpk= 967, iat= 241,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 246, 247,
 &end
#
#   17 MET  HA           17 MET  HG-         4.50    (#    968:20   Preassigned)
 &rst
  ixpk= 968, iat= 241,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 246, 247,
 &end
#
#    0 AMB  20-2:969     19 LEU  HG          4.50    (#    969:20   Single Ambig)
 &rst
  ixpk= 969, iat=  -1, 276, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 271, 223, 224,
 &end
#
#    0 AMB  20-2:971     23 GLU  HG-         3.50    (#    971:20   Single Ambig)
 &rst
  ixpk= 971, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 333,2689,
 igr2= 338, 339,
 &end
#
#   27 ILE  HA           27 ILE  HG1-        6.00    (#    972:20   Unique)
 &rst
  ixpk= 972, iat= 407,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2= 415, 416,
 &end
#
#   28 LEU  HA           28 LEU  HG          4.50    (#    973:20   Unique)
 &rst
  ixpk= 973, iat= 426, 431, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   31 MET  HA           31 MET  HG+         4.50    (#    974:20   Unique)
 &rst
  ixpk= 974, iat= 477,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 482, 483,
 &end
#
#   31 MET  HA           31 MET  HG-         3.50    (#    975:20   Unique)
 &rst
  ixpk= 975, iat= 477,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 482, 483,
 &end
#
#    0 AMB  20-2:976      0 AMB  20-1:976    4.50    (#    976:20   Double Ambig)
 &rst
  ixpk= 976, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 496, 426,
 igr2= 501, 502,1169,
 &end
#
#   32 LYS  HA           32 LYS  HG-         3.50    (#    977:20   Unique)
 &rst
  ixpk= 977, iat= 496,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 501, 502,
 &end
#
#    0 AMB  20-2:978     72 LEU  MDY         3.50    (#    978:20   Single Ambig)
 &rst
  ixpk= 978, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1053, 983,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:979      0 AMB  20-1:979    3.50    (#    979:20   Double Ambig)
 &rst
  ixpk= 979, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1= 951, 952, 951, 952, 546,
 igr2= 701, 702, 551, 552,
 &end
#
#    0 AMB  20-2:980     35 MET  HG-         3.50    (#    980:20   Single Ambig)
 &rst
  ixpk= 980, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 546, 719,
 igr2= 551, 552,
 &end
#
#    0 AMB  20-2:981     36 LYS  HG+         3.50    (#    981:20   Single Ambig)
 &rst
  ixpk= 981, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 565,1108,1109,1108,1109,
 igr2= 570, 571,
 &end
#
#    0 AMB  20-2:982     36 LYS  HG-         3.50    (#    982:20   Single Ambig)
 &rst
  ixpk= 982, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 565,1108,1109,1108,1109,
 igr2= 570, 571,
 &end
#
#    0 AMB  20-2:984      0 AMB  20-1:984    3.50    (#    984:20   Double Ambig)
 &rst
  ixpk= 984, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 699,2286,
 igr2= 704, 705,2274,2275,
 &end
#
#   44 GLN  HA           44 GLN  HG-         3.50    (#    985:20   Unique)
 &rst
  ixpk= 985, iat= 699,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 704, 705,
 &end
#
#   48 VAL  HA           48 VAL  MGX         3.50    (#    986:20   Unique)
 &rst
  ixpk= 986, iat= 756,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#   48 VAL  HA           48 VAL  MGY         3.50    (#    987:20   Preassigned)
 &rst
  ixpk= 987, iat= 756,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#   49 GLN  HA           49 GLN  QG          3.50    (#    988:20   Unique)
 &rst
  ixpk= 988, iat= 772,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 777, 778,
 &end
#
#   49 GLN  HA           49 GLN  QG          3.50    (#    989:20   Unique)
 &rst
  ixpk= 989, iat= 772,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 777, 778,
 &end
#
#   52 THR  HA           52 THR  MG2         3.50    (#    990:20   Preassigned)
 &rst
  ixpk= 990, iat= 820,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 824, 825, 826,
 &end
#
#    0 AMB  20-2:991     56 THR  MG2         3.50    (#    991:20   Single Ambig)
 &rst
  ixpk= 991, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 888, 890,
 igr2= 892, 893, 894,
 &end
#
#    0 AMB  20-2:992     57 GLU  HG+         4.50    (#    992:20   Single Ambig)
 &rst
  ixpk= 992, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 902, 756,
 igr2= 907, 908,
 &end
#
#    0 AMB  20-2:993     57 GLU  HG-         4.50    (#    993:20   Single Ambig)
 &rst
  ixpk= 993, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 902, 756,
 igr2= 907, 908,
 &end
#
#   64 VAL  HA           64 VAL  MG1         3.50    (#    994:20   Unique)
 &rst
  ixpk= 994, iat=1013,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1017,1018,1019,
 &end
#
#   67 LYS  HA           67 LYS  HG+         3.50    (#    995:20   Unique)
 &rst
  ixpk= 995, iat=1075,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1080,1081,
 &end
#
#   67 LYS  HA           67 LYS  HG-         3.50    (#    996:20   Unique)
 &rst
  ixpk= 996, iat=1075,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1080,1081,
 &end
#
#   69 PRO  HA           69 PRO  HG-         3.50    (#    997:20   Unique)
 &rst
  ixpk= 997, iat=1117,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1111,1112,
 &end
#
#    0 AMB  20-2:998     74 LYS  HG+         3.50    (#    998:20   Single Ambig)
 &rst
  ixpk= 998, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1183,1135,
 igr2=1188,1189,
 &end
#
#    0 AMB  20-2:999     74 LYS  HG-         3.50    (#    999:20   Single Ambig)
 &rst
  ixpk= 999, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1183,1135,
 igr2=1188,1189,
 &end
#
#   76 VAL  HA           76 VAL  MG1         3.50    (#   1000:20   Preassigned)
 &rst
  ixpk= 1000, iat=1222,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1226,1227,1228,
 &end
#
#   76 VAL  HA           76 VAL  MG2         3.50    (#   1001:20   Preassigned)
 &rst
  ixpk= 1001, iat=1222,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1230,1231,1232,
 &end
#
#    0 AMB  20-2:1002    79 MET  HG+         4.50    (#   1002:20   Single Ambig)
 &rst
  ixpk= 1002, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1277, 811, 812,
 igr2=1282,1283,
 &end
#
#    0 AMB  20-2:1003    79 MET  HG-         3.50    (#   1003:20   Single Ambig)
 &rst
  ixpk= 1003, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1277, 811, 812,
 igr2=1282,1283,
 &end
#
#   80 LEU  HA           80 LEU  HG          6.00    (#   1004:20   Unique)
 &rst
  ixpk= 1004, iat=1296,1301, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:1006    85 THR  MG2         3.50    (#   1006:20   Single Ambig)
 &rst
  ixpk= 1006, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1381,2454,2455,
 igr2=1385,1386,1387,
 &end
#
#   89 ILE  HA           89 ILE  HG1-        4.50    (#   1007:20   Unique)
 &rst
  ixpk= 1007, iat=1432,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1440,1441,
 &end
#
#   89 ILE  HA           89 ILE  MG2         3.50    (#   1008:20   Preassigned)
 &rst
  ixpk= 1008, iat=1432,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1436,1437,1438,
 &end
#
#    0 AMB  20-2:1009     0 AMB  20-1:1009   3.50    (#   1009:20   Double Ambig)
 &rst
  ixpk= 1009, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1486,1207,1208,
 igr2=1490,1491,1492,1188,1189,
 &end
#
#   94 THR  HA           94 THR  MG2         3.50    (#   1010:20   Unique)
 &rst
  ixpk= 1010, iat=1512,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1516,1517,1518,
 &end
#
#   95 GLU  HA           95 GLU  QG          3.50    (#   1011:20   Unique)
 &rst
  ixpk= 1011, iat=1526,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1531,1532,
 &end
#
#   95 GLU  HA           95 GLU  QG          3.50    (#   1012:20   Unique)
 &rst
  ixpk= 1012, iat=1526,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1531,1532,
 &end
#
#   96 VAL  HA           96 VAL  MG2         3.50    (#   1013:20   Preassigned)
 &rst
  ixpk= 1013, iat=1541,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1549,1550,1551,
 &end
#
#   96 VAL  HA           96 VAL  MG1         3.50    (#   1014:20   Unique)
 &rst
  ixpk= 1014, iat=1541,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1545,1546,1547,
 &end
#
#   99 GLU  HA            0 AMB  20-1:1015   3.50    (#   1015:20   Single Ambig)
 &rst
  ixpk= 1015, iat=1601,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2=1606,1607,1606,1607,
 &end
#
#   99 GLU  HA            0 AMB  20-1:1016   3.50    (#   1016:20   Single Ambig)
 &rst
  ixpk= 1016, iat=1601,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2=1606,1607,1606,1607,
 &end
#
#    0 AMB  20-2:1017     0 AMB  20-1:1017   3.50    (#   1017:20   Double Ambig)
 &rst
  ixpk= 1017, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1616,2722,
 igr2=1621,1622,2712,2713,
 &end
#
#    0 AMB  20-2:1018     0 AMB  20-1:1018   3.50    (#   1018:20   Double Ambig)
 &rst
  ixpk= 1018, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1616,2722,
 igr2=1621,1622,2712,2713,
 &end
#
#    0 AMB  20-2:1019   101 LEU  HG          3.50    (#   1019:20   Single Ambig)
 &rst
  ixpk= 1019, iat=  -1,1636, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1631,1577,
 &end
#
#  105 PRO  HA          105 PRO  QG          3.50    (#   1020:20   Unique)
 &rst
  ixpk= 1020, iat=1699,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1693,1694,
 &end
#
#  108 THR  HA          108 THR  MG2         3.50    (#   1021:20   Unique)
 &rst
  ixpk= 1021, iat=1727,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1731,1732,1733,
 &end
#
#  111 LEU  HA          111 LEU  HG          4.50    (#   1022:20   Unique)
 &rst
  ixpk= 1022, iat=1779,1784, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  112 ILE  HA          112 ILE  HG1+        4.50    (#   1023:20   Unique)
 &rst
  ixpk= 1023, iat=1798,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1806,1807,
 &end
#
#  112 ILE  HA          112 ILE  HG1-        4.50    (#   1024:20   Unique)
 &rst
  ixpk= 1024, iat=1798,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1806,1807,
 &end
#
#  113 ILE  HA          113 ILE  HG1+        4.50    (#   1025:20   Unique)
 &rst
  ixpk= 1025, iat=1817,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1825,1826,
 &end
#
#  113 ILE  HA          113 ILE  HG1-        4.50    (#   1026:20   Unique)
 &rst
  ixpk= 1026, iat=1817,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1825,1826,
 &end
#
#  113 ILE  HA          113 ILE  MG2         3.50    (#   1027:20   Preassigned)
 &rst
  ixpk= 1027, iat=1817,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1821,1822,1823,
 &end
#
#  114 ILE  HA          114 ILE  HG1+        4.50    (#   1028:20   Unique)
 &rst
  ixpk= 1028, iat=1836,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1844,1845,
 &end
#
#  114 ILE  HA          114 ILE  HG1-        4.50    (#   1029:20   Unique)
 &rst
  ixpk= 1029, iat=1836,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1844,1845,
 &end
#
#    0 AMB  20-2:1030     0 AMB  20-1:1030   3.50    (#   1030:20   Double Ambig)
 &rst
  ixpk= 1030, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1888,2337,  46,
 igr2=1893,1894,  77,  78,
 &end
#
#    0 AMB  20-2:1031     0 AMB  20-1:1031   3.50    (#   1031:20   Double Ambig)
 &rst
  ixpk= 1031, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1888,2337,  46,
 igr2=1893,1894,  77,  78,
 &end
#
#    0 AMB  20-2:1032   120 THR  MG2         2.70    (#   1032:20   Single Ambig)
 &rst
  ixpk= 1032, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.64, r4= 4.39,
 igr1=1913,1334,
 igr2=1917,1918,1919,
 &end
#
#    0 AMB  20-2:1033     0 AMB  20-1:1033   3.50    (#   1033:20   Double Ambig)
 &rst
  ixpk= 1033, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2158,1971,2184,1957,2623,
 igr2=2647,1979,1980,
 &end
#
#  125 ILE  HA          125 ILE  MG2         3.50    (#   1034:20   Unique)
 &rst
  ixpk= 1034, iat=1971,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1975,1976,1977,
 &end
#
#  129 LYS  HA          129 LYS  QG          4.50    (#   1035:20   Preassigned)
 &rst
  ixpk= 1035, iat=2022,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2027,2028,
 &end
#
#    0 AMB  20-2:1036     0 AMB  20-1:1036   3.50    (#   1036:20   Double Ambig)
 &rst
  ixpk= 1036, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2056,1145,1117,
 igr2=2064,2065,1150,
 &end
#
#  131 ILE  HA          131 ILE  MG2         3.50    (#   1037:20   Unique)
 &rst
  ixpk= 1037, iat=2056,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2060,2061,2062,
 &end
#
#    0 AMB  20-2:1038     0 AMB  20-1:1038   3.50    (#   1038:20   Double Ambig)
 &rst
  ixpk= 1038, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.98, r4= 6.73,
 igr1=2836, 262, 263,2075,2056,
 igr2=2886,2887, 276,2083,2084,
 &end
#
#    0 AMB  20-2:1039   132 ILE  HG1-        3.50    (#   1039:20   Single Ambig)
 &rst
  ixpk= 1039, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2075,2056,
 igr2=2083,2084,
 &end
#
#  135 ILE  HA          135 ILE  HG1+        4.50    (#   1040:20   Unique)
 &rst
  ixpk= 1040, iat=2139,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2147,2148,
 &end
#
#  135 ILE  HA          135 ILE  HG1-        4.50    (#   1041:20   Unique)
 &rst
  ixpk= 1041, iat=2139,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2147,2148,
 &end
#
#  135 ILE  HA          135 ILE  MG2         3.50    (#   1042:20   Unique)
 &rst
  ixpk= 1042, iat=2139,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2143,2144,2145,
 &end
#
#    0 AMB  20-2:1043     0 AMB  20-1:1043   3.50    (#   1043:20   Double Ambig)
 &rst
  ixpk= 1043, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=2158, 223, 224,1763,
 igr2=2166,2167, 276,2083,2084,
 &end
#
#    0 AMB  20-2:1044     0 AMB  20-1:1044   4.50    (#   1044:20   Double Ambig)
 &rst
  ixpk= 1044, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1= 223, 224,2158,
 igr2= 278, 279, 280, 282, 283, 284,2166,2167,
 &end
#
#    0 AMB  20-2:1045   136 ILE  MG2         3.50    (#   1045:20   Single Ambig)
 &rst
  ixpk= 1045, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2158,2184,
 igr2=2162,2163,2164,
 &end
#
#  138 ILE  HA          138 ILE  HG1+        3.50    (#   1046:20   Unique)
 &rst
  ixpk= 1046, iat=2184,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2192,2193,
 &end
#
#  138 ILE  HA          138 ILE  HG1-        4.50    (#   1047:20   Unique)
 &rst
  ixpk= 1047, iat=2184,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2192,2193,
 &end
#
#  138 ILE  HA          138 ILE  MG2         3.50    (#   1048:20   Unique)
 &rst
  ixpk= 1048, iat=2184,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2188,2189,2190,
 &end
#
#    0 AMB  20-2:1049     0 AMB  20-1:1049   3.50    (#   1049:20   Double Ambig)
 &rst
  ixpk= 1049, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=2024,2025,2024,2025,2210,
 igr2=2027,2028,2215,2216,
 &end
#
#  143 GLN  HA          143 GLN  HG+         3.50    (#   1051:20   Unique)
 &rst
  ixpk= 1051, iat=2269,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2274,2275,
 &end
#
#  143 GLN  HA          143 GLN  HG-         3.50    (#   1052:20   Unique)
 &rst
  ixpk= 1052, iat=2269,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2274,2275,
 &end
#
#  144 THR  HA          144 THR  MG2         3.50    (#   1053:20   Unique)
 &rst
  ixpk= 1053, iat=2286,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2290,2291,2292,
 &end
#
#    0 AMB  20-2:1054     0 AMB  20-1:1054   3.50    (#   1054:20   Double Ambig)
 &rst
  ixpk= 1054, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2865,2300,
 igr2=2928,2929,2305,2306,
 &end
#
#  145 LYS  HA          145 LYS  HG-         3.50    (#   1055:20   Unique)
 &rst
  ixpk= 1055, iat=2300,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2305,2306,
 &end
#
#    0 AMB  20-2:1056   146 GLU  HG+         3.50    (#   1056:20   Single Ambig)
 &rst
  ixpk= 1056, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2322,2339,2340,
 igr2=2327,2328,
 &end
#
#    0 AMB  20-2:1057     0 AMB  20-1:1057   3.50    (#   1057:20   Double Ambig)
 &rst
  ixpk= 1057, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2339,2340,2322,
 igr2=1893,1894,2327,2328,
 &end
#
#    0 AMB  20-2:1058     0 AMB  20-1:1058   3.50    (#   1058:20   Double Ambig)
 &rst
  ixpk= 1058, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.47, r4= 7.22,
 igr1=3020,2348,2722,2269,1616,
 igr2=3025,3026,2353,2354,2712,2713,1606,1607,
 &end
#
#  149 GLU  HA          149 GLU  HG+         3.50    (#   1059:20   Unique)
 &rst
  ixpk= 1059, iat=2365,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2370,2371,
 &end
#
#  149 GLU  HA          149 GLU  HG+         3.50    (#   1060:20   Unique)
 &rst
  ixpk= 1060, iat=2365,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2370,2371,
 &end
#
#  153 LYS  HA          153 LYS  HG+         3.50    (#   1061:20   Preassigned)
 &rst
  ixpk= 1061, iat=2430,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2435,2436,
 &end
#
#    0 AMB  20-2:1063     0 AMB  20-1:1063   3.50    (#   1063:20   Double Ambig)
 &rst
  ixpk= 1063, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=3020,2348,2269,
 igr2=3025,3026,2353,2354,
 &end
#
#  165 ILE  HA          165 ILE  MG2         3.50    (#   1065:20   Unique)
 &rst
  ixpk= 1065, iat=2623,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2627,2628,2629,
 &end
#
#  170 GLU  HA          170 GLU  HG+         3.50    (#   1067:20   Unique)
 &rst
  ixpk= 1067, iat=2707,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2712,2713,
 &end
#
#  170 GLU  HA          170 GLU  HG-         3.50    (#   1068:20   Unique)
 &rst
  ixpk= 1068, iat=2707,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2712,2713,
 &end
#
#    0 AMB  20-2:1069     0 AMB  20-1:1069   3.50    (#   1069:20   Double Ambig)
 &rst
  ixpk= 1069, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.47, r4= 7.22,
 igr1=  46, 628,2203,2204,2382,
 igr2=  54,  55,1083,1084,2218,2219,2438,2439,
 &end
#
#  172 LEU  HA          172 LEU  HG          4.50    (#   1070:20   Unique)
 &rst
  ixpk= 1070, iat=2744,2749, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1071   173 LYS  QG          3.50    (#   1071:20   Single Ambig)
 &rst
  ixpk= 1071, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2763,2722,
 igr2=2768,2769,
 &end
#
#  175 LEU  HA          175 LEU  HG          4.50    (#   1072:20   Preassigned)
 &rst
  ixpk= 1072, iat=2797,2802, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1073     0 AMB  20-1:1073   3.50    (#   1073:20   Double Ambig)
 &rst
  ixpk= 1073, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=3020,2348,2850,
 igr2=3025,3026,3025,3026,2353,2354,2353,2354,2855,2856,
      
 &end
#
#    0 AMB  20-2:1074     0 AMB  20-1:1074   3.50    (#   1074:20   Double Ambig)
 &rst
  ixpk= 1074, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2348,2850,
 igr2=2353,2354,2855,2856,
 &end
#
#    0 AMB  20-2:1075     0 AMB  20-1:1075   3.50    (#   1075:20   Double Ambig)
 &rst
  ixpk= 1075, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2865,1117,
 igr2=2870,1169,
 &end
#
#  180 GLN  HA          180 GLN  QG          3.50    (#   1076:20   Unique)
 &rst
  ixpk= 1076, iat=2884,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2889,2890,
 &end
#
#  183 ILE  HA            0 AMB  20-1:1077   3.50    (#   1077:20   Single Ambig)
 &rst
  ixpk= 1077, iat=2945,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2=2953,2954,2931,2932,
 &end
#
#    0 AMB  20-2:1078   185 VAL  MGX         3.50    (#   1078:20   Single Ambig)
 &rst
  ixpk= 1078, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2985,3001,
 igr2=2989,2990,2991,2993,2994,2995,
 &end
#
#    0 AMB  20-2:1080     0 AMB  20-1:1080   3.50    (#   1080:20   Double Ambig)
 &rst
  ixpk= 1080, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=3001,3020,2484,2485,
 igr2=3005,3006,3007,2079,2080,2081,
 &end
#
#    0 AMB  20-2:1081    26 LYS  HA          4.50    (#   1081:20   Single Ambig)
 &rst
  ixpk= 1081, iat=  -1, 385, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 396, 397,2690,
 &end
#
#    0 AMB  20-2:1082    32 LYS  HA          4.50    (#   1082:20   Single Ambig)
 &rst
  ixpk= 1082, iat=  -1, 496, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 507, 508, 477,
 &end
#
#   37 LYS  QE           37 LYS  HA          6.00    (#   1083:20   Unique)
 &rst
  ixpk= 1083, iat=  -1, 587, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 598, 599,
 &end
#
#    0 AMB  20-2:1084     0 AMB  20-1:1084   4.50    (#   1084:20   Double Ambig)
 &rst
  ixpk= 1084, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 951, 952, 951, 952, 877, 878,1086,1087, 719,
 igr2= 699, 866,
 &end
#
#  145 LYS  QE          145 LYS  HA          4.50    (#   1087:20   Unique)
 &rst
  ixpk= 1087, iat=  -1,2300, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2311,2312,
 &end
#
#    0 AMB  20-2:1089     0 AMB  20-1:1089   6.00    (#   1089:20   Double Ambig)
 &rst
  ixpk= 1089, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.97, r4=10.72,
 igr1=2441,2442, 530, 576, 577,2454,2455,
 igr2=2430, 518,1123,
 &end
#
#    0 AMB  20-2:1090   173 LYS  HA          3.50    (#   1090:20   Single Ambig)
 &rst
  ixpk= 1090, iat=  -1,2763, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2774,2775,2818,2819,
 &end
#
#    0 AMB  20-2:1091   173 LYS  HA          3.50    (#   1091:20   Single Ambig)
 &rst
  ixpk= 1091, iat=  -1,2763, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2774,2775,2818,2819,
 &end
#
#   74 LYS  QE           74 LYS  HA          6.00    (#   1092:20   Unique)
 &rst
  ixpk= 1092, iat=  -1,1183, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1194,1195,
 &end
#
#    0 AMB  20-2:1093     0 AMB  20-1:1093   3.50    (#   1093:20   Double Ambig)
 &rst
  ixpk= 1093, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=  46,2797,
 igr2=  57,  58,2612,2613,
 &end
#
#    0 AMB  20-2:1094     0 AMB  20-1:1094   3.50    (#   1094:20   Double Ambig)
 &rst
  ixpk= 1094, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2707,2430,2482,2529,
 igr2= 396, 397,2504,2505,
 &end
#
#   32 LYS  HA           32 LYS  QE          4.50    (#   1096:20   Unique)
 &rst
  ixpk= 1096, iat= 496,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 507, 508,
 &end
#
#    0 AMB  20-2:1097    36 LYS  HE+         6.00    (#   1097:20   Single Ambig)
 &rst
  ixpk= 1097, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.49, r4= 9.24,
 igr1=1108,1109,1108,1109,
 igr2= 576, 577,
 &end
#
#    0 AMB  20-2:1098     0 AMB  20-1:1098   4.50    (#   1098:20   Double Ambig)
 &rst
  ixpk= 1098, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1135,1108,1109,1108,1109,
 igr2=1194,1195, 576, 577,
 &end
#
#    0 AMB  20-2:1099     0 AMB  20-1:1099   4.50    (#   1099:20   Double Ambig)
 &rst
  ixpk= 1099, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2850, 518,2923,
 igr2=2912,2913, 598, 599,
 &end
#
#    0 AMB  20-2:1100     0 AMB  20-1:1100   4.50    (#   1100:20   Double Ambig)
 &rst
  ixpk= 1100, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=1108,1109,2901, 587,
 igr2= 576, 577,2912,2913, 598, 599,
 &end
#
#    0 AMB  20-2:1101     0 AMB  20-1:1101   4.50    (#   1101:20   Double Ambig)
 &rst
  ixpk= 1101, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1=2565, 866, 699,
 igr2=2120, 877, 878,1086,1087,
 &end
#
#    0 AMB  20-2:1102     0 AMB  20-1:1102   3.50    (#   1102:20   Double Ambig)
 &rst
  ixpk= 1102, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 971, 972,1108,1109,1029,1135,
 igr2=1040,1041,1099,1100,
 &end
#
#    0 AMB  20-2:1103    65 LYS  HE-         3.50    (#   1103:20   Single Ambig)
 &rst
  ixpk= 1103, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 971, 972,1029,
 igr2=1040,1041,
 &end
#
#    0 AMB  20-2:1104     0 AMB  20-1:1104   3.50    (#   1104:20   Double Ambig)
 &rst
  ixpk= 1104, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2493,2601,
 igr2=2504,2505,2612,2613,
 &end
#
#    0 AMB  20-2:1105     0 AMB  20-1:1105   3.50    (#   1105:20   Double Ambig)
 &rst
  ixpk= 1105, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.47, r4= 7.22,
 igr1=2601,2675,2523,1238,
 igr2=2612,2613,2221,2222,2504,2505,1249,1250,2733,2734,
      
 &end
#
#    0 AMB  20-2:1107     0 AMB  20-1:1107   3.50    (#   1107:20   Double Ambig)
 &rst
  ixpk= 1107, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2024,2025,2024,2025,  68,  69,
 igr2=2033,2034,  57,  58,
 &end
#
#  153 LYS  HA          153 LYS  HE+         6.00    (#   1110:20   Preassigned)
 &rst
  ixpk= 1110, iat=2430,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=2441,2442,
 &end
#
#    0 AMB  20-2:1111     0 AMB  20-1:1111   3.50    (#   1111:20   Double Ambig)
 &rst
  ixpk= 1111, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2380,2002,
 igr2=2441,2442,2033,2034,
 &end
#
#    0 AMB  20-2:1112     0 AMB  20-1:1112   4.50    (#   1112:20   Double Ambig)
 &rst
  ixpk= 1112, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2722,2550,
 igr2=2733,2734,2612,2613,
 &end
#
#   39 SER  HA           67 LYS  QE          6.00    (#   1113:20   Unique)
 &rst
  ixpk= 1113, iat= 628,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1086,1087,
 &end
#
#    0 AMB  20-2:1114     0 AMB  20-1:1114   3.50    (#   1114:20   Double Ambig)
 &rst
  ixpk= 1114, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1=1135,1108,1109,2865,
 igr2=1194,1195, 576, 577, 576, 577,2934,2935,
 &end
#
#    0 AMB  20-2:1115     0 AMB  20-1:1115   4.50    (#   1115:20   Double Ambig)
 &rst
  ixpk= 1115, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=  44,  66, 235,
 igr2=  35, 809,
 &end
#
#    6 ASN  HN            5 GLY  HA+         3.50    (#   1117:20   Unique)
 &rst
  ixpk= 1117, iat=  73,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  68,  69,
 &end
#
#    0 AMB  20-2:1118     0 AMB  20-1:1118   3.50    (#   1118:20   Double Ambig)
 &rst
  ixpk= 1118, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=  73,2201,
 igr2=  68,  69,2203,2204,
 &end
#
#    8 ASP  HN            7 VAL  HA          3.50    (#   1119:20   Unique)
 &rst
  ixpk= 1119, iat= 103,  89, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   10 VAL  HN            9 LEU  HA          3.50    (#   1121:20   Unique)
 &rst
  ixpk= 1121, iat= 134, 117, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   11 PHE  HN           10 VAL  HA          3.50    (#   1122:20   Unique)
 &rst
  ixpk= 1122, iat= 150, 136, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   12 LEU  HN           11 PHE  HA          3.50    (#   1123:20   Unique)
 &rst
  ixpk= 1123, iat= 170, 152, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1124    12 LEU  HA          3.50    (#   1124:20   Single Ambig)
 &rst
  ixpk= 1124, iat=  -1, 172, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 189, 754,
 &end
#
#   14 ASP  HN           13 PHE  HA          3.50    (#   1125:20   Unique)
 &rst
  ixpk= 1125, iat= 209, 191, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   16 SER  HN           15 GLY  HA+         6.00    (#   1126:20   Unique)
 &rst
  ixpk= 1126, iat= 228,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2= 223, 224,
 &end
#
#   16 SER  HN           15 GLY  HA-         6.00    (#   1127:20   Unique)
 &rst
  ixpk= 1127, iat= 228,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2= 223, 224,
 &end
#
#   17 MET  HN           16 SER  HA          3.50    (#   1128:20   Unique)
 &rst
  ixpk= 1128, iat= 239, 230, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1129     0 AMB  20-1:1129   3.50    (#   1129:20   Double Ambig)
 &rst
  ixpk= 1129, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 258,1162, 300, 301, 269,1181, 923, 931,1313,
 igr2= 241,1145,
 &end
#
#    0 AMB  20-2:1130     0 AMB  20-1:1130   3.50    (#   1130:20   Double Ambig)
 &rst
  ixpk= 1130, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1313, 258, 300, 301, 269,
 igr2= 230, 260,
 &end
#
#   22 ASP  HN           21 PRO  HA          6.00    (#   1132:20   Unique)
 &rst
  ixpk= 1132, iat= 319, 315, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:1133    22 ASP  HA          3.50    (#   1133:20   Single Ambig)
 &rst
  ixpk= 1133, iat=  -1, 321, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 331, 378, 379,
 &end
#
#    0 AMB  20-2:1134    23 GLU  HA          4.50    (#   1134:20   Single Ambig)
 &rst
  ixpk= 1134, iat=  -1, 333, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 346, 366,
 &end
#
#    0 AMB  20-2:1135     0 AMB  20-1:1135   3.50    (#   1135:20   Double Ambig)
 &rst
  ixpk= 1135, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2795, 383, 405,
 igr2=2744, 368,
 &end
#
#    0 AMB  20-2:1136    27 ILE  HA          4.50    (#   1136:20   Single Ambig)
 &rst
  ixpk= 1136, iat=  -1, 407, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1= 424, 463, 471,2693,2701,
 &end
#
#   29 ASP  HN           28 LEU  HA          4.50    (#   1137:20   Unique)
 &rst
  ixpk= 1137, iat= 443, 426, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1138     0 AMB  20-1:1138   3.50    (#   1138:20   Double Ambig)
 &rst
  ixpk= 1138, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1121, 455, 494,1143,
 igr2=1123, 445,
 &end
#
#    0 AMB  20-2:1139    30 PHE  HA          3.50    (#   1139:20   Single Ambig)
 &rst
  ixpk= 1139, iat=  -1, 457, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 463, 471, 475,
 &end
#
#   33 ASP  HN           32 LYS  HA          4.50    (#   1140:20   Unique)
 &rst
  ixpk= 1140, iat= 516, 496, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1141     0 AMB  20-1:1141   3.50    (#   1141:20   Double Ambig)
 &rst
  ixpk= 1141, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 528,2411, 494,
 igr2= 518,2430,
 &end
#
#   35 MET  HN           34 VAL  HA          4.50    (#   1142:20   Unique)
 &rst
  ixpk= 1142, iat= 544, 530, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   36 LYS  HN           35 MET  HA          4.50    (#   1143:20   Unique)
 &rst
  ixpk= 1143, iat= 563, 546, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   37 LYS  HN           36 LYS  HA          3.50    (#   1144:20   Unique)
 &rst
  ixpk= 1144, iat= 585, 565, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1145     0 AMB  20-1:1145   3.50    (#   1145:20   Double Ambig)
 &rst
  ixpk= 1145, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2279,2280, 607,
 igr2=2210, 587,
 &end
#
#   39 SER  HN           38 LEU  HA          3.50    (#   1146:20   Unique)
 &rst
  ixpk= 1146, iat= 626, 609, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   40 ASN  HN           39 SER  HA          3.50    (#   1147:20   Unique)
 &rst
  ixpk= 1147, iat= 637, 628, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   41 THR  HN           40 ASN  HA          4.50    (#   1148:20   Unique)
 &rst
  ixpk= 1148, iat= 651, 639, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   44 GLN  HN           43 TYR  HA          3.50    (#   1150:20   Unique)
 &rst
  ixpk= 1150, iat= 697, 678, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   45 PHE  HN           44 GLN  HA          3.50    (#   1151:20   Unique)
 &rst
  ixpk= 1151, iat= 714, 699, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   46 ALA  HN           45 PHE  HA          3.50    (#   1152:20   Unique)
 &rst
  ixpk= 1152, iat= 734, 716, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   47 ALA  HN           46 ALA  HA          3.50    (#   1153:20   Unique)
 &rst
  ixpk= 1153, iat= 744, 736, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   49 GLN  HN           48 VAL  HA          3.50    (#   1154:20   Unique)
 &rst
  ixpk= 1154, iat= 770, 756, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   50 PHE  HN           49 GLN  HA          3.50    (#   1155:20   Unique)
 &rst
  ixpk= 1155, iat= 787, 772, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   51 SER  HN           50 PHE  HA          3.50    (#   1156:20   Unique)
 &rst
  ixpk= 1156, iat= 807, 789, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   53 SER  HN           52 THR  HA          6.00    (#   1158:20   Unique)
 &rst
  ixpk= 1158, iat= 832, 820, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:1159    53 SER  HA          3.50    (#   1159:20   Single Ambig)
 &rst
  ixpk= 1159, iat=  -1, 834, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 843,1374,1375,
 &end
#
#   55 LYS  HN           54 TYR  HA          3.50    (#   1160:20   Unique)
 &rst
  ixpk= 1160, iat= 864, 845, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   56 THR  HN           55 LYS  HA          3.50    (#   1161:20   Unique)
 &rst
  ixpk= 1161, iat= 886, 866, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1162    56 THR  HA          3.50    (#   1162:20   Single Ambig)
 &rst
  ixpk= 1162, iat=  -1, 888, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 900, 886,
 &end
#
#    0 AMB  20-2:1163    57 GLU  HA          3.50    (#   1163:20   Single Ambig)
 &rst
  ixpk= 1163, iat=  -1, 902, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 915, 782, 783,
 &end
#
#   59 ASP  HN           58 PHE  HA          3.50    (#   1164:20   Unique)
 &rst
  ixpk= 1164, iat= 935, 917, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1165    60 PHE  HA          3.50    (#   1165:20   Single Ambig)
 &rst
  ixpk= 1165, iat=  -1, 949, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 967,1011,
 &end
#
#    0 AMB  20-2:1166    61 SER  HA          3.50    (#   1166:20   Single Ambig)
 &rst
  ixpk= 1166, iat=  -1, 969, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 967,1011,
 &end
#
#   63 TYR  HN           62 ASP  HA          4.50    (#   1167:20   Unique)
 &rst
  ixpk= 1167, iat= 990, 980, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   64 VAL  HN           63 TYR  HA          4.50    (#   1168:20   Unique)
 &rst
  ixpk= 1168, iat=1011, 992, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   65 LYS  HN           64 VAL  HA          3.50    (#   1169:20   Unique)
 &rst
  ixpk= 1169, iat=1027,1013, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   66 TRP  HN           65 LYS  HA          3.50    (#   1170:20   Unique)
 &rst
  ixpk= 1170, iat=1049,1029, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1171     0 AMB  20-1:1171   3.50    (#   1171:20   Double Ambig)
 &rst
  ixpk= 1171, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 665,1073,
 igr2= 667,1051,
 &end
#
#    0 AMB  20-2:1172     0 AMB  20-1:1172   3.50    (#   1172:20   Double Ambig)
 &rst
  ixpk= 1172, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1095, 331,
 igr2=1075, 333,
 &end
#
#    0 AMB  20-2:1173    69 PRO  HA          3.50    (#   1173:20   Single Ambig)
 &rst
  ixpk= 1173, iat=  -1,1117, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1143,1121,
 &end
#
#    0 AMB  20-2:1174     0 AMB  20-1:1174   3.50    (#   1174:20   Double Ambig)
 &rst
  ixpk= 1174, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1133, 424,
 igr2=1123, 445,
 &end
#
#   72 LEU  HN           71 ALA  HA          3.50    (#   1175:20   Unique)
 &rst
  ixpk= 1175, iat=1143,1135, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1176     0 AMB  20-1:1176   3.50    (#   1176:20   Double Ambig)
 &rst
  ixpk= 1176, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 258,1162, 300, 301, 269,1181,
 igr2= 241,1145,
 &end
#
#   77 LYS  HN           76 VAL  HA          3.50    (#   1178:20   Unique)
 &rst
  ixpk= 1178, iat=1236,1222, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   78 HIS  HN           77 LYS  HA          3.50    (#   1179:20   Unique)
 &rst
  ixpk= 1179, iat=1258,1238, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   79 MET  HN           78 HIS  HA          3.50    (#   1180:20   Unique)
 &rst
  ixpk= 1180, iat=1275,1260, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   80 LEU  HN           79 MET  HA          3.50    (#   1181:20   Unique)
 &rst
  ixpk= 1181, iat=1294,1277, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   81 LEU  HN           80 LEU  HA          3.50    (#   1182:20   Unique)
 &rst
  ixpk= 1182, iat=1313,1296, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   82 LEU  HN           81 LEU  HA          4.50    (#   1183:20   Unique)
 &rst
  ixpk= 1183, iat=1332,1315, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   83 THR  HN           82 LEU  HA          3.50    (#   1184:20   Unique)
 &rst
  ixpk= 1184, iat=1351,1334, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   85 THR  HN            0 AMB  20-1:1185   3.50    (#   1185:20   Single Ambig)
 &rst
  ixpk= 1185, iat=1379,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1903,1367,
 &end
#
#   86 PHE  HN           85 THR  HA          6.00    (#   1186:20   Unique)
 &rst
  ixpk= 1186, iat=1393,1381, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   87 GLY  HN           86 PHE  HA          4.50    (#   1187:20   Unique)
 &rst
  ixpk= 1187, iat=1413,1395, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   88 ALA  HN           87 GLY  HA+         4.50    (#   1188:20   Unique)
 &rst
  ixpk= 1188, iat=1420,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1415,1416,
 &end
#
#   88 ALA  HN           87 GLY  HA-         3.50    (#   1189:20   Unique)
 &rst
  ixpk= 1189, iat=1420,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1415,1416,
 &end
#
#   90 ASN  HN           89 ILE  HA          4.50    (#   1190:20   Unique)
 &rst
  ixpk= 1190, iat=1449,1432, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1191    90 ASN  HA          3.50    (#   1191:20   Single Ambig)
 &rst
  ixpk= 1191, iat=  -1,1451, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1458,1459,1510,
 &end
#
#   94 THR  HN           93 ALA  HA          4.50    (#   1192:20   Unique)
 &rst
  ixpk= 1192, iat=1510,1502, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   95 GLU  HN           94 THR  HA          4.50    (#   1193:20   Unique)
 &rst
  ixpk= 1193, iat=1524,1512, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1194    95 GLU  HA          3.50    (#   1194:20   Single Ambig)
 &rst
  ixpk= 1194, iat=  -1,1526, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1539,1555,
 &end
#
#    0 AMB  20-2:1195    96 VAL  HA          3.50    (#   1195:20   Single Ambig)
 &rst
  ixpk= 1195, iat=  -1,1541, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1539,1555,
 &end
#
#    0 AMB  20-2:1196     0 AMB  20-1:1196   3.50    (#   1196:20   Double Ambig)
 &rst
  ixpk= 1196, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1575,3033,
 igr2=1557,2964,
 &end
#
#  101 LEU  HN          100 GLU  HA          3.50    (#   1197:20   Unique)
 &rst
  ixpk= 1197, iat=1629,1616, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  102 GLY  HN          101 LEU  HA          4.50    (#   1198:20   Unique)
 &rst
  ixpk= 1198, iat=1648,1631, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1199     0 AMB  20-1:1199   4.50    (#   1199:20   Double Ambig)
 &rst
  ixpk= 1199, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.14, r4= 7.89,
 igr1=2279,2280,2247,1655,
 igr2=2203,2204,1650,1651,
 &end
#
#  103 ALA  HN          102 GLY  HA-         4.50    (#   1200:20   Unique)
 &rst
  ixpk= 1200, iat=1655,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1650,1651,
 &end
#
#  104 ARG  HN          103 ALA  HA          3.50    (#   1201:20   Unique)
 &rst
  ixpk= 1201, iat=1665,1657, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  106 ASP  HN          105 PRO  HA          3.50    (#   1202:20   Unique)
 &rst
  ixpk= 1202, iat=1703,1699, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1203     0 AMB  20-1:1203   3.50    (#   1203:20   Double Ambig)
 &rst
  ixpk= 1203, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1715,2563,
 igr2=1705,2493,
 &end
#
#  108 THR  HN          107 ALA  HA          3.50    (#   1204:20   Unique)
 &rst
  ixpk= 1204, iat=1725,1717, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  109 LYS  HN          108 THR  HA          3.50    (#   1205:20   Unique)
 &rst
  ixpk= 1205, iat=1739,1727, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  111 LEU  HN          110 VAL  HA          3.50    (#   1207:20   Unique)
 &rst
  ixpk= 1207, iat=1777,1763, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  113 ILE  HN          112 ILE  HA          3.50    (#   1208:20   Unique)
 &rst
  ixpk= 1208, iat=1815,1798, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  114 ILE  HN          113 ILE  HA          3.50    (#   1209:20   Unique)
 &rst
  ixpk= 1209, iat=1834,1817, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1210   114 ILE  HA          3.50    (#   1210:20   Single Ambig)
 &rst
  ixpk= 1210, iat=  -1,1836, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1853,2156,
 &end
#
#  116 ASP  HN          115 THR  HA          4.50    (#   1211:20   Unique)
 &rst
  ixpk= 1211, iat=1867,1855, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  117 GLY  HN          116 ASP  HA          4.50    (#   1212:20   Unique)
 &rst
  ixpk= 1212, iat=1879,1869, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  118 GLU  HN          117 GLY  HA+         3.50    (#   1213:20   Unique)
 &rst
  ixpk= 1213, iat=1886,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1881,1882,
 &end
#
#  118 GLU  HN          117 GLY  HA-         3.50    (#   1214:20   Unique)
 &rst
  ixpk= 1214, iat=1886,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1881,1882,
 &end
#
#    0 AMB  20-2:1215     0 AMB  20-1:1215   2.70    (#   1215:20   Double Ambig)
 &rst
  ixpk= 1215, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.64, r4= 4.39,
 igr1=1901,  66,  44,
 igr2=1888,  46,
 &end
#
#  120 THR  HN          119 ALA  HA          3.50    (#   1216:20   Unique)
 &rst
  ixpk= 1216, iat=1911,1903, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  121 ASP  HN          120 THR  HA          4.50    (#   1217:20   Unique)
 &rst
  ixpk= 1217, iat=1925,1913, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  122 SER  HN          121 ASP  HA          3.50    (#   1218:20   Unique)
 &rst
  ixpk= 1218, iat=1937,1927, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  123 GLY  HN          122 SER  HA          3.50    (#   1219:20   Unique)
 &rst
  ixpk= 1219, iat=1948,1939, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  124 ASN  HN          123 GLY  HA+         3.50    (#   1220:20   Unique)
 &rst
  ixpk= 1220, iat=1955,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1950,1951,
 &end
#
#  124 ASN  HN          123 GLY  HA-         3.50    (#   1221:20   Unique)
 &rst
  ixpk= 1221, iat=1955,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1950,1951,
 &end
#
#    0 AMB  20-2:1222   124 ASN  HA          3.50    (#   1222:20   Single Ambig)
 &rst
  ixpk= 1222, iat=  -1,1957, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1969,1988,
 &end
#
#    0 AMB  20-2:1223     0 AMB  20-1:1223   3.50    (#   1223:20   Double Ambig)
 &rst
  ixpk= 1223, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2640,1969,1988,2000,
 igr2=2184,1971,
 &end
#
#    0 AMB  20-2:1224     0 AMB  20-1:1224   3.50    (#   1224:20   Double Ambig)
 &rst
  ixpk= 1224, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2000,1969,
 igr2=1990,1451,
 &end
#
#  128 ALA  HN          127 ALA  HA          3.50    (#   1225:20   Unique)
 &rst
  ixpk= 1225, iat=2010,2002, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  129 LYS  HN          128 ALA  HA          3.50    (#   1226:20   Unique)
 &rst
  ixpk= 1226, iat=2020,2012, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  130 ASP  HN          129 LYS  HA          4.50    (#   1227:20   Unique)
 &rst
  ixpk= 1227, iat=2042,2022, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1228     0 AMB  20-1:1228   3.50    (#   1228:20   Double Ambig)
 &rst
  ixpk= 1228, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.53, r4= 7.28,
 igr1= 607,2054, 782, 783,1655,  82,  83,
 igr2= 609,2044,1238,1577,1631,1667,
 &end
#
#  132 ILE  HN          131 ILE  HA          3.50    (#   1229:20   Unique)
 &rst
  ixpk= 1229, iat=2073,2056, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1230     0 AMB  20-1:1230   3.50    (#   1230:20   Double Ambig)
 &rst
  ixpk= 1230, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2092, 832,
 igr2=2075, 811, 812,
 &end
#
#  134 TYR  HN          133 ARG  HA          3.50    (#   1231:20   Unique)
 &rst
  ixpk= 1231, iat=2116,2094, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  135 ILE  HN          134 TYR  HA          3.50    (#   1232:20   Unique)
 &rst
  ixpk= 1232, iat=2137,2118, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  136 ILE  HN          135 ILE  HA          3.50    (#   1233:20   Unique)
 &rst
  ixpk= 1233, iat=2156,2139, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1234     0 AMB  20-1:1234   3.50    (#   1234:20   Double Ambig)
 &rst
  ixpk= 1234, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 770,2175,
 igr2= 756,2158,
 &end
#
#  138 ILE  HN          137 GLY  HA+         3.50    (#   1235:20   Unique)
 &rst
  ixpk= 1235, iat=2182,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2177,2178,
 &end
#
#  138 ILE  HN          137 GLY  HA-         3.50    (#   1236:20   Unique)
 &rst
  ixpk= 1236, iat=2182,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2177,2178,
 &end
#
#  139 GLY  HN          138 ILE  HA          3.50    (#   1237:20   Unique)
 &rst
  ixpk= 1237, iat=2201,2184, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  140 LYS  HN          139 GLY  HA+         3.50    (#   1238:20   Unique)
 &rst
  ixpk= 1238, iat=2208,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2203,2204,
 &end
#
#  140 LYS  HN          139 GLY  HA-         3.50    (#   1239:20   Unique)
 &rst
  ixpk= 1239, iat=2208,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2203,2204,
 &end
#
#  141 HIS  HN          140 LYS  HA          4.50    (#   1240:20   Unique)
 &rst
  ixpk= 1240, iat=2230,2210, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1241   141 HIS  HA          3.50    (#   1241:20   Single Ambig)
 &rst
  ixpk= 1241, iat=  -1,2232, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2279,2280,2247,
 &end
#
#  143 GLN  HN          142 PHE  HA          3.50    (#   1242:20   Unique)
 &rst
  ixpk= 1242, iat=2267,2249, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1243     0 AMB  20-1:1243   3.50    (#   1243:20   Double Ambig)
 &rst
  ixpk= 1243, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2284,2863,2010,
 igr2=2269,2850,1451,
 &end
#
#  145 LYS  HN          144 THR  HA          4.50    (#   1244:20   Unique)
 &rst
  ixpk= 1244, iat=2298,2286, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  146 GLU  HN          145 LYS  HA          4.50    (#   1245:20   Unique)
 &rst
  ixpk= 1245, iat=2320,2300, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1246   146 GLU  HA          3.50    (#   1246:20   Single Ambig)
 &rst
  ixpk= 1246, iat=  -1,2322, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2363,2335,
 &end
#
#    0 AMB  20-2:1247   149 GLU  HA          4.50    (#   1247:20   Single Ambig)
 &rst
  ixpk= 1247, iat=  -1,2365, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2378,2428,2346,
 &end
#
#    0 AMB  20-2:1248     0 AMB  20-1:1248   3.50    (#   1248:20   Double Ambig)
 &rst
  ixpk= 1248, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2411,1268, 346,
 igr2=2394, 271,
 &end
#
#    0 AMB  20-2:1249     0 AMB  20-1:1249   3.50    (#   1249:20   Double Ambig)
 &rst
  ixpk= 1249, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2279,2280,2848,2428,
 igr2=2210,2850,2269,2413,
 &end
#
#    0 AMB  20-2:1250     0 AMB  20-1:1250   3.50    (#   1250:20   Double Ambig)
 &rst
  ixpk= 1250, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2450,2824,2828,2826,2822,2830,
 igr2=2430, 518,
 &end
#
#    0 AMB  20-2:1251   154 PHE  HA          3.50    (#   1251:20   Single Ambig)
 &rst
  ixpk= 1251, iat=  -1,2452, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2450,2470,
 &end
#
#  156 SER  HN          155 ALA  HA          3.50    (#   1252:20   Unique)
 &rst
  ixpk= 1252, iat=2480,2472, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  159 ALA  HN          158 PRO  HA          6.00    (#   1253:20   Unique)
 &rst
  ixpk= 1253, iat=2527,2523, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:1255     0 AMB  20-1:1255   3.50    (#   1255:20   Double Ambig)
 &rst
  ixpk= 1255, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2548,2583,2378,
 igr2=2539,2322,
 &end
#
#    0 AMB  20-2:1256     0 AMB  20-1:1256   4.50    (#   1256:20   Double Ambig)
 &rst
  ixpk= 1256, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2563,2899,
 igr2=2550,2923,
 &end
#
#  166 LEU  HN          165 ILE  HA          3.50    (#   1258:20   Unique)
 &rst
  ixpk= 1258, iat=2640,2623, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1259   166 LEU  HA          3.50    (#   1259:20   Single Ambig)
 &rst
  ixpk= 1259, iat=  -1,2642, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2659,2640,
 &end
#
#    0 AMB  20-2:1260     0 AMB  20-1:1260   3.50    (#   1260:20   Double Ambig)
 &rst
  ixpk= 1260, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2697,2671,2695,2699,2257,2261,
 igr2= 271,2661,2394,
 &end
#
#    0 AMB  20-2:1262   169 PHE  HA          3.50    (#   1262:20   Single Ambig)
 &rst
  ixpk= 1262, iat=  -1,2687, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2685,2705,
 &end
#
#  171 LYS  HN          170 GLU  HA          3.50    (#   1263:20   Unique)
 &rst
  ixpk= 1263, iat=2720,2707, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1265   174 ASP  HA          3.50    (#   1265:20   Single Ambig)
 &rst
  ixpk= 1265, iat=  -1,2785, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2795,2848,
 &end
#
#  178 GLU  HN          177 THR  HA          4.50    (#   1266:20   Unique)
 &rst
  ixpk= 1266, iat=2848,2836, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1267     0 AMB  20-1:1267   3.50    (#   1267:20   Double Ambig)
 &rst
  ixpk= 1267, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=2335,2999,2962,1648,
 igr2=2339,2340,2945, 971, 972,
 &end
#
#  186 ILE  HN          185 VAL  HA          3.50    (#   1268:20   Preassigned)
 &rst
  ixpk= 1268, iat=2999,2985, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1269     6 ASN  HB+         3.50    (#   1269:20   Single Ambig)
 &rst
  ixpk= 1269, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=  73,1725,
 igr2=  77,  78,
 &end
#
#    0 AMB  20-2:1270     6 ASN  HB-         4.50    (#   1270:20   Single Ambig)
 &rst
  ixpk= 1270, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=  73,1725,
 igr2=  77,  78,
 &end
#
#    0 AMB  20-2:1271     8 ASP  HB3         4.50    (#   1271:20   Single Ambig)
 &rst
  ixpk= 1271, iat=  -1, 108, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 103, 115,
 &end
#
#    9 LEU  HN            9 LEU  HB3         4.50    (#   1272:20   Unique)
 &rst
  ixpk= 1272, iat= 115, 120, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    9 LEU  HN            9 LEU  HB2         4.50    (#   1273:20   Unique)
 &rst
  ixpk= 1273, iat= 115, 119, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1274    10 VAL  HB          3.50    (#   1274:20   Single Ambig)
 &rst
  ixpk= 1274, iat=  -1, 138, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 134,1796,
 &end
#
#   11 PHE  HN           11 PHE  QB          3.50    (#   1275:20   Unique)
 &rst
  ixpk= 1275, iat= 150,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 154, 155,
 &end
#
#   12 LEU  HN           12 LEU  HB3         4.50    (#   1276:20   Unique)
 &rst
  ixpk= 1276, iat= 170, 175, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   12 LEU  HN           12 LEU  HB2         4.50    (#   1277:20   Unique)
 &rst
  ixpk= 1277, iat= 170, 174, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   13 PHE  HN            0 AMB  20-1:1278   4.50    (#   1278:20   Single Ambig)
 &rst
  ixpk= 1278, iat= 189,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr2= 193, 194, 193, 194,
 &end
#
#   14 ASP  HN            0 AMB  20-1:1279   4.50    (#   1279:20   Single Ambig)
 &rst
  ixpk= 1279, iat= 209,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr2= 213, 214, 213, 214,
 &end
#
#   14 ASP  HN            0 AMB  20-1:1280   3.50    (#   1280:20   Single Ambig)
 &rst
  ixpk= 1280, iat= 209,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 213, 214, 213, 214,
 &end
#
#   16 SER  HN           16 SER  QB          6.00    (#   1281:20   Unique)
 &rst
  ixpk= 1281, iat= 228,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2= 232, 233,
 &end
#
#   17 MET  HN           17 MET  HB+         3.50    (#   1282:20   Unique)
 &rst
  ixpk= 1282, iat= 239,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 243, 244,
 &end
#
#   17 MET  HN           17 MET  HB-         3.50    (#   1283:20   Unique)
 &rst
  ixpk= 1283, iat= 239,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 243, 244,
 &end
#
#    0 AMB  20-2:1284    18 SER  HB-         3.50    (#   1284:20   Single Ambig)
 &rst
  ixpk= 1284, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 269, 258,2243,
 igr2= 262, 263,
 &end
#
#    0 AMB  20-2:1285    19 LEU  HB+         3.50    (#   1285:20   Single Ambig)
 &rst
  ixpk= 1285, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 269, 354, 362,
 igr2= 273, 274,
 &end
#
#    0 AMB  20-2:1286    19 LEU  HB-         3.50    (#   1286:20   Single Ambig)
 &rst
  ixpk= 1286, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 269, 354, 362,
 igr2= 273, 274,
 &end
#
#    0 AMB  20-2:1287     0 AMB  20-1:1287   3.50    (#   1287:20   Double Ambig)
 &rst
  ixpk= 1287, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 443, 319,
 igr2= 447, 448, 447, 448, 323, 324,
 &end
#
#   22 ASP  HN           22 ASP  HB-         3.50    (#   1288:20   Unique)
 &rst
  ixpk= 1288, iat= 319,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 323, 324,
 &end
#
#   23 GLU  HN           23 GLU  HB+         4.50    (#   1289:20   Unique)
 &rst
  ixpk= 1289, iat= 331,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 335, 336,
 &end
#
#   23 GLU  HN           23 GLU  HB-         4.50    (#   1290:20   Unique)
 &rst
  ixpk= 1290, iat= 331,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 335, 336,
 &end
#
#    0 AMB  20-2:1291    24 PHE  HB3         3.50    (#   1291:20   Single Ambig)
 &rst
  ixpk= 1291, iat=  -1, 351, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 346, 366,
 &end
#
#    0 AMB  20-2:1292    24 PHE  HB2         3.50    (#   1292:20   Single Ambig)
 &rst
  ixpk= 1292, iat=  -1, 350, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 346, 366,
 &end
#
#   25 GLN  HN            0 AMB  20-1:1293   3.50    (#   1293:20   Single Ambig)
 &rst
  ixpk= 1293, iat= 366,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 370, 371, 370, 371,
 &end
#
#   25 GLN  HN            0 AMB  20-1:1294   3.50    (#   1294:20   Single Ambig)
 &rst
  ixpk= 1294, iat= 366,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 370, 371, 370, 371,
 &end
#
#   27 ILE  HN           27 ILE  HB          3.50    (#   1295:20   Unique)
 &rst
  ixpk= 1295, iat= 405, 409, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   28 LEU  HN           28 LEU  HB+         3.50    (#   1296:20   Unique)
 &rst
  ixpk= 1296, iat= 424,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 428, 429,
 &end
#
#   28 LEU  HN           28 LEU  HB-         3.50    (#   1297:20   Unique)
 &rst
  ixpk= 1297, iat= 424,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 428, 429,
 &end
#
#   30 PHE  HN           30 PHE  QB          3.50    (#   1298:20   Unique)
 &rst
  ixpk= 1298, iat= 455,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 459, 460,
 &end
#
#    0 AMB  20-2:1299     0 AMB  20-1:1299   3.50    (#   1299:20   Double Ambig)
 &rst
  ixpk= 1299, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 475,1057,2742,
 igr2= 479, 480,1031,1032,2724,2725,
 &end
#
#   31 MET  HN           31 MET  HB-         4.50    (#   1300:20   Unique)
 &rst
  ixpk= 1300, iat= 475,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 479, 480,
 &end
#
#    0 AMB  20-2:1301     0 AMB  20-1:1301   3.50    (#   1301:20   Double Ambig)
 &rst
  ixpk= 1301, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 494,2491, 455,
 igr2= 498, 499,2495, 387, 388, 387, 388,1115,
 &end
#
#   32 LYS  HN           32 LYS  HB-         3.50    (#   1302:20   Unique)
 &rst
  ixpk= 1302, iat= 494,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 498, 499,
 &end
#
#   33 ASP  HN           33 ASP  QB          3.50    (#   1303:20   Unique)
 &rst
  ixpk= 1303, iat= 516,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 520, 521,
 &end
#
#   34 VAL  HN           34 VAL  HB          3.50    (#   1304:20   Unique)
 &rst
  ixpk= 1304, iat= 528, 532, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1305     0 AMB  20-1:1305   3.50    (#   1305:20   Double Ambig)
 &rst
  ixpk= 1305, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 544,1567,
 igr2= 548, 138,
 &end
#
#   35 MET  HN           35 MET  HB3         4.50    (#   1306:20   Unique)
 &rst
  ixpk= 1306, iat= 544, 549, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1307     0 AMB  20-1:1307   3.50    (#   1307:20   Double Ambig)
 &rst
  ixpk= 1307, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 563,  73,
 igr2= 567, 568,  48,  49,
 &end
#
#    0 AMB  20-2:1308     0 AMB  20-1:1308   3.50    (#   1308:20   Double Ambig)
 &rst
  ixpk= 1308, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 563,  73,
 igr2= 567, 568,  48,  49,
 &end
#
#   38 LEU  HN           38 LEU  QB          3.50    (#   1309:20   Unique)
 &rst
  ixpk= 1309, iat= 607,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 611, 612,
 &end
#
#   38 LEU  HN           39 SER  QB          6.00    (#   1310:20   Unique)
 &rst
  ixpk= 1310, iat= 607,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2= 630, 631,
 &end
#
#   39 SER  HN           39 SER  QB          3.50    (#   1311:20   Preassigned)
 &rst
  ixpk= 1311, iat= 626,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 630, 631,
 &end
#
#    0 AMB  20-2:1312    40 ASN  QB          4.50    (#   1312:20   Single Ambig)
 &rst
  ixpk= 1312, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 637, 665,
 igr2= 641, 642,
 &end
#
#    0 AMB  20-2:1313     0 AMB  20-1:1313   4.50    (#   1313:20   Double Ambig)
 &rst
  ixpk= 1313, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 665,1073,
 igr2= 669, 670, 992,
 &end
#
#   43 TYR  HN           43 TYR  HB2         3.50    (#   1314:20   Unique)
 &rst
  ixpk= 1314, iat= 676, 680, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1315     0 AMB  20-1:1315   4.50    (#   1315:20   Double Ambig)
 &rst
  ixpk= 1315, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 676, 807,1374,1375,
 igr2= 681, 847, 848,
 &end
#
#   44 GLN  HN            0 AMB  20-1:1316   4.50    (#   1316:20   Single Ambig)
 &rst
  ixpk= 1316, iat= 697,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr2= 701, 702, 701, 702,
 &end
#
#   45 PHE  HN           45 PHE  HB3         4.50    (#   1317:20   Unique)
 &rst
  ixpk= 1317, iat= 714, 719, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   45 PHE  HN           45 PHE  HB2         4.50    (#   1318:20   Unique)
 &rst
  ixpk= 1318, iat= 714, 718, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   46 ALA  HN           46 ALA  MB          4.50    (#   1319:20   Unique)
 &rst
  ixpk= 1319, iat= 734,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2= 738, 739, 740,
 &end
#
#    0 AMB  20-2:1320    47 ALA  MB          3.50    (#   1320:20   Single Ambig)
 &rst
  ixpk= 1320, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 744, 915,
 igr2= 748, 749, 750,
 &end
#
#    0 AMB  20-2:1321    48 VAL  HB          3.50    (#   1321:20   Single Ambig)
 &rst
  ixpk= 1321, iat=  -1, 758, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 754, 189,
 &end
#
#    0 AMB  20-2:1322    51 SER  HB+         3.50    (#   1322:20   Single Ambig)
 &rst
  ixpk= 1322, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 807,1294, 221,
 igr2= 811, 812,
 &end
#
#    0 AMB  20-2:1323    51 SER  HB-         4.50    (#   1323:20   Single Ambig)
 &rst
  ixpk= 1323, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 807,1294, 221,
 igr2= 811, 812,
 &end
#
#   52 THR  HN           52 THR  HB          3.50    (#   1324:20   Unique)
 &rst
  ixpk= 1324, iat= 818, 822, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   53 SER  HN           53 SER  QB          3.50    (#   1325:20   Unique)
 &rst
  ixpk= 1325, iat= 832,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 836, 837,
 &end
#
#   54 TYR  HN           54 TYR  HB+         3.50    (#   1326:20   Unique)
 &rst
  ixpk= 1326, iat= 843,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 847, 848,
 &end
#
#   54 TYR  HN           54 TYR  HB-         4.50    (#   1327:20   Unique)
 &rst
  ixpk= 1327, iat= 843,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 847, 848,
 &end
#
#    0 AMB  20-2:1328    55 LYS  HB3         4.50    (#   1328:20   Single Ambig)
 &rst
  ixpk= 1328, iat=  -1, 869, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 864, 770,
 &end
#
#    0 AMB  20-2:1329    55 LYS  HB2         4.50    (#   1329:20   Single Ambig)
 &rst
  ixpk= 1329, iat=  -1, 868, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 864, 770,
 &end
#
#   57 GLU  HN           57 GLU  HB3         4.50    (#   1330:20   Unique)
 &rst
  ixpk= 1330, iat= 900, 905, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   57 GLU  HN           57 GLU  HB2         6.00    (#   1331:20   Unique)
 &rst
  ixpk= 1331, iat= 900, 904, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:1332    58 PHE  HB+         4.50    (#   1332:20   Single Ambig)
 &rst
  ixpk= 1332, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 915,1057, 744,
 igr2= 919, 920,
 &end
#
#    0 AMB  20-2:1333    58 PHE  HB-         4.50    (#   1333:20   Single Ambig)
 &rst
  ixpk= 1333, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 915,1057, 744,
 igr2= 919, 920,
 &end
#
#   59 ASP  HN           59 ASP  HB+         4.50    (#   1334:20   Unique)
 &rst
  ixpk= 1334, iat= 935,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 939, 940,
 &end
#
#   59 ASP  HN           59 ASP  HB-         4.50    (#   1335:20   Unique)
 &rst
  ixpk= 1335, iat= 935,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 939, 940,
 &end
#
#   61 SER  HN           61 SER  HB+         3.50    (#   1336:20   Preassigned)
 &rst
  ixpk= 1336, iat= 967,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 971, 972,
 &end
#
#   62 ASP  HN           62 ASP  HB2         4.50    (#   1337:20   Unique)
 &rst
  ixpk= 1337, iat= 978, 982, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1338     0 AMB  20-1:1338   3.50    (#   1338:20   Double Ambig)
 &rst
  ixpk= 1338, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  73, 978,
 igr2=  57,  58, 983,
 &end
#
#   63 TYR  HN           63 TYR  HB+         4.50    (#   1339:20   Unique)
 &rst
  ixpk= 1339, iat= 990,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 994, 995,
 &end
#
#   63 TYR  HN           63 TYR  HB-         4.50    (#   1340:20   Unique)
 &rst
  ixpk= 1340, iat= 990,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 994, 995,
 &end
#
#   64 VAL  HN            0 AMB  20-1:1341   3.50    (#   1341:20   Single Ambig)
 &rst
  ixpk= 1341, iat=1011,  -1, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr2=1015, 701, 702, 701, 702,
 &end
#
#   65 LYS  HN           65 LYS  HB+         3.50    (#   1342:20   Unique)
 &rst
  ixpk= 1342, iat=1027,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1031,1032,
 &end
#
#   66 TRP  HN           66 TRP  HB3         3.50    (#   1343:20   Unique)
 &rst
  ixpk= 1343, iat=1049,1054, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   66 TRP  HN           66 TRP  HB2         3.50    (#   1344:20   Unique)
 &rst
  ixpk= 1344, iat=1049,1053, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1345    67 LYS  QB          3.50    (#   1345:20   Single Ambig)
 &rst
  ixpk= 1345, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1073, 637,
 igr2=1077,1078,
 &end
#
#   68 ASP  HN           68 ASP  QB          3.50    (#   1346:20   Unique)
 &rst
  ixpk= 1346, iat=1095,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1099,1100,
 &end
#
#    0 AMB  20-2:1347     0 AMB  20-1:1347   3.50    (#   1347:20   Double Ambig)
 &rst
  ixpk= 1347, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1121, 455,
 igr2=1125,1126, 447, 448, 447, 448,
 &end
#
#   70 ASP  HN           70 ASP  HB-         3.50    (#   1348:20   Unique)
 &rst
  ixpk= 1348, iat=1121,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1125,1126,
 &end
#
#   71 ALA  HN           71 ALA  MB          3.50    (#   1349:20   Unique)
 &rst
  ixpk= 1349, iat=1133,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1137,1138,1139,
 &end
#
#   72 LEU  HN           72 LEU  HB2         4.50    (#   1350:20   Unique)
 &rst
  ixpk= 1350, iat=1143,1147, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   72 LEU  HN           72 LEU  HB3         4.50    (#   1351:20   Unique)
 &rst
  ixpk= 1351, iat=1143,1148, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1352    73 LEU  HB2         3.50    (#   1352:20   Single Ambig)
 &rst
  ixpk= 1352, iat=  -1,1166, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1162,1181,
 &end
#
#    0 AMB  20-2:1353    73 LEU  HB3         3.50    (#   1353:20   Single Ambig)
 &rst
  ixpk= 1353, iat=  -1,1167, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1162,1181,
 &end
#
#   74 LYS  HN           74 LYS  HB+         3.50    (#   1354:20   Unique)
 &rst
  ixpk= 1354, iat=1181,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1185,1186,
 &end
#
#   74 LYS  HN           74 LYS  HB-         3.50    (#   1355:20   Unique)
 &rst
  ixpk= 1355, iat=1181,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1185,1186,
 &end
#
#   75 HIS  HN           75 HIS  HB+         6.00    (#   1356:20   Unique)
 &rst
  ixpk= 1356, iat=1203,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1207,1208,
 &end
#
#   75 HIS  HN           75 HIS  HB-         6.00    (#   1357:20   Unique)
 &rst
  ixpk= 1357, iat=1203,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1207,1208,
 &end
#
#    0 AMB  20-2:1358     0 AMB  20-1:1358   3.50    (#   1358:20   Double Ambig)
 &rst
  ixpk= 1358, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1220, 354, 362,2720,2822,2830,
 igr2=1224,1262,2730,2731,2765,2766,
 &end
#
#   77 LYS  HN           77 LYS  QB          3.50    (#   1359:20   Unique)
 &rst
  ixpk= 1359, iat=1236,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1240,1241,
 &end
#
#   78 HIS  HN           78 HIS  HB3         4.50    (#   1360:20   Unique)
 &rst
  ixpk= 1360, iat=1258,1263, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   78 HIS  HN           78 HIS  HB2         4.50    (#   1361:20   Unique)
 &rst
  ixpk= 1361, iat=1258,1262, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   79 MET  HN           79 MET  HB2         4.50    (#   1362:20   Unique)
 &rst
  ixpk= 1362, iat=1275,1279, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   79 MET  HN           79 MET  HB3         4.50    (#   1363:20   Unique)
 &rst
  ixpk= 1363, iat=1275,1280, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1364     0 AMB  20-1:1364   4.50    (#   1364:20   Double Ambig)
 &rst
  ixpk= 1364, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1294,1925,
 igr2=1298,1299,1336,1337,
 &end
#
#   81 LEU  HN           81 LEU  HB2         4.50    (#   1365:20   Unique)
 &rst
  ixpk= 1365, iat=1313,1317, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   82 LEU  HN           82 LEU  HB+         4.50    (#   1366:20   Unique)
 &rst
  ixpk= 1366, iat=1332,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1336,1337,
 &end
#
#   82 LEU  HN           82 LEU  HB-         4.50    (#   1367:20   Unique)
 &rst
  ixpk= 1367, iat=1332,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1336,1337,
 &end
#
#   83 THR  HN           83 THR  HB          4.50    (#   1368:20   Unique)
 &rst
  ixpk= 1368, iat=1351,1355, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   84 ASN  HN           84 ASN  HB2         4.50    (#   1369:20   Unique)
 &rst
  ixpk= 1369, iat=1365,1369, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   84 ASN  HN           84 ASN  HB3         4.50    (#   1370:20   Unique)
 &rst
  ixpk= 1370, iat=1365,1370, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   85 THR  HN           85 THR  HB          4.50    (#   1371:20   Unique)
 &rst
  ixpk= 1371, iat=1379,1383, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   86 PHE  HN           86 PHE  HB2         3.50    (#   1372:20   Unique)
 &rst
  ixpk= 1372, iat=1393,1397, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   86 PHE  HN           86 PHE  HB3         3.50    (#   1373:20   Unique)
 &rst
  ixpk= 1373, iat=1393,1398, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   88 ALA  HN           88 ALA  MB          3.50    (#   1374:20   Preassigned)
 &rst
  ixpk= 1374, iat=1420,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1424,1425,1426,
 &end
#
#   89 ILE  HN           89 ILE  HB          3.50    (#   1375:20   Unique)
 &rst
  ixpk= 1375, iat=1430,1434, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   92 VAL  HN           92 VAL  HB          3.50    (#   1376:20   Unique)
 &rst
  ixpk= 1376, iat=1484,1488, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   93 ALA  HN           93 ALA  MB          3.50    (#   1377:20   Unique)
 &rst
  ixpk= 1377, iat=1500,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1504,1505,1506,
 &end
#
#   94 THR  HN           94 THR  HB          4.50    (#   1378:20   Unique)
 &rst
  ixpk= 1378, iat=1510,1514, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   97 PHE  HN           97 PHE  HB+         3.50    (#   1379:20   Unique)
 &rst
  ixpk= 1379, iat=1555,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1559,1560,
 &end
#
#   97 PHE  HN           97 PHE  HB-         3.50    (#   1380:20   Unique)
 &rst
  ixpk= 1380, iat=1555,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1559,1560,
 &end
#
#   98 ARG  HN           98 ARG  HB+         4.50    (#   1381:20   Unique)
 &rst
  ixpk= 1381, iat=1575,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1579,1580,
 &end
#
#   98 ARG  HN           98 ARG  HB-         4.50    (#   1382:20   Unique)
 &rst
  ixpk= 1382, iat=1575,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1579,1580,
 &end
#
#   99 GLU  HN           99 GLU  QB          6.00    (#   1383:20   Unique)
 &rst
  ixpk= 1383, iat=1599,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1603,1604,
 &end
#
#  100 GLU  HN          100 GLU  HB+         4.50    (#   1384:20   Unique)
 &rst
  ixpk= 1384, iat=1614,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1618,1619,
 &end
#
#  101 LEU  HN          101 LEU  HB3         4.50    (#   1385:20   Unique)
 &rst
  ixpk= 1385, iat=1629,1634, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  101 LEU  HN          101 LEU  HB2         3.50    (#   1386:20   Unique)
 &rst
  ixpk= 1386, iat=1629,1633, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  103 ALA  HN          103 ALA  MB          3.50    (#   1387:20   Unique)
 &rst
  ixpk= 1387, iat=1655,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1659,1660,1661,
 &end
#
#  104 ARG  HN          104 ARG  QB          4.50    (#   1388:20   Unique)
 &rst
  ixpk= 1388, iat=1665,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1669,1670,
 &end
#
#  106 ASP  HN          106 ASP  HB+         3.50    (#   1389:20   Unique)
 &rst
  ixpk= 1389, iat=1703,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1707,1708,
 &end
#
#    0 AMB  20-2:1390     0 AMB  20-1:1390   3.50    (#   1390:20   Double Ambig)
 &rst
  ixpk= 1390, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1703,2480,
 igr2=1707,1708,2567,2568,
 &end
#
#  108 THR  HN          108 THR  HB          3.50    (#   1391:20   Unique)
 &rst
  ixpk= 1391, iat=1725,1729, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1392   109 LYS  HB2         4.50    (#   1392:20   Single Ambig)
 &rst
  ixpk= 1392, iat=  -1,1743, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1739,2073,
 &end
#
#    0 AMB  20-2:1393     0 AMB  20-1:1393   4.50    (#   1393:20   Double Ambig)
 &rst
  ixpk= 1393, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2073,1739, 676,
 igr2=1744,  91,
 &end
#
#  110 VAL  HN          110 VAL  HB          3.50    (#   1394:20   Unique)
 &rst
  ixpk= 1394, iat=1761,1765, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  111 LEU  HN          111 LEU  HB3         3.50    (#   1395:20   Unique)
 &rst
  ixpk= 1395, iat=1777,1782, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  111 LEU  HN          111 LEU  HB2         4.50    (#   1396:20   Unique)
 &rst
  ixpk= 1396, iat=1777,1781, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  112 ILE  HN          112 ILE  HB          3.50    (#   1397:20   Unique)
 &rst
  ixpk= 1397, iat=1796,1800, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1398     0 AMB  20-1:1398   3.50    (#   1398:20   Double Ambig)
 &rst
  ixpk= 1398, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1815,1853,
 igr2=1819,2160,
 &end
#
#  114 ILE  HN          114 ILE  HB          3.50    (#   1399:20   Unique)
 &rst
  ixpk= 1399, iat=1834,1838, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  115 THR  HN          115 THR  HB          6.00    (#   1400:20   Unique)
 &rst
  ixpk= 1400, iat=1853,1857, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  116 ASP  HN          116 ASP  HB3         4.50    (#   1401:20   Unique)
 &rst
  ixpk= 1401, iat=1867,1872, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  118 GLU  HN          118 GLU  HB2         3.50    (#   1402:20   Unique)
 &rst
  ixpk= 1402, iat=1886,1890, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  119 ALA  HN          119 ALA  MB          3.50    (#   1403:20   Unique)
 &rst
  ixpk= 1403, iat=1901,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1905,1906,1907,
 &end
#
#  120 THR  HN          120 THR  HB          6.00    (#   1404:20   Unique)
 &rst
  ixpk= 1404, iat=1911,1915, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  121 ASP  HN          121 ASP  HB+         4.50    (#   1405:20   Unique)
 &rst
  ixpk= 1405, iat=1925,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1929,1930,
 &end
#
#  121 ASP  HN          121 ASP  HB-         4.50    (#   1406:20   Unique)
 &rst
  ixpk= 1406, iat=1925,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1929,1930,
 &end
#
#  122 SER  HN          122 SER  QB          4.50    (#   1407:20   Unique)
 &rst
  ixpk= 1407, iat=1937,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1941,1942,
 &end
#
#    0 AMB  20-2:1408     0 AMB  20-1:1408   6.00    (#   1408:20   Double Ambig)
 &rst
  ixpk= 1408, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.49, r4= 9.24,
 igr1=1955,1203,
 igr2=1959,1960,1194,1195,
 &end
#
#  124 ASN  HN          124 ASN  HB-         4.50    (#   1409:20   Unique)
 &rst
  ixpk= 1409, iat=1955,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1959,1960,
 &end
#
#    0 AMB  20-2:1410   126 ASP  QB          3.50    (#   1410:20   Single Ambig)
 &rst
  ixpk= 1410, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1988,2000,
 igr2=1992,1993,
 &end
#
#  127 ALA  HN          127 ALA  MB          3.50    (#   1411:20   Preassigned)
 &rst
  ixpk= 1411, iat=2000,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2004,2005,2006,
 &end
#
#    0 AMB  20-2:1412   128 ALA  MB          3.50    (#   1412:20   Single Ambig)
 &rst
  ixpk= 1412, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2010,1500,
 igr2=2014,2015,2016,
 &end
#
#  130 ASP  HN          130 ASP  HB+         3.50    (#   1413:20   Unique)
 &rst
  ixpk= 1413, iat=2042,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2046,2047,
 &end
#
#  130 ASP  HN          130 ASP  HB-         3.50    (#   1414:20   Unique)
 &rst
  ixpk= 1414, iat=2042,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2046,2047,
 &end
#
#  131 ILE  HN          131 ILE  HB          3.50    (#   1415:20   Unique)
 &rst
  ixpk= 1415, iat=2054,2058, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  132 ILE  HN          132 ILE  HB          3.50    (#   1416:20   Unique)
 &rst
  ixpk= 1416, iat=2073,2077, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  134 TYR  HN          134 TYR  HB2         3.50    (#   1417:20   Unique)
 &rst
  ixpk= 1417, iat=2116,2120, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1418     0 AMB  20-1:1418   3.50    (#   1418:20   Double Ambig)
 &rst
  ixpk= 1418, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1969,2116,
 igr2=1959,1960,2121,
 &end
#
#  135 ILE  HN          135 ILE  HB          3.50    (#   1419:20   Unique)
 &rst
  ixpk= 1419, iat=2137,2141, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1420     0 AMB  20-1:1420   3.50    (#   1420:20   Double Ambig)
 &rst
  ixpk= 1420, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2156,1853,
 igr2=2160,1819,
 &end
#
#  138 ILE  HN          138 ILE  HB          3.50    (#   1421:20   Unique)
 &rst
  ixpk= 1421, iat=2182,2186, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  140 LYS  HN          140 LYS  QB          3.50    (#   1422:20   Unique)
 &rst
  ixpk= 1422, iat=2208,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2212,2213,
 &end
#
#  141 HIS  HN          141 HIS  HB+         4.50    (#   1423:20   Unique)
 &rst
  ixpk= 1423, iat=2230,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2234,2235,
 &end
#
#  141 HIS  HN          141 HIS  HB-         4.50    (#   1424:20   Unique)
 &rst
  ixpk= 1424, iat=2230,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2234,2235,
 &end
#
#    0 AMB  20-2:1425   142 PHE  HB3         4.50    (#   1425:20   Single Ambig)
 &rst
  ixpk= 1425, iat=  -1,2252, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2247,2346,
 &end
#
#  142 PHE  HN          142 PHE  HB2         3.50    (#   1426:20   Unique)
 &rst
  ixpk= 1426, iat=2247,2251, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1430   145 LYS  HB+         4.50    (#   1430:20   Single Ambig)
 &rst
  ixpk= 1430, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2298,2320,
 igr2=2302,2303,
 &end
#
#    0 AMB  20-2:1431     0 AMB  20-1:1431   6.00    (#   1431:20   Double Ambig)
 &rst
  ixpk= 1431, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1=2230,2298,2320,
 igr2=2212,2213,2302,2303,
 &end
#
#    0 AMB  20-2:1432     0 AMB  20-1:1432   3.50    (#   1432:20   Double Ambig)
 &rst
  ixpk= 1432, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1834,2320,
 igr2=1844,1845,2324,2325,
 &end
#
#  185 VAL  HN          185 VAL  HA          3.50    (#   1433:20   Preassigned)
 &rst
  ixpk= 1433, iat=2983,2985, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  149 GLU  HN          149 GLU  HB-         3.50    (#   1434:20   Unique)
 &rst
  ixpk= 1434, iat=2363,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2367,2368,
 &end
#
#  151 LEU  HN          151 LEU  HB2         4.50    (#   1435:20   Unique)
 &rst
  ixpk= 1435, iat=2392,2396, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  151 LEU  HN          151 LEU  HB3         4.50    (#   1436:20   Unique)
 &rst
  ixpk= 1436, iat=2392,2397, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  152 HIS  HN          152 HIS  HB2         3.50    (#   1437:20   Unique)
 &rst
  ixpk= 1437, iat=2411,2415, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1438   152 HIS  HB3         4.50    (#   1438:20   Single Ambig)
 &rst
  ixpk= 1438, iat=  -1,2416, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2411,2421,
 &end
#
#    0 AMB  20-2:1439     0 AMB  20-1:1439   3.50    (#   1439:20   Double Ambig)
 &rst
  ixpk= 1439, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2428,2548,
 igr2=2432,2433,2553,
 &end
#
#  153 LYS  HN          153 LYS  HB-         4.50    (#   1440:20   Unique)
 &rst
  ixpk= 1440, iat=2428,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2432,2433,
 &end
#
#    0 AMB  20-2:1441     0 AMB  20-1:1441   3.50    (#   1441:20   Double Ambig)
 &rst
  ixpk= 1441, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2470, 726,2450, 724, 728,
 igr2=2454,2455, 680,
 &end
#
#  155 ALA  HN          155 ALA  MB          3.50    (#   1442:20   Unique)
 &rst
  ixpk= 1442, iat=2470,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2474,2475,2476,
 &end
#
#  159 ALA  HN          159 ALA  MB          3.50    (#   1443:20   Preassigned)
 &rst
  ixpk= 1443, iat=2527,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2531,2532,2533,
 &end
#
#  160 SER  HN          160 SER  QB          3.50    (#   1444:20   Unique)
 &rst
  ixpk= 1444, iat=2537,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2541,2542,
 &end
#
#    0 AMB  20-2:1445     0 AMB  20-1:1445   3.50    (#   1445:20   Double Ambig)
 &rst
  ixpk= 1445, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.53, r4= 7.28,
 igr1=2761, 383,2921,2583,2783, 405,
 igr2=2765,2766, 387, 388,2925,2926,2587,
 &end
#
#  165 ILE  HN          165 ILE  HB          3.50    (#   1446:20   Unique)
 &rst
  ixpk= 1446, iat=2621,2625, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  166 LEU  HN          166 LEU  QB          3.50    (#   1447:20   Unique)
 &rst
  ixpk= 1447, iat=2640,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2644,2645,
 &end
#
#    0 AMB  20-2:1448   168 THR  HB          4.50    (#   1448:20   Single Ambig)
 &rst
  ixpk= 1448, iat=  -1,2675, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2720,2671,
 &end
#
#  170 GLU  HN          170 GLU  QB          4.50    (#   1449:20   Unique)
 &rst
  ixpk= 1449, iat=2705,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2709,2710,
 &end
#
#    0 AMB  20-2:1451   172 LEU  HB+         3.50    (#   1451:20   Single Ambig)
 &rst
  ixpk= 1451, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2742,2761,
 igr2=2746,2747,
 &end
#
#    0 AMB  20-2:1452   172 LEU  HB-         3.50    (#   1452:20   Single Ambig)
 &rst
  ixpk= 1452, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2742,2761,
 igr2=2746,2747,
 &end
#
#    0 AMB  20-2:1453     0 AMB  20-1:1453   3.50    (#   1453:20   Double Ambig)
 &rst
  ixpk= 1453, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2761,2583,2783,
 igr2=2765,2766,2587,
 &end
#
#    0 AMB  20-2:1454     0 AMB  20-1:1454   3.50    (#   1454:20   Double Ambig)
 &rst
  ixpk= 1454, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2783,2795,2428,2378,
 igr2=2787,2441,2442,
 &end
#
#    0 AMB  20-2:1455     0 AMB  20-1:1455   3.50    (#   1455:20   Double Ambig)
 &rst
  ixpk= 1455, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2795,2783,1062,
 igr2=2788,1040,1041,
 &end
#
#  175 LEU  HN          175 LEU  HB2         3.50    (#   1456:20   Unique)
 &rst
  ixpk= 1456, iat=2795,2799, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  175 LEU  HN          175 LEU  HB3         3.50    (#   1457:20   Unique)
 &rst
  ixpk= 1457, iat=2795,2800, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  176 PHE  HN          176 PHE  HB+         4.50    (#   1458:20   Unique)
 &rst
  ixpk= 1458, iat=2814,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2818,2819,
 &end
#
#  176 PHE  HN          176 PHE  HB-         4.50    (#   1459:20   Preassigned)
 &rst
  ixpk= 1459, iat=2814,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2818,2819,
 &end
#
#  177 THR  HN          177 THR  HB          3.50    (#   1460:20   Unique)
 &rst
  ixpk= 1460, iat=2834,2838, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  178 GLU  HN          178 GLU  QB          3.50    (#   1462:20   Unique)
 &rst
  ixpk= 1462, iat=2848,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2852,2853,
 &end
#
#    0 AMB  20-2:1463     0 AMB  20-1:1463   3.50    (#   1463:20   Double Ambig)
 &rst
  ixpk= 1463, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2882,1739,
 igr2=2886,2887,2083,2084,
 &end
#
#    0 AMB  20-2:1464     0 AMB  20-1:1464   4.50    (#   1464:20   Double Ambig)
 &rst
  ixpk= 1464, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2882,2201,
 igr2=2886,2887,2192,2193,
 &end
#
#    0 AMB  20-2:1465     0 AMB  20-1:1465   3.50    (#   1465:20   Double Ambig)
 &rst
  ixpk= 1465, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2983,1678,
 igr2=2987, 701, 702,
 &end
#
#    0 AMB  20-2:1466   186 ILE  HB          3.50    (#   1466:20   Single Ambig)
 &rst
  ixpk= 1466, iat=  -1,3003, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2999,3033,
 &end
#
#    0 AMB  20-2:1467     9 LEU  HB3         6.00    (#   1467:20   Single Ambig)
 &rst
  ixpk= 1467, iat=  -1, 120, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 134,1796,
 &end
#
#    0 AMB  20-2:1468     0 AMB  20-1:1468   6.00    (#   1468:20   Double Ambig)
 &rst
  ixpk= 1468, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.49, r4= 9.24,
 igr1= 221,1879,
 igr2= 213, 214, 213, 214,
 &end
#
#    0 AMB  20-2:1470    47 ALA  MB          3.50    (#   1470:20   Single Ambig)
 &rst
  ixpk= 1470, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 754, 189,
 igr2= 748, 749, 750,
 &end
#
#   51 SER  HN           50 PHE  HB2         6.00    (#   1471:20   Unique)
 &rst
  ixpk= 1471, iat= 807, 791, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   56 THR  HN           56 THR  HB          3.50    (#   1472:20   Unique)
 &rst
  ixpk= 1472, iat= 886, 890, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1473     0 AMB  20-1:1473   3.50    (#   1473:20   Double Ambig)
 &rst
  ixpk= 1473, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=  66,2685, 990,
 igr2=  57,  58,2221,2222, 983,
 &end
#
#   25 GLN  HE2+         25 GLN  HG-         3.50    (#   1474:20   Unique)
 &rst
  ixpk= 1474, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 378, 379,
 igr2= 373, 374,
 &end
#
#   72 LEU  HN           71 ALA  MB          3.50    (#   1475:20   Unique)
 &rst
  ixpk= 1475, iat=1143,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1137,1138,1139,
 &end
#
#   73 LEU  HN           72 LEU  HB2         6.00    (#   1476:20   Unique)
 &rst
  ixpk= 1476, iat=1162,1147, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  120 THR  HN           83 THR  HB          4.50    (#   1477:20   Unique)
 &rst
  ixpk= 1477, iat=1911,1355, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  104 ARG  HN          103 ALA  MB          3.50    (#   1478:20   Unique)
 &rst
  ixpk= 1478, iat=1665,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1659,1660,1661,
 &end
#
#    0 AMB  20-2:1479     0 AMB  20-1:1479   3.50    (#   1479:20   Double Ambig)
 &rst
  ixpk= 1479, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1703,2480,
 igr2=1696,2097,
 &end
#
#  116 ASP  HN          115 THR  HB          4.50    (#   1480:20   Unique)
 &rst
  ixpk= 1480, iat=1867,1857, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  119 ALA  HN          118 GLU  HB3         3.50    (#   1481:20   Unique)
 &rst
  ixpk= 1481, iat=1901,1891, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  121 ASP  HN          120 THR  HB          6.00    (#   1482:20   Unique)
 &rst
  ixpk= 1482, iat=1925,1915, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:1483     0 AMB  20-1:1483   3.50    (#   1483:20   Double Ambig)
 &rst
  ixpk= 1483, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1969,2116,1988,
 igr2=1959,1960,2121,
 &end
#
#    0 AMB  20-2:1484   124 ASN  HB-         4.50    (#   1484:20   Single Ambig)
 &rst
  ixpk= 1484, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1969,1988,
 igr2=1959,1960,
 &end
#
#    0 AMB  20-2:1485   126 ASP  QB          3.50    (#   1485:20   Single Ambig)
 &rst
  ixpk= 1485, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2000,1969,
 igr2=1992,1993,
 &end
#
#  146 GLU  HN          145 LYS  HB+         3.50    (#   1486:20   Unique)
 &rst
  ixpk= 1486, iat=2320,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2302,2303,
 &end
#
#    0 AMB  20-2:1487     0 AMB  20-1:1487   3.50    (#   1487:20   Double Ambig)
 &rst
  ixpk= 1487, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2230,2320,
 igr2=2212,2213,2302,2303,
 &end
#
#    0 AMB  20-2:1488     0 AMB  20-1:1488   3.50    (#   1488:20   Double Ambig)
 &rst
  ixpk= 1488, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 346,2335,2363,
 igr2= 335, 336,2324,2325,2367,2368,
 &end
#
#  156 SER  HN          155 ALA  MB          3.50    (#   1489:20   Unique)
 &rst
  ixpk= 1489, iat=2480,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2474,2475,2476,
 &end
#
#  160 SER  HN          159 ALA  MB          3.50    (#   1490:20   Unique)
 &rst
  ixpk= 1490, iat=2537,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2531,2532,2533,
 &end
#
#  177 THR  HN          176 PHE  HB+         6.00    (#   1491:20   Unique)
 &rst
  ixpk= 1491, iat=2834,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=2818,2819,
 &end
#
#  179 LEU  HN          178 GLU  QB          3.50    (#   1492:20   Unique)
 &rst
  ixpk= 1492, iat=2863,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2852,2853,
 &end
#
#    0 AMB  20-2:1493     7 VAL  MG2         4.50    (#   1493:20   Single Ambig)
 &rst
  ixpk= 1493, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=  87, 684, 693,
 igr2=  97,  98,  99,
 &end
#
#   10 VAL  HN           10 VAL  MG2         3.50    (#   1494:20   Unique)
 &rst
  ixpk= 1494, iat= 134,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  20-2:1495     0 AMB  20-1:1495   4.50    (#   1495:20   Double Ambig)
 &rst
  ixpk= 1495, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 228,1777, 170,
 igr2= 276,1806,1807, 177,2083,2084,
 &end
#
#   17 MET  HN           17 MET  HG+         3.50    (#   1496:20   Unique)
 &rst
  ixpk= 1496, iat= 239,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 246, 247,
 &end
#
#   17 MET  HN           17 MET  HG-         4.50    (#   1497:20   Unique)
 &rst
  ixpk= 1497, iat= 239,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 246, 247,
 &end
#
#   23 GLU  HN           23 GLU  HG-         4.50    (#   1498:20   Unique)
 &rst
  ixpk= 1498, iat= 331,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 338, 339,
 &end
#
#   28 LEU  HN           28 LEU  HG          3.50    (#   1499:20   Unique)
 &rst
  ixpk= 1499, iat= 424, 431, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1500    31 MET  HG+         3.50    (#   1500:20   Single Ambig)
 &rst
  ixpk= 1500, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 475, 463, 471,
 igr2= 482, 483,
 &end
#
#   31 MET  HN           31 MET  HG-         3.50    (#   1501:20   Unique)
 &rst
  ixpk= 1501, iat= 475,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 482, 483,
 &end
#
#    0 AMB  20-2:1503     0 AMB  20-1:1503   3.50    (#   1503:20   Double Ambig)
 &rst
  ixpk= 1503, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 818,1121, 494,
 igr2=1322,1323,1324,1326,1327,1328, 501, 502,
 &end
#
#    0 AMB  20-2:1505     0 AMB  20-1:1505   3.50    (#   1505:20   Double Ambig)
 &rst
  ixpk= 1505, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1143, 528,
 igr2=1152,1153,1154,1156,1157,1158, 534, 535, 536,
 &end
#
#   35 MET  HN           35 MET  HG+         3.50    (#   1506:20   Unique)
 &rst
  ixpk= 1506, iat= 544,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 551, 552,
 &end
#
#   35 MET  HN           35 MET  HG-         4.50    (#   1507:20   Unique)
 &rst
  ixpk= 1507, iat= 544,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 551, 552,
 &end
#
#   36 LYS  HN           36 LYS  HG+         3.50    (#   1508:20   Unique)
 &rst
  ixpk= 1508, iat= 563,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 570, 571,
 &end
#
#   36 LYS  HN           36 LYS  HG-         4.50    (#   1509:20   Unique)
 &rst
  ixpk= 1509, iat= 563,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 570, 571,
 &end
#
#   37 LYS  HN           37 LYS  QG          3.50    (#   1510:20   Unique)
 &rst
  ixpk= 1510, iat= 585,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 592, 593,
 &end
#
#   38 LEU  HN           38 LEU  HG          3.50    (#   1511:20   Unique)
 &rst
  ixpk= 1511, iat= 607, 614, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   44 GLN  HN           44 GLN  HG+         4.50    (#   1512:20   Unique)
 &rst
  ixpk= 1512, iat= 697,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 704, 705,
 &end
#
#   44 GLN  HN           44 GLN  HG-         6.00    (#   1513:20   Unique)
 &rst
  ixpk= 1513, iat= 697,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2= 704, 705,
 &end
#
#    0 AMB  20-2:1514    48 VAL  MGX         3.50    (#   1514:20   Single Ambig)
 &rst
  ixpk= 1514, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 754, 189,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#   48 VAL  HN           48 VAL  MGY         4.50    (#   1515:20   Preassigned)
 &rst
  ixpk= 1515, iat= 754,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#   50 PHE  HN           49 GLN  QG          4.50    (#   1516:20   Unique)
 &rst
  ixpk= 1516, iat= 787,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 777, 778,
 &end
#
#    0 AMB  20-2:1517     0 AMB  20-1:1517   4.50    (#   1517:20   Double Ambig)
 &rst
  ixpk= 1517, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=2411, 818,
 igr2=2435,2436, 824, 825, 826,
 &end
#
#   57 GLU  HN           57 GLU  HG+         4.50    (#   1518:20   Unique)
 &rst
  ixpk= 1518, iat= 900,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 907, 908,
 &end
#
#   64 VAL  HN           64 VAL  MG2         3.50    (#   1519:20   Unique)
 &rst
  ixpk= 1519, iat=1011,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1021,1022,1023,
 &end
#
#   64 VAL  HN           64 VAL  MG1         4.50    (#   1520:20   Preassigned)
 &rst
  ixpk= 1520, iat=1011,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1017,1018,1019,
 &end
#
#    0 AMB  20-2:1521     0 AMB  20-1:1521   3.50    (#   1521:20   Double Ambig)
 &rst
  ixpk= 1521, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1073, 770,
 igr2=1080,1081, 871, 872,
 &end
#
#   67 LYS  HN           67 LYS  HG-         3.50    (#   1522:20   Unique)
 &rst
  ixpk= 1522, iat=1073,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1080,1081,
 &end
#
#   50 PHE  HE           12 LEU  HG          3.50    (#   1523:20   Unique)
 &rst
  ixpk= 1523, iat=  -1, 177, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 797, 801,
 &end
#
#   74 LYS  HN           74 LYS  HG+         3.50    (#   1524:20   Unique)
 &rst
  ixpk= 1524, iat=1181,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1188,1189,
 &end
#
#   74 LYS  HN           74 LYS  HG-         3.50    (#   1525:20   Unique)
 &rst
  ixpk= 1525, iat=1181,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1188,1189,
 &end
#
#   79 MET  HN           79 MET  HG+         4.50    (#   1526:20   Unique)
 &rst
  ixpk= 1526, iat=1275,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1282,1283,
 &end
#
#   79 MET  HN           79 MET  HG-         4.50    (#   1527:20   Unique)
 &rst
  ixpk= 1527, iat=1275,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1282,1283,
 &end
#
#   80 LEU  HN           80 LEU  HG          6.00    (#   1528:20   Unique)
 &rst
  ixpk= 1528, iat=1294,1301, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   82 LEU  HN           82 LEU  HG          3.50    (#   1529:20   Unique)
 &rst
  ixpk= 1529, iat=1332,1339, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   85 THR  HN           85 THR  MG2         6.00    (#   1530:20   Unique)
 &rst
  ixpk= 1530, iat=1379,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1385,1386,1387,
 &end
#
#   89 ILE  HN           89 ILE  HG1+        3.50    (#   1531:20   Unique)
 &rst
  ixpk= 1531, iat=1430,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1440,1441,
 &end
#
#   89 ILE  HN           89 ILE  HG1-        4.50    (#   1532:20   Unique)
 &rst
  ixpk= 1532, iat=1430,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1440,1441,
 &end
#
#    0 AMB  20-2:1533    89 ILE  MG2         6.00    (#   1533:20   Single Ambig)
 &rst
  ixpk= 1533, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1430,1420,
 igr2=1436,1437,1438,
 &end
#
#   92 VAL  HN           92 VAL  MG2         3.50    (#   1534:20   Preassigned)
 &rst
  ixpk= 1534, iat=1484,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1494,1495,1496,
 &end
#
#   94 THR  HN           94 THR  MG2         3.50    (#   1535:20   Preassigned)
 &rst
  ixpk= 1535, iat=1510,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1516,1517,1518,
 &end
#
#   95 GLU  HN           95 GLU  QG          3.50    (#   1536:20   Unique)
 &rst
  ixpk= 1536, iat=1524,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1531,1532,
 &end
#
#   96 VAL  HN           96 VAL  MG2         3.50    (#   1537:20   Unique)
 &rst
  ixpk= 1537, iat=1539,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1549,1550,1551,
 &end
#
#    0 AMB  20-2:1538    96 VAL  MG1         3.50    (#   1538:20   Single Ambig)
 &rst
  ixpk= 1538, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1555, 955, 963,1539,
 igr2=1545,1546,1547,
 &end
#
#   98 ARG  HN           98 ARG  HG+         3.50    (#   1539:20   Unique)
 &rst
  ixpk= 1539, iat=1575,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1582,1583,
 &end
#
#   98 ARG  HN           98 ARG  HG-         4.50    (#   1540:20   Unique)
 &rst
  ixpk= 1540, iat=1575,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1582,1583,
 &end
#
#  100 GLU  HN          100 GLU  QG          4.50    (#   1541:20   Unique)
 &rst
  ixpk= 1541, iat=1614,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1621,1622,
 &end
#
#  100 GLU  HN          100 GLU  QG          4.50    (#   1542:20   Unique)
 &rst
  ixpk= 1542, iat=1614,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1621,1622,
 &end
#
#    0 AMB  20-2:1543   101 LEU  HG          3.50    (#   1543:20   Single Ambig)
 &rst
  ixpk= 1543, iat=  -1,1636, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1629,1588,
 &end
#
#  108 THR  HN          108 THR  MG2         6.00    (#   1544:20   Unique)
 &rst
  ixpk= 1544, iat=1725,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1731,1732,1733,
 &end
#
#  109 LYS  HN          109 LYS  HG+         4.50    (#   1545:20   Unique)
 &rst
  ixpk= 1545, iat=1739,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1746,1747,
 &end
#
#  109 LYS  HN          109 LYS  HG-         4.50    (#   1546:20   Unique)
 &rst
  ixpk= 1546, iat=1739,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1746,1747,
 &end
#
#  110 VAL  HN          110 VAL  MG1         6.00    (#   1547:20   Unique)
 &rst
  ixpk= 1547, iat=1761,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1767,1768,1769,
 &end
#
#    0 AMB  20-2:1548   111 LEU  HG          6.00    (#   1548:20   Single Ambig)
 &rst
  ixpk= 1548, iat=  -1,1784, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1777, 170,
 &end
#
#    0 AMB  20-2:1549   112 ILE  HG1+        4.50    (#   1549:20   Single Ambig)
 &rst
  ixpk= 1549, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1796, 134,
 igr2=1806,1807,
 &end
#
#    0 AMB  20-2:1550   112 ILE  HG1-        4.50    (#   1550:20   Single Ambig)
 &rst
  ixpk= 1550, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1796, 134,
 igr2=1806,1807,
 &end
#
#  113 ILE  HN          113 ILE  HG1+        4.50    (#   1551:20   Unique)
 &rst
  ixpk= 1551, iat=1815,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1825,1826,
 &end
#
#  113 ILE  HN          113 ILE  HG1-        4.50    (#   1552:20   Unique)
 &rst
  ixpk= 1552, iat=1815,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1825,1826,
 &end
#
#    0 AMB  20-2:1553   113 ILE  MG2         4.50    (#   1553:20   Single Ambig)
 &rst
  ixpk= 1553, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1853,1815,
 igr2=1821,1822,1823,
 &end
#
#  118 GLU  HN          118 GLU  HG+         3.50    (#   1554:20   Unique)
 &rst
  ixpk= 1554, iat=1886,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1893,1894,
 &end
#
#  118 GLU  HN          118 GLU  HG-         3.50    (#   1555:20   Unique)
 &rst
  ixpk= 1555, iat=1886,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1893,1894,
 &end
#
#  129 LYS  HN          129 LYS  QG          3.50    (#   1556:20   Unique)
 &rst
  ixpk= 1556, iat=2020,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2027,2028,
 &end
#
#  131 ILE  HN          131 ILE  MG2         4.50    (#   1558:20   Unique)
 &rst
  ixpk= 1558, iat=2054,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2060,2061,2062,
 &end
#
#    0 AMB  20-2:1559     0 AMB  20-1:1559   3.50    (#   1559:20   Double Ambig)
 &rst
  ixpk= 1559, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=2073, 235,2621,1739,
 igr2=2083,2084, 276,2609,2610,
 &end
#
#    0 AMB  20-2:1560   132 ILE  HG1-        4.50    (#   1560:20   Single Ambig)
 &rst
  ixpk= 1560, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2073,1739,
 igr2=2083,2084,
 &end
#
#  132 ILE  HN          132 ILE  MG2         4.50    (#   1561:20   Unique)
 &rst
  ixpk= 1561, iat=2073,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2079,2080,2081,
 &end
#
#  136 ILE  HN          136 ILE  HG1+        4.50    (#   1562:20   Unique)
 &rst
  ixpk= 1562, iat=2156,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2166,2167,
 &end
#
#  136 ILE  HN          136 ILE  HG1-        4.50    (#   1563:20   Unique)
 &rst
  ixpk= 1563, iat=2156,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2166,2167,
 &end
#
#    0 AMB  20-2:1564   136 ILE  MG2         3.50    (#   1564:20   Single Ambig)
 &rst
  ixpk= 1564, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1853,2156,
 igr2=2162,2163,2164,
 &end
#
#  138 ILE  HN          138 ILE  HG1+        4.50    (#   1565:20   Unique)
 &rst
  ixpk= 1565, iat=2182,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2192,2193,
 &end
#
#  138 ILE  HN          138 ILE  MG2         6.00    (#   1566:20   Unique)
 &rst
  ixpk= 1566, iat=2182,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2188,2189,2190,
 &end
#
#  140 LYS  HN          140 LYS  QG          4.50    (#   1567:20   Unique)
 &rst
  ixpk= 1567, iat=2208,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2215,2216,
 &end
#
#  144 THR  HN          144 THR  MG2         3.50    (#   1568:20   Preassigned)
 &rst
  ixpk= 1568, iat=2284,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2290,2291,2292,
 &end
#
#  146 GLU  HN          146 GLU  HG+         4.50    (#   1569:20   Unique)
 &rst
  ixpk= 1569, iat=2320,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2327,2328,
 &end
#
#  146 GLU  HN          146 GLU  HG-         4.50    (#   1570:20   Unique)
 &rst
  ixpk= 1570, iat=2320,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2327,2328,
 &end
#
#  149 GLU  HN          149 GLU  HG+         3.50    (#   1571:20   Unique)
 &rst
  ixpk= 1571, iat=2363,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2370,2371,
 &end
#
#  151 LEU  HN          151 LEU  HG          3.50    (#   1572:20   Unique)
 &rst
  ixpk= 1572, iat=2392,2399, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1573     0 AMB  20-1:1573   3.50    (#   1573:20   Double Ambig)
 &rst
  ixpk= 1573, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2428, 782, 783,
 igr2=2435,2436,1226,1227,1228,
 &end
#
#  153 LYS  HN          153 LYS  HG-         4.50    (#   1574:20   Unique)
 &rst
  ixpk= 1574, iat=2428,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2435,2436,
 &end
#
#   38 LEU  HN           34 VAL  MG1         6.00    (#   1575:20   Unique)
 &rst
  ixpk= 1575, iat= 607,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 534, 535, 536,
 &end
#
#    0 AMB  20-2:1576     0 AMB  20-1:1576   4.50    (#   1576:20   Double Ambig)
 &rst
  ixpk= 1576, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2621,2042,2073,
 igr2=2631,2632,2064,2065,
 &end
#
#  165 ILE  HN          165 ILE  HG1-        4.50    (#   1577:20   Unique)
 &rst
  ixpk= 1577, iat=2621,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2631,2632,
 &end
#
#  165 ILE  HN          165 ILE  MG2         4.50    (#   1578:20   Unique)
 &rst
  ixpk= 1578, iat=2621,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2627,2628,2629,
 &end
#
#    0 AMB  20-2:1579     0 AMB  20-1:1579   3.50    (#   1579:20   Double Ambig)
 &rst
  ixpk= 1579, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2640,1969,2659,1988,
 igr2=2647,1979,1980,
 &end
#
#  168 THR  HN          168 THR  MG2         3.50    (#   1580:20   Preassigned)
 &rst
  ixpk= 1580, iat=2671,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2677,2678,2679,
 &end
#
#    0 AMB  20-2:1581     0 AMB  20-1:1581   3.50    (#   1581:20   Double Ambig)
 &rst
  ixpk= 1581, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.22, r4= 7.97,
 igr1= 923, 931,1216, 199, 203, 998,1007, 925, 929,1220,
       201,
 igr2= 904,1246,1247,1083,1084, 874, 875,
 &end
#
#  172 LEU  HN          172 LEU  HG          3.50    (#   1582:20   Unique)
 &rst
  ixpk= 1582, iat=2742,2749, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1583     0 AMB  20-1:1583   4.50    (#   1583:20   Double Ambig)
 &rst
  ixpk= 1583, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2834, 697,2863,
 igr2=2840,2841,2842,1021,1022,1023,
 &end
#
#  148 GLN  HN          148 GLN  HG+         3.50    (#   1584:20   Unique)
 &rst
  ixpk= 1584, iat=2346,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2353,2354,
 &end
#
#  148 GLN  HN          148 GLN  HG-         4.50    (#   1585:20   Unique)
 &rst
  ixpk= 1585, iat=2346,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2353,2354,
 &end
#
#  179 LEU  HN          179 LEU  HG          3.50    (#   1586:20   Unique)
 &rst
  ixpk= 1586, iat=2863,2870, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  180 GLN  HN          180 GLN  QG          4.50    (#   1587:20   Unique)
 &rst
  ixpk= 1587, iat=2882,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2889,2890,
 &end
#
#  186 ILE  HN          186 ILE  HG1+        3.50    (#   1588:20   Unique)
 &rst
  ixpk= 1588, iat=2999,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=3009,3010,
 &end
#
#  186 ILE  HN          186 ILE  MG2         4.50    (#   1589:20   Preassigned)
 &rst
  ixpk= 1589, iat=2999,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=3005,3006,3007,
 &end
#
#    0 AMB  20-2:1590     0 AMB  20-1:1590   3.50    (#   1590:20   Double Ambig)
 &rst
  ixpk= 1590, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=3018,2358,2359,
 igr2=3025,3026,2353,2354,
 &end
#
#    0 AMB  20-2:1591     0 AMB  20-1:1591   4.50    (#   1591:20   Double Ambig)
 &rst
  ixpk= 1591, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=3018,2358,2359,
 igr2=3025,3026,2353,2354,
 &end
#
#    0 AMB  20-2:1592     0 AMB  20-1:1592   4.50    (#   1592:20   Double Ambig)
 &rst
  ixpk= 1592, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=2257,2261, 709, 710,  87,2259,
 igr2=1893,1894,  77,  78,
 &end
#
#    0 AMB  20-2:1593     0 AMB  20-1:1593   4.50    (#   1593:20   Double Ambig)
 &rst
  ixpk= 1593, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=2257,2261, 709, 710,  87,2259,
 igr2=1893,1894,  77,  78,
 &end
#
#    8 ASP  HN            8 ASP  HB2         3.50    (#   1594:20   Unique)
 &rst
  ixpk= 1594, iat= 103, 107, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1595     9 LEU  HB2         6.00    (#   1595:20   Single Ambig)
 &rst
  ixpk= 1595, iat=  -1, 119, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 134,1796,
 &end
#
#   12 LEU  HN           11 PHE  QB          4.50    (#   1596:20   Unique)
 &rst
  ixpk= 1596, iat= 170,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 154, 155,
 &end
#
#   17 MET  HN           16 SER  QB          4.50    (#   1597:20   Unique)
 &rst
  ixpk= 1597, iat= 239,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 232, 233,
 &end
#
#   20 GLN  HN           19 LEU  HB-         4.50    (#   1598:20   Unique)
 &rst
  ixpk= 1598, iat= 288,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 273, 274,
 &end
#
#   22 ASP  HN           21 PRO  HB3         4.50    (#   1599:20   Unique)
 &rst
  ixpk= 1599, iat= 319, 313, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   22 ASP  HN           21 PRO  HB2         4.50    (#   1600:20   Unique)
 &rst
  ixpk= 1600, iat= 319, 312, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1601     0 AMB  20-1:1601   3.50    (#   1601:20   Double Ambig)
 &rst
  ixpk= 1601, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.47, r4= 7.22,
 igr1= 331,1964,1965, 378, 379,
 igr2= 323, 324,1992,1993, 447, 448, 447, 448,
 &end
#
#   23 GLU  HN           22 ASP  HB-         4.50    (#   1602:20   Unique)
 &rst
  ixpk= 1602, iat= 331,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 323, 324,
 &end
#
#   24 PHE  HN           23 GLU  HB-         6.00    (#   1603:20   Unique)
 &rst
  ixpk= 1603, iat= 346,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2= 335, 336,
 &end
#
#   26 LYS  HN            0 AMB  20-1:1604   3.50    (#   1604:20   Single Ambig)
 &rst
  ixpk= 1604, iat= 383,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 370, 371, 370, 371,
 &end
#
#   26 LYS  HN            0 AMB  20-1:1605   3.50    (#   1605:20   Single Ambig)
 &rst
  ixpk= 1605, iat= 383,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 370, 371, 370, 371,
 &end
#
#    0 AMB  20-2:1606     0 AMB  20-1:1606   2.70    (#   1606:20   Double Ambig)
 &rst
  ixpk= 1606, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.29, r4= 5.04,
 igr1=2761, 383,2783, 405,
 igr2=2765,2766, 387, 388,
 &end
#
#   28 LEU  HN           27 ILE  HB          3.50    (#   1607:20   Unique)
 &rst
  ixpk= 1607, iat= 424, 409, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   29 ASP  HN           28 LEU  HB+         4.50    (#   1608:20   Unique)
 &rst
  ixpk= 1608, iat= 443,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 428, 429,
 &end
#
#   29 ASP  HN           28 LEU  HB-         4.50    (#   1609:20   Unique)
 &rst
  ixpk= 1609, iat= 443,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 428, 429,
 &end
#
#    0 AMB  20-2:1610     0 AMB  20-1:1610   3.50    (#   1610:20   Double Ambig)
 &rst
  ixpk= 1610, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1121, 455,
 igr2=1125,1126, 447, 448, 447, 448,
 &end
#
#   31 MET  HN           30 PHE  QB          3.50    (#   1611:20   Unique)
 &rst
  ixpk= 1611, iat= 475,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 459, 460,
 &end
#
#   32 LYS  HN           31 MET  HB-         4.50    (#   1613:20   Unique)
 &rst
  ixpk= 1613, iat= 494,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 479, 480,
 &end
#
#    0 AMB  20-2:1614     0 AMB  20-1:1614   3.50    (#   1614:20   Double Ambig)
 &rst
  ixpk= 1614, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 585, 516,
 igr2= 589, 590, 498, 499,
 &end
#
#   34 VAL  HN           33 ASP  QB          3.50    (#   1615:20   Unique)
 &rst
  ixpk= 1615, iat= 528,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 520, 521,
 &end
#
#   35 MET  HN           34 VAL  HB          3.50    (#   1616:20   Unique)
 &rst
  ixpk= 1616, iat= 544, 532, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   36 LYS  HN           35 MET  HB2         6.00    (#   1617:20   Unique)
 &rst
  ixpk= 1617, iat= 563, 548, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:1618     0 AMB  20-1:1618   3.50    (#   1618:20   Double Ambig)
 &rst
  ixpk= 1618, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 585, 516,
 igr2= 567, 568, 498, 499,
 &end
#
#    0 AMB  20-2:1619     0 AMB  20-1:1619   3.50    (#   1619:20   Double Ambig)
 &rst
  ixpk= 1619, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 585, 516,
 igr2= 567, 568, 498, 499,
 &end
#
#   38 LEU  HN            0 AMB  20-1:1620   3.50    (#   1620:20   Single Ambig)
 &rst
  ixpk= 1620, iat= 607,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 589, 590, 589, 590,
 &end
#
#    0 AMB  20-2:1621     0 AMB  20-1:1621   3.50    (#   1621:20   Double Ambig)
 &rst
  ixpk= 1621, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1027, 607,
 igr2=1031,1032, 589, 590, 589, 590,
 &end
#
#    0 AMB  20-2:1622     0 AMB  20-1:1622   3.50    (#   1622:20   Double Ambig)
 &rst
  ixpk= 1622, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 676,1011,
 igr2= 669, 670, 992,
 &end
#
#   44 GLN  HN           43 TYR  HB2         4.50    (#   1623:20   Unique)
 &rst
  ixpk= 1623, iat= 697, 680, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1624     0 AMB  20-1:1624   4.50    (#   1624:20   Double Ambig)
 &rst
  ixpk= 1624, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 697,1484,
 igr2= 681, 847, 848,
 &end
#
#   45 PHE  HN            0 AMB  20-1:1625   4.50    (#   1625:20   Single Ambig)
 &rst
  ixpk= 1625, iat= 714,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr2= 701, 702, 701, 702,
 &end
#
#   46 ALA  HN           45 PHE  HB3         4.50    (#   1626:20   Unique)
 &rst
  ixpk= 1626, iat= 734, 719, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   46 ALA  HN           45 PHE  HB2         4.50    (#   1627:20   Unique)
 &rst
  ixpk= 1627, iat= 734, 718, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   47 ALA  HN           46 ALA  MB          3.50    (#   1628:20   Unique)
 &rst
  ixpk= 1628, iat= 744,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 738, 739, 740,
 &end
#
#    0 AMB  20-2:1629    50 PHE  HB3         6.00    (#   1629:20   Single Ambig)
 &rst
  ixpk= 1629, iat=  -1, 792, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 807, 221,
 &end
#
#   52 THR  HN           51 SER  HB+         4.50    (#   1630:20   Unique)
 &rst
  ixpk= 1630, iat= 818,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 811, 812,
 &end
#
#   52 THR  HN           51 SER  HB-         4.50    (#   1631:20   Unique)
 &rst
  ixpk= 1631, iat= 818,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 811, 812,
 &end
#
#   53 SER  HN           52 THR  HB          3.50    (#   1632:20   Unique)
 &rst
  ixpk= 1632, iat= 832, 822, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   54 TYR  HN           53 SER  QB          3.50    (#   1633:20   Unique)
 &rst
  ixpk= 1633, iat= 843,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 836, 837,
 &end
#
#    0 AMB  20-2:1634     0 AMB  20-1:1634   4.50    (#   1634:20   Double Ambig)
 &rst
  ixpk= 1634, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 864, 150,
 igr2= 847, 848,1800,
 &end
#
#   55 LYS  HN           54 TYR  HB-         4.50    (#   1635:20   Unique)
 &rst
  ixpk= 1635, iat= 864,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 847, 848,
 &end
#
#    0 AMB  20-2:1636    57 GLU  HB3         4.50    (#   1636:20   Single Ambig)
 &rst
  ixpk= 1636, iat=  -1, 905, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 915, 782, 783, 744,
 &end
#
#    0 AMB  20-2:1637     0 AMB  20-1:1637   3.50    (#   1637:20   Double Ambig)
 &rst
  ixpk= 1637, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 915, 782, 783,
 igr2= 904, 874, 875,
 &end
#
#   59 ASP  HN           58 PHE  HB+         4.50    (#   1638:20   Unique)
 &rst
  ixpk= 1638, iat= 935,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 919, 920,
 &end
#
#   59 ASP  HN           58 PHE  HB-         4.50    (#   1639:20   Unique)
 &rst
  ixpk= 1639, iat= 935,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 919, 920,
 &end
#
#   61 SER  HN           60 PHE  HB+         3.50    (#   1640:20   Unique)
 &rst
  ixpk= 1640, iat= 967,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 951, 952,
 &end
#
#   61 SER  HN           60 PHE  HB-         4.50    (#   1641:20   Unique)
 &rst
  ixpk= 1641, iat= 967,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 951, 952,
 &end
#
#   63 TYR  HN           62 ASP  HB2         4.50    (#   1644:20   Unique)
 &rst
  ixpk= 1644, iat= 990, 982, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   64 VAL  HN           63 TYR  HB+         4.50    (#   1645:20   Unique)
 &rst
  ixpk= 1645, iat=1011,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 994, 995,
 &end
#
#   64 VAL  HN           63 TYR  HB-         4.50    (#   1646:20   Unique)
 &rst
  ixpk= 1646, iat=1011,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 994, 995,
 &end
#
#    0 AMB  20-2:1647     0 AMB  20-1:1647   3.50    (#   1647:20   Double Ambig)
 &rst
  ixpk= 1647, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2983,1027,
 igr2=2987,1015,
 &end
#
#   66 TRP  HN           65 LYS  HB+         3.50    (#   1648:20   Unique)
 &rst
  ixpk= 1648, iat=1049,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1031,1032,
 &end
#
#    0 AMB  20-2:1649     0 AMB  20-1:1649   3.50    (#   1649:20   Double Ambig)
 &rst
  ixpk= 1649, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 585,1049,
 igr2= 589, 590,1031,1032,
 &end
#
#   67 LYS  HN           66 TRP  HB3         4.50    (#   1650:20   Unique)
 &rst
  ixpk= 1650, iat=1073,1054, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   67 LYS  HN           66 TRP  HB2         4.50    (#   1651:20   Unique)
 &rst
  ixpk= 1651, iat=1073,1053, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1652     0 AMB  20-1:1652   3.50    (#   1652:20   Double Ambig)
 &rst
  ixpk= 1652, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2105,1095,
 igr2=2097,1077,1078,
 &end
#
#    0 AMB  20-2:1654     0 AMB  20-1:1654   3.50    (#   1654:20   Double Ambig)
 &rst
  ixpk= 1654, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1= 494,2491,1121, 818,
 igr2= 498, 499,2495,1115,1280,
 &end
#
#    0 AMB  20-2:1655     0 AMB  20-1:1655   3.50    (#   1655:20   Double Ambig)
 &rst
  ixpk= 1655, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1133, 424,
 igr2=1125,1126, 447, 448,
 &end
#
#   71 ALA  HN           70 ASP  HB-         3.50    (#   1656:20   Unique)
 &rst
  ixpk= 1656, iat=1133,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1125,1126,
 &end
#
#    0 AMB  20-2:1657    72 LEU  HB3         6.00    (#   1657:20   Single Ambig)
 &rst
  ixpk= 1657, iat=  -1,1148, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1162, 927,1181,
 &end
#
#    0 AMB  20-2:1658     0 AMB  20-1:1658   4.50    (#   1658:20   Double Ambig)
 &rst
  ixpk= 1658, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1=1220, 923, 931,1181,2450,
 igr2=1207,1208,2415,
 &end
#
#    0 AMB  20-2:1659     0 AMB  20-1:1659   4.50    (#   1659:20   Double Ambig)
 &rst
  ixpk= 1659, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1=1220, 923, 931,1181,2450,
 igr2=1207,1208,2416,
 &end
#
#   77 LYS  HN            0 AMB  20-1:1660   6.00    (#   1660:20   Single Ambig)
 &rst
  ixpk= 1660, iat=1236,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1224,1262,
 &end
#
#    0 AMB  20-2:1661    79 MET  HB2         4.50    (#   1661:20   Single Ambig)
 &rst
  ixpk= 1661, iat=  -1,1279, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1294, 807,
 &end
#
#    0 AMB  20-2:1662     0 AMB  20-1:1662   4.50    (#   1662:20   Double Ambig)
 &rst
  ixpk= 1662, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1313, 269,
 igr2=1298,1299,1336,1337,
 &end
#
#   82 LEU  HN           81 LEU  HB3         4.50    (#   1663:20   Unique)
 &rst
  ixpk= 1663, iat=1332,1318, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   82 LEU  HN           81 LEU  HB2         4.50    (#   1664:20   Unique)
 &rst
  ixpk= 1664, iat=1332,1317, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   83 THR  HN           82 LEU  HB+         3.50    (#   1665:20   Unique)
 &rst
  ixpk= 1665, iat=1351,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1336,1337,
 &end
#
#   83 THR  HN           82 LEU  HB-         3.50    (#   1666:20   Unique)
 &rst
  ixpk= 1666, iat=1351,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1336,1337,
 &end
#
#   86 PHE  HN           85 THR  HB          4.50    (#   1667:20   Unique)
 &rst
  ixpk= 1667, iat=1393,1383, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   87 GLY  HN           86 PHE  HB2         4.50    (#   1668:20   Unique)
 &rst
  ixpk= 1668, iat=1413,1397, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   87 GLY  HN           86 PHE  HB3         4.50    (#   1669:20   Unique)
 &rst
  ixpk= 1669, iat=1413,1398, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1670    88 ALA  MB          3.50    (#   1670:20   Single Ambig)
 &rst
  ixpk= 1670, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1420,1430,
 igr2=1424,1425,1426,
 &end
#
#   90 ASN  HN           89 ILE  HB          3.50    (#   1671:20   Unique)
 &rst
  ixpk= 1671, iat=1449,1434, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1672    91 TYR  HB3         3.50    (#   1672:20   Single Ambig)
 &rst
  ixpk= 1672, iat=  -1,1468, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1484,1463,
 &end
#
#    0 AMB  20-2:1673    91 TYR  HB2         3.50    (#   1673:20   Single Ambig)
 &rst
  ixpk= 1673, iat=  -1,1467, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1463,1484,
 &end
#
#   94 THR  HN           93 ALA  MB          3.50    (#   1674:20   Unique)
 &rst
  ixpk= 1674, iat=1510,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1504,1505,1506,
 &end
#
#   95 GLU  HN           94 THR  HB          4.50    (#   1675:20   Unique)
 &rst
  ixpk= 1675, iat=1524,1514, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1676     0 AMB  20-1:1676   3.50    (#   1676:20   Double Ambig)
 &rst
  ixpk= 1676, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 955, 963,1539,1555, 998,1007,
 igr2= 701, 702, 701, 702,1543,
 &end
#
#  100 GLU  HN           99 GLU  QB          6.00    (#   1677:20   Unique)
 &rst
  ixpk= 1677, iat=1614,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1603,1604,
 &end
#
#  101 LEU  HN          100 GLU  HB+         3.50    (#   1678:20   Unique)
 &rst
  ixpk= 1678, iat=1629,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1618,1619,
 &end
#
#  101 LEU  HN          100 GLU  HB-         4.50    (#   1679:20   Unique)
 &rst
  ixpk= 1679, iat=1629,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1618,1619,
 &end
#
#  106 ASP  HN          105 PRO  HB3         4.50    (#   1680:20   Unique)
 &rst
  ixpk= 1680, iat=1703,1697, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  107 ALA  HN          106 ASP  HB+         4.50    (#   1681:20   Unique)
 &rst
  ixpk= 1681, iat=1715,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1707,1708,
 &end
#
#    0 AMB  20-2:1682     0 AMB  20-1:1682   3.50    (#   1682:20   Double Ambig)
 &rst
  ixpk= 1682, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2563,1715,
 igr2=2567,2568,1707,1708,
 &end
#
#  108 THR  HN          107 ALA  MB          3.50    (#   1683:20   Unique)
 &rst
  ixpk= 1683, iat=1725,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1719,1720,1721,
 &end
#
#  109 LYS  HN          108 THR  HB          4.50    (#   1684:20   Unique)
 &rst
  ixpk= 1684, iat=1739,1729, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  110 VAL  HN            0 AMB  20-1:1685   6.00    (#   1685:20   Single Ambig)
 &rst
  ixpk= 1685, iat=1761,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1744,  91,
 &end
#
#    0 AMB  20-2:1686   111 LEU  HB3         4.50    (#   1686:20   Single Ambig)
 &rst
  ixpk= 1686, iat=  -1,1782, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2116,1796, 134,
 &end
#
#    0 AMB  20-2:1687   111 LEU  HB2         4.50    (#   1687:20   Single Ambig)
 &rst
  ixpk= 1687, iat=  -1,1781, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1796, 134,
 &end
#
#    0 AMB  20-2:1688     0 AMB  20-1:1688   4.50    (#   1688:20   Double Ambig)
 &rst
  ixpk= 1688, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1834,1365,2137,
 igr2=1819,1336,1337,2160,
 &end
#
#  119 ALA  HN          118 GLU  HB2         4.50    (#   1689:20   Unique)
 &rst
  ixpk= 1689, iat=1901,1890, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  120 THR  HN          119 ALA  MB          3.50    (#   1690:20   Unique)
 &rst
  ixpk= 1690, iat=1911,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1905,1906,1907,
 &end
#
#  122 SER  HN          121 ASP  HB+         3.50    (#   1691:20   Unique)
 &rst
  ixpk= 1691, iat=1937,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1929,1930,
 &end
#
#  122 SER  HN          121 ASP  HB-         3.50    (#   1692:20   Unique)
 &rst
  ixpk= 1692, iat=1937,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1929,1930,
 &end
#
#    0 AMB  20-2:1693   122 SER  QB          4.50    (#   1693:20   Single Ambig)
 &rst
  ixpk= 1693, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1948,2462,
 igr2=1941,1942,
 &end
#
#  129 LYS  HN          128 ALA  MB          4.50    (#   1694:20   Unique)
 &rst
  ixpk= 1694, iat=2020,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2014,2015,2016,
 &end
#
#    0 AMB  20-2:1695   135 ILE  HB          4.50    (#   1695:20   Single Ambig)
 &rst
  ixpk= 1695, iat=  -1,2141, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2156,1853,
 &end
#
#  137 GLY  HN          136 ILE  HB          6.00    (#   1696:20   Unique)
 &rst
  ixpk= 1696, iat=2175,2160, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:1697   138 ILE  HB          6.00    (#   1697:20   Single Ambig)
 &rst
  ixpk= 1697, iat=  -1,2186, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2201,1879,
 &end
#
#  142 PHE  HN          141 HIS  HB+         6.00    (#   1700:20   Unique)
 &rst
  ixpk= 1700, iat=2247,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=2234,2235,
 &end
#
#    0 AMB  20-2:1701     0 AMB  20-1:1701   3.50    (#   1701:20   Double Ambig)
 &rst
  ixpk= 1701, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2677,2678,2679, 657, 658, 659,
 igr2=2675, 655,
 &end
#
#    0 AMB  20-2:1703     0 AMB  20-1:1703   3.50    (#   1703:20   Double Ambig)
 &rst
  ixpk= 1703, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2346,2335,2943,2999,
 igr2=2339,2340,2945,
 &end
#
#    0 AMB  20-2:1704     0 AMB  20-1:1704   4.50    (#   1704:20   Double Ambig)
 &rst
  ixpk= 1704, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1=2378,2346,2428, 383, 405,
 igr2=2367,2368,2324,2325, 335, 336,
 &end
#
#    0 AMB  20-2:1705     0 AMB  20-1:1705   4.50    (#   1705:20   Double Ambig)
 &rst
  ixpk= 1705, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.14, r4= 7.89,
 igr1=2378,2279,2280,2428,
 igr2=2367,2368,2218,2219,
 &end
#
#  153 LYS  HN          152 HIS  HB2         4.50    (#   1706:20   Unique)
 &rst
  ixpk= 1706, iat=2428,2415, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  153 LYS  HN          152 HIS  HB3         4.50    (#   1707:20   Unique)
 &rst
  ixpk= 1707, iat=2428,2416, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  154 PHE  HN          153 LYS  HB+         4.50    (#   1708:20   Unique)
 &rst
  ixpk= 1708, iat=2450,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2432,2433,
 &end
#
#    0 AMB  20-2:1709   155 ALA  MB          4.50    (#   1709:20   Single Ambig)
 &rst
  ixpk= 1709, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2571,2579,2424,
 igr2=2474,2475,2476,
 &end
#
#    0 AMB  20-2:1710     0 AMB  20-1:1710   3.50    (#   1710:20   Double Ambig)
 &rst
  ixpk= 1710, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2548, 405, 383,
 igr2=2541,2542, 348,
 &end
#
#  164 LYS  HN          163 VAL  HB          6.00    (#   1711:20   Unique)
 &rst
  ixpk= 1711, iat=2599,2587, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:1712   165 ILE  HB          4.50    (#   1712:20   Single Ambig)
 &rst
  ixpk= 1712, iat=  -1,2625, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2640,2659,
 &end
#
#    0 AMB  20-2:1713     0 AMB  20-1:1713   3.50    (#   1713:20   Double Ambig)
 &rst
  ixpk= 1713, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2671,2450,
 igr2=2663,2664,2663,2664,2454,2455,
 &end
#
#    0 AMB  20-2:1715     0 AMB  20-1:1715   3.50    (#   1715:20   Double Ambig)
 &rst
  ixpk= 1715, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 665,2705,2685,
 igr2= 655,2675,
 &end
#
#    0 AMB  20-2:1716   169 PHE  HB3         4.50    (#   1716:20   Single Ambig)
 &rst
  ixpk= 1716, iat=  -1,2690, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2685,2705,
 &end
#
#  171 LYS  HN          170 GLU  QB          3.50    (#   1717:20   Unique)
 &rst
  ixpk= 1717, iat=2720,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2709,2710,
 &end
#
#    0 AMB  20-2:1718     0 AMB  20-1:1718   6.00    (#   1718:20   Double Ambig)
 &rst
  ixpk= 1718, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1=1049,2834,2010,
 igr2= 983,2787,2033,2034,
 &end
#
#  177 THR  HN          176 PHE  HB+         6.00    (#   1719:20   Unique)
 &rst
  ixpk= 1719, iat=2834,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=2818,2819,
 &end
#
#  177 THR  HN          176 PHE  HB-         4.50    (#   1720:20   Unique)
 &rst
  ixpk= 1720, iat=2834,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2818,2819,
 &end
#
#  178 GLU  HN          177 THR  HB          3.50    (#   1721:20   Unique)
 &rst
  ixpk= 1721, iat=2848,2838, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  180 GLN  HN            0 AMB  20-1:1722   4.50    (#   1722:20   Single Ambig)
 &rst
  ixpk= 1722, iat=2882,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr2=2867,2868,2867,2868,
 &end
#
#  180 GLN  HN            0 AMB  20-1:1723   4.50    (#   1723:20   Single Ambig)
 &rst
  ixpk= 1723, iat=2882,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr2=2867,2868,2867,2868,
 &end
#
#    0 AMB  20-2:1724     0 AMB  20-1:1724   3.50    (#   1724:20   Double Ambig)
 &rst
  ixpk= 1724, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.80, r4= 7.55,
 igr1=2899,2697,2695,2699,1565,1569, 356, 360, 467,
 igr2=2886,2887, 276,1784,2166,2167,
 &end
#
#    0 AMB  20-2:1725     0 AMB  20-1:1725   4.50    (#   1725:20   Double Ambig)
 &rst
  ixpk= 1725, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2999,2962, 947,
 igr2=2987, 701, 702,
 &end
#
#  187 GLU  HN          186 ILE  HB          4.50    (#   1726:20   Unique)
 &rst
  ixpk= 1726, iat=3018,3003, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1727    21 PRO  HA          3.50    (#   1727:20   Single Ambig)
 &rst
  ixpk= 1727, iat=  -1, 315, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 346, 366,
 &end
#
#    0 AMB  20-2:1728     0 AMB  20-1:1728   3.50    (#   1728:20   Double Ambig)
 &rst
  ixpk= 1728, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 366,2863, 346,
 igr2= 321,2797,
 &end
#
#    0 AMB  20-2:1729    23 GLU  HA          4.50    (#   1729:20   Single Ambig)
 &rst
  ixpk= 1729, iat=  -1, 333, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 383, 405,
 &end
#
#    0 AMB  20-2:1730     0 AMB  20-1:1730   3.50    (#   1730:20   Double Ambig)
 &rst
  ixpk= 1730, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 424, 463, 471,
 igr2= 368,2744,
 &end
#
#   29 ASP  HN           26 LYS  HA          3.50    (#   1731:20   Unique)
 &rst
  ixpk= 1731, iat= 443, 385, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   30 PHE  HN           27 ILE  HA          4.50    (#   1732:20   Unique)
 &rst
  ixpk= 1732, iat= 455, 407, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   33 ASP  HN           30 PHE  HA          3.50    (#   1733:20   Unique)
 &rst
  ixpk= 1733, iat= 516, 457, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1734    31 MET  HA          4.50    (#   1734:20   Single Ambig)
 &rst
  ixpk= 1734, iat=  -1, 477, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 528, 494,
 &end
#
#    0 AMB  20-2:1735    32 LYS  HA          4.50    (#   1735:20   Single Ambig)
 &rst
  ixpk= 1735, iat=  -1, 496, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 544, 475,
 &end
#
#   36 LYS  HN           33 ASP  HA          3.50    (#   1736:20   Unique)
 &rst
  ixpk= 1736, iat= 563, 518, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1737     0 AMB  20-1:1737   3.50    (#   1737:20   Double Ambig)
 &rst
  ixpk= 1737, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1420, 585,1430,
 igr2=1381, 530,
 &end
#
#    0 AMB  20-2:1738     0 AMB  20-1:1738   4.50    (#   1738:20   Double Ambig)
 &rst
  ixpk= 1738, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 990,1955,
 igr2= 949,1971,
 &end
#
#    8 ASP  HN            7 VAL  HA          3.50    (#   1739:20   Unique)
 &rst
  ixpk= 1739, iat= 103,  89, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1740    62 ASP  HA          3.50    (#   1740:20   Single Ambig)
 &rst
  ixpk= 1740, iat=  -1, 980, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1027,1062,
 &end
#
#   72 LEU  HN           69 PRO  HA          4.50    (#   1741:20   Unique)
 &rst
  ixpk= 1741, iat=1143,1117, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1742    70 ASP  HA          3.50    (#   1742:20   Single Ambig)
 &rst
  ixpk= 1742, iat=  -1,1123, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1162,1181,
 &end
#
#    0 AMB  20-2:1743    86 PHE  HA          4.50    (#   1743:20   Single Ambig)
 &rst
  ixpk= 1743, iat=  -1,1395, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1430,1420,
 &end
#
#    0 AMB  20-2:1744     0 AMB  20-1:1744   4.50    (#   1744:20   Double Ambig)
 &rst
  ixpk= 1744, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=1449,2247,2983,
 igr2=1415,1416,1881,1882,3035,3036,
 &end
#
#    0 AMB  20-2:1745    88 ALA  HA          3.50    (#   1745:20   Single Ambig)
 &rst
  ixpk= 1745, iat=  -1,1422, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1463,1484,
 &end
#
#    0 AMB  20-2:1746    89 ILE  HA          3.50    (#   1746:20   Single Ambig)
 &rst
  ixpk= 1746, iat=  -1,1432, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1484,1463,
 &end
#
#    0 AMB  20-2:1747    90 ASN  HA          3.50    (#   1747:20   Single Ambig)
 &rst
  ixpk= 1747, iat=  -1,1451, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1500,1463,1484,
 &end
#
#   95 GLU  HN           92 VAL  HA          6.00    (#   1748:20   Unique)
 &rst
  ixpk= 1748, iat=1524,1486, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  148 GLN  HN          145 LYS  HA          3.50    (#   1749:20   Unique)
 &rst
  ixpk= 1749, iat=2346,2300, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1750   149 GLU  HA          3.50    (#   1750:20   Single Ambig)
 &rst
  ixpk= 1750, iat=  -1,2365, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2363,2411,2421,
 &end
#
#    0 AMB  20-2:1751     0 AMB  20-1:1751   3.50    (#   1751:20   Double Ambig)
 &rst
  ixpk= 1751, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1563,1571,2563,
 igr2=1502,2529,
 &end
#
#    0 AMB  20-2:1752     0 AMB  20-1:1752   3.50    (#   1752:20   Double Ambig)
 &rst
  ixpk= 1752, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 405,2742,2761,
 igr2= 385,2707,
 &end
#
#    0 AMB  20-2:1753   171 LYS  HA          3.50    (#   1753:20   Single Ambig)
 &rst
  ixpk= 1753, iat=  -1,2722, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2783,2761,2742,
 &end
#
#  176 PHE  HN          173 LYS  HA          4.50    (#   1754:20   Unique)
 &rst
  ixpk= 1754, iat=2814,2763, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1755   176 PHE  HA          3.50    (#   1755:20   Single Ambig)
 &rst
  ixpk= 1755, iat=  -1,2816, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2863,2834,
 &end
#
#  180 GLN  HN          177 THR  HA          6.00    (#   1756:20   Unique)
 &rst
  ixpk= 1756, iat=2882,2836, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  181 LYS  HN          178 GLU  HA          3.50    (#   1757:20   Unique)
 &rst
  ixpk= 1757, iat=2899,2850, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1758    43 TYR  HA          3.50    (#   1758:20   Single Ambig)
 &rst
  ixpk= 1758, iat=  -1, 678, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=  87, 684, 693, 709, 710,
 &end
#
#    9 LEU  HN           45 PHE  HA          4.50    (#   1759:20   Unique)
 &rst
  ixpk= 1759, iat= 115, 716, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   11 PHE  HN           47 ALA  HA          3.50    (#   1760:20   Unique)
 &rst
  ixpk= 1760, iat= 150, 746, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1761    49 GLN  HA          3.50    (#   1761:20   Single Ambig)
 &rst
  ixpk= 1761, iat=  -1, 772, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 189, 754,
 &end
#
#   46 ALA  HN           10 VAL  HA          3.50    (#   1763:20   Unique)
 &rst
  ixpk= 1763, iat= 734, 136, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1764    12 LEU  HA          3.50    (#   1764:20   Single Ambig)
 &rst
  ixpk= 1764, iat=  -1, 172, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 189, 754,
 &end
#
#    0 AMB  20-2:1765   111 LEU  HA          3.50    (#   1765:20   Single Ambig)
 &rst
  ixpk= 1765, iat=  -1,1779, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1796, 134,
 &end
#
#   12 LEU  HN          113 ILE  HA          4.50    (#   1766:20   Unique)
 &rst
  ixpk= 1766, iat= 170,1817, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1767     0 AMB  20-1:1767   3.50    (#   1767:20   Double Ambig)
 &rst
  ixpk= 1767, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1725, 967, 978,
 igr2=  89, 969,
 &end
#
#  110 VAL  HN            9 LEU  HA          4.50    (#   1768:20   Unique)
 &rst
  ixpk= 1768, iat=1761, 117, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1769    11 PHE  HA          4.50    (#   1769:20   Single Ambig)
 &rst
  ixpk= 1769, iat=  -1, 152, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1796,1834, 134,
 &end
#
#  114 ILE  HN           13 PHE  HA          4.50    (#   1770:20   Unique)
 &rst
  ixpk= 1770, iat=1834, 191, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  111 LEU  HN          133 ARG  HA          4.50    (#   1771:20   Unique)
 &rst
  ixpk= 1771, iat=1777,2094, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1772   135 ILE  HA          3.50    (#   1772:20   Single Ambig)
 &rst
  ixpk= 1772, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1815,2599,
 &end
#
#    0 AMB  20-2:1773   137 GLY  HA+         4.50    (#   1773:20   Single Ambig)
 &rst
  ixpk= 1773, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1853,2156,
 igr2=2177,2178,
 &end
#
#    0 AMB  20-2:1774   137 GLY  HA-         6.00    (#   1774:20   Single Ambig)
 &rst
  ixpk= 1774, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=1853,2156,
 igr2=2177,2178,
 &end
#
#    0 AMB  20-2:1775   110 VAL  HA          3.50    (#   1775:20   Single Ambig)
 &rst
  ixpk= 1775, iat=  -1,1763, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2073,1739,
 &end
#
#    0 AMB  20-2:1776   112 ILE  HA          4.50    (#   1776:20   Single Ambig)
 &rst
  ixpk= 1776, iat=  -1,1798, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1796,2116,
 &end
#
#    0 AMB  20-2:1777   114 ILE  HA          3.50    (#   1777:20   Single Ambig)
 &rst
  ixpk= 1777, iat=  -1,1836, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1853,2156,
 &end
#
#  164 LYS  HN          136 ILE  HA          3.50    (#   1778:20   Unique)
 &rst
  ixpk= 1778, iat=2599,2158, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  137 GLY  HN          165 ILE  HA          3.50    (#   1780:20   Unique)
 &rst
  ixpk= 1780, iat=2175,2623, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   57 GLU  HN           48 VAL  HA          3.50    (#   1781:20   Unique)
 &rst
  ixpk= 1781, iat= 900, 756, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   48 VAL  HA           56 THR  HA          3.50    (#   1782:20   Unique)
 &rst
  ixpk= 1782, iat= 756, 888, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   56 THR  HA           48 VAL  HA          3.50    (#   1783:20   Unique)
 &rst
  ixpk= 1783, iat= 888, 756, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   54 TYR  HA           50 PHE  HA          3.50    (#   1784:20   Unique)
 &rst
  ixpk= 1784, iat= 845, 789, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   50 PHE  HA           54 TYR  HA          3.50    (#   1785:20   Unique)
 &rst
  ixpk= 1785, iat= 789, 845, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  170 GLU  QB          168 THR  HB          4.50    (#   1786:20   Unique)
 &rst
  ixpk= 1786, iat=  -1,2675, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2709,2710,
 &end
#
#    0 AMB  20-2:1787   115 THR  HB          3.50    (#   1787:20   Single Ambig)
 &rst
  ixpk= 1787, iat=  -1,1857, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 213, 214, 213, 214,
 &end
#
#    0 AMB  20-2:1788   115 THR  HB          3.50    (#   1788:20   Single Ambig)
 &rst
  ixpk= 1788, iat=  -1,1857, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 799, 797, 801,
 &end
#
#    0 AMB  20-2:1789   115 THR  HB          3.50    (#   1789:20   Single Ambig)
 &rst
  ixpk= 1789, iat=  -1,1857, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1859,1860,1861,1357,1358,1359,
 &end
#
#  144 THR  MG2         144 THR  HB          3.50    (#   1790:20   Unique)
 &rst
  ixpk= 1790, iat=  -1,2288, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2290,2291,2292,
 &end
#
#    0 AMB  20-2:1791     0 AMB  20-1:1791   3.50    (#   1791:20   Double Ambig)
 &rst
  ixpk= 1791, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2677,2678,2679, 657, 658, 659,
 igr2=2675, 655,
 &end
#
#  135 ILE  MD1         115 THR  HB          4.50    (#   1792:20   Unique)
 &rst
  ixpk= 1792, iat=  -1,1857, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2150,2151,2152,
 &end
#
#  113 ILE  MG2         115 THR  HB          3.50    (#   1793:20   Unique)
 &rst
  ixpk= 1793, iat=  -1,1857, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1821,1822,1823,
 &end
#
#  146 GLU  HN          144 THR  HB          4.50    (#   1794:20   Unique)
 &rst
  ixpk= 1794, iat=2320,2288, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1796     0 AMB  20-1:1796   4.50    (#   1796:20   Double Ambig)
 &rst
  ixpk= 1796, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2327,2328,2712,2713,
 igr2=2288,2675,
 &end
#
#    0 AMB  20-2:1797     0 AMB  20-1:1797   6.00    (#   1797:20   Double Ambig)
 &rst
  ixpk= 1797, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=2687,2300,
 igr2=2675,2288,
 &end
#
#   95 GLU  QG           94 THR  HB          4.50    (#   1799:20   Unique)
 &rst
  ixpk= 1799, iat=  -1,1514, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1531,1532,
 &end
#
#   94 THR  MG2          94 THR  HB          2.70    (#   1800:20   Unique)
 &rst
  ixpk= 1800, iat=  -1,1514, r1= 0.00, r2= 1.80, r3= 3.24, r4= 3.99,
 igr1=1516,1517,1518,
 &end
#
#    0 AMB  20-2:1801    94 THR  HB          6.00    (#   1801:20   Single Ambig)
 &rst
  ixpk= 1801, iat=  -1,1514, r1= 0.00, r2= 1.80, r3= 8.49, r4= 9.24,
 igr1=1504,1505,1506,2004,2005,2006,1582,1583,
 &end
#
#    0 AMB  20-2:1803    83 THR  HB          3.50    (#   1803:20   Single Ambig)
 &rst
  ixpk= 1803, iat=  -1,1355, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1917,1918,1919,1357,1358,1359,
 &end
#
#  120 THR  MG2         120 THR  HB          3.50    (#   1804:20   Unique)
 &rst
  ixpk= 1804, iat=  -1,1915, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1917,1918,1919,
 &end
#
#   82 LEU  MDX         120 THR  HB          4.50    (#   1805:20   Unique)
 &rst
  ixpk= 1805, iat=  -1,1915, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1341,1342,1343,1345,1346,1347,
 &end
#
#   82 LEU  MDY         120 THR  HB          4.50    (#   1806:20   Unique)
 &rst
  ixpk= 1806, iat=  -1,1915, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1341,1342,1343,1345,1346,1347,
 &end
#
#  119 ALA  HA           83 THR  HB          4.50    (#   1807:20   Unique)
 &rst
  ixpk= 1807, iat=1903,1355, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   83 THR  HN          120 THR  HB          4.50    (#   1811:20   Unique)
 &rst
  ixpk= 1811, iat=1351,1915, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1812   150 THR  HB          3.50    (#   1812:20   Single Ambig)
 &rst
  ixpk= 1812, iat=  -1,2382, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=2384,2385,2386,2438,2439,
 &end
#
#  150 THR  HA          150 THR  HB          3.50    (#   1813:20   Preassigned)
 &rst
  ixpk= 1813, iat=2380,2382, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1816   150 THR  HB          6.00    (#   1816:20   Single Ambig)
 &rst
  ixpk= 1816, iat=  -1,2382, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=2392,1403,1407,
 &end
#
#    0 AMB  20-2:1817   150 THR  HB          4.50    (#   1817:20   Single Ambig)
 &rst
  ixpk= 1817, iat=  -1,2382, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2378,2428,
 &end
#
#    0 AMB  20-2:1818   108 THR  HB          3.50    (#   1818:20   Single Ambig)
 &rst
  ixpk= 1818, iat=  -1,1729, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  97,  98,  99,  93,  94,  95,
 &end
#
#  108 THR  MG2         108 THR  HB          3.50    (#   1819:20   Unique)
 &rst
  ixpk= 1819, iat=  -1,1729, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1731,1732,1733,
 &end
#
#  110 VAL  MG2         108 THR  HB          3.50    (#   1820:20   Unique)
 &rst
  ixpk= 1820, iat=  -1,1729, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1771,1772,1773,
 &end
#
#  107 ALA  HA          108 THR  HB          6.00    (#   1821:20   Unique)
 &rst
  ixpk= 1821, iat=1717,1729, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    7 VAL  HA          108 THR  HB          6.00    (#   1822:20   Unique)
 &rst
  ixpk= 1822, iat=  89,1729, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   85 THR  MG2          85 THR  HB          3.50    (#   1824:20   Preassigned)
 &rst
  ixpk= 1824, iat=  -1,1383, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1385,1386,1387,
 &end
#
#  119 ALA  MB           85 THR  HB          3.50    (#   1825:20   Unique)
 &rst
  ixpk= 1825, iat=  -1,1383, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1905,1906,1907,
 &end
#
#   85 THR  HG1          85 THR  HB          3.50    (#   1826:20   Unique)
 &rst
  ixpk= 1826, iat=1389,1383, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1827    85 THR  HB          3.50    (#   1827:20   Single Ambig)
 &rst
  ixpk= 1827, iat=  -1,1383, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1903,1367,
 &end
#
#   50 PHE  HE           85 THR  HB          6.00    (#   1828:20   Unique)
 &rst
  ixpk= 1828, iat=  -1,1383, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 797, 801,
 &end
#
#    0 AMB  20-2:1829    85 THR  HB          6.00    (#   1829:20   Single Ambig)
 &rst
  ixpk= 1829, iat=  -1,1383, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1357,1358,1359,1859,1860,1861,
 &end
#
#    0 AMB  20-2:1831    52 THR  HB          3.50    (#   1831:20   Single Ambig)
 &rst
  ixpk= 1831, iat=  -1, 822, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1322,1323,1324,1326,1327,1328,1322,1323,1324,1326,
      1327,1328,
 &end
#
#   52 THR  MG2          52 THR  HB          3.50    (#   1832:20   Unique)
 &rst
  ixpk= 1832, iat=  -1, 822, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 824, 825, 826,
 &end
#
#    0 AMB  20-2:1833    52 THR  HB          3.50    (#   1833:20   Single Ambig)
 &rst
  ixpk= 1833, iat=  -1, 822, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1317,1336,1337,1339,
 &end
#
#    0 AMB  20-2:1834    52 THR  HB          3.50    (#   1834:20   Single Ambig)
 &rst
  ixpk= 1834, iat=  -1, 822, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1318,1336,1337,1280,
 &end
#
#    0 AMB  20-2:1835    52 THR  HB          4.50    (#   1835:20   Single Ambig)
 &rst
  ixpk= 1835, iat=  -1, 822, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 836, 837, 811, 812, 834,1369,
 &end
#
#   51 SER  HB+          52 THR  HB          4.50    (#   1836:20   Unique)
 &rst
  ixpk= 1836, iat=  -1, 822, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 811, 812,
 &end
#
#    0 AMB  20-2:1837    52 THR  HB          3.50    (#   1837:20   Single Ambig)
 &rst
  ixpk= 1837, iat=  -1, 822, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 828, 839,
 &end
#
#   82 LEU  HN           52 THR  HB          6.00    (#   1838:20   Unique)
 &rst
  ixpk= 1838, iat=1332, 822, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:1839   177 THR  HB          6.00    (#   1839:20   Single Ambig)
 &rst
  ixpk= 1839, iat=  -1,2838, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=2886,2887,2903,2904,
 &end
#
#  177 THR  MG2         177 THR  HB          3.50    (#   1840:20   Unique)
 &rst
  ixpk= 1840, iat=  -1,2838, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2840,2841,2842,
 &end
#
#  178 GLU  QB          177 THR  HB          4.50    (#   1841:20   Unique)
 &rst
  ixpk= 1841, iat=  -1,2838, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2852,2853,
 &end
#
#   56 THR  MG2          56 THR  HB          3.50    (#   1842:20   Unique)
 &rst
  ixpk= 1842, iat=  -1, 890, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 892, 893, 894,
 &end
#
#    0 AMB  20-2:1843    56 THR  HB          4.50    (#   1843:20   Single Ambig)
 &rst
  ixpk= 1843, iat=  -1, 890, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=1549,1550,1551, 760, 761, 762, 764, 765, 766,
 &end
#
#    0 AMB  20-2:1844    56 THR  HB          4.50    (#   1844:20   Single Ambig)
 &rst
  ixpk= 1844, iat=  -1, 890, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 902, 917, 756,
 &end
#
#    0 AMB  20-2:1845    34 VAL  HA          3.50    (#   1845:20   Single Ambig)
 &rst
  ixpk= 1845, iat=  -1, 530, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 595, 596, 592, 593,
 &end
#
#   37 LYS  QD           34 VAL  HA          3.50    (#   1846:20   Unique)
 &rst
  ixpk= 1846, iat=  -1, 530, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 595, 596,
 &end
#
#    0 AMB  20-2:1847    34 VAL  HA          3.50    (#   1847:20   Single Ambig)
 &rst
  ixpk= 1847, iat=  -1, 530, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 589, 590, 589, 590,2886,2887,
 &end
#
#  172 LEU  MDX          27 ILE  HA          3.50    (#   1850:20   Unique)
 &rst
  ixpk= 1850, iat=  -1, 407, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2751,2752,2753,2755,2756,2757,
 &end
#
#  172 LEU  MDY          27 ILE  HA          4.50    (#   1851:20   Unique)
 &rst
  ixpk= 1851, iat=  -1, 407, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2751,2752,2753,2755,2756,2757,
 &end
#
#   30 PHE  QB           27 ILE  HA          3.50    (#   1853:20   Unique)
 &rst
  ixpk= 1853, iat=  -1, 407, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 459, 460,
 &end
#
#    0 AMB  20-2:1854    85 THR  HA          6.00    (#   1854:20   Single Ambig)
 &rst
  ixpk= 1854, iat=  -1,1381, r1= 0.00, r2= 1.80, r3= 7.85, r4= 8.60,
 igr1=1825,1826,1975,1976,1977,
 &end
#
#   88 ALA  MB           85 THR  HA          3.50    (#   1855:20   Unique)
 &rst
  ixpk= 1855, iat=  -1,1381, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1424,1425,1426,
 &end
#
#    0 AMB  20-2:1856     0 AMB  20-1:1856   3.50    (#   1856:20   Double Ambig)
 &rst
  ixpk= 1856, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 589, 590,1440,1441, 177,
 igr2= 530,1381,
 &end
#
#    0 AMB  20-2:1857     0 AMB  20-1:1857   6.00    (#   1857:20   Double Ambig)
 &rst
  ixpk= 1857, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.81, r4= 9.56,
 igr1=2889,2890,1905,1906,1907,
 igr2= 530,1381,
 &end
#
#    0 AMB  20-2:1858    85 THR  HA          3.50    (#   1858:20   Single Ambig)
 &rst
  ixpk= 1858, iat=  -1,1381, r1= 0.00, r2= 1.80, r3= 5.22, r4= 5.97,
 igr1= 179, 180, 181, 183, 184, 185,1440,1441,1443,1444,
      1445,
 &end
#
#   85 THR  HG1          85 THR  HA          4.50    (#   1859:20   Unique)
 &rst
  ixpk= 1859, iat=1389,1381, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1860    85 THR  HA          4.50    (#   1860:20   Single Ambig)
 &rst
  ixpk= 1860, iat=  -1,1381, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1395,1415,1416,
 &end
#
#    0 AMB  20-2:1861     0 AMB  20-1:1861   4.50    (#   1861:20   Double Ambig)
 &rst
  ixpk= 1861, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 795, 803,2894,2895,
 igr2=1381, 530,
 &end
#
#    0 AMB  20-2:1862     0 AMB  20-1:1862   6.00    (#   1862:20   Double Ambig)
 &rst
  ixpk= 1862, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1401,1409, 467,
 igr2=1381, 530,
 &end
#
#    0 AMB  20-2:1863    34 VAL  HA          3.50    (#   1863:20   Single Ambig)
 &rst
  ixpk= 1863, iat=  -1, 530, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=2824,2828,2822,2830,2826,
 &end
#
#    0 AMB  20-2:1864     0 AMB  20-1:1864   4.50    (#   1864:20   Double Ambig)
 &rst
  ixpk= 1864, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=2824,2828, 797, 801,2826,
 igr2= 530,1381,
 &end
#
#    0 AMB  20-2:1865    34 VAL  HA          4.50    (#   1865:20   Single Ambig)
 &rst
  ixpk= 1865, iat=  -1, 530, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2822,2830,2894,2895,
 &end
#
#   24 PHE  HB3          21 PRO  HA          3.50    (#   1866:20   Unique)
 &rst
  ixpk= 1866, iat= 351, 315, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1867    21 PRO  HA          6.00    (#   1867:20   Single Ambig)
 &rst
  ixpk= 1867, iat=  -1, 315, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1= 306, 307, 306, 307,
 &end
#
#  180 GLN  HB-         177 THR  HA          4.50    (#   1868:20   Unique)
 &rst
  ixpk= 1868, iat=  -1,2836, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2886,2887,
 &end
#
#  180 GLN  HB+         177 THR  HA          3.50    (#   1870:20   Unique)
 &rst
  ixpk= 1870, iat=  -1,2836, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2886,2887,
 &end
#
#  180 GLN  QG          177 THR  HA          3.50    (#   1871:20   Unique)
 &rst
  ixpk= 1871, iat=  -1,2836, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2889,2890,
 &end
#
#    0 AMB  20-2:1876    21 PRO  HA          4.50    (#   1876:20   Single Ambig)
 &rst
  ixpk= 1876, iat=  -1, 315, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 354, 362, 331,
 &end
#
#  181 LYS  HN          177 THR  HA          4.50    (#   1877:20   Unique)
 &rst
  ixpk= 1877, iat=2899,2836, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   16 SER  HG           16 SER  QB          6.00    (#   1878:20   Unique)
 &rst
  ixpk= 1878, iat= 235,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2= 232, 233,
 &end
#
#    0 AMB  20-2:1879   177 THR  HA          6.00    (#   1879:20   Single Ambig)
 &rst
  ixpk= 1879, iat=  -1,2836, r1= 0.00, r2= 1.80, r3= 7.85, r4= 8.60,
 igr1=2822,2830,2824,2828,2826,
 &end
#
#    0 AMB  20-2:1880    92 VAL  HA          4.50    (#   1880:20   Single Ambig)
 &rst
  ixpk= 1880, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1545,1546,1547, 144, 145, 146, 179, 180, 181, 183,
       184, 185,
 &end
#
#    0 AMB  20-2:1881    92 VAL  HA          3.50    (#   1881:20   Single Ambig)
 &rst
  ixpk= 1881, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1549,1550,1551, 760, 761, 762, 764, 765, 766,
 &end
#
#   96 VAL  HB           92 VAL  HA          3.50    (#   1882:20   Unique)
 &rst
  ixpk= 1882, iat=1543,1486, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   92 VAL  HB           89 ILE  HA          3.50    (#   1883:20   Unique)
 &rst
  ixpk= 1883, iat=1488,1432, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1884    89 ILE  HA          3.50    (#   1884:20   Single Ambig)
 &rst
  ixpk= 1884, iat=  -1,1432, r1= 0.00, r2= 1.80, r3= 4.84, r4= 5.59,
 igr1=1494,1495,1496,2014,2015,2016, 174,
 &end
#
#    0 AMB  20-2:1885    89 ILE  HA          3.50    (#   1885:20   Single Ambig)
 &rst
  ixpk= 1885, iat=  -1,1432, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,
 &end
#
#    0 AMB  20-2:1886    89 ILE  HA          3.50    (#   1886:20   Single Ambig)
 &rst
  ixpk= 1886, iat=  -1,1432, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,
 &end
#
#    0 AMB  20-2:1887    92 VAL  HA          3.50    (#   1887:20   Single Ambig)
 &rst
  ixpk= 1887, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1539,1555,
 &end
#
#   67 LYS  QB           64 VAL  HA          6.00    (#   1888:20   Unique)
 &rst
  ixpk= 1888, iat=  -1,1013, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1077,1078,
 &end
#
#   67 LYS  HD+          64 VAL  HA          4.50    (#   1889:20   Unique)
 &rst
  ixpk= 1889, iat=  -1,1013, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1083,1084,
 &end
#
#   67 LYS  QE           64 VAL  HA          4.50    (#   1890:20   Unique)
 &rst
  ixpk= 1890, iat=  -1,1013, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1086,1087,
 &end
#
#   65 LYS  HB-          64 VAL  HA          6.00    (#   1891:20   Unique)
 &rst
  ixpk= 1891, iat=  -1,1013, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1031,1032,
 &end
#
#   67 LYS  HN           64 VAL  HA          6.00    (#   1893:20   Unique)
 &rst
  ixpk= 1893, iat=1073,1013, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   63 TYR  HD           64 VAL  HA          4.50    (#   1894:20   Unique)
 &rst
  ixpk= 1894, iat=  -1,1013, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 998,1007,
 &end
#
#    0 AMB  20-2:1897    52 THR  HA          3.50    (#   1897:20   Single Ambig)
 &rst
  ixpk= 1897, iat=  -1, 820, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1336,1337,1317,
 &end
#
#   82 LEU  HB+          52 THR  HA          3.50    (#   1898:20   Unique)
 &rst
  ixpk= 1898, iat=  -1, 820, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1336,1337,
 &end
#
#   84 ASN  HB3          52 THR  HA          4.50    (#   1899:20   Unique)
 &rst
  ixpk= 1899, iat=1370, 820, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   84 ASN  HB2          52 THR  HA          6.00    (#   1900:20   Unique)
 &rst
  ixpk= 1900, iat=1369, 820, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   82 LEU  MDX          52 THR  HA          3.50    (#   1901:20   Unique)
 &rst
  ixpk= 1901, iat=  -1, 820, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1341,1342,1343,1345,1346,1347,
 &end
#
#    0 AMB  20-2:1902    52 THR  HA          3.50    (#   1902:20   Single Ambig)
 &rst
  ixpk= 1902, iat=  -1, 820, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1341,1342,1343,1345,1346,1347,1322,1323,1324,1326,
      1327,1328,1322,1323,1324,1326,1327,1328,
 &end
#
#   72 LEU  MDX          69 PRO  HA          3.50    (#   1903:20   Unique)
 &rst
  ixpk= 1903, iat=  -1,1117, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:1904    69 PRO  HA          4.50    (#   1904:20   Single Ambig)
 &rst
  ixpk= 1904, iat=  -1,1117, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1152,1153,1154,1156,1157,1158,1171,1172,1173,1175,
      1176,1177,
 &end
#
#    0 AMB  20-2:1905    69 PRO  HA          4.50    (#   1905:20   Single Ambig)
 &rst
  ixpk= 1905, iat=  -1,1117, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1148, 479, 480,
 &end
#
#   72 LEU  HB2          69 PRO  HA          3.50    (#   1906:20   Unique)
 &rst
  ixpk= 1906, iat=1147,1117, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1907    69 PRO  HA          4.50    (#   1907:20   Single Ambig)
 &rst
  ixpk= 1907, iat=  -1,1117, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1169, 549, 501, 502, 498, 499,
 &end
#
#    0 AMB  20-2:1908    69 PRO  HA          6.00    (#   1908:20   Single Ambig)
 &rst
  ixpk= 1908, iat=  -1,1117, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=1099,1100,1125,1126,
 &end
#
#   32 LYS  HA           69 PRO  HA          6.00    (#   1909:20   Unique)
 &rst
  ixpk= 1909, iat= 496,1117, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:1910    69 PRO  HA          4.50    (#   1910:20   Single Ambig)
 &rst
  ixpk= 1910, iat=  -1,1117, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1150, 570, 571,1167,
 &end
#
#    0 AMB  20-2:1911    52 THR  HA          6.00    (#   1911:20   Single Ambig)
 &rst
  ixpk= 1911, iat=  -1, 820, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 828, 839,
 &end
#
#    0 AMB  20-2:1912    52 THR  HA          4.50    (#   1912:20   Single Ambig)
 &rst
  ixpk= 1912, iat=  -1, 820, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1332,1374,1375,
 &end
#
#    0 AMB  20-2:1913    52 THR  HA          4.50    (#   1913:20   Single Ambig)
 &rst
  ixpk= 1913, iat=  -1, 820, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1374,1375, 807,1925,
 &end
#
#    0 AMB  20-2:1914    69 PRO  HA          4.50    (#   1914:20   Single Ambig)
 &rst
  ixpk= 1914, iat=  -1,1117, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1162,1095,
 &end
#
#   71 ALA  HN           69 PRO  HA          6.00    (#   1915:20   Unique)
 &rst
  ixpk= 1915, iat=1133,1117, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:1916   150 THR  HA          6.00    (#   1916:20   Single Ambig)
 &rst
  ixpk= 1916, iat=  -1,2380, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2411,2363,
 &end
#
#    0 AMB  20-2:1917   150 THR  HA          3.50    (#   1917:20   Single Ambig)
 &rst
  ixpk= 1917, iat=  -1,2380, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2378,2428,
 &end
#
#    0 AMB  20-2:1919   150 THR  HA          4.50    (#   1919:20   Single Ambig)
 &rst
  ixpk= 1919, iat=  -1,2380, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=2367,2368,2399,2370,2371,
 &end
#
#  153 LYS  HE+         150 THR  HA          6.00    (#   1920:20   Unique)
 &rst
  ixpk= 1920, iat=  -1,2380, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2441,2442,
 &end
#
#  153 LYS  HE-         150 THR  HA          6.00    (#   1921:20   Unique)
 &rst
  ixpk= 1921, iat=  -1,2380, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2441,2442,
 &end
#
#  151 LEU  HN          150 THR  HA          4.50    (#   1922:20   Unique)
 &rst
  ixpk= 1922, iat=2392,2380, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  150 THR  HB          150 THR  HA          3.50    (#   1923:20   Unique)
 &rst
  ixpk= 1923, iat=2382,2380, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:1926   122 SER  QB          6.00    (#   1926:20   Single Ambig)
 &rst
  ixpk= 1926, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.49, r4= 9.24,
 igr1=1929,1930,1929,1930,
 igr2=1941,1942,
 &end
#
#  123 GLY  HA+         122 SER  QB          6.00    (#   1928:20   Unique)
 &rst
  ixpk= 1928, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=1950,1951,
 igr2=1941,1942,
 &end
#
#    0 AMB  20-2:1929   105 PRO  HA          3.50    (#   1929:20   Single Ambig)
 &rst
  ixpk= 1929, iat=  -1,1699, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1690,1691,1690,1691,
 &end
#
#    0 AMB  20-2:1930   105 PRO  HA          6.00    (#   1930:20   Single Ambig)
 &rst
  ixpk= 1930, iat=  -1,1699, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1667,1705,
 &end
#
#   99 GLU  HG-         105 PRO  HA          6.00    (#   1931:20   Unique)
 &rst
  ixpk= 1931, iat=  -1,1699, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1606,1607,
 &end
#
#   89 ILE  MD1          86 PHE  HA          3.50    (#   1932:20   Unique)
 &rst
  ixpk= 1932, iat=  -1,1395, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1443,1444,1445,
 &end
#
#  125 ILE  MG2          86 PHE  HA          3.50    (#   1933:20   Unique)
 &rst
  ixpk= 1933, iat=  -1,1395, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1975,1976,1977,
 &end
#
#   89 ILE  HB           86 PHE  HA          4.50    (#   1934:20   Unique)
 &rst
  ixpk= 1934, iat=1434,1395, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   89 ILE  HG1+         86 PHE  HA          6.00    (#   1935:20   Unique)
 &rst
  ixpk= 1935, iat=  -1,1395, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1440,1441,
 &end
#
#   85 THR  MG2          86 PHE  HA          6.00    (#   1936:20   Unique)
 &rst
  ixpk= 1936, iat=  -1,1395, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1385,1386,1387,
 &end
#
#   89 ILE  MG2          86 PHE  HA          6.00    (#   1937:20   Unique)
 &rst
  ixpk= 1937, iat=  -1,1395, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1436,1437,1438,
 &end
#
#    0 AMB  20-2:1938    76 VAL  HA          4.50    (#   1938:20   Single Ambig)
 &rst
  ixpk= 1938, iat=  -1,1222, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1246,1247, 774, 775, 874, 875,1240,1241,
 &end
#
#   57 GLU  HG-          76 VAL  HA          4.50    (#   1939:20   Unique)
 &rst
  ixpk= 1939, iat=  -1,1222, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 907, 908,
 &end
#
#    0 AMB  20-2:1940    76 VAL  HA          4.50    (#   1940:20   Single Ambig)
 &rst
  ixpk= 1940, iat=  -1,1222, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 877, 878, 877, 878,1207,1208,
 &end
#
#   48 VAL  MGY          56 THR  HA          3.50    (#   1941:20   Unique)
 &rst
  ixpk= 1941, iat=  -1, 888, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 760, 761, 762, 764, 765, 766,
 &end
#
#    0 AMB  20-2:1942    56 THR  HA          4.50    (#   1942:20   Single Ambig)
 &rst
  ixpk= 1942, iat=  -1, 888, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 904, 869, 774, 775,
 &end
#
#    0 AMB  20-2:1943     0 AMB  20-1:1943   4.50    (#   1943:20   Double Ambig)
 &rst
  ixpk= 1943, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 907, 908,1559,1560,
 igr2= 888,1512,
 &end
#
#    0 AMB  20-2:1944     0 AMB  20-1:1944   3.50    (#   1944:20   Double Ambig)
 &rst
  ixpk= 1944, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1504,1505,1506,1582,1583,1582,1583,2004,2005,2006,
       847, 848,
 igr2=1512, 888,
 &end
#
#   95 GLU  QG           94 THR  HA          6.00    (#   1945:20   Unique)
 &rst
  ixpk= 1945, iat=  -1,1512, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1531,1532,
 &end
#
#    0 AMB  20-2:1946    94 THR  HA          4.50    (#   1946:20   Single Ambig)
 &rst
  ixpk= 1946, iat=  -1,1512, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1539,1555,
 &end
#
#    0 AMB  20-2:1947     0 AMB  20-1:1947   4.50    (#   1947:20   Double Ambig)
 &rst
  ixpk= 1947, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 915,1588, 744,
 igr2= 888,1512,
 &end
#
#   49 GLN  HN           56 THR  HA          4.50    (#   1948:20   Unique)
 &rst
  ixpk= 1948, iat= 770, 888, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:1949   108 THR  HA          6.00    (#   1949:20   Single Ambig)
 &rst
  ixpk= 1949, iat=  -1,1727, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=  97,  98,  99,  93,  94,  95,
 &end
#
#  109 LYS  HG+         108 THR  HA          3.50    (#   1950:20   Unique)
 &rst
  ixpk= 1950, iat=  -1,1727, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1746,1747,
 &end
#
#    0 AMB  20-2:1951   108 THR  HA          4.50    (#   1951:20   Single Ambig)
 &rst
  ixpk= 1951, iat=  -1,1727, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=1746,1747,1719,1720,1721,
 &end
#
#  109 LYS  HB2         108 THR  HA          4.50    (#   1952:20   Unique)
 &rst
  ixpk= 1952, iat=1743,1727, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  101 LEU  MDX          96 VAL  HA          3.50    (#   1953:20   Unique)
 &rst
  ixpk= 1953, iat=  -1,1541, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1638,1639,1640,1642,1643,1644,
 &end
#
#  101 LEU  MDY          96 VAL  HA          3.50    (#   1954:20   Unique)
 &rst
  ixpk= 1954, iat=  -1,1541, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:1955    96 VAL  HA          6.00    (#   1955:20   Single Ambig)
 &rst
  ixpk= 1955, iat=  -1,1541, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1659,1660,1661,1494,1495,1496,
 &end
#
#   95 GLU  HA           96 VAL  HA          6.00    (#   1958:20   Unique)
 &rst
  ixpk= 1958, iat=1526,1541, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   52 THR  MG2          53 SER  QB          6.00    (#   1959:20   Unique)
 &rst
  ixpk= 1959, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 824, 825, 826,
 igr2= 836, 837,
 &end
#
#    0 AMB  20-2:1960    53 SER  QB          4.50    (#   1960:20   Single Ambig)
 &rst
  ixpk= 1960, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1288,1289,1290,1280,
 igr2= 836, 837,
 &end
#
#    7 VAL  MG2           3 SER  QB          6.00    (#   1962:20   Unique)
 &rst
  ixpk= 1962, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=  97,  98,  99,
 igr2=  37,  38,
 &end
#
#    0 AMB  20-2:1963     0 AMB  20-1:1963   3.50    (#   1963:20   Double Ambig)
 &rst
  ixpk= 1963, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1152,1153,1154,1156,1157,1158, 538, 539, 540,
 igr2= 992,2816,
 &end
#
#    0 AMB  20-2:1964   176 PHE  HA          3.50    (#   1964:20   Single Ambig)
 &rst
  ixpk= 1964, iat=  -1,2816, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2872,2873,2874,2876,2877,2878,2872,2873,2874,2876,
      2877,2878,
 &end
#
#    0 AMB  20-2:1965   176 PHE  HA          3.50    (#   1965:20   Single Ambig)
 &rst
  ixpk= 1965, iat=  -1,2816, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=2867,2868,2867,2868,2870,
 &end
#
#   86 PHE  HE           86 PHE  HA          6.00    (#   1966:20   Unique)
 &rst
  ixpk= 1966, iat=  -1,1395, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1403,1407,
 &end
#
#   86 PHE  HD           86 PHE  HA          4.50    (#   1967:20   Unique)
 &rst
  ixpk= 1967, iat=  -1,1395, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1401,1409,
 &end
#
#   86 PHE  HD           86 PHE  HA          4.50    (#   1969:20   Unique)
 &rst
  ixpk= 1969, iat=  -1,1395, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1401,1409,
 &end
#
#  176 PHE  HD          176 PHE  HA          3.50    (#   1970:20   Preassigned)
 &rst
  ixpk= 1970, iat=  -1,2816, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2822,2830,
 &end
#
#  176 PHE  HD          176 PHE  HA          3.50    (#   1971:20   Unique)
 &rst
  ixpk= 1971, iat=  -1,2816, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2822,2830,
 &end
#
#    0 AMB  20-2:1972     0 AMB  20-1:1972   6.00    (#   1972:20   Double Ambig)
 &rst
  ixpk= 1972, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.71, r4=10.46,
 igr1= 686, 691,2972,2977, 709, 710,
 igr2= 669, 670,2985,
 &end
#
#   40 ASN  HD2-         42 SER  QB          4.50    (#   1974:20   Unique)
 &rst
  ixpk= 1974, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 646, 647,
 igr2= 669, 670,
 &end
#
#    0 AMB  20-2:1975     0 AMB  20-1:1975   3.50    (#   1975:20   Double Ambig)
 &rst
  ixpk= 1975, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 814,2487, 789,
 igr2= 811, 812,2075,
 &end
#
#    0 AMB  20-2:1976    51 SER  HB-         3.50    (#   1976:20   Single Ambig)
 &rst
  ixpk= 1976, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 814, 789,
 igr2= 811, 812,
 &end
#
#    0 AMB  20-2:1977   147 SER  QB          4.50    (#   1977:20   Single Ambig)
 &rst
  ixpk= 1977, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2342,2249,
 igr2=2339,2340,
 &end
#
#    0 AMB  20-2:1978    61 SER  HB-         3.50    (#   1978:20   Single Ambig)
 &rst
  ixpk= 1978, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 978, 967,
 igr2= 971, 972,
 &end
#
#    0 AMB  20-2:1979    61 SER  HB-         3.50    (#   1979:20   Single Ambig)
 &rst
  ixpk= 1979, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 969,1650,1651,
 igr2= 971, 972,
 &end
#
#  159 ALA  MB          158 PRO  HA          6.00    (#   1981:20   Unique)
 &rst
  ixpk= 1981, iat=  -1,2523, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=2531,2532,2533,
 &end
#
#    0 AMB  20-2:1982   158 PRO  HA          4.50    (#   1982:20   Single Ambig)
 &rst
  ixpk= 1982, iat=  -1,2523, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2498,2499,2498,2499,
 &end
#
#  157 LYS  HG-         158 PRO  HA          6.00    (#   1983:20   Unique)
 &rst
  ixpk= 1983, iat=  -1,2523, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2498,2499,
 &end
#
#    0 AMB  20-2:1984   158 PRO  HA          3.50    (#   1984:20   Single Ambig)
 &rst
  ixpk= 1984, iat=  -1,2523, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2496,2501,2502,
 &end
#
#    0 AMB  20-2:1986   158 PRO  HA          3.50    (#   1986:20   Single Ambig)
 &rst
  ixpk= 1986, iat=  -1,2523, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2495,2552,
 &end
#
#   67 LYS  HN           63 TYR  HA          3.50    (#   1987:20   Unique)
 &rst
  ixpk= 1987, iat=1073, 992, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  150 THR  MG2         147 SER  HA          3.50    (#   1988:20   Unique)
 &rst
  ixpk= 1988, iat=  -1,2337, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2384,2385,2386,
 &end
#
#  118 GLU  HG+         147 SER  HA          6.00    (#   1990:20   Unique)
 &rst
  ixpk= 1990, iat=  -1,2337, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1893,1894,
 &end
#
#  156 SER  HG            0 AMB  20-1:1991   3.50    (#   1991:20   Single Ambig)
 &rst
  ixpk= 1991, iat=2487,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2484,2485,2482,
 &end
#
#    0 AMB  20-2:1992    18 SER  HB+         4.50    (#   1992:20   Single Ambig)
 &rst
  ixpk= 1992, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 269, 258,2243,
 igr2= 262, 263,
 &end
#
#  172 LEU  HN          169 PHE  HA          3.50    (#   1993:20   Unique)
 &rst
  ixpk= 1993, iat=2742,2687, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  169 PHE  HD          169 PHE  HA          3.50    (#   1994:20   Unique)
 &rst
  ixpk= 1994, iat=  -1,2687, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2693,2701,
 &end
#
#  169 PHE  HD          169 PHE  HA          4.50    (#   1995:20   Unique)
 &rst
  ixpk= 1995, iat=  -1,2687, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2693,2701,
 &end
#
#    0 AMB  20-2:1996   169 PHE  HA          4.50    (#   1996:20   Single Ambig)
 &rst
  ixpk= 1996, iat=  -1,2687, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2720,2671,
 &end
#
#    0 AMB  20-2:1997     0 AMB  20-1:1997   4.50    (#   1997:20   Double Ambig)
 &rst
  ixpk= 1997, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.99, r4= 7.74,
 igr1= 356, 360,1539,2695,2699, 358,2697,
 igr2= 348,1465,
 &end
#
#   24 PHE  HD           24 PHE  HA          3.50    (#   1998:20   Unique)
 &rst
  ixpk= 1998, iat=  -1, 348, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 354, 362,
 &end
#
#   91 TYR  HD           91 TYR  HA          4.50    (#   1999:20   Unique)
 &rst
  ixpk= 1999, iat=  -1,1465, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1471,1480,
 &end
#
#    0 AMB  20-2:2000     0 AMB  20-1:2000   3.50    (#   2000:20   Double Ambig)
 &rst
  ixpk= 2000, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2491,2999,
 igr2=2482,2484,2485,3001,
 &end
#
#   18 SER  HG           18 SER  HB+         4.50    (#   2001:20   Unique)
 &rst
  ixpk= 2001, iat= 265,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 262, 263,
 &end
#
#  138 ILE  MG2         169 PHE  HA          4.50    (#   2002:20   Unique)
 &rst
  ixpk= 2002, iat=  -1,2687, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2188,2189,2190,
 &end
#
#  166 LEU  MDX         169 PHE  HA          4.50    (#   2003:20   Unique)
 &rst
  ixpk= 2003, iat=  -1,2687, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2649,2650,2651,2653,2654,2655,
 &end
#
#  138 ILE  MD1         169 PHE  HA          3.50    (#   2004:20   Unique)
 &rst
  ixpk= 2004, iat=  -1,2687, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2195,2196,2197,
 &end
#
#    0 AMB  20-2:2005   169 PHE  HA          3.50    (#   2005:20   Single Ambig)
 &rst
  ixpk= 2005, iat=  -1,2687, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2751,2752,2753,2755,2756,2757,2649,2650,2651,2653,
      2654,2655,
 &end
#
#    0 AMB  20-2:2008   169 PHE  HA          3.50    (#   2008:20   Single Ambig)
 &rst
  ixpk= 2008, iat=  -1,2687, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2746,2747,2647,2644,2645,2192,2193, 390, 391,
 &end
#
#  172 LEU  HG          169 PHE  HA          3.50    (#   2009:20   Unique)
 &rst
  ixpk= 2009, iat=2749,2687, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2010   169 PHE  HA          4.50    (#   2010:20   Single Ambig)
 &rst
  ixpk= 2010, iat=  -1,2687, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2746,2747, 387, 388, 393, 394,2724,2725,2218,2219,
      2727,2728,
 &end
#
#    0 AMB  20-2:2011     0 AMB  20-1:2011   4.50    (#   2011:20   Double Ambig)
 &rst
  ixpk= 2011, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.79, r4= 8.54,
 igr1= 393, 394, 390, 391,2218,2219,2553,2727,2728,
 igr2=2687,2541,2542,
 &end
#
#    0 AMB  20-2:2013    24 PHE  HA          3.50    (#   2013:20   Single Ambig)
 &rst
  ixpk= 2013, iat=  -1, 348, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 278, 279, 280, 282, 283, 284, 418, 419, 420,
 &end
#
#    0 AMB  20-2:2014    24 PHE  HA          3.50    (#   2014:20   Single Ambig)
 &rst
  ixpk= 2014, iat=  -1, 348, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 278, 279, 280, 282, 283, 284, 415, 416,
 &end
#
#    0 AMB  20-2:2015     0 AMB  20-1:2015   3.50    (#   2015:20   Double Ambig)
 &rst
  ixpk= 2015, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 409,1531,1532,
 igr2= 348,1465,
 &end
#
#   95 GLU  HN           91 TYR  HA          4.50    (#   2017:20   Unique)
 &rst
  ixpk= 2017, iat=1524,1465, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2018    24 PHE  HA          3.50    (#   2018:20   Single Ambig)
 &rst
  ixpk= 2018, iat=  -1, 348, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 405, 383,
 &end
#
#   24 PHE  HD           24 PHE  HA          3.50    (#   2019:20   Unique)
 &rst
  ixpk= 2019, iat=  -1, 348, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 354, 362,
 &end
#
#    0 AMB  20-2:2020    24 PHE  HA          3.50    (#   2020:20   Single Ambig)
 &rst
  ixpk= 2020, iat=  -1, 348, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 278, 279, 280, 282, 283, 284, 415, 416,
 &end
#
#    0 AMB  20-2:2021     0 AMB  20-1:2021   3.50    (#   2021:20   Double Ambig)
 &rst
  ixpk= 2021, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1719,1720,1721,1017,1018,1019,
 igr2=  89, 969,
 &end
#
#   64 VAL  MG2          61 SER  HA          3.50    (#   2022:20   Unique)
 &rst
  ixpk= 2022, iat=  -1, 969, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1021,1022,1023,
 &end
#
#   64 VAL  HB           61 SER  HA          3.50    (#   2023:20   Unique)
 &rst
  ixpk= 2023, iat=1015, 969, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2024     0 AMB  20-1:2024   3.50    (#   2024:20   Double Ambig)
 &rst
  ixpk= 2024, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 971, 972,1729,
 igr2= 969,  89,
 &end
#
#    0 AMB  20-2:2025     0 AMB  20-1:2025   4.50    (#   2025:20   Double Ambig)
 &rst
  ixpk= 2025, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2378,1027,
 igr2=2337, 969,
 &end
#
#    0 AMB  20-2:2026   156 SER  HB-         4.50    (#   2026:20   Single Ambig)
 &rst
  ixpk= 2026, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2495,2097,
 igr2=2484,2485,
 &end
#
#  156 SER  HG          156 SER  HB-         4.50    (#   2028:20   Unique)
 &rst
  ixpk= 2028, iat=2487,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2484,2485,
 &end
#
#  157 LYS  HN          156 SER  HB-         4.50    (#   2029:20   Unique)
 &rst
  ixpk= 2029, iat=2491,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2484,2485,
 &end
#
#  156 SER  HN          156 SER  HB-         4.50    (#   2030:20   Unique)
 &rst
  ixpk= 2030, iat=2480,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2484,2485,
 &end
#
#    0 AMB  20-2:2035   112 ILE  HA          3.50    (#   2035:20   Single Ambig)
 &rst
  ixpk= 2035, iat=  -1,1798, r1= 0.00, r2= 1.80, r3= 5.61, r4= 6.36,
 igr1=1809,1810,1811,1786,1787,1788,1790,1791,1792,1786,
      1787,1788,1790,1791,1792,2166,2167,
 &end
#
#    0 AMB  20-2:2036   112 ILE  HA          4.50    (#   2036:20   Single Ambig)
 &rst
  ixpk= 2036, iat=  -1,1798, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1819,1782,1844,1845,2097, 138,
 &end
#
#    0 AMB  20-2:2037   112 ILE  HA          4.50    (#   2037:20   Single Ambig)
 &rst
  ixpk= 2037, iat=  -1,1798, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1825,1826,1782,1844,1845,2141,2097,
 &end
#
#    0 AMB  20-2:2038   113 ILE  HA          6.00    (#   2038:20   Single Ambig)
 &rst
  ixpk= 2038, iat=  -1,1817, r1= 0.00, r2= 1.80, r3= 8.95, r4= 9.70,
 igr1= 179, 180, 181, 183, 184, 185,1443,1444,1445,1440,
      1441,
 &end
#
#    0 AMB  20-2:2039   113 ILE  HA          4.50    (#   2039:20   Single Ambig)
 &rst
  ixpk= 2039, iat=  -1,1817, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1= 179, 180, 181, 183, 184, 185,1828,1829,1830,
 &end
#
#    0 AMB  20-2:2040   113 ILE  HA          3.50    (#   2040:20   Single Ambig)
 &rst
  ixpk= 2040, iat=  -1,1817, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1844,1845, 174,1802,1803,1804,
 &end
#
#   12 LEU  HB3         113 ILE  HA          4.50    (#   2041:20   Unique)
 &rst
  ixpk= 2041, iat= 175,1817, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   63 TYR  HB-          60 PHE  HA          6.00    (#   2042:20   Unique)
 &rst
  ixpk= 2042, iat=  -1, 949, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 994, 995,
 &end
#
#    0 AMB  20-2:2044    60 PHE  HA          6.00    (#   2044:20   Single Ambig)
 &rst
  ixpk= 2044, iat=  -1, 949, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1= 701, 702, 701, 702,
 &end
#
#   46 ALA  MB           60 PHE  HA          3.50    (#   2045:20   Unique)
 &rst
  ixpk= 2045, iat=  -1, 949, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 738, 739, 740,
 &end
#
#    0 AMB  20-2:2046   114 ILE  HA          3.50    (#   2046:20   Single Ambig)
 &rst
  ixpk= 2046, iat=  -1,1836, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2169,2170,2171,1821,1822,1823,
 &end
#
#    0 AMB  20-2:2047   114 ILE  HA          4.50    (#   2047:20   Single Ambig)
 &rst
  ixpk= 2047, iat=  -1,1836, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=1859,1860,1861,2147,2148,2192,2193,
 &end
#
#    0 AMB  20-2:2048     0 AMB  20-1:2048   3.50    (#   2048:20   Double Ambig)
 &rst
  ixpk= 2048, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.43, r4= 6.18,
 igr1=1436,1437,1438,2060,2061,2062,1744,
 igr2=1971,1763,
 &end
#
#  132 ILE  HB          110 VAL  HA          3.50    (#   2049:20   Unique)
 &rst
  ixpk= 2049, iat=2077,1763, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2050     0 AMB  20-1:2050   4.50    (#   2050:20   Double Ambig)
 &rst
  ixpk= 2050, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.14, r4= 7.89,
 igr1=1959,1960,1992,1993,1453,1454,2663,2664,
 igr2=1971,2184,
 &end
#
#    0 AMB  20-2:2051    60 PHE  HA          3.50    (#   2051:20   Single Ambig)
 &rst
  ixpk= 2051, iat=  -1, 949, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 955, 963, 998,1007,
 &end
#
#    0 AMB  20-2:2052    60 PHE  HA          4.50    (#   2052:20   Single Ambig)
 &rst
  ixpk= 2052, iat=  -1, 949, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1= 923, 931, 957, 961, 959,
 &end
#
#  119 ALA  MB          120 THR  HA          6.00    (#   2059:20   Unique)
 &rst
  ixpk= 2059, iat=  -1,1913, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1905,1906,1907,
 &end
#
#    0 AMB  20-2:2060   120 THR  HA          4.50    (#   2060:20   Single Ambig)
 &rst
  ixpk= 2060, iat=  -1,1913, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1903,1367,
 &end
#
#    0 AMB  20-2:2062    79 MET  HA          4.50    (#   2062:20   Single Ambig)
 &rst
  ixpk= 2062, iat=  -1,1277, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1320,1298,1299, 874, 875,1317,
 &end
#
#   49 GLN  HE2-         79 MET  HA          4.50    (#   2063:20   Unique)
 &rst
  ixpk= 2063, iat=  -1,1277, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 782, 783,
 &end
#
#   81 LEU  HN           79 MET  HA          6.00    (#   2064:20   Unique)
 &rst
  ixpk= 2064, iat=1313,1277, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:2065    30 PHE  HA          4.50    (#   2065:20   Single Ambig)
 &rst
  ixpk= 2065, iat=  -1, 457, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2822,2830, 465, 469,
 &end
#
#   30 PHE  HD           30 PHE  HA          3.50    (#   2068:20   Unique)
 &rst
  ixpk= 2068, iat=  -1, 457, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 463, 471,
 &end
#
#   33 ASP  QB           30 PHE  HA          3.50    (#   2069:20   Unique)
 &rst
  ixpk= 2069, iat=  -1, 457, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 520, 521,
 &end
#
#    0 AMB  20-2:2070    30 PHE  HA          4.50    (#   2070:20   Single Ambig)
 &rst
  ixpk= 2070, iat=  -1, 457, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1= 447, 448, 447, 448, 477, 507, 508,
 &end
#
#    0 AMB  20-2:2073    32 LYS  HA          3.50    (#   2073:20   Single Ambig)
 &rst
  ixpk= 2073, iat=  -1, 496, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1171,1172,1173,1175,1176,1177, 479, 480,
 &end
#
#   69 PRO  HB2          32 LYS  HA          3.50    (#   2074:20   Unique)
 &rst
  ixpk= 2074, iat=1114, 496, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  109 LYS  HG-         131 ILE  HA          4.50    (#   2076:20   Unique)
 &rst
  ixpk= 2076, iat=  -1,2056, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1746,1747,
 &end
#
#    0 AMB  20-2:2078   131 ILE  HA          6.00    (#   2078:20   Single Ambig)
 &rst
  ixpk= 2078, iat=  -1,2056, r1= 0.00, r2= 1.80, r3= 7.85, r4= 8.60,
 igr1=1746,1747,2014,2015,2016,
 &end
#
#    0 AMB  20-2:2079   131 ILE  HA          3.50    (#   2079:20   Single Ambig)
 &rst
  ixpk= 2079, iat=  -1,2056, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=2083,2084,2014,2015,2016,
 &end
#
#    0 AMB  20-2:2080   131 ILE  HA          4.50    (#   2080:20   Single Ambig)
 &rst
  ixpk= 2080, iat=  -1,2056, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2046,2047,1752,1753,
 &end
#
#    0 AMB  20-2:2081   131 ILE  HA          3.50    (#   2081:20   Single Ambig)
 &rst
  ixpk= 2081, iat=  -1,2056, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2067,2068,2069,2086,2087,2088,
 &end
#
#    0 AMB  20-2:2082   131 ILE  HA          3.50    (#   2082:20   Single Ambig)
 &rst
  ixpk= 2082, iat=  -1,2056, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2060,2061,2062,1744,
 &end
#
#    0 AMB  20-2:2083    32 LYS  HA          3.50    (#   2083:20   Single Ambig)
 &rst
  ixpk= 2083, iat=  -1, 496, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1115, 498, 499, 557, 558, 559,
 &end
#
#   69 PRO  HG+          32 LYS  HA          3.50    (#   2084:20   Unique)
 &rst
  ixpk= 2084, iat=  -1, 496, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1111,1112,
 &end
#
#   35 MET  HG+          32 LYS  HA          4.50    (#   2085:20   Unique)
 &rst
  ixpk= 2085, iat=  -1, 496, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 551, 552,
 &end
#
#    0 AMB  20-2:2086   115 THR  HA          3.50    (#   2086:20   Single Ambig)
 &rst
  ixpk= 2086, iat=  -1,1855, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 213, 214, 213, 214,
 &end
#
#   14 ASP  HA          115 THR  HA          6.00    (#   2087:20   Unique)
 &rst
  ixpk= 2087, iat= 211,1855, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   50 PHE  HE          115 THR  HA          4.50    (#   2088:20   Unique)
 &rst
  ixpk= 2088, iat=  -1,1855, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 797, 801,
 &end
#
#   14 ASP  HN          115 THR  HA          4.50    (#   2089:20   Unique)
 &rst
  ixpk= 2089, iat= 209,1855, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  117 GLY  HN          115 THR  HA          6.00    (#   2090:20   Unique)
 &rst
  ixpk= 2090, iat=1879,1855, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:2091    35 MET  HA          4.50    (#   2091:20   Single Ambig)
 &rst
  ixpk= 2091, iat=  -1, 546, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 548, 532, 557, 558, 559,1115,
 &end
#
#    0 AMB  20-2:2092    35 MET  HA          3.50    (#   2092:20   Single Ambig)
 &rst
  ixpk= 2092, iat=  -1, 546, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 534, 535, 536, 616, 617, 618, 620, 621, 622,
 &end
#
#   38 LEU  MDX          35 MET  HA          4.50    (#   2093:20   Unique)
 &rst
  ixpk= 2093, iat=  -1, 546, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 616, 617, 618, 620, 621, 622,
 &end
#
#   45 PHE  HZ           35 MET  HA          3.50    (#   2094:20   Unique)
 &rst
  ixpk= 2094, iat= 726, 546, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2095    35 MET  HA          3.50    (#   2095:20   Single Ambig)
 &rst
  ixpk= 2095, iat=  -1, 546, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 724, 728, 726, 162,
 &end
#
#   45 PHE  HE           35 MET  HA          4.50    (#   2096:20   Unique)
 &rst
  ixpk= 2096, iat=  -1, 546, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 724, 728,
 &end
#
#   38 LEU  HN           35 MET  HA          4.50    (#   2097:20   Unique)
 &rst
  ixpk= 2097, iat= 607, 546, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  134 TYR  HB3         112 ILE  HA          4.50    (#   2098:20   Unique)
 &rst
  ixpk= 2098, iat=2121,1798, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  134 TYR  HB2         112 ILE  HA          6.00    (#   2099:20   Unique)
 &rst
  ixpk= 2099, iat=2120,1798, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  138 ILE  MD1         138 ILE  HA          3.50    (#   2100:20   Unique)
 &rst
  ixpk= 2100, iat=  -1,2184, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2195,2196,2197,
 &end
#
#    0 AMB  20-2:2101     0 AMB  20-1:2101   3.50    (#   2101:20   Double Ambig)
 &rst
  ixpk= 2101, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.86, r4= 6.61,
 igr1=2014,2015,2016, 748, 749, 750, 871, 872,1494,1495,
      1496,
 igr2=1971, 756,
 &end
#
#    0 AMB  20-2:2102     0 AMB  20-1:2102   4.50    (#   2102:20   Double Ambig)
 &rst
  ixpk= 2102, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 904,1434, 774, 775,2218,2219,
 igr2= 756,1971,2184,
 &end
#
#    0 AMB  20-2:2103     0 AMB  20-1:2103   3.50    (#   2103:20   Double Ambig)
 &rst
  ixpk= 2103, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 907, 908,1959,1960,1992,1993,1453,1454,
 igr2= 756,1971,
 &end
#
#    0 AMB  20-2:2104     0 AMB  20-1:2104   4.50    (#   2104:20   Double Ambig)
 &rst
  ixpk= 2104, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 907, 908,2251,1398,
 igr2= 756,2184,1971,
 &end
#
#    0 AMB  20-2:2105     0 AMB  20-1:2105   6.00    (#   2105:20   Double Ambig)
 &rst
  ixpk= 2105, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.81, r4= 9.56,
 igr1=2177,2178, 905, 777, 778,
 igr2=2184, 756,
 &end
#
#    0 AMB  20-2:2106    48 VAL  HA          6.00    (#   2106:20   Single Ambig)
 &rst
  ixpk= 2106, iat=  -1, 756, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 746, 789,
 &end
#
#   90 ASN  HD2-        125 ILE  HA          3.50    (#   2107:20   Unique)
 &rst
  ixpk= 2107, iat=  -1,1971, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1458,1459,
 &end
#
#    0 AMB  20-2:2108     0 AMB  20-1:2108   3.50    (#   2108:20   Double Ambig)
 &rst
  ixpk= 2108, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1458,1459, 947,
 igr2=1971, 949,
 &end
#
#    9 LEU  MDY          10 VAL  HA          4.50    (#   2109:20   Unique)
 &rst
  ixpk= 2109, iat=  -1, 136, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:2110     0 AMB  20-1:2110   6.00    (#   2110:20   Double Ambig)
 &rst
  ixpk= 2110, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.71, r4=10.46,
 igr1=2606,2607,2474,2475,2476,2305,2306,2305,2306,
 igr2=2565,2286,
 &end
#
#    0 AMB  20-2:2111     0 AMB  20-1:2111   6.00    (#   2111:20   Double Ambig)
 &rst
  ixpk= 2111, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.71, r4=10.46,
 igr1=2302,2303,2324,2325,2587,2350,2351,2555,2556,
 igr2=2286,2565,
 &end
#
#    0 AMB  20-2:2112     0 AMB  20-1:2112   4.50    (#   2112:20   Double Ambig)
 &rst
  ixpk= 2112, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.99, r4= 7.74,
 igr1=2552,2302,2303,2603,2604,2603,2604,
 igr2=2565,2286,
 &end
#
#  162 PHE  HB-         162 PHE  HA          3.50    (#   2114:20   Unique)
 &rst
  ixpk= 2114, iat=  -1,2565, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2567,2568,
 &end
#
#    0 AMB  20-2:2117   184 TYR  HA          3.50    (#   2117:20   Single Ambig)
 &rst
  ixpk= 2117, iat=  -1,2964, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2970,2979,2894,2895,
 &end
#
#  162 PHE  HD          162 PHE  HA          3.50    (#   2118:20   Unique)
 &rst
  ixpk= 2118, iat=  -1,2565, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2571,2579,
 &end
#
#  134 TYR  HE          162 PHE  HA          3.50    (#   2119:20   Unique)
 &rst
  ixpk= 2119, iat=  -1,2565, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2126,2131,
 &end
#
#    0 AMB  20-2:2121     0 AMB  20-1:2121   4.50    (#   2121:20   Double Ambig)
 &rst
  ixpk= 2121, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2137,2320,
 igr2=2565,2286,
 &end
#
#    0 AMB  20-2:2123   162 PHE  HA          3.50    (#   2123:20   Single Ambig)
 &rst
  ixpk= 2123, iat=  -1,2565, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2124,2133,2573,2577,
 &end
#
#  185 VAL  HN          184 TYR  HA          3.50    (#   2124:20   Preassigned)
 &rst
  ixpk= 2124, iat=2983,2964, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2125   184 TYR  HA          3.50    (#   2125:20   Single Ambig)
 &rst
  ixpk= 2125, iat=  -1,2964, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2962,3033,2999,
 &end
#
#   84 ASN  HN           83 THR  HA          3.50    (#   2126:20   Unique)
 &rst
  ixpk= 2126, iat=1365,1353, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2128   100 GLU  HA          4.50    (#   2128:20   Single Ambig)
 &rst
  ixpk= 2128, iat=  -1,1616, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1631,1577,
 &end
#
#    0 AMB  20-2:2129    26 LYS  HA          3.50    (#   2129:20   Single Ambig)
 &rst
  ixpk= 2129, iat=  -1, 385, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 390, 391, 393, 394,
 &end
#
#   26 LYS  HG-          26 LYS  HA          3.50    (#   2130:20   Unique)
 &rst
  ixpk= 2130, iat=  -1, 385, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 390, 391,
 &end
#
#    0 AMB  20-2:2131    26 LYS  HA          4.50    (#   2131:20   Single Ambig)
 &rst
  ixpk= 2131, iat=  -1, 385, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 370, 371, 370, 371,
 &end
#
#    0 AMB  20-2:2132    26 LYS  HA          3.50    (#   2132:20   Single Ambig)
 &rst
  ixpk= 2132, iat=  -1, 385, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 447, 448, 447, 448,
 &end
#
#    0 AMB  20-2:2133    26 LYS  HA          4.50    (#   2133:20   Single Ambig)
 &rst
  ixpk= 2133, iat=  -1, 385, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 455, 378, 379,
 &end
#
#  131 ILE  HN          129 LYS  HA          4.50    (#   2134:20   Unique)
 &rst
  ixpk= 2134, iat=2054,2022, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   38 LEU  HN           36 LYS  HA          4.50    (#   2135:20   Unique)
 &rst
  ixpk= 2135, iat= 607, 565, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   39 SER  HN           36 LYS  HA          4.50    (#   2137:20   Unique)
 &rst
  ixpk= 2137, iat= 626, 565, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   65 LYS  HG-          65 LYS  HA          3.50    (#   2140:20   Unique)
 &rst
  ixpk= 2140, iat=  -1,1029, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1034,1035,
 &end
#
#    0 AMB  20-2:2142   145 LYS  HA          3.50    (#   2142:20   Single Ambig)
 &rst
  ixpk= 2142, iat=  -1,2300, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2353,2354,2353,2354,
 &end
#
#    0 AMB  20-2:2143   145 LYS  HA          3.50    (#   2143:20   Single Ambig)
 &rst
  ixpk= 2143, iat=  -1,2300, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2350,2351,2350,2351,
 &end
#
#   65 LYS  HG-          65 LYS  HA          3.50    (#   2144:20   Unique)
 &rst
  ixpk= 2144, iat=  -1,1029, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1034,1035,
 &end
#
#   65 LYS  HG+          65 LYS  HA          3.50    (#   2145:20   Unique)
 &rst
  ixpk= 2145, iat=  -1,1029, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1034,1035,
 &end
#
#    0 AMB  20-2:2146   145 LYS  HA          6.00    (#   2146:20   Single Ambig)
 &rst
  ixpk= 2146, iat=  -1,2300, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2342,2249,
 &end
#
#    0 AMB  20-2:2149     0 AMB  20-1:2149   3.50    (#   2149:20   Double Ambig)
 &rst
  ixpk= 2149, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=2358,2359,1049,2363,2335,
 igr2=2300,1029,
 &end
#
#  103 ALA  HN           99 GLU  HA          3.50    (#   2152:20   Unique)
 &rst
  ixpk= 2152, iat=1655,1601, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  101 LEU  HN           99 GLU  HA          4.50    (#   2153:20   Unique)
 &rst
  ixpk= 2153, iat=1629,1601, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   51 SER  HG           16 SER  HA          3.50    (#   2154:20   Unique)
 &rst
  ixpk= 2154, iat= 814, 230, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  102 GLY  HN          100 GLU  HA          4.50    (#   2155:20   Unique)
 &rst
  ixpk= 2155, iat=1648,1616, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  184 TYR  QB          184 TYR  HA          3.50    (#   2157:20   Unique)
 &rst
  ixpk= 2157, iat=  -1,2964, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2966,2967,
 &end
#
#  163 VAL  MG2         162 PHE  HA          6.00    (#   2158:20   Unique)
 &rst
  ixpk= 2158, iat=  -1,2565, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=2593,2594,2595,
 &end
#
#  103 ALA  MB           99 GLU  HA          3.50    (#   2159:20   Unique)
 &rst
  ixpk= 2159, iat=  -1,1601, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1659,1660,1661,
 &end
#
#   83 THR  MG2          83 THR  HA          3.50    (#   2160:20   Unique)
 &rst
  ixpk= 2160, iat=  -1,1353, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1357,1358,1359,
 &end
#
#    0 AMB  20-2:2161     0 AMB  20-1:2161   3.50    (#   2161:20   Double Ambig)
 &rst
  ixpk= 2161, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2118,2342,
 igr2=2565,2286,
 &end
#
#    0 AMB  20-2:2162   135 ILE  HA          3.50    (#   2162:20   Single Ambig)
 &rst
  ixpk= 2162, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 4.84, r4= 5.59,
 igr1=2150,2151,2152,2166,2167,1825,1826,
 &end
#
#    0 AMB  20-2:2163   135 ILE  HA          3.50    (#   2163:20   Single Ambig)
 &rst
  ixpk= 2163, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2169,2170,2171,1821,1822,1823,
 &end
#
#    0 AMB  20-2:2164   135 ILE  HA          3.50    (#   2164:20   Single Ambig)
 &rst
  ixpk= 2164, iat=  -1,2139, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1819,1825,1826,
 &end
#
#  103 ALA  MB           97 PHE  HA          3.50    (#   2165:20   Unique)
 &rst
  ixpk= 2165, iat=  -1,1557, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1659,1660,1661,
 &end
#
#    0 AMB  20-2:2166     0 AMB  20-1:2166   3.50    (#   2166:20   Double Ambig)
 &rst
  ixpk= 2166, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2970,2979, 959,
 igr2=2964,1557,
 &end
#
#    0 AMB  20-2:2167     0 AMB  20-1:2167   3.50    (#   2167:20   Double Ambig)
 &rst
  ixpk= 2167, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 957, 961,2970,2979,2894,2895,
 igr2=1557,2964,
 &end
#
#   81 LEU  HN           16 SER  HA          3.50    (#   2168:20   Unique)
 &rst
  ixpk= 2168, iat=1313, 230, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   16 SER  HG           16 SER  HA          4.50    (#   2169:20   Unique)
 &rst
  ixpk= 2169, iat= 235, 230, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   18 SER  HG           18 SER  HA          4.50    (#   2171:20   Unique)
 &rst
  ixpk= 2171, iat= 265, 260, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  169 PHE  HB2         168 THR  HA          6.00    (#   2173:20   Unique)
 &rst
  ixpk= 2173, iat=2689,2673, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:2175    33 ASP  HA          2.70    (#   2175:20   Single Ambig)
 &rst
  ixpk= 2175, iat=  -1, 518, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1= 567, 568, 498, 499,
 &end
#
#  159 ALA  MB          152 HIS  HA          3.50    (#   2176:20   Unique)
 &rst
  ixpk= 2176, iat=  -1,2413, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2531,2532,2533,
 &end
#
#    0 AMB  20-2:2177     0 AMB  20-1:2177   3.50    (#   2177:20   Double Ambig)
 &rst
  ixpk= 2177, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2593,2594,2595,2906,2907,2627,2628,2629,
 igr2=2413,2850,2269,
 &end
#
#   37 LYS  QD           37 LYS  HA          4.50    (#   2178:20   Unique)
 &rst
  ixpk= 2178, iat=  -1, 587, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 595, 596,
 &end
#
#  140 LYS  QB          140 LYS  HA          3.50    (#   2179:20   Unique)
 &rst
  ixpk= 2179, iat=  -1,2210, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2212,2213,
 &end
#
#    0 AMB  20-2:2180   180 GLN  HA          3.50    (#   2180:20   Single Ambig)
 &rst
  ixpk= 2180, iat=  -1,2884, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2886,2887,2953,2954,2867,2868,2867,2868,
 &end
#
#  180 GLN  HB+         180 GLN  HA          3.50    (#   2181:20   Unique)
 &rst
  ixpk= 2181, iat=  -1,2884, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2886,2887,
 &end
#
#  180 GLN  QG          180 GLN  HA          3.50    (#   2182:20   Unique)
 &rst
  ixpk= 2182, iat=  -1,2884, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2889,2890,
 &end
#
#    0 AMB  20-2:2183     0 AMB  20-1:2183   3.50    (#   2183:20   Double Ambig)
 &rst
  ixpk= 2183, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2947, 428, 429,
 igr2=2884, 426,
 &end
#
#   28 LEU  MDY          28 LEU  HA          3.50    (#   2184:20   Unique)
 &rst
  ixpk= 2184, iat=  -1, 426, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:2185    28 LEU  HA          4.50    (#   2185:20   Single Ambig)
 &rst
  ixpk= 2185, iat=  -1, 426, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 433, 434, 435, 437, 438, 439, 479, 480,
 &end
#
#   28 LEU  HG           28 LEU  HA          3.50    (#   2186:20   Unique)
 &rst
  ixpk= 2186, iat= 431, 426, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2187     0 AMB  20-1:2187   3.50    (#   2187:20   Double Ambig)
 &rst
  ixpk= 2187, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.47, r4= 7.22,
 igr1= 411, 412, 413,1171,1172,1173,1175,1176,1177, 482,
       483,2949,2950,2951, 616, 617, 618, 620, 621, 622,
      
 igr2= 426,2884,
 &end
#
#    0 AMB  20-2:2188     0 AMB  20-1:2188   4.50    (#   2188:20   Double Ambig)
 &rst
  ixpk= 2188, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.99, r4= 7.74,
 igr1= 488, 489, 490,2886,2887, 479, 480,
 igr2= 426,2884,
 &end
#
#   23 GLU  HG+          23 GLU  HA          3.50    (#   2189:20   Unique)
 &rst
  ixpk= 2189, iat=  -1, 333, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 338, 339,
 &end
#
#   72 LEU  MDX          67 LYS  HA          3.50    (#   2190:20   Unique)
 &rst
  ixpk= 2190, iat=  -1,1075, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:2191     0 AMB  20-1:2191   3.50    (#   2191:20   Double Ambig)
 &rst
  ixpk= 2191, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1083,1084, 393, 394,
 igr2=1075, 333,
 &end
#
#    0 AMB  20-2:2192    23 GLU  HA          3.50    (#   2192:20   Single Ambig)
 &rst
  ixpk= 2192, iat=  -1, 333, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 396, 397,2690,
 &end
#
#    0 AMB  20-2:2193     0 AMB  20-1:2193   3.50    (#   2193:20   Double Ambig)
 &rst
  ixpk= 2193, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1083,1084, 390, 391,
 igr2=1075, 333,
 &end
#
#    0 AMB  20-2:2194    23 GLU  HA          4.50    (#   2194:20   Single Ambig)
 &rst
  ixpk= 2194, iat=  -1, 333, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=2693,2701,2695,2699,2697,
 &end
#
#   63 TYR  HD           67 LYS  HA          3.50    (#   2195:20   Unique)
 &rst
  ixpk= 2195, iat=  -1,1075, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 998,1007,
 &end
#
#    0 AMB  20-2:2196     0 AMB  20-1:2196   6.00    (#   2196:20   Double Ambig)
 &rst
  ixpk= 2196, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1= 366,1049,
 igr2= 333,1075,
 &end
#
#    0 AMB  20-2:2197     0 AMB  20-1:2197   3.50    (#   2197:20   Double Ambig)
 &rst
  ixpk= 2197, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.86, r4= 6.61,
 igr1=2956,2957,2958, 479, 480,1171,1172,1173,1175,1176,
      1177,
 igr2=2884, 426,
 &end
#
#   32 LYS  QE           33 ASP  HA          3.50    (#   2198:20   Unique)
 &rst
  ixpk= 2198, iat=  -1, 518, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 507, 508,
 &end
#
#  180 GLN  HN          180 GLN  HA          3.50    (#   2199:20   Unique)
 &rst
  ixpk= 2199, iat=2882,2884, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2200   180 GLN  HA          4.50    (#   2200:20   Single Ambig)
 &rst
  ixpk= 2200, iat=  -1,2884, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2943,2962,
 &end
#
#    0 AMB  20-2:2201     0 AMB  20-1:2201   3.50    (#   2201:20   Double Ambig)
 &rst
  ixpk= 2201, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 424,2899,
 igr2= 426,2884,
 &end
#
#   56 THR  MG2          58 PHE  HA          3.50    (#   2204:20   Unique)
 &rst
  ixpk= 2204, iat=  -1, 917, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 892, 893, 894,
 &end
#
#    0 AMB  20-2:2205    58 PHE  HA          4.50    (#   2205:20   Single Ambig)
 &rst
  ixpk= 2205, iat=  -1, 917, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 983, 939, 940,
 &end
#
#  143 GLN  HE2+        140 LYS  HA          4.50    (#   2207:20   Unique)
 &rst
  ixpk= 2207, iat=  -1,2210, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2279,2280,
 &end
#
#  152 HIS  HD2         152 HIS  HA          4.50    (#   2208:20   Unique)
 &rst
  ixpk= 2208, iat=2424,2413, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  152 HIS  HD2         152 HIS  HA          4.50    (#   2209:20   Unique)
 &rst
  ixpk= 2209, iat=2424,2413, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   66 TRP  HE3          66 TRP  HA          3.50    (#   2211:20   Unique)
 &rst
  ixpk= 2211, iat=1068,1051, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   66 TRP  HE3          66 TRP  HA          3.50    (#   2212:20   Unique)
 &rst
  ixpk= 2212, iat=1068,1051, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2214    66 TRP  HA          4.50    (#   2214:20   Single Ambig)
 &rst
  ixpk= 2214, iat=  -1,1051, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1057,1027,1062,
 &end
#
#    0 AMB  20-2:2216     0 AMB  20-1:2216   3.50    (#   2216:20   Double Ambig)
 &rst
  ixpk= 2216, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2685, 665,
 igr2=2673, 667,
 &end
#
#    0 AMB  20-2:2217     0 AMB  20-1:2217   3.50    (#   2217:20   Double Ambig)
 &rst
  ixpk= 2217, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2020, 463, 471,
 igr2=1990,2763,
 &end
#
#  143 GLN  HN          141 HIS  HA          3.50    (#   2218:20   Unique)
 &rst
  ixpk= 2218, iat=2267,2232, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   97 PHE  HD           97 PHE  HA          3.50    (#   2220:20   Unique)
 &rst
  ixpk= 2220, iat=  -1,1557, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1563,1571,
 &end
#
#    0 AMB  20-2:2221     0 AMB  20-1:2221   3.50    (#   2221:20   Double Ambig)
 &rst
  ixpk= 2221, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2020, 463, 471,
 igr2=1990,2763,
 &end
#
#  176 PHE  HD          173 LYS  HA          4.50    (#   2222:20   Unique)
 &rst
  ixpk= 2222, iat=  -1,2763, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2822,2830,
 &end
#
#    0 AMB  20-2:2223     0 AMB  20-1:2223   3.50    (#   2223:20   Double Ambig)
 &rst
  ixpk= 2223, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2751,2752,2753,2755,2756,2757, 433, 434, 435, 437,
       438, 439,
 igr2=2744, 368,
 &end
#
#    0 AMB  20-2:2224   172 LEU  HA          3.50    (#   2224:20   Single Ambig)
 &rst
  ixpk= 2224, iat=  -1,2744, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2751,2752,2753,2755,2756,2757,2649,2650,2651,2653,
      2654,2655,
 &end
#
#  166 LEU  MDX         172 LEU  HA          3.50    (#   2225:20   Unique)
 &rst
  ixpk= 2225, iat=  -1,2744, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  20-2:2226   172 LEU  HA          3.50    (#   2226:20   Single Ambig)
 &rst
  ixpk= 2226, iat=  -1,2744, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2649,2650,2651,2653,2654,2655,2804,2805,2806,2808,
      2809,2810,
 &end
#
#  175 LEU  MDY         172 LEU  HA          3.50    (#   2227:20   Unique)
 &rst
  ixpk= 2227, iat=  -1,2744, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:2228   172 LEU  HA          3.50    (#   2228:20   Single Ambig)
 &rst
  ixpk= 2228, iat=  -1,2744, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2799, 387, 388,
 &end
#
#    0 AMB  20-2:2229     0 AMB  20-1:2229   3.50    (#   2229:20   Double Ambig)
 &rst
  ixpk= 2229, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.43, r4= 6.18,
 igr1= 431,2804,2805,2806,2808,2809,2810,
 igr2= 368,2744,
 &end
#
#   28 LEU  HB+          25 GLN  HA          3.50    (#   2230:20   Unique)
 &rst
  ixpk= 2230, iat=  -1, 368, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 428, 429,
 &end
#
#   25 GLN  HG+          25 GLN  HA          3.50    (#   2231:20   Unique)
 &rst
  ixpk= 2231, iat=  -1, 368, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 373, 374,
 &end
#
#   25 GLN  HG-          25 GLN  HA          3.50    (#   2232:20   Unique)
 &rst
  ixpk= 2232, iat=  -1, 368, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 373, 374,
 &end
#
#    0 AMB  20-2:2233     0 AMB  20-1:2233   3.50    (#   2233:20   Double Ambig)
 &rst
  ixpk= 2233, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2649,2650,2651,2653,2654,2655, 433, 434, 435, 437,
       438, 439,
 igr2=2744, 368,
 &end
#
#   28 LEU  HB-          25 GLN  HA          3.50    (#   2234:20   Unique)
 &rst
  ixpk= 2234, iat=  -1, 368, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 428, 429,
 &end
#
#  152 HIS  HD2         149 GLU  HA          4.50    (#   2236:20   Unique)
 &rst
  ixpk= 2236, iat=2424,2365, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  152 HIS  HD2         149 GLU  HA          6.00    (#   2237:20   Unique)
 &rst
  ixpk= 2237, iat=2424,2365, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  151 LEU  HN          149 GLU  HA          6.00    (#   2238:20   Unique)
 &rst
  ixpk= 2238, iat=2392,2365, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   29 ASP  HN           25 GLN  HA          4.50    (#   2240:20   Unique)
 &rst
  ixpk= 2240, iat= 443, 368, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   25 GLN  HE2-         25 GLN  HA          4.50    (#   2241:20   Unique)
 &rst
  ixpk= 2241, iat=  -1, 368, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 378, 379,
 &end
#
#   51 SER  HG           51 SER  HA          3.50    (#   2242:20   Preassigned)
 &rst
  ixpk= 2242, iat= 814, 809, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2246     0 AMB  20-1:2246   4.50    (#   2246:20   Double Ambig)
 &rst
  ixpk= 2246, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=  51,  52,1317,1320,
 igr2=  35, 809,
 &end
#
#    4 LYS  HA            3 SER  HA          4.50    (#   2247:20   Unique)
 &rst
  ixpk= 2247, iat=  46,  35, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2249     0 AMB  20-1:2249   3.50    (#   2249:20   Double Ambig)
 &rst
  ixpk= 2249, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=2712,2713,2271,2272,2271,2272,2274,2275,2274,2275,
      
 igr2=2707,2210,
 &end
#
#    0 AMB  20-2:2250    43 TYR  HA          3.50    (#   2250:20   Single Ambig)
 &rst
  ixpk= 2250, iat=  -1, 678, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  93,  94,  95,  97,  98,  99,
 &end
#
#    7 VAL  HB           43 TYR  HA          3.50    (#   2251:20   Unique)
 &rst
  ixpk= 2251, iat=  91, 678, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2253    62 ASP  HA          3.50    (#   2253:20   Single Ambig)
 &rst
  ixpk= 2253, iat=  -1, 980, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1031,1032,1037,1038,
 &end
#
#   72 LEU  MDY          62 ASP  HA          3.50    (#   2254:20   Unique)
 &rst
  ixpk= 2254, iat=  -1, 980, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:2256   179 LEU  HA          4.50    (#   2256:20   Single Ambig)
 &rst
  ixpk= 2256, iat=  -1,2865, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2925,2926,2925,2926,
 &end
#
#   80 LEU  HA           17 MET  HA          3.50    (#   2257:20   Unique)
 &rst
  ixpk= 2257, iat=1296, 241, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2258    90 ASN  HA          3.50    (#   2258:20   Single Ambig)
 &rst
  ixpk= 2258, iat=  -1,1451, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2014,2015,2016,1516,1517,1518,
 &end
#
#    0 AMB  20-2:2259     0 AMB  20-1:2259   3.50    (#   2259:20   Double Ambig)
 &rst
  ixpk= 2259, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2004,2005,2006,1504,1505,1506,1979,1980,
 igr2=1451,1990,
 &end
#
#    0 AMB  20-2:2260   179 LEU  HA          2.70    (#   2260:20   Single Ambig)
 &rst
  ixpk= 2260, iat=  -1,2865, r1= 0.00, r2= 1.80, r3= 4.09, r4= 4.84,
 igr1=2872,2873,2874,2876,2877,2878,2872,2873,2874,2876,
      2877,2878,
 &end
#
#   65 LYS  HB+          62 ASP  HA          3.50    (#   2261:20   Unique)
 &rst
  ixpk= 2261, iat=  -1, 980, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1031,1032,
 &end
#
#  165 ILE  MD1         165 ILE  HA          3.50    (#   2262:20   Unique)
 &rst
  ixpk= 2262, iat=  -1,2623, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2634,2635,2636,
 &end
#
#    0 AMB  20-2:2263    57 GLU  HA          3.50    (#   2263:20   Single Ambig)
 &rst
  ixpk= 2263, iat=  -1, 902, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 871, 872, 748, 749, 750,
 &end
#
#    0 AMB  20-2:2264     0 AMB  20-1:2264   3.50    (#   2264:20   Double Ambig)
 &rst
  ixpk= 2264, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2631,2632, 892, 893, 894,1230,1231,1232,
 igr2=2623, 902,
 &end
#
#   55 LYS  HG-          57 GLU  HA          3.50    (#   2265:20   Unique)
 &rst
  ixpk= 2265, iat=  -1, 902, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 871, 872,
 &end
#
#  151 LEU  MDY         165 ILE  HA          6.00    (#   2266:20   Unique)
 &rst
  ixpk= 2266, iat=  -1,2623, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2401,2402,2403,2405,2406,2407,
 &end
#
#  136 ILE  MG2         165 ILE  HA          4.50    (#   2267:20   Unique)
 &rst
  ixpk= 2267, iat=  -1,2623, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2162,2163,2164,
 &end
#
#   55 LYS  HE+          57 GLU  HA          4.50    (#   2269:20   Unique)
 &rst
  ixpk= 2269, iat=  -1, 902, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 877, 878,
 &end
#
#    0 AMB  20-2:2270    57 GLU  HA          3.50    (#   2270:20   Single Ambig)
 &rst
  ixpk= 2270, iat=  -1, 902, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1207,1208, 877, 878,
 &end
#
#    0 AMB  20-2:2271     0 AMB  20-1:2271   4.50    (#   2271:20   Double Ambig)
 &rst
  ixpk= 2271, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1975,1976,1977,1982,1983,1984,
 igr2=1451,1990,
 &end
#
#   80 LEU  MDX          17 MET  HA          3.50    (#   2272:20   Unique)
 &rst
  ixpk= 2272, iat=  -1, 241, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1303,1304,1305,1307,1308,1309,
 &end
#
#    0 AMB  20-2:2273     0 AMB  20-1:2273   3.50    (#   2273:20   Double Ambig)
 &rst
  ixpk= 2273, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1152,1153,1154,1156,1157,1158,1303,1304,1305,1307,
      1308,1309,
 igr2=1145, 241,
 &end
#
#    0 AMB  20-2:2274     0 AMB  20-1:2274   3.50    (#   2274:20   Double Ambig)
 &rst
  ixpk= 2274, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.86, r4= 6.61,
 igr1=2928,2929,1298,1299,2867,2868,2931,2932,2931,2932,
      2870,
 igr2=2865, 241,
 &end
#
#  182 LYS  HN          179 LEU  HA          4.50    (#   2275:20   Preassigned)
 &rst
  ixpk= 2275, iat=2921,2865, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2276    43 TYR  HA          4.50    (#   2276:20   Single Ambig)
 &rst
  ixpk= 2276, iat=  -1, 678, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 709, 710, 686, 691,
 &end
#
#    0 AMB  20-2:2277    43 TYR  HA          4.50    (#   2277:20   Single Ambig)
 &rst
  ixpk= 2277, iat=  -1, 678, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=  87, 684, 693,
 &end
#
#   90 ASN  HD2-         90 ASN  HA          3.50    (#   2278:20   Unique)
 &rst
  ixpk= 2278, iat=  -1,1451, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1458,1459,
 &end
#
#    0 AMB  20-2:2279    45 PHE  HA          6.00    (#   2279:20   Single Ambig)
 &rst
  ixpk= 2279, iat=  -1, 716, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 738, 739, 740, 144, 145, 146,
 &end
#
#    9 LEU  HB3          45 PHE  HA          4.50    (#   2280:20   Unique)
 &rst
  ixpk= 2280, iat= 120, 716, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2281    45 PHE  HA          4.50    (#   2281:20   Single Ambig)
 &rst
  ixpk= 2281, iat=  -1, 716, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 736, 994, 995,
 &end
#
#   10 VAL  HA           45 PHE  HA          4.50    (#   2282:20   Unique)
 &rst
  ixpk= 2282, iat= 136, 716, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2284    45 PHE  HA          3.50    (#   2284:20   Single Ambig)
 &rst
  ixpk= 2284, iat=  -1, 716, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 955, 963, 957, 961, 925, 929, 160, 164, 724, 728,
      
 &end
#
#    0 AMB  20-2:2286     0 AMB  20-1:2286   4.50    (#   2286:20   Double Ambig)
 &rst
  ixpk= 2286, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.02, r4= 8.77,
 igr1=2079,2080,2081,2401,2402,2403,2405,2406,2407,1825,
      1826,2166,2167,1767,1768,1769,
 igr2=2118,2249,
 &end
#
#    0 AMB  20-2:2287     0 AMB  20-1:2287   4.50    (#   2287:20   Double Ambig)
 &rst
  ixpk= 2287, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2627,2628,2629,1828,1829,1830,2593,2594,2595,
 igr2=2249,2118,
 &end
#
#    0 AMB  20-2:2288     0 AMB  20-1:2288   4.50    (#   2288:20   Double Ambig)
 &rst
  ixpk= 2288, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.14, r4= 7.89,
 igr1=2143,2144,2145,1802,1803,1804,2631,2632,
 igr2=2118,2249,
 &end
#
#    0 AMB  20-2:2289     0 AMB  20-1:2289   4.50    (#   2289:20   Double Ambig)
 &rst
  ixpk= 2289, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.99, r4= 7.74,
 igr1=2474,2475,2476,1806,1807,2631,2632,
 igr2=2118,2249,
 &end
#
#    0 AMB  20-2:2290   134 TYR  HA          4.50    (#   2290:20   Single Ambig)
 &rst
  ixpk= 2290, iat=  -1,2118, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2141,2097,1825,1826,
 &end
#
#  162 PHE  HB-         134 TYR  HA          4.50    (#   2291:20   Unique)
 &rst
  ixpk= 2291, iat=  -1,2118, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2567,2568,
 &end
#
#  162 PHE  HA          134 TYR  HA          4.50    (#   2292:20   Unique)
 &rst
  ixpk= 2292, iat=2565,2118, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2293   134 TYR  HA          4.50    (#   2293:20   Single Ambig)
 &rst
  ixpk= 2293, iat=  -1,2118, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2139,2094,1798,
 &end
#
#  162 PHE  HB+         134 TYR  HA          3.50    (#   2294:20   Unique)
 &rst
  ixpk= 2294, iat=  -1,2118, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2567,2568,
 &end
#
#    0 AMB  20-2:2295   142 PHE  HA          4.50    (#   2295:20   Single Ambig)
 &rst
  ixpk= 2295, iat=  -1,2249, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2353,2354,2353,2354,
 &end
#
#  148 GLN  HG-         142 PHE  HA          4.50    (#   2296:20   Unique)
 &rst
  ixpk= 2296, iat=  -1,2249, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2353,2354,
 &end
#
#    0 AMB  20-2:2298     0 AMB  20-1:2298   3.50    (#   2298:20   Double Ambig)
 &rst
  ixpk= 2298, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2339,2340,2567,2568,
 igr2=2249,2118,
 &end
#
#    0 AMB  20-2:2299   134 TYR  HA          3.50    (#   2299:20   Single Ambig)
 &rst
  ixpk= 2299, iat=  -1,2118, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2124,2133,2573,2577,
 &end
#
#  142 PHE  HD          142 PHE  HA          3.50    (#   2300:20   Unique)
 &rst
  ixpk= 2300, iat=  -1,2249, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2255,2263,
 &end
#
#    0 AMB  20-2:2301     0 AMB  20-1:2301   3.50    (#   2301:20   Double Ambig)
 &rst
  ixpk= 2301, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2571,2579,2255,2263,
 igr2=2118,2249,
 &end
#
#  144 THR  HN          142 PHE  HA          4.50    (#   2302:20   Unique)
 &rst
  ixpk= 2302, iat=2284,2249, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2303   142 PHE  HA          4.50    (#   2303:20   Single Ambig)
 &rst
  ixpk= 2303, iat=  -1,2249, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2203,2204,2300,
 &end
#
#  154 PHE  HD          154 PHE  HA          3.50    (#   2304:20   Unique)
 &rst
  ixpk= 2304, iat=  -1,2452, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2458,2466,
 &end
#
#  133 ARG  HE          154 PHE  HA          4.50    (#   2306:20   Unique)
 &rst
  ixpk= 2306, iat=2105,2452, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   33 ASP  HN           29 ASP  HA          4.50    (#   2307:20   Unique)
 &rst
  ixpk= 2307, iat= 516, 445, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2308     0 AMB  20-1:2308   3.50    (#   2308:20   Double Ambig)
 &rst
  ixpk= 2308, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1=3033,2363,2962,2999,2411,2358,2359,
 igr2=3020,2348,2923,
 &end
#
#  166 LEU  MDY         171 LYS  HA          4.50    (#   2309:20   Unique)
 &rst
  ixpk= 2309, iat=  -1,2722, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2649,2650,2651,2653,2654,2655,
 &end
#
#  171 LYS  QE          171 LYS  HA          4.50    (#   2310:20   Unique)
 &rst
  ixpk= 2310, iat=  -1,2722, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2733,2734,
 &end
#
#    0 AMB  20-2:2311     0 AMB  20-1:2311   2.70    (#   2311:20   Double Ambig)
 &rst
  ixpk= 2311, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.96, r4= 4.71,
 igr1=2727,2728,2553,2768,2769,
 igr2=2722,2550,
 &end
#
#  171 LYS  HB+         171 LYS  HA          3.50    (#   2312:20   Unique)
 &rst
  ixpk= 2312, iat=  -1,2722, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2724,2725,
 &end
#
#   86 PHE  HD          122 SER  HA          3.50    (#   2313:20   Unique)
 &rst
  ixpk= 2313, iat=  -1,1939, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1401,1409,
 &end
#
#    0 AMB  20-2:2314   122 SER  HA          3.50    (#   2314:20   Single Ambig)
 &rst
  ixpk= 2314, iat=  -1,1939, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1405,1401,1409,
 &end
#
#    0 AMB  20-2:2315     0 AMB  20-1:2315   3.50    (#   2315:20   Double Ambig)
 &rst
  ixpk= 2315, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2548,2761,2795,
 igr2=2550,2722,
 &end
#
#  162 PHE  HN          161 GLU  HA          4.50    (#   2316:20   Unique)
 &rst
  ixpk= 2316, iat=2563,2550, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2317   154 PHE  HA          3.50    (#   2317:20   Single Ambig)
 &rst
  ixpk= 2317, iat=  -1,2452, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1982,1983,1984,1975,1976,1977,
 &end
#
#    0 AMB  20-2:2318   154 PHE  HA          4.50    (#   2318:20   Single Ambig)
 &rst
  ixpk= 2318, iat=  -1,2452, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=2435,2436,1443,1444,1445,
 &end
#
#   80 LEU  HG           17 MET  HA          4.50    (#   2319:20   Unique)
 &rst
  ixpk= 2319, iat=1301, 241, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2320     0 AMB  20-1:2320   3.50    (#   2320:20   Double Ambig)
 &rst
  ixpk= 2320, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 269, 923, 931,1313, 925, 929,
 igr2= 241,1145,
 &end
#
#   80 LEU  HN           17 MET  HA          6.00    (#   2321:20   Unique)
 &rst
  ixpk= 2321, iat=1294, 241, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   73 LEU  MDX          70 ASP  HA          3.50    (#   2322:20   Unique)
 &rst
  ixpk= 2322, iat=  -1,1123, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1171,1172,1173,1175,1176,1177,
 &end
#
#    0 AMB  20-2:2323     0 AMB  20-1:2323   3.50    (#   2323:20   Double Ambig)
 &rst
  ixpk= 2323, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=1171,1172,1173,1175,1176,1177, 501, 502, 428, 429,
      
 igr2=1123, 445,
 &end
#
#    0 AMB  20-2:2324     0 AMB  20-1:2324   2.70    (#   2324:20   Double Ambig)
 &rst
  ixpk= 2324, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.29, r4= 5.04,
 igr1= 498, 499,2432,2433, 504, 505, 501, 502,
 igr2= 445,2430,
 &end
#
#   32 LYS  HB+          29 ASP  HA          2.70    (#   2325:20   Unique)
 &rst
  ixpk= 2325, iat=  -1, 445, r1= 0.00, r2= 1.80, r3= 3.03, r4= 3.78,
 igr1= 498, 499,
 &end
#
#   89 ILE  MG2          90 ASN  HA          3.50    (#   2326:20   Unique)
 &rst
  ixpk= 2326, iat=  -1,1451, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1436,1437,1438,
 &end
#
#  166 LEU  MDX         171 LYS  HA          4.50    (#   2327:20   Unique)
 &rst
  ixpk= 2327, iat=  -1,2722, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  20-2:2328     0 AMB  20-1:2328   3.50    (#   2328:20   Double Ambig)
 &rst
  ixpk= 2328, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1=2401,2402,2403,2405,2406,2407,3005,3006,3007,2989,
      2990,2991,2993,2994,2995,2989,2990,2991,2993,2994,
      2995,
 igr2=2348,3020,2923,
 &end
#
#    9 LEU  MDY          11 PHE  HA          6.00    (#   2329:20   Unique)
 &rst
  ixpk= 2329, iat=  -1, 152, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:2330    11 PHE  HA          4.50    (#   2330:20   Single Ambig)
 &rst
  ixpk= 2330, iat=  -1, 152, r1= 0.00, r2= 1.80, r3= 7.22, r4= 7.97,
 igr1=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,1809,1810,1811,1825,1826,
 &end
#
#  114 ILE  HG1-         11 PHE  HA          4.50    (#   2331:20   Unique)
 &rst
  ixpk= 2331, iat=  -1, 152, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1844,1845,
 &end
#
#    0 AMB  20-2:2332    11 PHE  HA          4.50    (#   2332:20   Single Ambig)
 &rst
  ixpk= 2332, iat=  -1, 152, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1= 124, 125, 126, 128, 129, 130, 140, 141, 142,
 &end
#
#    0 AMB  20-2:2333    11 PHE  HA          3.50    (#   2333:20   Single Ambig)
 &rst
  ixpk= 2333, iat=  -1, 152, r1= 0.00, r2= 1.80, r3= 5.22, r4= 5.97,
 igr1=1844,1845,1847,1848,1849,1802,1803,1804,1806,1807,
       174,
 &end
#
#    0 AMB  20-2:2334    11 PHE  HA          6.00    (#   2334:20   Single Ambig)
 &rst
  ixpk= 2334, iat=  -1, 152, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=1806,1807, 120, 177,
 &end
#
#  112 ILE  HB           11 PHE  HA          3.50    (#   2335:20   Unique)
 &rst
  ixpk= 2335, iat=1800, 152, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   11 PHE  HD           11 PHE  HA          4.50    (#   2337:20   Unique)
 &rst
  ixpk= 2337, iat=  -1, 152, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 158, 166,
 &end
#
#   11 PHE  HD           11 PHE  HA          4.50    (#   2338:20   Unique)
 &rst
  ixpk= 2338, iat=  -1, 152, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 158, 166,
 &end
#
#    0 AMB  20-2:2344   154 PHE  HA          6.00    (#   2344:20   Single Ambig)
 &rst
  ixpk= 2344, iat=  -1,2452, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1436,1437,1438,1828,1829,1830,
 &end
#
#    0 AMB  20-2:2345   154 PHE  HA          3.50    (#   2345:20   Single Ambig)
 &rst
  ixpk= 2345, iat=  -1,2452, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1979,1980,2432,2433,
 &end
#
#  175 LEU  MDY         175 LEU  HA          3.50    (#   2347:20   Unique)
 &rst
  ixpk= 2347, iat=  -1,2797, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2804,2805,2806,2808,2809,2810,
 &end
#
#  175 LEU  MDX         175 LEU  HA          3.50    (#   2348:20   Unique)
 &rst
  ixpk= 2348, iat=  -1,2797, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2804,2805,2806,2808,2809,2810,
 &end
#
#   72 LEU  MDY          72 LEU  HA          3.50    (#   2349:20   Unique)
 &rst
  ixpk= 2349, iat=  -1,1145, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:2350     0 AMB  20-1:2350   3.50    (#   2350:20   Double Ambig)
 &rst
  ixpk= 2350, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1152,1153,1154,1156,1157,1158,1303,1304,1305,1307,
      1308,1309,
 igr2=1145, 241,
 &end
#
#   71 ALA  MB           72 LEU  HA          4.50    (#   2351:20   Unique)
 &rst
  ixpk= 2351, iat=  -1,1145, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1137,1138,1139,
 &end
#
#  182 LYS  HG-         182 LYS  HA          3.50    (#   2352:20   Unique)
 &rst
  ixpk= 2352, iat=  -1,2923, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2928,2929,
 &end
#
#    0 AMB  20-2:2353     0 AMB  20-1:2353   3.50    (#   2353:20   Double Ambig)
 &rst
  ixpk= 2353, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1=2931,2932,2727,2728,2553,2768,2769,
 igr2=2923,2722,2550,
 &end
#
#    0 AMB  20-2:2354     0 AMB  20-1:2354   3.50    (#   2354:20   Double Ambig)
 &rst
  ixpk= 2354, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2925,2926,2555,2556,2765,2766,
 igr2=2923,2550,2722,
 &end
#
#    0 AMB  20-2:2355     0 AMB  20-1:2355   3.50    (#   2355:20   Double Ambig)
 &rst
  ixpk= 2355, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.86, r4= 6.61,
 igr1= 373, 374,2274,2275,2274,2275, 313,2271,2272,2271,
      2272,
 igr2= 321,2661,
 &end
#
#    0 AMB  20-2:2356     0 AMB  20-1:2356   3.50    (#   2356:20   Double Ambig)
 &rst
  ixpk= 2356, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 370, 371, 370, 371,2852,2853,
 igr2= 321,2797,
 &end
#
#    0 AMB  20-2:2357     0 AMB  20-1:2357   2.70    (#   2357:20   Double Ambig)
 &rst
  ixpk= 2357, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.68, r4= 5.43,
 igr1=  54,  55,  48,  49,2727,2728,2724,2725,2552,
 igr2=  46,2722,2550,
 &end
#
#    0 AMB  20-2:2358     0 AMB  20-1:2358   4.50    (#   2358:20   Double Ambig)
 &rst
  ixpk= 2358, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2934,2935,2912,2913,
 igr2=2550,2923,
 &end
#
#   80 LEU  MDX          80 LEU  HA          3.50    (#   2359:20   Unique)
 &rst
  ixpk= 2359, iat=  -1,1296, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1303,1304,1305,1307,1308,1309,
 &end
#
#   80 LEU  MDY          80 LEU  HA          3.50    (#   2360:20   Unique)
 &rst
  ixpk= 2360, iat=  -1,1296, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1303,1304,1305,1307,1308,1309,
 &end
#
#    0 AMB  20-2:2361    80 LEU  HA          3.50    (#   2361:20   Single Ambig)
 &rst
  ixpk= 2361, iat=  -1,1296, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 243, 244,1279, 273, 274,
 &end
#
#   17 MET  HA           80 LEU  HA          3.50    (#   2362:20   Unique)
 &rst
  ixpk= 2362, iat= 241,1296, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   16 SER  HA           80 LEU  HA          4.50    (#   2363:20   Unique)
 &rst
  ixpk= 2363, iat= 230,1296, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   17 MET  HN           80 LEU  HA          4.50    (#   2364:20   Unique)
 &rst
  ixpk= 2364, iat= 239,1296, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2365   133 ARG  HA          4.50    (#   2365:20   Single Ambig)
 &rst
  ixpk= 2365, iat=  -1,2094, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1828,1829,1830,2060,2061,2062,
 &end
#
#    0 AMB  20-2:2366   133 ARG  HA          4.50    (#   2366:20   Single Ambig)
 &rst
  ixpk= 2366, iat=  -1,2094, r1= 0.00, r2= 1.80, r3= 6.99, r4= 7.74,
 igr1=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,1825,1826,
 &end
#
#    0 AMB  20-2:2367   133 ARG  HA          4.50    (#   2367:20   Single Ambig)
 &rst
  ixpk= 2367, iat=  -1,2094, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1781,2474,2475,2476,
 &end
#
#    0 AMB  20-2:2368   133 ARG  HA          4.50    (#   2368:20   Single Ambig)
 &rst
  ixpk= 2368, iat=  -1,2094, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=2102,2103,2120,2484,2485,
 &end
#
#   95 GLU  HB2          95 GLU  HA          3.50    (#   2369:20   Unique)
 &rst
  ixpk= 2369, iat=1528,1526, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2370    95 GLU  HA          3.50    (#   2370:20   Single Ambig)
 &rst
  ixpk= 2370, iat=  -1,1526, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1582,1583,1582,1583,
 &end
#
#   98 ARG  HD-          95 GLU  HA          3.50    (#   2371:20   Unique)
 &rst
  ixpk= 2371, iat=  -1,1526, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1585,1586,
 &end
#
#   98 ARG  HD+          95 GLU  HA          3.50    (#   2372:20   Unique)
 &rst
  ixpk= 2372, iat=  -1,1526, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1585,1586,
 &end
#
#   95 GLU  HB3          95 GLU  HA          3.50    (#   2373:20   Unique)
 &rst
  ixpk= 2373, iat=1529,1526, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   96 VAL  MG2          95 GLU  HA          6.00    (#   2374:20   Unique)
 &rst
  ixpk= 2374, iat=  -1,1526, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1549,1550,1551,
 &end
#
#    0 AMB  20-2:2376     0 AMB  20-1:2376   3.50    (#   2376:20   Double Ambig)
 &rst
  ixpk= 2376, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2627,2628,2629,2593,2594,2595,2589,2590,2591,
 igr2=2661,2394,
 &end
#
#    0 AMB  20-2:2377     0 AMB  20-1:2377   3.50    (#   2377:20   Double Ambig)
 &rst
  ixpk= 2377, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 335, 336,2435,2436,
 igr2= 271,2394,
 &end
#
#    0 AMB  20-2:2378     0 AMB  20-1:2378   3.50    (#   2378:20   Double Ambig)
 &rst
  ixpk= 2378, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 278, 279, 280, 282, 283, 284,2143,2144,2145,
 igr2= 271,2394,
 &end
#
#  139 GLY  HA-         167 ASP  HA          3.50    (#   2379:20   Unique)
 &rst
  ixpk= 2379, iat=  -1,2661, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2203,2204,
 &end
#
#  154 PHE  HB+         151 LEU  HA          4.50    (#   2380:20   Unique)
 &rst
  ixpk= 2380, iat=  -1,2394, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2454,2455,
 &end
#
#  151 LEU  MDX         151 LEU  HA          3.50    (#   2381:20   Unique)
 &rst
  ixpk= 2381, iat=  -1,2394, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2401,2402,2403,2405,2406,2407,
 &end
#
#    0 AMB  20-2:2382     0 AMB  20-1:2382   2.70    (#   2382:20   Double Ambig)
 &rst
  ixpk= 2382, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.76, r4= 5.51,
 igr1= 278, 279, 280, 282, 283, 284,2401,2402,2403,2405,
      2406,2407,2150,2151,2152,
 igr2= 271,2394,
 &end
#
#  139 GLY  HN          167 ASP  HA          3.50    (#   2383:20   Unique)
 &rst
  ixpk= 2383, iat=2201,2661, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2384     0 AMB  20-1:2384   3.50    (#   2384:20   Double Ambig)
 &rst
  ixpk= 2384, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2279,2280, 300, 301,
 igr2=2661, 271,
 &end
#
#    0 AMB  20-2:2385   159 ALA  HA          3.50    (#   2385:20   Single Ambig)
 &rst
  ixpk= 2385, iat=  -1,2529, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2583,2548,
 &end
#
#    0 AMB  20-2:2387     0 AMB  20-1:2387   3.50    (#   2387:20   Double Ambig)
 &rst
  ixpk= 2387, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1563,1571,2563,1565,1569,
 igr2=1502,2529,
 &end
#
#    0 AMB  20-2:2388   151 LEU  HA          3.50    (#   2388:20   Single Ambig)
 &rst
  ixpk= 2388, iat=  -1,2394, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2458,2466,2460,2464,
 &end
#
#    0 AMB  20-2:2389     0 AMB  20-1:2389   4.50    (#   2389:20   Double Ambig)
 &rst
  ixpk= 2389, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1=2279,2280, 300, 301,2428,
 igr2=2661, 271,2394,
 &end
#
#    0 AMB  20-2:2390   151 LEU  HA          3.50    (#   2390:20   Single Ambig)
 &rst
  ixpk= 2390, iat=  -1,2394, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2460,2464,2462,2424,
 &end
#
#  162 PHE  HB-         159 ALA  HA          3.50    (#   2391:20   Unique)
 &rst
  ixpk= 2391, iat=  -1,2529, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2567,2568,
 &end
#
#  163 VAL  HB          159 ALA  HA          4.50    (#   2392:20   Unique)
 &rst
  ixpk= 2392, iat=2587,2529, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2393     0 AMB  20-1:2393   3.50    (#   2393:20   Double Ambig)
 &rst
  ixpk= 2393, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2064,2065,2474,2475,2476,2498,2499,2498,2499,
 igr2=1502,2529,
 &end
#
#    0 AMB  20-2:2394    93 ALA  HA          3.50    (#   2394:20   Single Ambig)
 &rst
  ixpk= 2394, iat=  -1,1502, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2014,2015,2016,1516,1517,1518,
 &end
#
#    0 AMB  20-2:2395    93 ALA  HA          3.50    (#   2395:20   Single Ambig)
 &rst
  ixpk= 2395, iat=  -1,1502, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1490,1491,1492,1786,1787,1788,1790,1791,1792,1786,
      1787,1788,1790,1791,1792,
 &end
#
#    0 AMB  20-2:2396     0 AMB  20-1:2396   3.50    (#   2396:20   Double Ambig)
 &rst
  ixpk= 2396, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2067,2068,2069,2593,2594,2595,
 igr2=1502,2529,
 &end
#
#    0 AMB  20-2:2397     0 AMB  20-1:2397   4.50    (#   2397:20   Double Ambig)
 &rst
  ixpk= 2397, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1488,2520,
 igr2=1502,2529,
 &end
#
#    0 AMB  20-2:2398     0 AMB  20-1:2398   4.50    (#   2398:20   Double Ambig)
 &rst
  ixpk= 2398, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=2501,2502,2058,2496,2552,
 igr2=2529,1502,
 &end
#
#   97 PHE  HB-          93 ALA  HA          4.50    (#   2399:20   Unique)
 &rst
  ixpk= 2399, iat=  -1,1502, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1559,1560,
 &end
#
#    0 AMB  20-2:2400    93 ALA  HA          4.50    (#   2400:20   Single Ambig)
 &rst
  ixpk= 2400, iat=  -1,1502, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1559,1560,1486,
 &end
#
#    0 AMB  20-2:2402     0 AMB  20-1:2402   6.00    (#   2402:20   Double Ambig)
 &rst
  ixpk= 2402, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.49, r4= 9.24,
 igr1= 265,2188,2189,2190,
 igr2= 271,2661,
 &end
#
#    0 AMB  20-2:2403    13 PHE  HA          6.00    (#   2403:20   Single Ambig)
 &rst
  ixpk= 2403, iat=  -1, 191, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1= 411, 412, 413,1821,1822,1823, 179, 180, 181, 183,
       184, 185,
 &end
#
#    0 AMB  20-2:2404    13 PHE  HA          4.50    (#   2404:20   Single Ambig)
 &rst
  ixpk= 2404, iat=  -1, 191, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=1844,1845,1847,1848,1849,
 &end
#
#  114 ILE  HG1-         13 PHE  HA          6.00    (#   2405:20   Unique)
 &rst
  ixpk= 2405, iat=  -1, 191, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1844,1845,
 &end
#
#    0 AMB  20-2:2406    13 PHE  HA          3.50    (#   2406:20   Single Ambig)
 &rst
  ixpk= 2406, iat=  -1, 191, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1838,1844,1845,
 &end
#
#   13 PHE  HD           13 PHE  HA          6.00    (#   2407:20   Unique)
 &rst
  ixpk= 2407, iat=  -1, 191, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 197, 205,
 &end
#
#   52 THR  MG2          53 SER  HA          4.50    (#   2408:20   Unique)
 &rst
  ixpk= 2408, iat=  -1, 834, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 824, 825, 826,
 &end
#
#    0 AMB  20-2:2409    53 SER  HA          4.50    (#   2409:20   Single Ambig)
 &rst
  ixpk= 2409, iat=  -1, 834, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 847, 848, 868,
 &end
#
#   54 TYR  HE           53 SER  HA          4.50    (#   2410:20   Unique)
 &rst
  ixpk= 2410, iat=  -1, 834, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 853, 858,
 &end
#
#   88 ALA  MB           50 PHE  HA          6.00    (#   2411:20   Unique)
 &rst
  ixpk= 2411, iat=  -1, 789, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1424,1425,1426,
 &end
#
#    0 AMB  20-2:2412    50 PHE  HA          4.50    (#   2412:20   Single Ambig)
 &rst
  ixpk= 2412, iat=  -1, 789, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 760, 761, 762, 764, 765, 766, 179, 180, 181, 183,
       184, 185,
 &end
#
#   79 MET  HE           50 PHE  HA          4.50    (#   2413:20   Unique)
 &rst
  ixpk= 2413, iat=  -1, 789, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1288,1289,1290,
 &end
#
#   54 TYR  HB+          50 PHE  HA          6.00    (#   2414:20   Unique)
 &rst
  ixpk= 2414, iat=  -1, 789, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 847, 848,
 &end
#
#   50 PHE  HD           50 PHE  HA          4.50    (#   2415:20   Unique)
 &rst
  ixpk= 2415, iat=  -1, 789, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 795, 803,
 &end
#
#   54 TYR  HD           50 PHE  HA          6.00    (#   2416:20   Unique)
 &rst
  ixpk= 2416, iat=  -1, 789, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 851, 860,
 &end
#
#    0 AMB  20-2:2417     9 LEU  HA          4.50    (#   2417:20   Single Ambig)
 &rst
  ixpk= 2417, iat=  -1, 117, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 144, 145, 146, 738, 739, 740,
 &end
#
#    9 LEU  MDY           9 LEU  HA          4.50    (#   2418:20   Unique)
 &rst
  ixpk= 2418, iat=  -1, 117, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 124, 125, 126, 128, 129, 130,
 &end
#
#    9 LEU  MDX           9 LEU  HA          3.50    (#   2419:20   Unique)
 &rst
  ixpk= 2419, iat=  -1, 117, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 124, 125, 126, 128, 129, 130,
 &end
#
#    7 VAL  MG1           9 LEU  HA          4.50    (#   2420:20   Unique)
 &rst
  ixpk= 2420, iat=  -1, 117, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=  93,  94,  95,
 &end
#
#    0 AMB  20-2:2421     9 LEU  HA          3.50    (#   2421:20   Single Ambig)
 &rst
  ixpk= 2421, iat=  -1, 117, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1767,1768,1769,1771,1772,1773,
 &end
#
#  110 VAL  HB            9 LEU  HA          3.50    (#   2422:20   Unique)
 &rst
  ixpk= 2422, iat=1765, 117, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  110 VAL  MG1           9 LEU  HA          4.50    (#   2423:20   Unique)
 &rst
  ixpk= 2423, iat=  -1, 117, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1767,1768,1769,
 &end
#
#    0 AMB  20-2:2424     9 LEU  HA          4.50    (#   2424:20   Single Ambig)
 &rst
  ixpk= 2424, iat=  -1, 117, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 138,1782,
 &end
#
#    0 AMB  20-2:2425    50 PHE  HA          4.50    (#   2425:20   Single Ambig)
 &rst
  ixpk= 2425, iat=  -1, 789, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 864, 770,
 &end
#
#    0 AMB  20-2:2426   174 ASP  HA          4.50    (#   2426:20   Single Ambig)
 &rst
  ixpk= 2426, iat=  -1,2785, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2763,2722,
 &end
#
#    0 AMB  20-2:2427    81 LEU  HA          3.50    (#   2427:20   Single Ambig)
 &rst
  ixpk= 2427, iat=  -1,1315, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1322,1323,1324,1326,1327,1328,1322,1323,1324,1326,
      1327,1328,
 &end
#
#   17 MET  HB-          81 LEU  HA          4.50    (#   2428:20   Unique)
 &rst
  ixpk= 2428, iat=  -1,1315, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 243, 244,
 &end
#
#   80 LEU  HA           81 LEU  HA          6.00    (#   2429:20   Unique)
 &rst
  ixpk= 2429, iat=1296,1315, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:2430    81 LEU  HA          3.50    (#   2430:20   Single Ambig)
 &rst
  ixpk= 2430, iat=  -1,1315, r1= 0.00, r2= 1.80, r3= 4.84, r4= 5.59,
 igr1= 252, 253, 254, 243, 244, 243, 244,
 &end
#
#    0 AMB  20-2:2431     0 AMB  20-1:2431   3.50    (#   2431:20   Double Ambig)
 &rst
  ixpk= 2431, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=1341,1342,1343,1345,1346,1347, 871, 872,
 igr2=1334, 866,
 &end
#
#   48 VAL  MGY          55 LYS  HA          4.50    (#   2432:20   Unique)
 &rst
  ixpk= 2432, iat=  -1, 866, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 760, 761, 762, 764, 765, 766,
 &end
#
#   45 PHE  HD           44 GLN  HA          6.00    (#   2433:20   Unique)
 &rst
  ixpk= 2433, iat=  -1, 699, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 722, 730,
 &end
#
#   63 TYR  HD           44 GLN  HA          3.50    (#   2435:20   Unique)
 &rst
  ixpk= 2435, iat=  -1, 699, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 998,1007,
 &end
#
#    0 AMB  20-2:2436     0 AMB  20-1:2436   4.50    (#   2436:20   Double Ambig)
 &rst
  ixpk= 2436, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.99, r4= 7.74,
 igr1= 709, 710, 724, 728,1313, 258,  87,
 igr2= 699,1334,
 &end
#
#    0 AMB  20-2:2438     0 AMB  20-1:2438   3.50    (#   2438:20   Double Ambig)
 &rst
  ixpk= 2438, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 232, 233, 994, 995,
 igr2=1334, 699,
 &end
#
#    0 AMB  20-2:2439     0 AMB  20-1:2439   3.50    (#   2439:20   Double Ambig)
 &rst
  ixpk= 2439, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 871, 872,1021,1022,1023,
 igr2= 866, 699,
 &end
#
#    0 AMB  20-2:2440    93 ALA  HA          2.70    (#   2440:20   Single Ambig)
 &rst
  ixpk= 2440, iat=  -1,1502, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1504,1505,1506,2064,2065,
 &end
#
#    0 AMB  20-2:2441    93 ALA  HA          3.50    (#   2441:20   Single Ambig)
 &rst
  ixpk= 2441, iat=  -1,1502, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2014,2015,2016,1516,1517,1518,
 &end
#
#    0 AMB  20-2:2442    78 HIS  HA          4.50    (#   2442:20   Single Ambig)
 &rst
  ixpk= 2442, iat=  -1,1260, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1240,1241,1288,1289,1290, 774, 775,1280,
 &end
#
#    0 AMB  20-2:2443    78 HIS  HA          4.50    (#   2443:20   Single Ambig)
 &rst
  ixpk= 2443, iat=  -1,1260, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1277,1222, 811, 812,
 &end
#
#   49 GLN  HE2-         78 HIS  HA          3.50    (#   2444:20   Unique)
 &rst
  ixpk= 2444, iat=  -1,1260, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 782, 783,
 &end
#
#   24 PHE  HZ           78 HIS  HA          3.50    (#   2445:20   Unique)
 &rst
  ixpk= 2445, iat= 358,1260, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2446    78 HIS  HA          3.50    (#   2446:20   Single Ambig)
 &rst
  ixpk= 2446, iat=  -1,1260, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 356, 360, 358,
 &end
#
#   78 HIS  HD2          78 HIS  HA          3.50    (#   2447:20   Unique)
 &rst
  ixpk= 2447, iat=1271,1260, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   74 LYS  QD           71 ALA  HA          3.50    (#   2448:20   Unique)
 &rst
  ixpk= 2448, iat=  -1,1135, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1191,1192,
 &end
#
#   74 LYS  HB-          71 ALA  HA          3.50    (#   2449:20   Unique)
 &rst
  ixpk= 2449, iat=  -1,1135, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1185,1186,
 &end
#
#   74 LYS  HB+          71 ALA  HA          3.50    (#   2450:20   Unique)
 &rst
  ixpk= 2450, iat=  -1,1135, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1185,1186,
 &end
#
#   70 ASP  HB-          71 ALA  HA          6.00    (#   2451:20   Unique)
 &rst
  ixpk= 2451, iat=  -1,1135, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1125,1126,
 &end
#
#    0 AMB  20-2:2452    71 ALA  HA          6.00    (#   2452:20   Single Ambig)
 &rst
  ixpk= 2452, iat=  -1,1135, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=1125,1126,1099,1100,
 &end
#
#   74 LYS  HG-          71 ALA  HA          4.50    (#   2453:20   Unique)
 &rst
  ixpk= 2453, iat=  -1,1135, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1188,1189,
 &end
#
#    0 AMB  20-2:2454   127 ALA  HA          3.50    (#   2454:20   Single Ambig)
 &rst
  ixpk= 2454, iat=  -1,2002, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2004,2005,2006,1504,1505,1506,
 &end
#
#  126 ASP  QB          127 ALA  HA          4.50    (#   2455:20   Unique)
 &rst
  ixpk= 2455, iat=  -1,2002, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1992,1993,
 &end
#
#    0 AMB  20-2:2456   127 ALA  HA          4.50    (#   2456:20   Single Ambig)
 &rst
  ixpk= 2456, iat=  -1,2002, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1516,1517,1518,2014,2015,2016,
 &end
#
#    0 AMB  20-2:2457     0 AMB  20-1:2457   4.50    (#   2457:20   Double Ambig)
 &rst
  ixpk= 2457, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1207,1208,1585,1586, 919, 920,
 igr2=1164,1577,
 &end
#
#    0 AMB  20-2:2458     0 AMB  20-1:2458   4.50    (#   2458:20   Double Ambig)
 &rst
  ixpk= 2458, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 939, 940,1585,1586, 951, 952,
 igr2=1631,1577,
 &end
#
#    0 AMB  20-2:2459    20 GLN  HA          2.70    (#   2459:20   Single Ambig)
 &rst
  ixpk= 2459, iat=  -1, 290, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1= 306, 307, 306, 307,
 &end
#
#   20 GLN  HG-          20 GLN  HA          3.50    (#   2460:20   Unique)
 &rst
  ixpk= 2460, iat=  -1, 290, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 295, 296,
 &end
#
#   21 PRO  QG           20 GLN  HA          4.50    (#   2461:20   Unique)
 &rst
  ixpk= 2461, iat=  -1, 290, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 309, 310,
 &end
#
#   82 LEU  MDY          82 LEU  HA          3.50    (#   2462:20   Unique)
 &rst
  ixpk= 2462, iat=  -1,1334, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1341,1342,1343,1345,1346,1347,
 &end
#
#   20 GLN  HN           20 GLN  HA          3.50    (#   2464:20   Unique)
 &rst
  ixpk= 2464, iat= 288, 290, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   20 GLN  HE2+         20 GLN  HA          3.50    (#   2465:20   Unique)
 &rst
  ixpk= 2465, iat=  -1, 290, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 300, 301,
 &end
#
#   74 LYS  HN           71 ALA  HA          4.50    (#   2466:20   Unique)
 &rst
  ixpk= 2466, iat=1181,1135, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   91 TYR  HE           88 ALA  HA          6.00    (#   2467:20   Unique)
 &rst
  ixpk= 2467, iat=  -1,1422, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1473,1478,
 &end
#
#    0 AMB  20-2:2468    88 ALA  HA          3.50    (#   2468:20   Single Ambig)
 &rst
  ixpk= 2468, iat=  -1,1422, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1471,1480, 853, 858, 795, 803,
 &end
#
#    0 AMB  20-2:2469    88 ALA  HA          3.50    (#   2469:20   Single Ambig)
 &rst
  ixpk= 2469, iat=  -1,1422, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 760, 761, 762, 764, 765, 766, 179, 180, 181, 183,
       184, 185,
 &end
#
#   92 VAL  MG2          88 ALA  HA          4.50    (#   2470:20   Unique)
 &rst
  ixpk= 2470, iat=  -1,1422, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1494,1495,1496,
 &end
#
#   91 TYR  HB2          88 ALA  HA          3.50    (#   2471:20   Unique)
 &rst
  ixpk= 2471, iat=1467,1422, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  101 LEU  MDY         101 LEU  HA          3.50    (#   2472:20   Unique)
 &rst
  ixpk= 2472, iat=  -1,1631, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:2474     0 AMB  20-1:2474   3.50    (#   2474:20   Double Ambig)
 &rst
  ixpk= 2474, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1638,1639,1640,1642,1643,1644,1230,1231,1232,1659,
      1660,1661,
 igr2=1631,1164,1577,
 &end
#
#    0 AMB  20-2:2475     0 AMB  20-1:2475   3.50    (#   2475:20   Double Ambig)
 &rst
  ixpk= 2475, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=1659,1660,1661,1226,1227,1228, 748, 749, 750,
 igr2=1577,1238,1164,
 &end
#
#   73 LEU  MDY          73 LEU  HA          3.50    (#   2476:20   Unique)
 &rst
  ixpk= 2476, iat=  -1,1164, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1171,1172,1173,1175,1176,1177,
 &end
#
#   88 ALA  MB           54 TYR  HA          6.00    (#   2477:20   Unique)
 &rst
  ixpk= 2477, iat=  -1, 845, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1424,1425,1426,
 &end
#
#    0 AMB  20-2:2478    54 TYR  HA          4.50    (#   2478:20   Single Ambig)
 &rst
  ixpk= 2478, iat=  -1, 845, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 760, 761, 762, 764, 765, 766, 179, 180, 181, 183,
       184, 185,
 &end
#
#   50 PHE  HB2          54 TYR  HA          4.50    (#   2479:20   Unique)
 &rst
  ixpk= 2479, iat= 791, 845, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   50 PHE  HB3          54 TYR  HA          6.00    (#   2480:20   Unique)
 &rst
  ixpk= 2480, iat= 792, 845, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:2481    54 TYR  HA          6.00    (#   2481:20   Single Ambig)
 &rst
  ixpk= 2481, iat=  -1, 845, r1= 0.00, r2= 1.80, r3= 7.85, r4= 8.60,
 igr1= 836, 837, 834, 811, 812,
 &end
#
#   51 SER  HN           54 TYR  HA          4.50    (#   2482:20   Unique)
 &rst
  ixpk= 2482, iat= 807, 845, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2483    54 TYR  HA          6.00    (#   2483:20   Single Ambig)
 &rst
  ixpk= 2483, iat=  -1, 845, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 795, 803,1471,1480, 853, 858,
 &end
#
#   54 TYR  HD           54 TYR  HA          4.50    (#   2484:20   Unique)
 &rst
  ixpk= 2484, iat=  -1, 845, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 851, 860,
 &end
#
#   79 MET  HE           54 TYR  HA          3.50    (#   2485:20   Unique)
 &rst
  ixpk= 2485, iat=  -1, 845, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1288,1289,1290,
 &end
#
#  105 PRO  HD+         104 ARG  HA          3.50    (#   2486:20   Unique)
 &rst
  ixpk= 2486, iat=  -1,1667, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1690,1691,
 &end
#
#    0 AMB  20-2:2487     0 AMB  20-1:2487   3.50    (#   2487:20   Double Ambig)
 &rst
  ixpk= 2487, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1690,1691, 971, 972,1222,
 igr2=1667,1631,1238,
 &end
#
#   16 SER  HN           14 ASP  HA          4.50    (#   2488:20   Unique)
 &rst
  ixpk= 2488, iat= 228, 211, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   50 PHE  HN           14 ASP  HA          3.50    (#   2489:20   Unique)
 &rst
  ixpk= 2489, iat= 787, 211, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   15 GLY  HN           14 ASP  HA          3.50    (#   2490:20   Unique)
 &rst
  ixpk= 2490, iat= 221, 211, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   14 ASP  HN           14 ASP  HA          3.50    (#   2491:20   Unique)
 &rst
  ixpk= 2491, iat= 209, 211, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2492    14 ASP  HA          4.50    (#   2492:20   Single Ambig)
 &rst
  ixpk= 2492, iat=  -1, 211, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 797, 801, 799,
 &end
#
#   13 PHE  HA           14 ASP  HA          4.50    (#   2493:20   Unique)
 &rst
  ixpk= 2493, iat= 191, 211, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2494    14 ASP  HA          4.50    (#   2494:20   Single Ambig)
 &rst
  ixpk= 2494, iat=  -1, 211, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 814,1855,1361, 789,
 &end
#
#    0 AMB  20-2:2495    14 ASP  HA          4.50    (#   2495:20   Single Ambig)
 &rst
  ixpk= 2495, iat=  -1, 211, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 223, 224,1353,
 &end
#
#    0 AMB  20-2:2496    14 ASP  HA          3.50    (#   2496:20   Single Ambig)
 &rst
  ixpk= 2496, iat=  -1, 211, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 213, 214, 213, 214,
 &end
#
#   83 THR  MG2          14 ASP  HA          4.50    (#   2497:20   Unique)
 &rst
  ixpk= 2497, iat=  -1, 211, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1357,1358,1359,
 &end
#
#    0 AMB  20-2:2498    12 LEU  HA          3.50    (#   2498:20   Single Ambig)
 &rst
  ixpk= 2498, iat=  -1, 172, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 760, 761, 762, 764, 765, 766, 179, 180, 181, 183,
       184, 185,
 &end
#
#   12 LEU  MDX          12 LEU  HA          4.50    (#   2499:20   Unique)
 &rst
  ixpk= 2499, iat=  -1, 172, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 179, 180, 181, 183, 184, 185,
 &end
#
#   48 VAL  MGX          12 LEU  HA          3.50    (#   2500:20   Unique)
 &rst
  ixpk= 2500, iat=  -1, 172, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 760, 761, 762, 764, 765, 766,
 &end
#
#   48 VAL  HB           12 LEU  HA          4.50    (#   2502:20   Unique)
 &rst
  ixpk= 2502, iat= 758, 172, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2503   111 LEU  HA          6.00    (#   2503:20   Single Ambig)
 &rst
  ixpk= 2503, iat=  -1,1779, r1= 0.00, r2= 1.80, r3= 8.49, r4= 9.24,
 igr1= 174,1494,1495,1496,1802,1803,1804, 119,
 &end
#
#    0 AMB  20-2:2504   111 LEU  HA          4.50    (#   2504:20   Single Ambig)
 &rst
  ixpk= 2504, iat=  -1,1779, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=1490,1491,1492,1825,1826,
 &end
#
#    0 AMB  20-2:2505   111 LEU  HA          3.50    (#   2505:20   Single Ambig)
 &rst
  ixpk= 2505, iat=  -1,1779, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,
 &end
#
#    0 AMB  20-2:2506   111 LEU  HA          3.50    (#   2506:20   Single Ambig)
 &rst
  ixpk= 2506, iat=  -1,1779, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1= 124, 125, 126, 128, 129, 130, 140, 141, 142,2060,
      2061,2062,1828,1829,1830,
 &end
#
#   10 VAL  MG2         111 LEU  HA          4.50    (#   2507:20   Unique)
 &rst
  ixpk= 2507, iat=  -1,1779, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 144, 145, 146,
 &end
#
#    0 AMB  20-2:2508   111 LEU  HA          4.50    (#   2508:20   Single Ambig)
 &rst
  ixpk= 2508, iat=  -1,1779, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1800, 175,
 &end
#
#    0 AMB  20-2:2509   119 ALA  HA          3.50    (#   2509:20   Single Ambig)
 &rst
  ixpk= 2509, iat=  -1,1903, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1357,1358,1359,1917,1918,1919,
 &end
#
#    0 AMB  20-2:2510     0 AMB  20-1:2510   4.50    (#   2510:20   Double Ambig)
 &rst
  ixpk= 2510, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1888, 820,1353,
 igr2=1903,1367,
 &end
#
#    0 AMB  20-2:2511    84 ASN  HA          3.50    (#   2511:20   Single Ambig)
 &rst
  ixpk= 2511, iat=  -1,1367, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1929,1930,1929,1930,
 &end
#
#    0 AMB  20-2:2514    40 ASN  HA          4.50    (#   2514:20   Single Ambig)
 &rst
  ixpk= 2514, iat=  -1, 639, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=1080,1081, 657, 658, 659,
 &end
#
#    0 AMB  20-2:2516    59 ASP  HA          3.50    (#   2516:20   Single Ambig)
 &rst
  ixpk= 2516, iat=  -1, 937, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 738, 739, 740,1545,1546,1547,
 &end
#
#    0 AMB  20-2:2517    59 ASP  HA          3.50    (#   2517:20   Single Ambig)
 &rst
  ixpk= 2517, iat=  -1, 937, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 892, 893, 894,1638,1639,1640,1642,1643,1644,
 &end
#
#  101 LEU  HB3          59 ASP  HA          6.00    (#   2518:20   Unique)
 &rst
  ixpk= 2518, iat=1634, 937, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   46 ALA  HA           59 ASP  HA          3.50    (#   2519:20   Unique)
 &rst
  ixpk= 2519, iat= 736, 937, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  166 LEU  MDY         166 LEU  HA          3.50    (#   2520:20   Unique)
 &rst
  ixpk= 2520, iat=  -1,2642, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2649,2650,2651,2653,2654,2655,
 &end
#
#  166 LEU  MDX         166 LEU  HA          3.50    (#   2521:20   Unique)
 &rst
  ixpk= 2521, iat=  -1,2642, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2649,2650,2651,2653,2654,2655,
 &end
#
#  125 ILE  HG1+        124 ASN  HA          4.50    (#   2522:20   Unique)
 &rst
  ixpk= 2522, iat=  -1,1957, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1979,1980,
 &end
#
#  125 ILE  HG1-        124 ASN  HA          4.50    (#   2523:20   Unique)
 &rst
  ixpk= 2523, iat=  -1,1957, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1979,1980,
 &end
#
#  125 ILE  MG2         124 ASN  HA          4.50    (#   2524:20   Unique)
 &rst
  ixpk= 2524, iat=  -1,1957, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1975,1976,1977,
 &end
#
#    0 AMB  20-2:2530    49 GLN  HA          4.50    (#   2530:20   Single Ambig)
 &rst
  ixpk= 2530, iat=  -1, 772, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1= 760, 761, 762, 764, 765, 766, 179, 180, 181, 183,
       184, 185, 411, 412, 413,
 &end
#
#    0 AMB  20-2:2531    49 GLN  HA          4.50    (#   2531:20   Single Ambig)
 &rst
  ixpk= 2531, iat=  -1, 772, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 792, 907, 908,
 &end
#
#    0 AMB  20-2:2532    49 GLN  HA          6.00    (#   2532:20   Single Ambig)
 &rst
  ixpk= 2532, iat=  -1, 772, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 789, 746,
 &end
#
#    0 AMB  20-2:2533    49 GLN  HA          4.50    (#   2533:20   Single Ambig)
 &rst
  ixpk= 2533, iat=  -1, 772, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 197, 205, 201, 358,
 &end
#
#    0 AMB  20-2:2534    49 GLN  HA          4.50    (#   2534:20   Single Ambig)
 &rst
  ixpk= 2534, iat=  -1, 772, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1= 197, 205, 199, 203, 201,
 &end
#
#   49 GLN  HE2+         49 GLN  HA          4.50    (#   2535:20   Unique)
 &rst
  ixpk= 2535, iat=  -1, 772, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 782, 783,
 &end
#
#  104 ARG  QB          103 ALA  HA          4.50    (#   2536:20   Unique)
 &rst
  ixpk= 2536, iat=  -1,1657, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1669,1670,
 &end
#
#  107 ALA  MB          103 ALA  HA          6.00    (#   2537:20   Unique)
 &rst
  ixpk= 2537, iat=  -1,1657, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1719,1720,1721,
 &end
#
#    0 AMB  20-2:2538   103 ALA  HA          4.50    (#   2538:20   Single Ambig)
 &rst
  ixpk= 2538, iat=  -1,1657, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1557,1667,
 &end
#
#   44 GLN  HE2-        103 ALA  HA          6.00    (#   2539:20   Unique)
 &rst
  ixpk= 2539, iat=  -1,1657, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 709, 710,
 &end
#
#    0 AMB  20-2:2540   103 ALA  HA          3.50    (#   2540:20   Single Ambig)
 &rst
  ixpk= 2540, iat=  -1,1657, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 957, 961, 959, 709, 710,
 &end
#
#    0 AMB  20-2:2541   124 ASN  HA          3.50    (#   2541:20   Single Ambig)
 &rst
  ixpk= 2541, iat=  -1,1957, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1401,1409,1403,1407,
 &end
#
#   86 PHE  HD          124 ASN  HA          4.50    (#   2542:20   Unique)
 &rst
  ixpk= 2542, iat=  -1,1957, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1401,1409,
 &end
#
#   60 PHE  HN           59 ASP  HA          3.50    (#   2543:20   Unique)
 &rst
  ixpk= 2543, iat= 947, 937, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  165 ILE  HN          164 LYS  HA          3.50    (#   2544:20   Unique)
 &rst
  ixpk= 2544, iat=2621,2601, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  164 LYS  HN          164 LYS  HA          4.50    (#   2545:20   Unique)
 &rst
  ixpk= 2545, iat=2599,2601, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  138 ILE  MG2         116 ASP  HA          6.00    (#   2546:20   Unique)
 &rst
  ixpk= 2546, iat=  -1,1869, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=2188,2189,2190,
 &end
#
#  138 ILE  HB          116 ASP  HA          3.50    (#   2547:20   Unique)
 &rst
  ixpk= 2547, iat=2186,1869, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2548   116 ASP  HA          4.50    (#   2548:20   Single Ambig)
 &rst
  ixpk= 2548, iat=  -1,1869, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2192,2193,2215,2216,1859,1860,1861,
 &end
#
#    0 AMB  20-2:2550   116 ASP  HA          4.50    (#   2550:20   Single Ambig)
 &rst
  ixpk= 2550, iat=  -1,1869, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2695,2699,2697,
 &end
#
#  141 HIS  HD2         116 ASP  HA          4.50    (#   2551:20   Unique)
 &rst
  ixpk= 2551, iat=2243,1869, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2552   116 ASP  HA          4.50    (#   2552:20   Single Ambig)
 &rst
  ixpk= 2552, iat=  -1,1869, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2177,2178,2184,
 &end
#
#  142 PHE  HE          116 ASP  HA          3.50    (#   2553:20   Unique)
 &rst
  ixpk= 2553, iat=  -1,1869, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2257,2261,
 &end
#
#  138 ILE  HN          116 ASP  HA          3.50    (#   2554:20   Unique)
 &rst
  ixpk= 2554, iat=2182,1869, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2555   121 ASP  HA          4.50    (#   2555:20   Single Ambig)
 &rst
  ixpk= 2555, iat=  -1,1927, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1941,1942,1950,1951,
 &end
#
#    0 AMB  20-2:2556   155 ALA  HA          3.50    (#   2556:20   Single Ambig)
 &rst
  ixpk= 2556, iat=  -1,2472, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2097,2141,
 &end
#
#    6 ASN  HB+         107 ALA  HA          3.50    (#   2557:20   Unique)
 &rst
  ixpk= 2557, iat=  -1,1717, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=  77,  78,
 &end
#
#    0 AMB  20-2:2559   107 ALA  HA          4.50    (#   2559:20   Single Ambig)
 &rst
  ixpk= 2559, iat=  -1,1717, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1729,  68,  69,
 &end
#
#    0 AMB  20-2:2560   155 ALA  HA          4.50    (#   2560:20   Single Ambig)
 &rst
  ixpk= 2560, iat=  -1,2472, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2150,2151,2152,1982,1983,1984,1825,1826,
 &end
#
#  163 VAL  MG2         155 ALA  HA          4.50    (#   2561:20   Unique)
 &rst
  ixpk= 2561, iat=  -1,2472, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2593,2594,2595,
 &end
#
#    0 AMB  20-2:2562     0 AMB  20-1:2562   4.50    (#   2562:20   Double Ambig)
 &rst
  ixpk= 2562, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1828,1829,1830,  91,
 igr2=2472,1717,
 &end
#
#  133 ARG  HB2         155 ALA  HA          3.50    (#   2563:20   Unique)
 &rst
  ixpk= 2563, iat=2096,2472, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    6 ASN  HB-         107 ALA  HA          3.50    (#   2564:20   Unique)
 &rst
  ixpk= 2564, iat=  -1,1717, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=  77,  78,
 &end
#
#    0 AMB  20-2:2565     0 AMB  20-1:2565   4.50    (#   2565:20   Double Ambig)
 &rst
  ixpk= 2565, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=  97,  98,  99,1443,1444,1445,  93,  94,  95,
 igr2=1717,2472,
 &end
#
#    0 AMB  20-2:2566    47 ALA  HA          4.50    (#   2566:20   Single Ambig)
 &rst
  ixpk= 2566, iat=  -1, 746, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1= 738, 739, 740, 144, 145, 146,1545,1546,1547,
 &end
#
#   48 VAL  MGY          47 ALA  HA          4.50    (#   2567:20   Unique)
 &rst
  ixpk= 2567, iat=  -1, 746, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 760, 761, 762, 764, 765, 766,
 &end
#
#   10 VAL  MG1          47 ALA  HA          3.50    (#   2568:20   Unique)
 &rst
  ixpk= 2568, iat=  -1, 746, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 140, 141, 142,
 &end
#
#   48 VAL  HB           47 ALA  HA          4.50    (#   2569:20   Unique)
 &rst
  ixpk= 2569, iat= 758, 746, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   11 PHE  QB           47 ALA  HA          3.50    (#   2570:20   Unique)
 &rst
  ixpk= 2570, iat=  -1, 746, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 154, 155,
 &end
#
#   58 PHE  HE           47 ALA  HA          6.00    (#   2571:20   Unique)
 &rst
  ixpk= 2571, iat=  -1, 746, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 925, 929,
 &end
#
#    0 AMB  20-2:2572    47 ALA  HA          3.50    (#   2572:20   Single Ambig)
 &rst
  ixpk= 2572, iat=  -1, 746, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 760, 761, 762, 764, 765, 766, 892, 893, 894,
 &end
#
#   69 PRO  HG+          68 ASP  HA          4.50    (#   2573:20   Unique)
 &rst
  ixpk= 2573, iat=  -1,1097, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1111,1112,
 &end
#
#    0 AMB  20-2:2574    68 ASP  HA          4.50    (#   2574:20   Single Ambig)
 &rst
  ixpk= 2574, iat=  -1,1097, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=1111,1112,1077,1078, 548,
 &end
#
#    0 AMB  20-2:2575    68 ASP  HA          4.50    (#   2575:20   Single Ambig)
 &rst
  ixpk= 2575, iat=  -1,1097, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=1137,1138,1139,1080,1081,
 &end
#
#    0 AMB  20-2:2576    68 ASP  HA          2.70    (#   2576:20   Single Ambig)
 &rst
  ixpk= 2576, iat=  -1,1097, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=1108,1109,1108,1109,
 &end
#
#    0 AMB  20-2:2577    68 ASP  HA          4.50    (#   2577:20   Single Ambig)
 &rst
  ixpk= 2577, iat=  -1,1097, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1121,1143,
 &end
#
#   71 ALA  HN           68 ASP  HA          6.00    (#   2578:20   Unique)
 &rst
  ixpk= 2578, iat=1133,1097, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:2579     0 AMB  20-1:2579   3.50    (#   2579:20   Double Ambig)
 &rst
  ixpk= 2579, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1606,1607,1606,1607,1114,1697,
 igr2=1690,1691,1108,1109,
 &end
#
#    0 AMB  20-2:2580   105 PRO  HD-         3.50    (#   2580:20   Single Ambig)
 &rst
  ixpk= 2580, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1606,1607,1606,1607,1697,
 igr2=1690,1691,
 &end
#
#    0 AMB  20-2:2581   105 PRO  HD-         2.70    (#   2581:20   Single Ambig)
 &rst
  ixpk= 2581, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.82, r4= 4.57,
 igr1=1693,1694,1603,1604,
 igr2=1690,1691,
 &end
#
#    0 AMB  20-2:2582     0 AMB  20-1:2582   3.50    (#   2582:20   Double Ambig)
 &rst
  ixpk= 2582, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1111,1112,1693,1694,1603,1604,
 igr2=1108,1109,1690,1691,
 &end
#
#  105 PRO  HA          105 PRO  HD+         3.50    (#   2583:20   Unique)
 &rst
  ixpk= 2583, iat=1699,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1690,1691,
 &end
#
#  105 PRO  HA          105 PRO  HD-         4.50    (#   2584:20   Unique)
 &rst
  ixpk= 2584, iat=1699,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1690,1691,
 &end
#
#  104 ARG  HA          105 PRO  HD+         3.50    (#   2585:20   Unique)
 &rst
  ixpk= 2585, iat=1667,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1690,1691,
 &end
#
#  104 ARG  QB          105 PRO  HD-         3.50    (#   2586:20   Unique)
 &rst
  ixpk= 2586, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1669,1670,
 igr2=1690,1691,
 &end
#
#  106 ASP  HN          105 PRO  HD-         6.00    (#   2587:20   Unique)
 &rst
  ixpk= 2587, iat=1703,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1690,1691,
 &end
#
#  131 ILE  MD1         128 ALA  HA          3.50    (#   2589:20   Unique)
 &rst
  ixpk= 2589, iat=  -1,2012, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2067,2068,2069,
 &end
#
#    0 AMB  20-2:2590   128 ALA  HA          3.50    (#   2590:20   Single Ambig)
 &rst
  ixpk= 2590, iat=  -1,2012, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=2064,2065,1504,1505,1506,
 &end
#
#    0 AMB  20-2:2591   128 ALA  HA          4.50    (#   2591:20   Single Ambig)
 &rst
  ixpk= 2591, iat=  -1,2012, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=2060,2061,2062,1436,1437,1438,1744,
 &end
#
#  131 ILE  HB          128 ALA  HA          4.50    (#   2592:20   Unique)
 &rst
  ixpk= 2592, iat=2058,2012, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2593   128 ALA  HA          6.00    (#   2593:20   Single Ambig)
 &rst
  ixpk= 2593, iat=  -1,2012, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1502,2002,1451,
 &end
#
#  131 ILE  HN          128 ALA  HA          4.50    (#   2594:20   Unique)
 &rst
  ixpk= 2594, iat=2054,2012, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  130 ASP  HN          128 ALA  HA          4.50    (#   2595:20   Unique)
 &rst
  ixpk= 2595, iat=2042,2012, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2596     0 AMB  20-1:2596   4.50    (#   2596:20   Double Ambig)
 &rst
  ixpk= 2596, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.64, r4= 9.39,
 igr1= 892, 893, 894,1147,1137,1138,1139,1719,1720,1721,
      
 igr2= 736,1108,1109,1690,1691,
 &end
#
#    0 AMB  20-2:2597    69 PRO  HD-         3.50    (#   2597:20   Single Ambig)
 &rst
  ixpk= 2597, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1099,1100,1125,1126,
 igr2=1108,1109,
 &end
#
#    0 AMB  20-2:2598     0 AMB  20-1:2598   3.50    (#   2598:20   Double Ambig)
 &rst
  ixpk= 2598, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=1111,1112, 548,1696,
 igr2=1108,1109,1690,1691,
 &end
#
#    0 AMB  20-2:2599     0 AMB  20-1:2599   3.50    (#   2599:20   Double Ambig)
 &rst
  ixpk= 2599, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1115, 557, 558, 559,1669,1670,
 igr2=1108,1109,1690,1691,
 &end
#
#   68 ASP  HA            0 AMB  20-1:2600   3.50    (#   2600:20   Single Ambig)
 &rst
  ixpk= 2600, iat=1097,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2=1108,1109,1108,1109,
 &end
#
#    0 AMB  20-2:2601     0 AMB  20-1:2601   4.50    (#   2601:20   Double Ambig)
 &rst
  ixpk= 2601, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.84, r4= 8.59,
 igr1=1715,1133, 158, 166,
 igr2=1690,1691,1108,1109,1108,1109, 736,
 &end
#
#    0 AMB  20-2:2602    46 ALA  HA          4.50    (#   2602:20   Single Ambig)
 &rst
  ixpk= 2602, iat=  -1, 736, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 955, 963, 158, 166, 998,1007,
 &end
#
#   70 ASP  HN            0 AMB  20-1:2603   3.50    (#   2603:20   Single Ambig)
 &rst
  ixpk= 2603, iat=1121,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2=1108,1109,1108,1109,
 &end
#
#   69 PRO  HG+          69 PRO  HD+         3.50    (#   2604:20   Unique)
 &rst
  ixpk= 2604, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1111,1112,
 igr2=1108,1109,
 &end
#
#    0 AMB  20-2:2605    69 PRO  HD+         3.50    (#   2605:20   Single Ambig)
 &rst
  ixpk= 2605, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1111,1112, 548,
 igr2=1108,1109,
 &end
#
#    0 AMB  20-2:2606    69 PRO  HD+         4.50    (#   2606:20   Single Ambig)
 &rst
  ixpk= 2606, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1115, 557, 558, 559,
 igr2=1108,1109,
 &end
#
#   68 ASP  HA           69 PRO  HD+         3.50    (#   2607:20   Unique)
 &rst
  ixpk= 2607, iat=1097,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1108,1109,
 &end
#
#    0 AMB  20-2:2608     0 AMB  20-1:2608   3.50    (#   2608:20   Double Ambig)
 &rst
  ixpk= 2608, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 309, 310,1114,
 igr2= 306, 307,1108,1109,1108,1109,
 &end
#
#    0 AMB  20-2:2609     0 AMB  20-1:2609   3.50    (#   2609:20   Double Ambig)
 &rst
  ixpk= 2609, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 309, 310,1114,
 igr2= 306, 307,1108,1109,
 &end
#
#    0 AMB  20-2:2610     0 AMB  20-1:2610   3.50    (#   2610:20   Double Ambig)
 &rst
  ixpk= 2610, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1= 313, 295, 296,1125,1126, 323, 324, 350,
 igr2= 306, 307,1108,1109,
 &end
#
#    0 AMB  20-2:2611     0 AMB  20-1:2611   3.50    (#   2611:20   Double Ambig)
 &rst
  ixpk= 2611, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1= 313, 295, 296,1125,1126, 323, 324, 350,
 igr2= 306, 307,1108,1109,
 &end
#
#   20 GLN  HA           21 PRO  HD+         3.50    (#   2612:20   Unique)
 &rst
  ixpk= 2612, iat= 290,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 306, 307,
 &end
#
#  104 ARG  HA          105 PRO  HD-         3.50    (#   2613:20   Unique)
 &rst
  ixpk= 2613, iat=1667,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1690,1691,
 &end
#
#   20 GLN  HA           21 PRO  HD-         3.50    (#   2614:20   Unique)
 &rst
  ixpk= 2614, iat= 290,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 306, 307,
 &end
#
#    0 AMB  20-2:2615     0 AMB  20-1:2615   4.50    (#   2615:20   Double Ambig)
 &rst
  ixpk= 2615, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.84, r4= 8.59,
 igr1= 292, 293, 573, 574, 549, 570, 571,
 igr2= 306, 307,1108,1109,
 &end
#
#    0 AMB  20-2:2616     0 AMB  20-1:2616   3.50    (#   2616:20   Double Ambig)
 &rst
  ixpk= 2616, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.10, r4= 6.85,
 igr1= 292, 293, 573, 574, 549, 570, 571,
 igr2= 306, 307,1108,1109,
 &end
#
#   90 ASN  QB           87 GLY  HA+         4.50    (#   2617:20   Unique)
 &rst
  ixpk= 2617, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1453,1454,
 igr2=1415,1416,
 &end
#
#   88 ALA  MB           87 GLY  HA-         4.50    (#   2618:20   Unique)
 &rst
  ixpk= 2618, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1424,1425,1426,
 igr2=1415,1416,
 &end
#
#    0 AMB  20-2:2619     0 AMB  20-1:2619   4.50    (#   2619:20   Double Ambig)
 &rst
  ixpk= 2619, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.14, r4= 7.89,
 igr1=2234,2235,1453,1454,
 igr2=1881,1882,1415,1416,
 &end
#
#   12 LEU  MDX          12 LEU  HB2         3.50    (#   2620:20   Unique)
 &rst
  ixpk= 2620, iat=  -1, 174, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:2621    12 LEU  HB2         3.50    (#   2621:20   Single Ambig)
 &rst
  ixpk= 2621, iat=  -1, 174, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 179, 180, 181, 183, 184, 185, 760, 761, 762, 764,
       765, 766,
 &end
#
#   12 LEU  MDX          12 LEU  HB3         3.50    (#   2622:20   Unique)
 &rst
  ixpk= 2622, iat=  -1, 175, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:2623    12 LEU  HB3         3.50    (#   2623:20   Single Ambig)
 &rst
  ixpk= 2623, iat=  -1, 175, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 179, 180, 181, 183, 184, 185,1821,1822,1823,
 &end
#
#   12 LEU  HG           12 LEU  HB3         3.50    (#   2624:20   Unique)
 &rst
  ixpk= 2624, iat= 177, 175, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  113 ILE  HA           12 LEU  HB3         4.50    (#   2625:20   Unique)
 &rst
  ixpk= 2625, iat=1817, 175, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2626    12 LEU  HB3         3.50    (#   2626:20   Single Ambig)
 &rst
  ixpk= 2626, iat=  -1, 175, r1= 0.00, r2= 1.80, r3= 5.43, r4= 6.18,
 igr1=1825,1826,1786,1787,1788,1790,1791,1792,1786,1787,
      1788,1790,1791,1792,
 &end
#
#    0 AMB  20-2:2627    12 LEU  HB2         3.50    (#   2627:20   Single Ambig)
 &rst
  ixpk= 2627, iat=  -1, 174, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792, 760, 761, 762, 764, 765, 766,
 &end
#
#   88 ALA  MB           50 PHE  HB2         3.50    (#   2628:20   Unique)
 &rst
  ixpk= 2628, iat=  -1, 791, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1424,1425,1426,
 &end
#
#    0 AMB  20-2:2629    50 PHE  HB2         4.50    (#   2629:20   Single Ambig)
 &rst
  ixpk= 2629, iat=  -1, 791, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 179, 180, 181, 183, 184, 185, 760, 761, 762, 764,
       765, 766,
 &end
#
#   88 ALA  MB           50 PHE  HB3         4.50    (#   2630:20   Unique)
 &rst
  ixpk= 2630, iat=  -1, 792, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1424,1425,1426,
 &end
#
#    0 AMB  20-2:2631    50 PHE  HB3         3.50    (#   2631:20   Single Ambig)
 &rst
  ixpk= 2631, iat=  -1, 792, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 179, 180, 181, 183, 184, 185, 760, 761, 762, 764,
       765, 766,
 &end
#
#   50 PHE  HD           50 PHE  HB2         4.50    (#   2632:20   Preassigned)
 &rst
  ixpk= 2632, iat=  -1, 791, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 795, 803,
 &end
#
#   50 PHE  HE           50 PHE  HB3         6.00    (#   2633:20   Unique)
 &rst
  ixpk= 2633, iat=  -1, 792, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 797, 801,
 &end
#
#   50 PHE  HD           50 PHE  HB3         4.50    (#   2634:20   Preassigned)
 &rst
  ixpk= 2634, iat=  -1, 792, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 795, 803,
 &end
#
#    9 LEU  MDY         111 LEU  HA          6.00    (#   2635:20   Unique)
 &rst
  ixpk= 2635, iat=  -1,1779, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 124, 125, 126, 128, 129, 130,
 &end
#
#   85 THR  MG2           0 AMB  20-1:2636   4.50    (#   2636:20   Single Ambig)
 &rst
  ixpk= 2636, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1385,1386,1387,
 igr2=1903,1367,
 &end
#
#  121 ASP  HN            0 AMB  20-1:2637   3.50    (#   2637:20   Single Ambig)
 &rst
  ixpk= 2637, iat=1925,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1367,1903,
 &end
#
#    0 AMB  20-2:2638     0 AMB  20-1:2638   4.50    (#   2638:20   Double Ambig)
 &rst
  ixpk= 2638, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1401,1409,1374,1375,
 igr2=1367,1903,
 &end
#
#    0 AMB  20-2:2639     0 AMB  20-1:2639   4.50    (#   2639:20   Double Ambig)
 &rst
  ixpk= 2639, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 795, 803,2460,2464,2462,1948,
 igr2=1367,1903,
 &end
#
#   86 PHE  HN            0 AMB  20-1:2640   4.50    (#   2640:20   Single Ambig)
 &rst
  ixpk= 2640, iat=1393,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1367,1903,
 &end
#
#    0 AMB  20-2:2642    14 ASP  HA          6.00    (#   2642:20   Single Ambig)
 &rst
  ixpk= 2642, iat=  -1, 211, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1= 179, 180, 181, 183, 184, 185, 411, 412, 413,1821,
      1822,1823,
 &end
#
#   15 GLY  HA+          14 ASP  HA          4.50    (#   2643:20   Unique)
 &rst
  ixpk= 2643, iat=  -1, 211, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 223, 224,
 &end
#
#    0 AMB  20-2:2644    14 ASP  HA          6.00    (#   2644:20   Single Ambig)
 &rst
  ixpk= 2644, iat=  -1, 211, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1= 772, 232, 233,
 &end
#
#   24 PHE  HZ           14 ASP  HA          6.00    (#   2645:20   Unique)
 &rst
  ixpk= 2645, iat= 358, 211, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:2646    20 GLN  HA          4.50    (#   2646:20   Single Ambig)
 &rst
  ixpk= 2646, iat=  -1, 290, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1= 335, 336, 338, 339, 312,
 &end
#
#    0 AMB  20-2:2647     0 AMB  20-1:2647   3.50    (#   2647:20   Double Ambig)
 &rst
  ixpk= 2647, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1693,1694,1603,1604,2517,2518,2517,2518,1696,
 igr2=1667,2493,
 &end
#
#    0 AMB  20-2:2648     0 AMB  20-1:2648   3.50    (#   2648:20   Double Ambig)
 &rst
  ixpk= 2648, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1606,1607,1606,1607, 309, 310,2520,1697,
 igr2=1667, 290,2493,
 &end
#
#  159 ALA  MB          157 LYS  HA          3.50    (#   2649:20   Unique)
 &rst
  ixpk= 2649, iat=  -1,2493, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2531,2532,2533,
 &end
#
#    0 AMB  20-2:2650     0 AMB  20-1:2650   3.50    (#   2650:20   Double Ambig)
 &rst
  ixpk= 2650, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1171,1172,1173,1175,1176,1177, 616, 617, 618, 620,
       621, 622,
 igr2=1164, 609,
 &end
#
#    0 AMB  20-2:2652     0 AMB  20-1:2652   3.50    (#   2652:20   Double Ambig)
 &rst
  ixpk= 2652, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1230,1231,1232,2631,2632,
 igr2=1164,2601,
 &end
#
#   48 VAL  HA           49 GLN  HA          6.00    (#   2653:20   Unique)
 &rst
  ixpk= 2653, iat= 756, 772, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:2655    68 ASP  HA          6.00    (#   2655:20   Single Ambig)
 &rst
  ixpk= 2655, iat=  -1,1097, r1= 0.00, r2= 1.80, r3= 7.85, r4= 8.60,
 igr1= 573, 574, 570, 571, 549,
 &end
#
#    0 AMB  20-2:2656    68 ASP  HA          4.50    (#   2656:20   Single Ambig)
 &rst
  ixpk= 2656, iat=  -1,1097, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1075,1054,
 &end
#
#   69 PRO  HB2          68 ASP  HA          6.00    (#   2657:20   Unique)
 &rst
  ixpk= 2657, iat=1114,1097, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   45 PHE  HA           46 ALA  HA          4.50    (#   2658:20   Unique)
 &rst
  ixpk= 2658, iat= 716, 736, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2659     0 AMB  20-1:2659   4.50    (#   2659:20   Double Ambig)
 &rst
  ixpk= 2659, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1095, 959,
 igr2=1108,1109, 736,
 &end
#
#    0 AMB  20-2:2660    46 ALA  HA          6.00    (#   2660:20   Single Ambig)
 &rst
  ixpk= 2660, iat=  -1, 736, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1= 140, 141, 142,1148,
 &end
#
#    0 AMB  20-2:2661     0 AMB  20-1:2661   4.50    (#   2661:20   Double Ambig)
 &rst
  ixpk= 2661, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.14, r4= 8.89,
 igr1= 719,1075, 546, 939, 940, 154, 155,
 igr2= 736,1108,1109,1108,1109,
 &end
#
#    0 AMB  20-2:2662     0 AMB  20-1:2662   4.50    (#   2662:20   Double Ambig)
 &rst
  ixpk= 2662, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.84, r4= 8.59,
 igr1= 496, 919, 920,1657,
 igr2=1108,1109,1108,1109, 736,1690,1691,
 &end
#
#   47 ALA  HA           46 ALA  HA          6.00    (#   2663:20   Unique)
 &rst
  ixpk= 2663, iat= 746, 736, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   88 ALA  MB           87 GLY  HA+         6.00    (#   2664:20   Unique)
 &rst
  ixpk= 2664, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1424,1425,1426,
 igr2=1415,1416,
 &end
#
#   90 ASN  HD2-         87 GLY  HA-         3.50    (#   2665:20   Unique)
 &rst
  ixpk= 2665, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1458,1459,
 igr2=1415,1416,
 &end
#
#    0 AMB  20-2:2666     0 AMB  20-1:2666   6.00    (#   2666:20   Double Ambig)
 &rst
  ixpk= 2666, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.52, r4=10.27,
 igr1= 853, 858,2972,2977,
 igr2=1415,1416,3035,3036,
 &end
#
#   54 TYR  HB-          50 PHE  HB2         4.50    (#   2668:20   Unique)
 &rst
  ixpk= 2668, iat=  -1, 791, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 847, 848,
 &end
#
#   48 VAL  HB           50 PHE  HB2         6.00    (#   2669:20   Unique)
 &rst
  ixpk= 2669, iat= 758, 791, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   50 PHE  HE           50 PHE  HB2         6.00    (#   2673:20   Unique)
 &rst
  ixpk= 2673, iat=  -1, 791, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 797, 801,
 &end
#
#   60 PHE  HB+         102 GLY  HA-         6.00    (#   2676:20   Unique)
 &rst
  ixpk= 2676, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1= 951, 952,
 igr2=1650,1651,
 &end
#
#  138 ILE  MG2         139 GLY  HA+         4.50    (#   2677:20   Unique)
 &rst
  ixpk= 2677, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2188,2189,2190,
 igr2=2203,2204,
 &end
#
#    7 VAL  MG2           5 GLY  HA-         6.00    (#   2678:20   Unique)
 &rst
  ixpk= 2678, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=  97,  98,  99,
 igr2=  68,  69,
 &end
#
#  186 ILE  MG2           5 GLY  HA-         6.00    (#   2679:20   Unique)
 &rst
  ixpk= 2679, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=3005,3006,3007,
 igr2=  68,  69,
 &end
#
#    0 AMB  20-2:2680     0 AMB  20-1:2680   6.00    (#   2680:20   Double Ambig)
 &rst
  ixpk= 2680, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.46, r4=11.21,
 igr1=  51,  52,2215,2216,2644,2645,2647,
 igr2=  68,  69,2203,2204,
 &end
#
#    0 AMB  20-2:2681     0 AMB  20-1:2681   4.50    (#   2681:20   Double Ambig)
 &rst
  ixpk= 2681, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.02, r4= 8.77,
 igr1=2218,2219,  48,  49,  48,  49,2212,2213,
 igr2=2203,2204,  68,  69,
 &end
#
#    0 AMB  20-2:2682     0 AMB  20-1:2682   3.50    (#   2682:20   Double Ambig)
 &rst
  ixpk= 2682, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1=2218,2219,1279,1288,1289,1290,2212,2213,
 igr2=2203,2204, 223, 224,
 &end
#
#    0 AMB  20-2:2683   139 GLY  HA+         4.50    (#   2683:20   Single Ambig)
 &rst
  ixpk= 2683, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=2215,2216,2644,2645,2647,
 igr2=2203,2204,
 &end
#
#  101 LEU  HN          102 GLY  HA-         4.50    (#   2684:20   Unique)
 &rst
  ixpk= 2684, iat=1629,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1650,1651,
 &end
#
#   45 PHE  HD           45 PHE  HB2         4.50    (#   2686:20   Unique)
 &rst
  ixpk= 2686, iat=  -1, 718, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 722, 730,
 &end
#
#   11 PHE  HD           45 PHE  HB2         4.50    (#   2687:20   Unique)
 &rst
  ixpk= 2687, iat=  -1, 718, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 158, 166,
 &end
#
#    0 AMB  20-2:2688    45 PHE  HB3         4.50    (#   2688:20   Single Ambig)
 &rst
  ixpk= 2688, iat=  -1, 719, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 160, 164, 925, 929, 927, 162,
 &end
#
#  138 ILE  MG2         139 GLY  HA-         4.50    (#   2689:20   Unique)
 &rst
  ixpk= 2689, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2188,2189,2190,
 igr2=2203,2204,
 &end
#
#    7 VAL  MG2           5 GLY  HA+         6.00    (#   2690:20   Unique)
 &rst
  ixpk= 2690, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=  97,  98,  99,
 igr2=  68,  69,
 &end
#
#  103 ALA  MB          102 GLY  HA-         6.00    (#   2691:20   Unique)
 &rst
  ixpk= 2691, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1659,1660,1661,
 igr2=1650,1651,
 &end
#
#    0 AMB  20-2:2692   102 GLY  HA+         3.50    (#   2692:20   Single Ambig)
 &rst
  ixpk= 2692, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 951, 952, 951, 952,
 igr2=1650,1651,
 &end
#
#   45 PHE  HD           45 PHE  HB3         4.50    (#   2694:20   Unique)
 &rst
  ixpk= 2694, iat=  -1, 719, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 722, 730,
 &end
#
#   45 PHE  HD           45 PHE  HB3         3.50    (#   2695:20   Unique)
 &rst
  ixpk= 2695, iat=  -1, 719, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 722, 730,
 &end
#
#    0 AMB  20-2:2696    45 PHE  HB2         4.50    (#   2696:20   Single Ambig)
 &rst
  ixpk= 2696, iat=  -1, 718, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 925, 929, 998,1007, 160, 164,
 &end
#
#    0 AMB  20-2:2697    45 PHE  HB3         3.50    (#   2697:20   Single Ambig)
 &rst
  ixpk= 2697, iat=  -1, 719, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 925, 929, 158, 166, 998,1007,
 &end
#
#   11 PHE  HD           45 PHE  HB3         4.50    (#   2698:20   Unique)
 &rst
  ixpk= 2698, iat=  -1, 719, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 158, 166,
 &end
#
#    0 AMB  20-2:2699     0 AMB  20-1:2699   3.50    (#   2699:20   Double Ambig)
 &rst
  ixpk= 2699, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1855,1361,
 igr2= 213, 214, 213, 214,
 &end
#
#    0 AMB  20-2:2700     0 AMB  20-1:2700   3.50    (#   2700:20   Double Ambig)
 &rst
  ixpk= 2700, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1855,1361,
 igr2= 213, 214, 213, 214,
 &end
#
#   50 PHE  HE            0 AMB  20-1:2701   4.50    (#   2701:20   Single Ambig)
 &rst
  ixpk= 2701, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 797, 801,
 igr2= 213, 214, 213, 214,
 &end
#
#    0 AMB  20-2:2702     0 AMB  20-1:2702   4.50    (#   2702:20   Double Ambig)
 &rst
  ixpk= 2702, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 797, 801, 799,
 igr2= 213, 214, 213, 214,
 &end
#
#  116 ASP  HN            0 AMB  20-1:2703   4.50    (#   2703:20   Single Ambig)
 &rst
  ixpk= 2703, iat=1867,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr2= 213, 214, 213, 214,
 &end
#
#    0 AMB  20-2:2704   166 LEU  QB          3.50    (#   2704:20   Single Ambig)
 &rst
  ixpk= 2704, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2184,2158,
 igr2=2644,2645,
 &end
#
#    0 AMB  20-2:2705   166 LEU  QB          4.50    (#   2705:20   Single Ambig)
 &rst
  ixpk= 2705, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2671,2720,
 igr2=2644,2645,
 &end
#
#   78 HIS  HD2          15 GLY  HA-         4.50    (#   2706:20   Unique)
 &rst
  ixpk= 2706, iat=1271,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 223, 224,
 &end
#
#    0 AMB  20-2:2707     0 AMB  20-1:2707   3.50    (#   2707:20   Double Ambig)
 &rst
  ixpk= 2707, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 358, 197, 205,2671,
 igr2= 223, 224,2203,2204,
 &end
#
#    0 AMB  20-2:2708    15 GLY  HA-         3.50    (#   2708:20   Single Ambig)
 &rst
  ixpk= 2708, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 356, 360, 358,
 igr2= 223, 224,
 &end
#
#  138 ILE  MG2         166 LEU  QB          3.50    (#   2709:20   Unique)
 &rst
  ixpk= 2709, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2188,2189,2190,
 igr2=2644,2645,
 &end
#
#    9 LEU  MDY           9 LEU  HB2         4.50    (#   2710:20   Unique)
 &rst
  ixpk= 2710, iat=  -1, 119, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 124, 125, 126, 128, 129, 130,
 &end
#
#    9 LEU  MDX           9 LEU  HB2         3.50    (#   2711:20   Unique)
 &rst
  ixpk= 2711, iat=  -1, 119, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 124, 125, 126, 128, 129, 130,
 &end
#
#    7 VAL  MG1           9 LEU  HB2         3.50    (#   2712:20   Unique)
 &rst
  ixpk= 2712, iat=  -1, 119, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=  93,  94,  95,
 &end
#
#    9 LEU  MDY           9 LEU  HB3         3.50    (#   2713:20   Unique)
 &rst
  ixpk= 2713, iat=  -1, 120, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:2715     9 LEU  HB2         3.50    (#   2715:20   Single Ambig)
 &rst
  ixpk= 2715, iat=  -1, 119, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 724, 728, 726, 162, 709, 710, 160, 164,
 &end
#
#   43 TYR  HD            9 LEU  HB2         3.50    (#   2716:20   Unique)
 &rst
  ixpk= 2716, iat=  -1, 119, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 684, 693,
 &end
#
#  166 LEU  MDY         166 LEU  QB          3.50    (#   2717:20   Unique)
 &rst
  ixpk= 2717, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2649,2650,2651,2653,2654,2655,
 igr2=2644,2645,
 &end
#
#    0 AMB  20-2:2718   166 LEU  QB          3.50    (#   2718:20   Single Ambig)
 &rst
  ixpk= 2718, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2162,2163,2164,2649,2650,2651,2653,2654,2655,
 igr2=2644,2645,
 &end
#
#  138 ILE  MD1         166 LEU  QB          4.50    (#   2719:20   Unique)
 &rst
  ixpk= 2719, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2195,2196,2197,
 igr2=2644,2645,
 &end
#
#  171 LYS  HB+         166 LEU  QB          4.50    (#   2720:20   Unique)
 &rst
  ixpk= 2720, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2724,2725,
 igr2=2644,2645,
 &end
#
#    7 VAL  MG1           9 LEU  HB3         4.50    (#   2721:20   Unique)
 &rst
  ixpk= 2721, iat=  -1, 120, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=  93,  94,  95,
 &end
#
#    9 LEU  HG            9 LEU  HB2         3.50    (#   2722:20   Unique)
 &rst
  ixpk= 2722, iat= 122, 119, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  138 ILE  HG1-        166 LEU  QB          6.00    (#   2723:20   Unique)
 &rst
  ixpk= 2723, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=2192,2193,
 igr2=2644,2645,
 &end
#
#    9 LEU  MDX           9 LEU  HB3         3.50    (#   2724:20   Unique)
 &rst
  ixpk= 2724, iat=  -1, 120, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 124, 125, 126, 128, 129, 130,
 &end
#
#    9 LEU  HG            9 LEU  HB3         3.50    (#   2725:20   Unique)
 &rst
  ixpk= 2725, iat= 122, 120, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2726   166 LEU  QB          4.50    (#   2726:20   Single Ambig)
 &rst
  ixpk= 2726, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2160,2802,
 igr2=2644,2645,
 &end
#
#    0 AMB  20-2:2727   166 LEU  QB          3.50    (#   2727:20   Single Ambig)
 &rst
  ixpk= 2727, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2724,2725,2603,2604,2603,2604,2727,2728,
 igr2=2644,2645,
 &end
#
#  139 GLY  HN          166 LEU  QB          6.00    (#   2728:20   Unique)
 &rst
  ixpk= 2728, iat=2201,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=2644,2645,
 &end
#
#   19 LEU  MDX          15 GLY  HA+         3.50    (#   2729:20   Unique)
 &rst
  ixpk= 2729, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 278, 279, 280, 282, 283, 284,
 igr2= 223, 224,
 &end
#
#    0 AMB  20-2:2730    15 GLY  HA+         4.50    (#   2730:20   Single Ambig)
 &rst
  ixpk= 2730, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 273, 274,1279,1288,1289,1290,
 igr2= 223, 224,
 &end
#
#   14 ASP  HA           15 GLY  HA+         6.00    (#   2731:20   Unique)
 &rst
  ixpk= 2731, iat= 211,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2= 223, 224,
 &end
#
#    0 AMB  20-2:2732    15 GLY  HA+         3.50    (#   2732:20   Single Ambig)
 &rst
  ixpk= 2732, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 356, 360, 358,
 igr2= 223, 224,
 &end
#
#   78 HIS  HD2          15 GLY  HA+         4.50    (#   2733:20   Unique)
 &rst
  ixpk= 2733, iat=1271,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 223, 224,
 &end
#
#  115 THR  HB            0 AMB  20-1:2734   3.50    (#   2734:20   Single Ambig)
 &rst
  ixpk= 2734, iat=1857,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2= 213, 214, 213, 214,
 &end
#
#  151 LEU  MDX         137 GLY  HA+         3.50    (#   2735:20   Unique)
 &rst
  ixpk= 2735, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2401,2402,2403,2405,2406,2407,
 igr2=2177,2178,
 &end
#
#    0 AMB  20-2:2736   137 GLY  HA+         4.50    (#   2736:20   Single Ambig)
 &rst
  ixpk= 2736, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2401,2402,2403,2405,2406,2407,2150,2151,2152,
 igr2=2177,2178,
 &end
#
#    0 AMB  20-2:2737   137 GLY  HA+         3.50    (#   2737:20   Single Ambig)
 &rst
  ixpk= 2737, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=2634,2635,2636,2192,2193,
 igr2=2177,2178,
 &end
#
#    0 AMB  20-2:2738   137 GLY  HA+         3.50    (#   2738:20   Single Ambig)
 &rst
  ixpk= 2738, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1859,1860,1861,2192,2193,
 igr2=2177,2178,
 &end
#
#    0 AMB  20-2:2739   116 ASP  HB3         3.50    (#   2739:20   Single Ambig)
 &rst
  ixpk= 2739, iat=  -1,1872, r1= 0.00, r2= 1.80, r3= 4.84, r4= 5.59,
 igr1=2186, 278, 279, 280, 282, 283, 284,
 &end
#
#    0 AMB  20-2:2740    59 ASP  HB+         3.50    (#   2740:20   Single Ambig)
 &rst
  ixpk= 2740, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 892, 893, 894,1638,1639,1640,1642,1643,1644,
 igr2= 939, 940,
 &end
#
#    0 AMB  20-2:2741    59 ASP  HB-         3.50    (#   2741:20   Single Ambig)
 &rst
  ixpk= 2741, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 892, 893, 894,1638,1639,1640,1642,1643,1644,
 igr2= 939, 940,
 &end
#
#  151 LEU  MDX         137 GLY  HA-         3.50    (#   2742:20   Unique)
 &rst
  ixpk= 2742, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2401,2402,2403,2405,2406,2407,
 igr2=2177,2178,
 &end
#
#    0 AMB  20-2:2743   137 GLY  HA-         3.50    (#   2743:20   Single Ambig)
 &rst
  ixpk= 2743, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=2634,2635,2636,2192,2193,
 igr2=2177,2178,
 &end
#
#    0 AMB  20-2:2744   137 GLY  HA-         4.50    (#   2744:20   Single Ambig)
 &rst
  ixpk= 2744, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2627,2628,2629,2589,2590,2591,
 igr2=2177,2178,
 &end
#
#  136 ILE  MG2         137 GLY  HA-         4.50    (#   2745:20   Unique)
 &rst
  ixpk= 2745, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2162,2163,2164,
 igr2=2177,2178,
 &end
#
#    0 AMB  20-2:2746   137 GLY  HA-         4.50    (#   2746:20   Single Ambig)
 &rst
  ixpk= 2746, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2401,2402,2403,2405,2406,2407,2150,2151,2152,
 igr2=2177,2178,
 &end
#
#    0 AMB  20-2:2747   137 GLY  HA-         3.50    (#   2747:20   Single Ambig)
 &rst
  ixpk= 2747, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1859,1860,1861,2192,2193,
 igr2=2177,2178,
 &end
#
#  138 ILE  HB          116 ASP  HB2         3.50    (#   2748:20   Unique)
 &rst
  ixpk= 2748, iat=2186,1871, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   46 ALA  MB           59 ASP  HB-         4.50    (#   2749:20   Unique)
 &rst
  ixpk= 2749, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 738, 739, 740,
 igr2= 939, 940,
 &end
#
#   19 LEU  MDY          19 LEU  HB+         3.50    (#   2750:20   Unique)
 &rst
  ixpk= 2750, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 278, 279, 280, 282, 283, 284,
 igr2= 273, 274,
 &end
#
#   19 LEU  MDX          19 LEU  HB+         3.50    (#   2751:20   Unique)
 &rst
  ixpk= 2751, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 278, 279, 280, 282, 283, 284,
 igr2= 273, 274,
 &end
#
#   19 LEU  MDY          19 LEU  HB-         3.50    (#   2752:20   Unique)
 &rst
  ixpk= 2752, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 278, 279, 280, 282, 283, 284,
 igr2= 273, 274,
 &end
#
#   19 LEU  MDX          19 LEU  HB-         3.50    (#   2753:20   Unique)
 &rst
  ixpk= 2753, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 278, 279, 280, 282, 283, 284,
 igr2= 273, 274,
 &end
#
#   19 LEU  HG           19 LEU  HB-         4.50    (#   2754:20   Unique)
 &rst
  ixpk= 2754, iat= 276,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 273, 274,
 &end
#
#   19 LEU  HG           19 LEU  HB+         3.50    (#   2755:20   Unique)
 &rst
  ixpk= 2755, iat= 276,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 273, 274,
 &end
#
#   24 PHE  HN           19 LEU  HB-         4.50    (#   2756:20   Unique)
 &rst
  ixpk= 2756, iat= 346,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 273, 274,
 &end
#
#   20 GLN  HE2+         19 LEU  HB-         6.00    (#   2757:20   Unique)
 &rst
  ixpk= 2757, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1= 300, 301,
 igr2= 273, 274,
 &end
#
#    0 AMB  20-2:2758    81 LEU  HB2         3.50    (#   2758:20   Single Ambig)
 &rst
  ixpk= 2758, iat=  -1,1317, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1322,1323,1324,1326,1327,1328,1322,1323,1324,1326,
      1327,1328,
 &end
#
#  175 LEU  MDY         175 LEU  HB3         3.50    (#   2759:20   Unique)
 &rst
  ixpk= 2759, iat=  -1,2800, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2804,2805,2806,2808,2809,2810,
 &end
#
#  175 LEU  MDX         175 LEU  HB3         3.50    (#   2760:20   Unique)
 &rst
  ixpk= 2760, iat=  -1,2800, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:2761    81 LEU  HB3         3.50    (#   2761:20   Single Ambig)
 &rst
  ixpk= 2761, iat=  -1,1318, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1322,1323,1324,1326,1327,1328,1322,1323,1324,1326,
      1327,1328,1341,1342,1343,1345,1346,1347,
 &end
#
#    0 AMB  20-2:2762   175 LEU  HB2         3.50    (#   2762:20   Single Ambig)
 &rst
  ixpk= 2762, iat=  -1,2799, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2804,2805,2806,2808,2809,2810,2166,2167,
 &end
#
#  175 LEU  MDX         175 LEU  HB2         3.50    (#   2763:20   Unique)
 &rst
  ixpk= 2763, iat=  -1,2799, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:2764   175 LEU  HB2         3.50    (#   2764:20   Single Ambig)
 &rst
  ixpk= 2764, iat=  -1,2799, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=2802,2724,2725,2603,2604,
 &end
#
#  169 PHE  HD          116 ASP  HB2         6.00    (#   2765:20   Unique)
 &rst
  ixpk= 2765, iat=  -1,1871, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2693,2701,
 &end
#
#  169 PHE  HD          116 ASP  HB3         6.00    (#   2766:20   Unique)
 &rst
  ixpk= 2766, iat=  -1,1872, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2693,2701,
 &end
#
#    0 AMB  20-2:2767   116 ASP  HB2         4.50    (#   2767:20   Single Ambig)
 &rst
  ixpk= 2767, iat=  -1,1871, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2697,2695,2699,
 &end
#
#   95 GLU  HA           98 ARG  HD+         3.50    (#   2768:20   Unique)
 &rst
  ixpk= 2768, iat=1526,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1585,1586,
 &end
#
#   98 ARG  HE           98 ARG  HD+         4.50    (#   2770:20   Unique)
 &rst
  ixpk= 2770, iat=1588,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1585,1586,
 &end
#
#   98 ARG  HN            0 AMB  20-1:2771   6.00    (#   2771:20   Single Ambig)
 &rst
  ixpk= 2771, iat=1575,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr2=1585,1586, 939, 940,
 &end
#
#   98 ARG  HE           98 ARG  HD-         4.50    (#   2772:20   Unique)
 &rst
  ixpk= 2772, iat=1588,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1585,1586,
 &end
#
#   98 ARG  HA           98 ARG  HD-         6.00    (#   2774:20   Unique)
 &rst
  ixpk= 2774, iat=1577,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1585,1586,
 &end
#
#   95 GLU  HA           98 ARG  HD-         3.50    (#   2775:20   Unique)
 &rst
  ixpk= 2775, iat=1526,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1585,1586,
 &end
#
#   98 ARG  HB+          98 ARG  HD-         3.50    (#   2776:20   Unique)
 &rst
  ixpk= 2776, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1579,1580,
 igr2=1585,1586,
 &end
#
#   98 ARG  HB+          98 ARG  HD+         4.50    (#   2777:20   Unique)
 &rst
  ixpk= 2777, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1579,1580,
 igr2=1585,1586,
 &end
#
#    0 AMB  20-2:2778    98 ARG  HD+         4.50    (#   2778:20   Single Ambig)
 &rst
  ixpk= 2778, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1636,1529,
 igr2=1585,1586,
 &end
#
#    0 AMB  20-2:2779    98 ARG  HD+         3.50    (#   2779:20   Single Ambig)
 &rst
  ixpk= 2779, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1579,1580,1582,1583,1582,1583,
 igr2=1585,1586,
 &end
#
#  101 LEU  MDX          98 ARG  HD+         3.50    (#   2780:20   Unique)
 &rst
  ixpk= 2780, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1638,1639,1640,1642,1643,1644,
 igr2=1585,1586,
 &end
#
#    0 AMB  20-2:2781    11 PHE  QB          3.50    (#   2781:20   Single Ambig)
 &rst
  ixpk= 2781, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 748, 749, 750,1847,1848,1849,
 igr2= 154, 155,
 &end
#
#  101 LEU  MDX          98 ARG  HD-         3.50    (#   2782:20   Unique)
 &rst
  ixpk= 2782, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1638,1639,1640,1642,1643,1644,
 igr2=1585,1586,
 &end
#
#    0 AMB  20-2:2784    98 ARG  HD-         3.50    (#   2784:20   Single Ambig)
 &rst
  ixpk= 2784, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1579,1580,1582,1583,1582,1583,
 igr2=1585,1586,
 &end
#
#   27 ILE  MG2          13 PHE  HB+         3.50    (#   2785:20   Unique)
 &rst
  ixpk= 2785, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 411, 412, 413,
 igr2= 193, 194,
 &end
#
#    0 AMB  20-2:2786     0 AMB  20-1:2786   2.70    (#   2786:20   Double Ambig)
 &rst
  ixpk= 2786, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.60, r4= 6.35,
 igr1=2724,2725,1240,1241,1077,1078,2771,2772, 774, 775,
      
 igr2=2733,2734, 877, 878,1086,1087,2774,2775,
 &end
#
#    0 AMB  20-2:2787     0 AMB  20-1:2787   2.70    (#   2787:20   Double Ambig)
 &rst
  ixpk= 2787, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.70, r4= 5.45,
 igr1= 869,1083,1084, 874, 875,1246,1247,
 igr2= 877, 878,1086,1087,
 &end
#
#    0 AMB  20-2:2788     0 AMB  20-1:2788   2.70    (#   2788:20   Double Ambig)
 &rst
  ixpk= 2788, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.92, r4= 8.67,
 igr1=2603,2604,2218,2219,1246,1247,2609,2610, 390, 391,
      2308,2309, 869,  54,  55,2501,2502,2030,2031, 874,
       875,2768,2769, 393, 394,2727,2728,2727,2728,
 igr2=2612,2613,2221,2222,1249,1250, 396, 397,2311,2312,
       877, 878,  57,  58,2504,2505,2033,2034,2774,2775,
      2733,2734,
 &end
#
#    0 AMB  20-2:2790     0 AMB  20-1:2790   3.50    (#   2790:20   Double Ambig)
 &rst
  ixpk= 2790, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 501, 502,1034,1035,
 igr2= 507, 508,1040,1041,
 &end
#
#    0 AMB  20-2:2791    36 LYS  HE+         3.50    (#   2791:20   Single Ambig)
 &rst
  ixpk= 2791, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1111,1112, 567, 568,
 igr2= 576, 577,
 &end
#
#    0 AMB  20-2:2792     0 AMB  20-1:2792   3.50    (#   2792:20   Double Ambig)
 &rst
  ixpk= 2792, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.54, r4= 8.29,
 igr1=2903,2904,2925,2926,1111,1112,1185,1186, 567, 568,
      
 igr2=2912,2913,2934,2935, 576, 577,1194,1195, 598, 599,
      
 &end
#
#    0 AMB  20-2:2794     0 AMB  20-1:2794   2.70    (#   2794:20   Double Ambig)
 &rst
  ixpk= 2794, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.91, r4= 7.66,
 igr1=  48,  49,  48,  49,2302,2303, 387, 388, 387, 388,
      1240,1241,2603,2604,2603,2604,2218,2219,2212,2213,
      
 igr2=  57,  58,2311,2312, 396, 397,1249,1250,2612,2613,
      2221,2222, 877, 878,
 &end
#
#    0 AMB  20-2:2795     0 AMB  20-1:2795   3.50    (#   2795:20   Double Ambig)
 &rst
  ixpk= 2795, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.80, r4= 7.55,
 igr1= 411, 412, 413,2751,2752,2753,2755,2756,2757,
 igr2= 193, 194, 193, 194, 396, 397,
 &end
#
#    0 AMB  20-2:2796     0 AMB  20-1:2796   3.50    (#   2796:20   Double Ambig)
 &rst
  ixpk= 2796, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 871, 872,1080,1081,1806,1807,
 igr2= 877, 878,1086,1087,2120,
 &end
#
#    0 AMB  20-2:2797    67 LYS  QE          3.50    (#   2797:20   Single Ambig)
 &rst
  ixpk= 2797, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1080,1081,1017,1018,1019,
 igr2=1086,1087,
 &end
#
#    0 AMB  20-2:2798   171 LYS  QE          4.50    (#   2798:20   Single Ambig)
 &rst
  ixpk= 2798, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2724,2725,2709,2710,
 igr2=2733,2734,
 &end
#
#    0 AMB  20-2:2800     0 AMB  20-1:2800   3.50    (#   2800:20   Double Ambig)
 &rst
  ixpk= 2800, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.85, r4= 7.60,
 igr1=2709,2710, 338, 339,2852,2853, 409,
 igr2= 396, 397,2612,2613, 193, 194, 193, 194,
 &end
#
#    0 AMB  20-2:2801     0 AMB  20-1:2801   3.50    (#   2801:20   Double Ambig)
 &rst
  ixpk= 2801, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1838, 338, 339, 335, 336,
 igr2= 193, 194, 193, 194, 396, 397,
 &end
#
#    0 AMB  20-2:2802     0 AMB  20-1:2802   3.50    (#   2802:20   Double Ambig)
 &rst
  ixpk= 2802, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.47, r4= 7.22,
 igr1= 573, 574,2931,2932, 501, 502, 570, 571, 504, 505,
      
 igr2= 576, 577,2934,2935,
 &end
#
#    0 AMB  20-2:2803     0 AMB  20-1:2803   3.50    (#   2803:20   Double Ambig)
 &rst
  ixpk= 2803, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.22, r4= 8.97,
 igr1= 390, 391,2027,2028,2606,2607,2215,2216,2305,2306,
      1243,1244,
 igr2= 396, 397,2033,2034,2612,2613,2221,2222,2311,2312,
      1249,1250, 877, 878,
 &end
#
#    0 AMB  20-2:2804     0 AMB  20-1:2804   3.50    (#   2804:20   Double Ambig)
 &rst
  ixpk= 2804, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1= 871, 872,2677,2678,2679,
 igr2= 877, 878,2221,2222,
 &end
#
#   65 LYS  HG-          65 LYS  HE+         3.50    (#   2806:20   Unique)
 &rst
  ixpk= 2806, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1034,1035,
 igr2=1040,1041,
 &end
#
#   65 LYS  HG-          65 LYS  HE-         4.50    (#   2807:20   Unique)
 &rst
  ixpk= 2807, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1034,1035,
 igr2=1040,1041,
 &end
#
#    0 AMB  20-2:2808     0 AMB  20-1:2808   3.50    (#   2808:20   Double Ambig)
 &rst
  ixpk= 2808, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1031,1032,1037,1038, 570, 571,
 igr2=1040,1041, 507, 508,
 &end
#
#    0 AMB  20-2:2810    32 LYS  QE          3.50    (#   2810:20   Single Ambig)
 &rst
  ixpk= 2810, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 498, 499, 504, 505, 570, 571, 501, 502,
 igr2= 507, 508,
 &end
#
#    0 AMB  20-2:2811     0 AMB  20-1:2811   3.50    (#   2811:20   Double Ambig)
 &rst
  ixpk= 2811, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 498, 499,2724,2725, 567, 568,
 igr2= 507, 508,2788,
 &end
#
#  101 LEU  MDX         101 LEU  HB3         3.50    (#   2812:20   Unique)
 &rst
  ixpk= 2812, iat=  -1,1634, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1638,1639,1640,1642,1643,1644,
 &end
#
#  101 LEU  HG          101 LEU  HB3         4.50    (#   2813:20   Unique)
 &rst
  ixpk= 2813, iat=1636,1634, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:2816     0 AMB  20-1:2816   3.50    (#   2816:20   Double Ambig)
 &rst
  ixpk= 2816, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2906,2907, 501, 502,1188,1189,
 igr2=2912,2913, 576, 577,1194,1195,
 &end
#
#  109 LYS  QD          109 LYS  QE          2.70    (#   2817:20   Unique)
 &rst
  ixpk= 2817, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=1749,1750,
 igr2=1752,1753,
 &end
#
#  109 LYS  HB3         109 LYS  QE          3.50    (#   2818:20   Unique)
 &rst
  ixpk= 2818, iat=1744,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1752,1753,
 &end
#
#  153 LYS  HG-         153 LYS  HE+         3.50    (#   2819:20   Preassigned)
 &rst
  ixpk= 2819, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2435,2436,
 igr2=2441,2442,
 &end
#
#  153 LYS  HG-         153 LYS  HE-         3.50    (#   2820:20   Unique)
 &rst
  ixpk= 2820, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2435,2436,
 igr2=2441,2442,
 &end
#
#    0 AMB  20-2:2821     0 AMB  20-1:2821   3.50    (#   2821:20   Double Ambig)
 &rst
  ixpk= 2821, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1152,1153,1154,1156,1157,1158,2751,2752,2753,2755,
      2756,2757,
 igr2= 983, 396, 397,
 &end
#
#    0 AMB  20-2:2822     0 AMB  20-1:2822   2.70    (#   2822:20   Double Ambig)
 &rst
  ixpk= 2822, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.15, r4= 6.90,
 igr1=2909,2910,1191,1192,2931,2932, 501, 502,2928,2929,
       570, 571, 504, 505,
 igr2=2912,2913,1194,1195,2934,2935, 576, 577, 576, 577,
      
 &end
#
#    0 AMB  20-2:2823     0 AMB  20-1:2823   3.50    (#   2823:20   Double Ambig)
 &rst
  ixpk= 2823, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.27, r4= 8.02,
 igr1=2903,2904,1185,1186,2928,2929, 570, 571,
 igr2=2912,2913,1194,1195,2934,2935, 576, 577, 576, 577,
      
 &end
#
#    0 AMB  20-2:2824    36 LYS  HE+         3.50    (#   2824:20   Single Ambig)
 &rst
  ixpk= 2824, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 573, 574, 570, 571, 504, 505,
 igr2= 576, 577,
 &end
#
#    0 AMB  20-2:2825     0 AMB  20-1:2825   3.50    (#   2825:20   Double Ambig)
 &rst
  ixpk= 2825, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 595, 596,2906,2907,1188,1189,
 igr2= 598, 599,2912,2913,1194,1195,
 &end
#
#    0 AMB  20-2:2826    65 LYS  HE-         3.50    (#   2826:20   Single Ambig)
 &rst
  ixpk= 2826, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1031,1032,1037,1038,
 igr2=1040,1041,
 &end
#
#  172 LEU  MDY         172 LEU  HB+         3.50    (#   2827:20   Unique)
 &rst
  ixpk= 2827, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2751,2752,2753,2755,2756,2757,
 igr2=2746,2747,
 &end
#
#    0 AMB  20-2:2828     0 AMB  20-1:2828   2.70    (#   2828:20   Double Ambig)
 &rst
  ixpk= 2828, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.52, r4= 5.27,
 igr1=1638,1639,1640,1642,1643,1644,1844,1845,1847,1848,
      1849,
 igr2=1633,1838,
 &end
#
#    0 AMB  20-2:2829   114 ILE  HB          2.70    (#   2829:20   Single Ambig)
 &rst
  ixpk= 2829, iat=  -1,1838, r1= 0.00, r2= 1.80, r3= 3.64, r4= 4.39,
 igr1= 411, 412, 413,2169,2170,2171,
 &end
#
#  101 LEU  HG          101 LEU  HB2         2.70    (#   2830:20   Unique)
 &rst
  ixpk= 2830, iat=1636,1633, r1= 0.00, r2= 1.80, r3= 2.70, r4= 3.45,  &end
#
#  172 LEU  MDX         172 LEU  HB+         2.70    (#   2831:20   Unique)
 &rst
  ixpk= 2831, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.09, r4= 4.84,
 igr1=2751,2752,2753,2755,2756,2757,
 igr2=2746,2747,
 &end
#
#    0 AMB  20-2:2832    73 LEU  HB2         3.50    (#   2832:20   Single Ambig)
 &rst
  ixpk= 2832, iat=  -1,1166, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1171,1172,1173,1175,1176,1177,1188,1189,
 &end
#
#    0 AMB  20-2:2833     0 AMB  20-1:2833   3.50    (#   2833:20   Double Ambig)
 &rst
  ixpk= 2833, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.60, r4= 8.35,
 igr1=2872,2873,2874,2876,2877,2878,2872,2873,2874,2876,
      2877,2878,2956,2957,2958,1171,1172,1173,1175,1176,
      1177,
 igr2=2867,2868,2867,2868,1167,
 &end
#
#    0 AMB  20-2:2834   179 LEU  HB-         3.50    (#   2834:20   Single Ambig)
 &rst
  ixpk= 2834, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2872,2873,2874,2876,2877,2878,2872,2873,2874,2876,
      2877,2878,2956,2957,2958,
 igr2=2867,2868,
 &end
#
#  172 LEU  MDY         172 LEU  HB-         3.50    (#   2835:20   Unique)
 &rst
  ixpk= 2835, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2751,2752,2753,2755,2756,2757,
 igr2=2746,2747,
 &end
#
#   57 GLU  HG+          73 LEU  HB3         6.00    (#   2837:20   Unique)
 &rst
  ixpk= 2837, iat=  -1,1167, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 907, 908,
 &end
#
#   72 LEU  MDX          72 LEU  HB2         3.50    (#   2840:20   Unique)
 &rst
  ixpk= 2840, iat=  -1,1147, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:2841    72 LEU  HB2         3.50    (#   2841:20   Single Ambig)
 &rst
  ixpk= 2841, iat=  -1,1147, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1152,1153,1154,1156,1157,1158,1171,1172,1173,1175,
      1176,1177,
 &end
#
#    0 AMB  20-2:2842    11 PHE  QB          3.50    (#   2842:20   Single Ambig)
 &rst
  ixpk= 2842, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.86, r4= 6.61,
 igr1= 479, 480, 124, 125, 126, 128, 129, 130, 140, 141,
       142,
 igr2= 154, 155,
 &end
#
#   31 MET  HG-          11 PHE  QB          3.50    (#   2843:20   Unique)
 &rst
  ixpk= 2843, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 482, 483,
 igr2= 154, 155,
 &end
#
#  172 LEU  HA          175 LEU  HB2         3.50    (#   2844:20   Unique)
 &rst
  ixpk= 2844, iat=2744,2799, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  172 LEU  HA          175 LEU  HB3         6.00    (#   2845:20   Unique)
 &rst
  ixpk= 2845, iat=2744,2800, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:2847     0 AMB  20-1:2847   3.50    (#   2847:20   Double Ambig)
 &rst
  ixpk= 2847, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 197, 205,1216,
 igr2= 193, 194, 193, 194, 877, 878,
 &end
#
#   13 PHE  HD            0 AMB  20-1:2848   3.50    (#   2848:20   Single Ambig)
 &rst
  ixpk= 2848, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 197, 205,
 igr2= 193, 194, 193, 194,
 &end
#
#    0 AMB  20-2:2849     0 AMB  20-1:2849   3.50    (#   2849:20   Double Ambig)
 &rst
  ixpk= 2849, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 197, 205, 331,2470,
 igr2= 193, 194, 396, 397,2504,2505,
 &end
#
#    0 AMB  20-2:2850     0 AMB  20-1:2850   3.50    (#   2850:20   Double Ambig)
 &rst
  ixpk= 2850, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 197, 205,1216,
 igr2= 193, 194,1249,1250, 877, 878,
 &end
#
#   11 PHE  HD           11 PHE  QB          3.50    (#   2851:20   Unique)
 &rst
  ixpk= 2851, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 158, 166,
 igr2= 154, 155,
 &end
#
#   71 ALA  HN           68 ASP  QB          3.50    (#   2852:20   Unique)
 &rst
  ixpk= 2852, iat=1133,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1099,1100,
 &end
#
#    0 AMB  20-2:2853     0 AMB  20-1:2853   3.50    (#   2853:20   Double Ambig)
 &rst
  ixpk= 2853, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1143, 494,1121, 528,1068, 455,
 igr2=1099,1100, 507, 508,
 &end
#
#    0 AMB  20-2:2854     0 AMB  20-1:2854   4.50    (#   2854:20   Double Ambig)
 &rst
  ixpk= 2854, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.14, r4= 7.89,
 igr1= 637, 770,1073, 864,
 igr2=1086,1087, 877, 878,
 &end
#
#   11 PHE  HD           11 PHE  QB          3.50    (#   2855:20   Unique)
 &rst
  ixpk= 2855, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 158, 166,
 igr2= 154, 155,
 &end
#
#   47 ALA  HA           11 PHE  QB          3.50    (#   2856:20   Unique)
 &rst
  ixpk= 2856, iat= 746,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 154, 155,
 &end
#
#  123 GLY  HA-         124 ASN  HB+         6.00    (#   2857:20   Unique)
 &rst
  ixpk= 2857, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=1950,1951,
 igr2=1959,1960,
 &end
#
#   72 LEU  MDY          62 ASP  HB2         3.50    (#   2858:20   Unique)
 &rst
  ixpk= 2858, iat=  -1, 982, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:2859    62 ASP  HB2         6.00    (#   2859:20   Single Ambig)
 &rst
  ixpk= 2859, iat=  -1, 982, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1031,1032,1150,
 &end
#
#    0 AMB  20-2:2860    62 ASP  HB2         4.50    (#   2860:20   Single Ambig)
 &rst
  ixpk= 2860, iat=  -1, 982, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 917, 937,
 &end
#
#   59 ASP  HN           62 ASP  HB2         4.50    (#   2861:20   Unique)
 &rst
  ixpk= 2861, iat= 935, 982, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   58 PHE  HB-          62 ASP  HB2         3.50    (#   2862:20   Unique)
 &rst
  ixpk= 2862, iat=  -1, 982, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 919, 920,
 &end
#
#  138 ILE  MG2         138 ILE  HB          3.50    (#   2863:20   Unique)
 &rst
  ixpk= 2863, iat=  -1,2186, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2188,2189,2190,
 &end
#
#   72 LEU  MDX          72 LEU  HB3         3.50    (#   2864:20   Unique)
 &rst
  ixpk= 2864, iat=  -1,1148, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:2865    72 LEU  HB3         3.50    (#   2865:20   Single Ambig)
 &rst
  ixpk= 2865, iat=  -1,1148, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1152,1153,1154,1156,1157,1158,1171,1172,1173,1175,
      1176,1177,
 &end
#
#   72 LEU  HG           72 LEU  HB2         3.50    (#   2867:20   Unique)
 &rst
  ixpk= 2867, iat=1150,1147, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2868   138 ILE  HB          3.50    (#   2868:20   Single Ambig)
 &rst
  ixpk= 2868, iat=  -1,2186, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2192,2193,2215,2216,
 &end
#
#    0 AMB  20-2:2869   172 LEU  HB-         4.50    (#   2869:20   Single Ambig)
 &rst
  ixpk= 2869, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 447, 448, 447, 448,
 igr2=2746,2747,
 &end
#
#   29 ASP  HB-         172 LEU  HB-         4.50    (#   2870:20   Unique)
 &rst
  ixpk= 2870, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 447, 448,
 igr2=2746,2747,
 &end
#
#   59 ASP  HN           62 ASP  HB3         3.50    (#   2871:20   Unique)
 &rst
  ixpk= 2871, iat= 935, 983, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  116 ASP  HA          138 ILE  HB          6.00    (#   2872:20   Unique)
 &rst
  ixpk= 2872, iat=1869,2186, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  138 ILE  MD1         138 ILE  HB          3.50    (#   2873:20   Unique)
 &rst
  ixpk= 2873, iat=  -1,2186, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2195,2196,2197,
 &end
#
#  138 ILE  HG1-        138 ILE  HB          3.50    (#   2874:20   Unique)
 &rst
  ixpk= 2874, iat=  -1,2186, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2192,2193,
 &end
#
#  151 LEU  MDX         151 LEU  HB2         3.50    (#   2875:20   Unique)
 &rst
  ixpk= 2875, iat=  -1,2396, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2401,2402,2403,2405,2406,2407,
 &end
#
#    0 AMB  20-2:2876   151 LEU  HB2         3.50    (#   2876:20   Single Ambig)
 &rst
  ixpk= 2876, iat=  -1,2396, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2589,2590,2591,2593,2594,2595,
 &end
#
#  151 LEU  HG          151 LEU  HB2         3.50    (#   2877:20   Unique)
 &rst
  ixpk= 2877, iat=2399,2396, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2878     0 AMB  20-1:2878   4.50    (#   2878:20   Double Ambig)
 &rst
  ixpk= 2878, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2143,2144,2145,1230,1231,1232,
 igr2=2397,1167,
 &end
#
#    0 AMB  20-2:2879     0 AMB  20-1:2879   3.50    (#   2879:20   Double Ambig)
 &rst
  ixpk= 2879, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2401,2402,2403,2405,2406,2407,1171,1172,1173,1175,
      1176,1177,2150,2151,2152,
 igr2=2397,1167,
 &end
#
#    0 AMB  20-2:2880     0 AMB  20-1:2880   3.50    (#   2880:20   Double Ambig)
 &rst
  ixpk= 2880, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2401,2402,2403,2405,2406,2407, 433, 434, 435, 437,
       438, 439,
 igr2=2397,1167,
 &end
#
#  172 LEU  HG          172 LEU  HB+         2.70    (#   2881:20   Unique)
 &rst
  ixpk= 2881, iat=2749,  -1, r1= 0.00, r2= 1.80, r3= 3.03, r4= 3.78,
 igr2=2746,2747,
 &end
#
#   28 LEU  MDY          28 LEU  HB+         3.50    (#   2882:20   Unique)
 &rst
  ixpk= 2882, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 433, 434, 435, 437, 438, 439,
 igr2= 428, 429,
 &end
#
#   28 LEU  MDX          28 LEU  HB+         3.50    (#   2883:20   Unique)
 &rst
  ixpk= 2883, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 433, 434, 435, 437, 438, 439,
 igr2= 428, 429,
 &end
#
#   28 LEU  MDY          28 LEU  HB-         4.50    (#   2884:20   Unique)
 &rst
  ixpk= 2884, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 433, 434, 435, 437, 438, 439,
 igr2= 428, 429,
 &end
#
#   28 LEU  HG           28 LEU  HB-         3.50    (#   2885:20   Unique)
 &rst
  ixpk= 2885, iat= 431,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 428, 429,
 &end
#
#  135 ILE  HG1-        135 ILE  HB          3.50    (#   2888:20   Unique)
 &rst
  ixpk= 2888, iat=  -1,2141, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2147,2148,
 &end
#
#    0 AMB  20-2:2889     0 AMB  20-1:2889   3.50    (#   2889:20   Double Ambig)
 &rst
  ixpk= 2889, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 431,2143,2144,2145,
 igr2= 428, 429,2141,
 &end
#
#    0 AMB  20-2:2890    28 LEU  HB-         6.00    (#   2890:20   Single Ambig)
 &rst
  ixpk= 2890, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.49, r4= 9.24,
 igr1= 447, 448, 447, 448,
 igr2= 428, 429,
 &end
#
#    0 AMB  20-2:2891     0 AMB  20-1:2891   4.50    (#   2891:20   Double Ambig)
 &rst
  ixpk= 2891, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 447, 448, 447, 448,2567,2568,
 igr2= 428, 429,2141,
 &end
#
#   10 VAL  MG2         109 LYS  QE          6.00    (#   2893:20   Unique)
 &rst
  ixpk= 2893, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 144, 145, 146,
 igr2=1752,1753,
 &end
#
#   72 LEU  MDX          62 ASP  HB3         4.50    (#   2894:20   Unique)
 &rst
  ixpk= 2894, iat=  -1, 983, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:2895   140 LYS  QE          3.50    (#   2895:20   Single Ambig)
 &rst
  ixpk= 2895, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=2695,2699,2693,2701,2697,
 igr2=2221,2222,
 &end
#
#    0 AMB  20-2:2896     0 AMB  20-1:2896   3.50    (#   2896:20   Double Ambig)
 &rst
  ixpk= 2896, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2695,2699,2697,1405,
 igr2=2221,2222,2441,2442,
 &end
#
#    0 AMB  20-2:2897     0 AMB  20-1:2897   3.50    (#   2897:20   Double Ambig)
 &rst
  ixpk= 2897, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2124,2133, 646, 647,
 igr2=2120,1086,1087,
 &end
#
#    0 AMB  20-2:2898     0 AMB  20-1:2898   3.50    (#   2898:20   Double Ambig)
 &rst
  ixpk= 2898, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1216, 998,1007,
 igr2= 877, 878,1086,1087,
 &end
#
#  124 ASN  HD2-        124 ASN  HB-         3.50    (#   2899:20   Unique)
 &rst
  ixpk= 2899, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1964,1965,
 igr2=1959,1960,
 &end
#
#    0 AMB  20-2:2900     0 AMB  20-1:2900   3.50    (#   2900:20   Double Ambig)
 &rst
  ixpk= 2900, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=2826,1964,1965,2824,2828,
 igr2= 598, 599,1959,1960,
 &end
#
#    0 AMB  20-2:2901     0 AMB  20-1:2901   4.50    (#   2901:20   Double Ambig)
 &rst
  ixpk= 2901, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1=2460,2464,2462,2571,2579,
 igr2=2441,2442,2121,
 &end
#
#    0 AMB  20-2:2902     0 AMB  20-1:2902   4.50    (#   2902:20   Double Ambig)
 &rst
  ixpk= 2902, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1964,1965,1121,1458,1459,
 igr2=1959,1960, 576, 577,
 &end
#
#    0 AMB  20-2:2903     0 AMB  20-1:2903   3.50    (#   2903:20   Double Ambig)
 &rst
  ixpk= 2903, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1964,1965,1121,
 igr2=1959,1960, 576, 577,
 &end
#
#    0 AMB  20-2:2904     0 AMB  20-1:2904   4.50    (#   2904:20   Double Ambig)
 &rst
  ixpk= 2904, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 538, 539, 540, 144, 145, 146,
 igr2= 520, 521, 107,
 &end
#
#    0 AMB  20-2:2905     8 ASP  HB2         3.50    (#   2905:20   Single Ambig)
 &rst
  ixpk= 2905, iat=  -1, 107, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1719,1720,1721,1746,1747,
 &end
#
#   13 PHE  HA          114 ILE  HB          3.50    (#   2906:20   Unique)
 &rst
  ixpk= 2906, iat= 191,1838, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:2907     0 AMB  20-1:2907   4.50    (#   2907:20   Double Ambig)
 &rst
  ixpk= 2907, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 209,1648,
 igr2=1838,1633,
 &end
#
#   97 PHE  HB+         109 LYS  QE          3.50    (#   2908:20   Unique)
 &rst
  ixpk= 2908, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1559,1560,
 igr2=1752,1753,
 &end
#
#    0 AMB  20-2:2910     0 AMB  20-1:2910   3.50    (#   2910:20   Double Ambig)
 &rst
  ixpk= 2910, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 457,  89,
 igr2= 520, 521, 107,
 &end
#
#   30 PHE  QB          172 LEU  HB+         4.50    (#   2912:20   Unique)
 &rst
  ixpk= 2912, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 459, 460,
 igr2=2746,2747,
 &end
#
#   30 PHE  QB          172 LEU  HB-         4.50    (#   2913:20   Unique)
 &rst
  ixpk= 2913, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 459, 460,
 igr2=2746,2747,
 &end
#
#    0 AMB  20-2:2914     0 AMB  20-1:2914   4.50    (#   2914:20   Double Ambig)
 &rst
  ixpk= 2914, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 144, 145, 146,1545,1546,1547, 738, 739, 740,
 igr2= 108,1634,
 &end
#
#    0 AMB  20-2:2915     0 AMB  20-1:2915   2.70    (#   2915:20   Double Ambig)
 &rst
  ixpk= 2915, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.09, r4= 4.84,
 igr1=1752,1753, 507, 508,
 igr2= 107, 520, 521,
 &end
#
#    8 ASP  HB2         109 LYS  QE          2.70    (#   2916:20   Unique)
 &rst
  ixpk= 2916, iat= 107,  -1, r1= 0.00, r2= 1.80, r3= 3.03, r4= 3.78,
 igr2=1752,1753,
 &end
#
#    0 AMB  20-2:2918     0 AMB  20-1:2918   3.50    (#   2918:20   Double Ambig)
 &rst
  ixpk= 2918, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=1579,1580, 701, 702,1618,1619,1618,1619,
 igr2=1634, 108,
 &end
#
#  151 LEU  MDY         151 LEU  HB2         3.50    (#   2919:20   Unique)
 &rst
  ixpk= 2919, iat=  -1,2396, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2401,2402,2403,2405,2406,2407,
 &end
#
#  155 ALA  MB          162 PHE  HB+         3.50    (#   2921:20   Unique)
 &rst
  ixpk= 2921, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2474,2475,2476,
 igr2=2567,2568,
 &end
#
#    0 AMB  20-2:2923   162 PHE  HB+         4.50    (#   2923:20   Single Ambig)
 &rst
  ixpk= 2923, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2565,2493,
 igr2=2567,2568,
 &end
#
#  134 TYR  HA          162 PHE  HB+         4.50    (#   2924:20   Unique)
 &rst
  ixpk= 2924, iat=2118,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2567,2568,
 &end
#
#  162 PHE  HN          162 PHE  HB+         4.50    (#   2925:20   Unique)
 &rst
  ixpk= 2925, iat=2563,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2567,2568,
 &end
#
#    0 AMB  20-2:2926   162 PHE  HB+         4.50    (#   2926:20   Single Ambig)
 &rst
  ixpk= 2926, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2573,2577,2575,
 igr2=2567,2568,
 &end
#
#  162 PHE  HD          162 PHE  HB+         4.50    (#   2927:20   Unique)
 &rst
  ixpk= 2927, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2571,2579,
 igr2=2567,2568,
 &end
#
#   25 GLN  HA           28 LEU  HB+         3.50    (#   2928:20   Unique)
 &rst
  ixpk= 2928, iat= 368,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 428, 429,
 &end
#
#    0 AMB  20-2:2929     0 AMB  20-1:2929   4.50    (#   2929:20   Double Ambig)
 &rst
  ixpk= 2929, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1= 405, 383,2583,
 igr2= 428, 429,2141,
 &end
#
#  151 LEU  HA          154 PHE  HB-         3.50    (#   2931:20   Unique)
 &rst
  ixpk= 2931, iat=2394,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2454,2455,
 &end
#
#   25 GLN  HA           28 LEU  HB-         4.50    (#   2934:20   Unique)
 &rst
  ixpk= 2934, iat= 368,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 428, 429,
 &end
#
#  131 ILE  MD1         131 ILE  HB          3.50    (#   2935:20   Unique)
 &rst
  ixpk= 2935, iat=  -1,2058, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2067,2068,2069,
 &end
#
#  131 ILE  MG2         131 ILE  HB          3.50    (#   2936:20   Unique)
 &rst
  ixpk= 2936, iat=  -1,2058, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2060,2061,2062,
 &end
#
#  128 ALA  MB          131 ILE  HB          3.50    (#   2937:20   Unique)
 &rst
  ixpk= 2937, iat=  -1,2058, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2014,2015,2016,
 &end
#
#    0 AMB  20-2:2938     0 AMB  20-1:2938   3.50    (#   2938:20   Double Ambig)
 &rst
  ixpk= 2938, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.41, r4= 9.16,
 igr1=2147,2148,2027,2028,2064,2065, 390, 391,2474,2475,
      2476,2647, 498, 499, 504, 505,
 igr2=2454,2455,2046,2047, 447, 448,2663,2664,2663,2664,
      1125,1126,
 &end
#
#    0 AMB  20-2:2939     0 AMB  20-1:2939   3.50    (#   2939:20   Double Ambig)
 &rst
  ixpk= 2939, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1=2027,2028, 338, 339,2064,2065, 390, 391,
 igr2=2046,2047, 323, 324,
 &end
#
#   28 LEU  MDX          28 LEU  HB-         3.50    (#   2940:20   Unique)
 &rst
  ixpk= 2940, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 433, 434, 435, 437, 438, 439,
 igr2= 428, 429,
 &end
#
#   72 LEU  MDY          58 PHE  HB+         3.50    (#   2944:20   Unique)
 &rst
  ixpk= 2944, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1152,1153,1154,1156,1157,1158,
 igr2= 919, 920,
 &end
#
#   72 LEU  MDY          58 PHE  HB-         4.50    (#   2945:20   Unique)
 &rst
  ixpk= 2945, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1152,1153,1154,1156,1157,1158,
 igr2= 919, 920,
 &end
#
#   62 ASP  HB3          58 PHE  HB+         3.50    (#   2946:20   Unique)
 &rst
  ixpk= 2946, iat= 983,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 919, 920,
 &end
#
#    0 AMB  20-2:2947     0 AMB  20-1:2947   3.50    (#   2947:20   Double Ambig)
 &rst
  ixpk= 2947, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2147,2148,2677,2678,2679,
 igr2=2454,2455,2663,2664,2663,2664,
 &end
#
#    0 AMB  20-2:2948     0 AMB  20-1:2948   3.50    (#   2948:20   Double Ambig)
 &rst
  ixpk= 2948, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1137,1138,1139,1746,1747, 431,
 igr2=1125,1126,2046,2047, 447, 448, 447, 448,
 &end
#
#    0 AMB  20-2:2950     0 AMB  20-1:2950   3.50    (#   2950:20   Double Ambig)
 &rst
  ixpk= 2950, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.49, r4= 8.24,
 igr1=1669,1670, 387, 388, 387, 388,1111,1112, 428, 429,
       498, 499,
 igr2=1707,1708, 447, 448, 447, 448,1125,1126,
 &end
#
#  131 ILE  MD1         130 ASP  HB-         4.50    (#   2951:20   Unique)
 &rst
  ixpk= 2951, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2067,2068,2069,
 igr2=2046,2047,
 &end
#
#    0 AMB  20-2:2952     0 AMB  20-1:2952   4.50    (#   2952:20   Double Ambig)
 &rst
  ixpk= 2952, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1137,1138,1139,1746,1747,
 igr2=1125,1126,2046,2047,
 &end
#
#   62 ASP  HB3          58 PHE  HB-         3.50    (#   2953:20   Unique)
 &rst
  ixpk= 2953, iat= 983,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 919, 920,
 &end
#
#   89 ILE  MD1         154 PHE  HB-         4.50    (#   2954:20   Unique)
 &rst
  ixpk= 2954, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1443,1444,1445,
 igr2=2454,2455,
 &end
#
#    0 AMB  20-2:2955     0 AMB  20-1:2955   3.50    (#   2955:20   Double Ambig)
 &rst
  ixpk= 2955, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1443,1444,1445, 335, 336,2195,2196,2197,
 igr2=2454,2455,2690,
 &end
#
#    0 AMB  20-2:2956     0 AMB  20-1:2956   3.50    (#   2956:20   Double Ambig)
 &rst
  ixpk= 2956, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.32, r4= 8.07,
 igr1=2751,2752,2753,2755,2756,2757,1828,1829,1830, 616,
       617, 618, 620, 621, 622, 616, 617, 618, 620, 621,
       622,
 igr2=2690,2454,2455, 680,
 &end
#
#    0 AMB  20-2:2957     0 AMB  20-1:2957   3.50    (#   2957:20   Double Ambig)
 &rst
  ixpk= 2957, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.60, r4= 7.35,
 igr1=2150,2151,2152,1982,1983,1984, 418, 419, 420,2401,
      2402,2403,2405,2406,2407,
 igr2=2454,2455,2690,
 &end
#
#    0 AMB  20-2:2958     0 AMB  20-1:2958   3.50    (#   2958:20   Double Ambig)
 &rst
  ixpk= 2958, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1828,1829,1830,2649,2650,2651,2653,2654,2655,2627,
      2628,2629,
 igr2=2454,2455,2663,2664,
 &end
#
#    0 AMB  20-2:2959     0 AMB  20-1:2959   3.50    (#   2959:20   Double Ambig)
 &rst
  ixpk= 2959, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2004,2005,2006,2746,2747,
 igr2=1992,1993, 447, 448, 447, 448,
 &end
#
#   80 LEU  HG           80 LEU  QB          3.50    (#   2960:20   Unique)
 &rst
  ixpk= 2960, iat=1301,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1298,1299,
 &end
#
#   80 LEU  MDX          80 LEU  QB          3.50    (#   2961:20   Unique)
 &rst
  ixpk= 2961, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1303,1304,1305,1307,1308,1309,
 igr2=1298,1299,
 &end
#
#   80 LEU  MDY          80 LEU  QB          3.50    (#   2962:20   Unique)
 &rst
  ixpk= 2962, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1303,1304,1305,1307,1308,1309,
 igr2=1298,1299,
 &end
#
#    0 AMB  20-2:2963     0 AMB  20-1:2963   3.50    (#   2963:20   Double Ambig)
 &rst
  ixpk= 2963, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.80, r4= 7.55,
 igr1=1341,1342,1343,1345,1346,1347,1786,1787,1788,1790,
      1791,1792,1786,1787,1788,1790,1791,1792,
 igr2=1336,1337,2058,
 &end
#
#    0 AMB  20-2:2964     0 AMB  20-1:2964   3.50    (#   2964:20   Double Ambig)
 &rst
  ixpk= 2964, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=1341,1342,1343,1345,1346,1347,2064,2065,1786,1787,
      1788,1790,1791,1792,1786,1787,1788,1790,1791,1792,
      
 igr2=1336,1337,2058,
 &end
#
#    0 AMB  20-2:2965     0 AMB  20-1:2965   3.50    (#   2965:20   Double Ambig)
 &rst
  ixpk= 2965, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2169,2170,2171,1821,1822,1823,2804,2805,2806,2808,
      2809,2810,
 igr2=2160,1819,
 &end
#
#  136 ILE  MG2         136 ILE  HB          3.50    (#   2966:20   Unique)
 &rst
  ixpk= 2966, iat=  -1,2160, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2162,2163,2164,
 &end
#
#    0 AMB  20-2:2967     0 AMB  20-1:2967   6.00    (#   2967:20   Double Ambig)
 &rst
  ixpk= 2967, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.19, r4=10.94,
 igr1=2195,2196,2197,1443,1444,1445, 179, 180, 181, 183,
       184, 185,
 igr2=2160,1819,
 &end
#
#    0 AMB  20-2:2968   136 ILE  HB          3.50    (#   2968:20   Single Ambig)
 &rst
  ixpk= 2968, iat=  -1,2160, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1840,1841,1842,1844,1845,
 &end
#
#    0 AMB  20-2:2969     0 AMB  20-1:2969   3.50    (#   2969:20   Double Ambig)
 &rst
  ixpk= 2969, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.43, r4= 6.18,
 igr1=2150,2151,2152,2166,2167,1825,1826,
 igr2=1819,2160,
 &end
#
#    0 AMB  20-2:2970     0 AMB  20-1:2970   3.50    (#   2970:20   Double Ambig)
 &rst
  ixpk= 2970, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1828,1829,1830,2751,2752,2753,2755,2756,2757,
 igr2=1819,2160,
 &end
#
#    0 AMB  20-2:2971     0 AMB  20-1:2971   2.70    (#   2971:20   Double Ambig)
 &rst
  ixpk= 2971, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.82, r4= 4.57,
 igr1=2147,2148,2166,2167,
 igr2=1819,2160,
 &end
#
#    0 AMB  20-2:2972     0 AMB  20-1:2972   3.50    (#   2972:20   Double Ambig)
 &rst
  ixpk= 2972, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.86, r4= 6.61,
 igr1=1844,1845,1847,1848,1849,2143,2144,2145,1802,1803,
      1804,
 igr2=2160,1819,
 &end
#
#  165 ILE  MG2         142 PHE  HB3         3.50    (#   2973:20   Unique)
 &rst
  ixpk= 2973, iat=  -1,2252, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2627,2628,2629,
 &end
#
#  172 LEU  MDY          30 PHE  QB          4.50    (#   2974:20   Unique)
 &rst
  ixpk= 2974, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2751,2752,2753,2755,2756,2757,
 igr2= 459, 460,
 &end
#
#  172 LEU  MDX           0 AMB  20-1:2975   3.50    (#   2975:20   Single Ambig)
 &rst
  ixpk= 2975, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2751,2752,2753,2755,2756,2757,
 igr2= 459, 460,2689,
 &end
#
#  165 ILE  MG2         142 PHE  HB2         3.50    (#   2976:20   Unique)
 &rst
  ixpk= 2976, iat=  -1,2251, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2627,2628,2629,
 &end
#
#    0 AMB  20-2:2977     0 AMB  20-1:2977   4.50    (#   2977:20   Double Ambig)
 &rst
  ixpk= 2977, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.10, r4= 8.85,
 igr1=2634,2635,2636, 335, 336,1303,1304,1305,1307,1308,
      1309,1303,1304,1305,1307,1308,1309,
 igr2=2251, 350,
 &end
#
#    0 AMB  20-2:2978     0 AMB  20-1:2978   3.50    (#   2978:20   Double Ambig)
 &rst
  ixpk= 2978, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.20, r4= 7.95,
 igr1= 760, 761, 762, 764, 765, 766, 124, 125, 126, 128,
       129, 130, 616, 617, 618, 620, 621, 622,  91,
 igr2= 847, 848,1800, 681,
 &end
#
#    0 AMB  20-2:2979    24 PHE  HB2         3.50    (#   2979:20   Single Ambig)
 &rst
  ixpk= 2979, iat=  -1, 350, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 278, 279, 280, 282, 283, 284, 415, 416,
 &end
#
#    0 AMB  20-2:2980    90 ASN  QB          3.50    (#   2980:20   Single Ambig)
 &rst
  ixpk= 2980, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2004,2005,2006,1504,1505,1506,
 igr2=1453,1454,
 &end
#
#   48 VAL  MGY          54 TYR  HB-         3.50    (#   2981:20   Unique)
 &rst
  ixpk= 2981, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 760, 761, 762, 764, 765, 766,
 igr2= 847, 848,
 &end
#
#    0 AMB  20-2:2982   112 ILE  HB          3.50    (#   2982:20   Single Ambig)
 &rst
  ixpk= 2982, iat=  -1,1800, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1802,1803,1804,1847,1848,1849,1844,1845,
 &end
#
#   27 ILE  HA           30 PHE  QB          3.50    (#   2983:20   Unique)
 &rst
  ixpk= 2983, iat= 407,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 459, 460,
 &end
#
#    0 AMB  20-2:2984     0 AMB  20-1:2984   3.50    (#   2984:20   Double Ambig)
 &rst
  ixpk= 2984, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1836,2139,
 igr2=2160,1819,
 &end
#
#    0 AMB  20-2:2985   154 PHE  HB+         3.50    (#   2985:20   Single Ambig)
 &rst
  ixpk= 2985, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2458,2466,2105,
 igr2=2454,2455,
 &end
#
#  133 ARG  HE          154 PHE  HB-         4.50    (#   2986:20   Unique)
 &rst
  ixpk= 2986, iat=2105,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2454,2455,
 &end
#
#    9 LEU  MDY           0 AMB  20-1:2987   4.50    (#   2987:20   Single Ambig)
 &rst
  ixpk= 2987, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 124, 125, 126, 128, 129, 130,
 igr2=1800, 681,
 &end
#
#   72 LEU  MDX          63 TYR  HB-         4.50    (#   2988:20   Unique)
 &rst
  ixpk= 2988, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1152,1153,1154,1156,1157,1158,
 igr2= 994, 995,
 &end
#
#   72 LEU  MDX          63 TYR  HB+         6.00    (#   2989:20   Unique)
 &rst
  ixpk= 2989, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1=1152,1153,1154,1156,1157,1158,
 igr2= 994, 995,
 &end
#
#    0 AMB  20-2:2990   142 PHE  HB3         4.50    (#   2990:20   Single Ambig)
 &rst
  ixpk= 2990, iat=  -1,2252, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2203,2204,2300,
 &end
#
#   87 GLY  HA-          90 ASN  QB          3.50    (#   2991:20   Unique)
 &rst
  ixpk= 2991, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1415,1416,
 igr2=1453,1454,
 &end
#
#   17 MET  HA           80 LEU  QB          3.50    (#   2992:20   Unique)
 &rst
  ixpk= 2992, iat= 241,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1298,1299,
 &end
#
#   90 ASN  HN           90 ASN  QB          3.50    (#   2993:20   Unique)
 &rst
  ixpk= 2993, iat=1449,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1453,1454,
 &end
#
#   90 ASN  HD2-         90 ASN  QB          3.50    (#   2994:20   Unique)
 &rst
  ixpk= 2994, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1458,1459,
 igr2=1453,1454,
 &end
#
#   90 ASN  HD2+         90 ASN  QB          4.50    (#   2995:20   Unique)
 &rst
  ixpk= 2995, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1458,1459,
 igr2=1453,1454,
 &end
#
#   91 TYR  HN           90 ASN  QB          4.50    (#   2996:20   Unique)
 &rst
  ixpk= 2996, iat=1463,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1453,1454,
 &end
#
#   91 TYR  HN           90 ASN  QB          3.50    (#   2997:20   Unique)
 &rst
  ixpk= 2997, iat=1463,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1453,1454,
 &end
#
#   90 ASN  HN           90 ASN  QB          3.50    (#   2998:20   Unique)
 &rst
  ixpk= 2998, iat=1449,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1453,1454,
 &end
#
#   90 ASN  HD2+         90 ASN  QB          4.50    (#   2999:20   Unique)
 &rst
  ixpk= 2999, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1458,1459,
 igr2=1453,1454,
 &end
#
#   90 ASN  HD2-         90 ASN  QB          3.50    (#   3000:20   Unique)
 &rst
  ixpk= 3000, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1458,1459,
 igr2=1453,1454,
 &end
#
#  142 PHE  HD          142 PHE  HB3         4.50    (#   3002:20   Unique)
 &rst
  ixpk= 3002, iat=  -1,2252, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2255,2263,
 &end
#
#  142 PHE  HD          142 PHE  HB3         4.50    (#   3003:20   Unique)
 &rst
  ixpk= 3003, iat=  -1,2252, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2255,2263,
 &end
#
#    0 AMB  20-2:3005     0 AMB  20-1:3005   4.50    (#   3005:20   Double Ambig)
 &rst
  ixpk= 3005, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1= 465, 469,2695,2699, 467,2697,2671,
 igr2= 459, 460,2689,
 &end
#
#    0 AMB  20-2:3006     0 AMB  20-1:3006   3.50    (#   3006:20   Double Ambig)
 &rst
  ixpk= 3006, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 463, 471,2693,2701,
 igr2= 459, 460,2689,
 &end
#
#    0 AMB  20-2:3007    24 PHE  HB3         4.50    (#   3007:20   Single Ambig)
 &rst
  ixpk= 3007, iat=  -1, 351, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 354, 362, 378, 379,
 &end
#
#    0 AMB  20-2:3008     0 AMB  20-1:3008   4.50    (#   3008:20   Double Ambig)
 &rst
  ixpk= 3008, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 356, 360,2695,2699,2697, 358,
 igr2= 351,2690,
 &end
#
#    0 AMB  20-2:3009    24 PHE  HB2         3.50    (#   3009:20   Single Ambig)
 &rst
  ixpk= 3009, iat=  -1, 350, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 354, 362, 331,
 &end
#
#    0 AMB  20-2:3010     0 AMB  20-1:3010   3.50    (#   3010:20   Double Ambig)
 &rst
  ixpk= 3010, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1471,1480, 686, 691, 853, 858,
 igr2= 847, 848, 681,
 &end
#
#    0 AMB  20-2:3011    43 TYR  HB3         3.50    (#   3011:20   Single Ambig)
 &rst
  ixpk= 3011, iat=  -1, 681, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 726, 724, 728,
 &end
#
#    0 AMB  20-2:3012     0 AMB  20-1:3012   4.50    (#   3012:20   Double Ambig)
 &rst
  ixpk= 3012, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2257,2261, 356, 360, 358,2259,
 igr2=2251, 350,
 &end
#
#  142 PHE  HD          142 PHE  HB2         3.50    (#   3013:20   Unique)
 &rst
  ixpk= 3013, iat=  -1,2251, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2255,2263,
 &end
#
#  142 PHE  HD          142 PHE  HB2         3.50    (#   3014:20   Unique)
 &rst
  ixpk= 3014, iat=  -1,2251, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2255,2263,
 &end
#
#    0 AMB  20-2:3016     0 AMB  20-1:3016   3.50    (#   3016:20   Double Ambig)
 &rst
  ixpk= 3016, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.00, r4= 7.75,
 igr1= 955, 963,2822,2830,2894,2895, 465, 469,
 igr2= 951, 952, 951, 952,2818,2819,2966,2967,
 &end
#
#    0 AMB  20-2:3017     0 AMB  20-1:3017   3.50    (#   3017:20   Double Ambig)
 &rst
  ixpk= 3017, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.00, r4= 7.75,
 igr1= 955, 963,2822,2830,2970,2979,2894,2895,
 igr2= 951, 952, 951, 952,2818,2819,2966,2967,
 &end
#
#   40 ASN  HD2-         40 ASN  QB          3.50    (#   3018:20   Unique)
 &rst
  ixpk= 3018, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 646, 647,
 igr2= 641, 642,
 &end
#
#    0 AMB  20-2:3019     0 AMB  20-1:3019   3.50    (#   3019:20   Double Ambig)
 &rst
  ixpk= 3019, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2983,1655,
 igr2=2966,2967, 951, 952, 951, 952,
 &end
#
#    0 AMB  20-2:3020     0 AMB  20-1:3020   3.50    (#   3020:20   Double Ambig)
 &rst
  ixpk= 3020, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 463, 471,1401,1409, 465, 469,
 igr2=2818,2819,1397,
 &end
#
#    0 AMB  20-2:3021   176 PHE  HB+         3.50    (#   3021:20   Single Ambig)
 &rst
  ixpk= 3021, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2822,2830, 465, 469,
 igr2=2818,2819,
 &end
#
#   54 TYR  HD           54 TYR  HB-         3.50    (#   3022:20   Unique)
 &rst
  ixpk= 3022, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 851, 860,
 igr2= 847, 848,
 &end
#
#  165 ILE  MD1         142 PHE  HB3         4.50    (#   3023:20   Unique)
 &rst
  ixpk= 3023, iat=  -1,2252, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2634,2635,2636,
 &end
#
#    0 AMB  20-2:3024    24 PHE  HB2         4.50    (#   3024:20   Single Ambig)
 &rst
  ixpk= 3024, iat=  -1, 350, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 276, 292, 293,
 &end
#
#   63 TYR  HD           63 TYR  HB-         3.50    (#   3026:20   Unique)
 &rst
  ixpk= 3026, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 998,1007,
 igr2= 994, 995,
 &end
#
#    0 AMB  20-2:3027    63 TYR  HB+         4.50    (#   3027:20   Single Ambig)
 &rst
  ixpk= 3027, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 998,1007, 925, 929,
 igr2= 994, 995,
 &end
#
#    0 AMB  20-2:3028   169 PHE  HB2         4.50    (#   3028:20   Single Ambig)
 &rst
  ixpk= 3028, iat=  -1,2689, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2705,2685,
 &end
#
#    0 AMB  20-2:3029     0 AMB  20-1:3029   3.50    (#   3029:20   Double Ambig)
 &rst
  ixpk= 3029, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=2203,2204, 315, 223, 224,
 igr2=2251, 350,
 &end
#
#   21 PRO  HA           24 PHE  HB3         3.50    (#   3030:20   Unique)
 &rst
  ixpk= 3030, iat= 315, 351, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   11 PHE  HA          112 ILE  HB          3.50    (#   3031:20   Unique)
 &rst
  ixpk= 3031, iat= 152,1800, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:3032   186 ILE  HB          6.00    (#   3032:20   Single Ambig)
 &rst
  ixpk= 3032, iat=  -1,3003, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=3020,2923,
 &end
#
#  183 ILE  HA          186 ILE  HB          4.50    (#   3033:20   Unique)
 &rst
  ixpk= 3033, iat=2945,3003, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  184 TYR  HA          184 TYR  QB          3.50    (#   3034:20   Unique)
 &rst
  ixpk= 3034, iat=2964,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2966,2967,
 &end
#
#  180 GLN  HA          183 ILE  HB          4.50    (#   3035:20   Unique)
 &rst
  ixpk= 3035, iat=2884,2947, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:3036     0 AMB  20-1:3036   3.50    (#   3036:20   Double Ambig)
 &rst
  ixpk= 3036, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2901, 971, 972,2985, 994, 995,
 igr2=2966,2967, 951, 952, 951, 952,
 &end
#
#  186 ILE  HG1-        186 ILE  HB          3.50    (#   3037:20   Unique)
 &rst
  ixpk= 3037, iat=  -1,3003, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=3009,3010,
 &end
#
#  186 ILE  HG1+        186 ILE  HB          2.70    (#   3039:20   Unique)
 &rst
  ixpk= 3039, iat=  -1,3003, r1= 0.00, r2= 1.80, r3= 3.03, r4= 3.78,
 igr1=3009,3010,
 &end
#
#    0 AMB  20-2:3040   186 ILE  HB          2.70    (#   3040:20   Single Ambig)
 &rst
  ixpk= 3040, iat=  -1,3003, r1= 0.00, r2= 1.80, r3= 3.64, r4= 4.39,
 igr1=3005,3006,3007,3012,3013,3014,
 &end
#
#    0 AMB  20-2:3041     0 AMB  20-1:3041   2.70    (#   3041:20   Double Ambig)
 &rst
  ixpk= 3041, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.91, r4= 5.66,
 igr1= 760, 761, 762, 764, 765, 766,1982,1983,1984,1975,
      1976,1977,
 igr2= 847, 848,1973,
 &end
#
#    0 AMB  20-2:3042     0 AMB  20-1:3042   3.50    (#   3042:20   Double Ambig)
 &rst
  ixpk= 3042, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1424,1425,1426,1809,1810,1811,
 igr2= 847, 848,1800,
 &end
#
#    0 AMB  20-2:3043     0 AMB  20-1:3043   3.50    (#   3043:20   Double Ambig)
 &rst
  ixpk= 3043, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1806,1807, 120,
 igr2=1800, 681,
 &end
#
#    0 AMB  20-2:3046     0 AMB  20-1:3046   3.50    (#   3046:20   Double Ambig)
 &rst
  ixpk= 3046, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1436,1437,1438, 124, 125, 126, 128, 129, 130,
 igr2=1973,1800,
 &end
#
#    0 AMB  20-2:3047     0 AMB  20-1:3047   3.50    (#   3047:20   Double Ambig)
 &rst
  ixpk= 3047, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1806,1807,2014,2015,2016,
 igr2=1800,1973,
 &end
#
#    0 AMB  20-2:3048   184 TYR  QB          3.50    (#   3048:20   Single Ambig)
 &rst
  ixpk= 3048, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2989,2990,2991,2993,2994,2995,2989,2990,2991,2993,
      2994,2995,
 igr2=2966,2967,
 &end
#
#   89 ILE  MD1          89 ILE  HB          3.50    (#   3049:20   Unique)
 &rst
  ixpk= 3049, iat=  -1,1434, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1443,1444,1445,
 &end
#
#   89 ILE  MG2          89 ILE  HB          3.50    (#   3050:20   Unique)
 &rst
  ixpk= 3050, iat=  -1,1434, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1436,1437,1438,
 &end
#
#    0 AMB  20-2:3051    89 ILE  HB          3.50    (#   3051:20   Single Ambig)
 &rst
  ixpk= 3051, iat=  -1,1434, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1975,1976,1977,1786,1787,1788,1790,1791,1792,
 &end
#
#   55 LYS  HG-          55 LYS  HB3         3.50    (#   3052:20   Unique)
 &rst
  ixpk= 3052, iat=  -1, 869, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 871, 872,
 &end
#
#   55 LYS  HG-          55 LYS  HB2         3.50    (#   3053:20   Unique)
 &rst
  ixpk= 3053, iat=  -1, 868, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 871, 872,
 &end
#
#   55 LYS  HG+          55 LYS  HB2         3.50    (#   3054:20   Unique)
 &rst
  ixpk= 3054, iat=  -1, 868, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 871, 872,
 &end
#
#   55 LYS  HG+          55 LYS  HB3         3.50    (#   3055:20   Unique)
 &rst
  ixpk= 3055, iat=  -1, 869, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 871, 872,
 &end
#
#    0 AMB  20-2:3056    55 LYS  HB3         2.70    (#   3056:20   Single Ambig)
 &rst
  ixpk= 3056, iat=  -1, 869, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1288,1289,1290, 774, 775,
 &end
#
#    0 AMB  20-2:3057    55 LYS  HB2         3.50    (#   3057:20   Single Ambig)
 &rst
  ixpk= 3057, iat=  -1, 868, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1288,1289,1290, 774, 775,
 &end
#
#    0 AMB  20-2:3058   183 ILE  HB          3.50    (#   3058:20   Single Ambig)
 &rst
  ixpk= 3058, iat=  -1,2947, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2953,2954,2867,2868,2867,2868,2886,2887,
 &end
#
#  183 ILE  HG1-        183 ILE  HB          3.50    (#   3059:20   Unique)
 &rst
  ixpk= 3059, iat=  -1,2947, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2953,2954,
 &end
#
#  183 ILE  MG2         183 ILE  HB          2.70    (#   3060:20   Unique)
 &rst
  ixpk= 3060, iat=  -1,2947, r1= 0.00, r2= 1.80, r3= 3.24, r4= 3.99,
 igr1=2949,2950,2951,
 &end
#
#    0 AMB  20-2:3061   183 ILE  HB          3.50    (#   3061:20   Single Ambig)
 &rst
  ixpk= 3061, iat=  -1,2947, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2956,2957,2958, 616, 617, 618, 620, 621, 622, 616,
       617, 618, 620, 621, 622,
 &end
#
#  125 ILE  MG2          86 PHE  HB3         3.50    (#   3063:20   Unique)
 &rst
  ixpk= 3063, iat=  -1,1398, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1975,1976,1977,
 &end
#
#    0 AMB  20-2:3064    97 PHE  HB+         4.50    (#   3064:20   Single Ambig)
 &rst
  ixpk= 3064, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1749,1750,2067,2068,2069,
 igr2=1559,1560,
 &end
#
#    0 AMB  20-2:3065     0 AMB  20-1:3065   3.50    (#   3065:20   Double Ambig)
 &rst
  ixpk= 3065, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.60, r4= 7.35,
 igr1=1749,1750,2067,2068,2069,1424,1425,1426, 760, 761,
       762, 764, 765, 766,1528,
 igr2=1559,1560,1468,
 &end
#
#    0 AMB  20-2:3066     0 AMB  20-1:3066   3.50    (#   3066:20   Double Ambig)
 &rst
  ixpk= 3066, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=  48,  49,1890,
 igr2=  77,  78,1893,1894,
 &end
#
#    0 AMB  20-2:3067     0 AMB  20-1:3067   4.50    (#   3067:20   Double Ambig)
 &rst
  ixpk= 3067, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=  54,  55,2384,2385,2386,
 igr2=  77,  78,1893,1894,
 &end
#
#  107 ALA  MB            6 ASN  HB+         3.50    (#   3068:20   Unique)
 &rst
  ixpk= 3068, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1719,1720,1721,
 igr2=  77,  78,
 &end
#
#  107 ALA  MB            6 ASN  HB-         3.50    (#   3069:20   Unique)
 &rst
  ixpk= 3069, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1719,1720,1721,
 igr2=  77,  78,
 &end
#
#    7 VAL  MG2           6 ASN  HB-         4.50    (#   3070:20   Unique)
 &rst
  ixpk= 3070, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=  97,  98,  99,
 igr2=  77,  78,
 &end
#
#    4 LYS  QE            6 ASN  HB-         4.50    (#   3071:20   Unique)
 &rst
  ixpk= 3071, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=  57,  58,
 igr2=  77,  78,
 &end
#
#    0 AMB  20-2:3072     0 AMB  20-1:3072   2.70    (#   3072:20   Double Ambig)
 &rst
  ixpk= 3072, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.76, r4= 5.51,
 igr1=2079,2080,2081, 418, 419, 420,1771,1772,1773, 278,
       279, 280, 282, 283, 284,
 igr2=2077, 409,
 &end
#
#    0 AMB  20-2:3073     0 AMB  20-1:3073   3.50    (#   3073:20   Double Ambig)
 &rst
  ixpk= 3073, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1= 415, 416,2083,2084, 278, 279, 280, 282, 283, 284,
      
 igr2= 409,2077,
 &end
#
#  149 GLU  HA          149 GLU  HG-         3.50    (#   3074:20   Unique)
 &rst
  ixpk= 3074, iat=2365,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2370,2371,
 &end
#
#  107 ALA  HA            6 ASN  HB-         3.50    (#   3075:20   Unique)
 &rst
  ixpk= 3075, iat=1717,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  77,  78,
 &end
#
#  107 ALA  HA            6 ASN  HB+         3.50    (#   3076:20   Unique)
 &rst
  ixpk= 3076, iat=1717,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  77,  78,
 &end
#
#    0 AMB  20-2:3077   149 GLU  HG+         3.50    (#   3077:20   Single Ambig)
 &rst
  ixpk= 3077, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2305,2306,2305,2306,
 igr2=2370,2371,
 &end
#
#   23 GLU  HB-          23 GLU  HG+         3.50    (#   3078:20   Unique)
 &rst
  ixpk= 3078, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 335, 336,
 igr2= 338, 339,
 &end
#
#   23 GLU  HB-          23 GLU  HG-         4.50    (#   3079:20   Unique)
 &rst
  ixpk= 3079, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 335, 336,
 igr2= 338, 339,
 &end
#
#    0 AMB  20-2:3081    23 GLU  HG+         3.50    (#   3081:20   Single Ambig)
 &rst
  ixpk= 3081, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 333,2689,
 igr2= 338, 339,
 &end
#
#   24 PHE  HA           27 ILE  HB          3.50    (#   3082:20   Unique)
 &rst
  ixpk= 3082, iat= 348, 409, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:3083     0 AMB  20-1:3083   2.70    (#   3083:20   Double Ambig)
 &rst
  ixpk= 3083, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.81, r4= 5.56,
 igr1=1579,1580,1618,1619,1618,1619,2709,2710,
 igr2=1621,1622,2712,2713,
 &end
#
#    0 AMB  20-2:3084     0 AMB  20-1:3084   2.70    (#   3084:20   Double Ambig)
 &rst
  ixpk= 3084, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.59, r4= 5.34,
 igr1=2324,2325,2730,2731,2302,2303,
 igr2=2327,2328,2712,2713,
 &end
#
#    0 AMB  20-2:3085     0 AMB  20-1:3085   2.70    (#   3085:20   Double Ambig)
 &rst
  ixpk= 3085, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.99, r4= 5.74,
 igr1=2324,2325,1890,1693,1694,
 igr2=2327,2328,1893,1894,1606,1607,1606,1607,
 &end
#
#    0 AMB  20-2:3086     0 AMB  20-1:3086   2.70    (#   3086:20   Double Ambig)
 &rst
  ixpk= 3086, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.15, r4= 5.90,
 igr1=1603,1604,2709,2710,2350,2351,
 igr2=1606,1607,1606,1607,2712,2713,2353,2354,
 &end
#
#    0 AMB  20-2:3087     0 AMB  20-1:3087   3.50    (#   3087:20   Double Ambig)
 &rst
  ixpk= 3087, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1585,1586,2689,
 igr2=1621,1622,2712,2713,
 &end
#
#   26 LYS  QE          170 GLU  HG+         4.50    (#   3088:20   Unique)
 &rst
  ixpk= 3088, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 396, 397,
 igr2=2712,2713,
 &end
#
#    0 AMB  20-2:3089     0 AMB  20-1:3089   3.50    (#   3089:20   Double Ambig)
 &rst
  ixpk= 3089, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=2311,2312,2365, 396, 397,
 igr2=2370,2371,2712,2713,
 &end
#
#    0 AMB  20-2:3090     0 AMB  20-1:3090   3.50    (#   3090:20   Double Ambig)
 &rst
  ixpk= 3090, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 179, 180, 181, 183, 184, 185,2634,2635,2636,
 igr2= 758,2625,
 &end
#
#    0 AMB  20-2:3091     0 AMB  20-1:3091   2.70    (#   3091:20   Double Ambig)
 &rst
  ixpk= 3091, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.91, r4= 5.66,
 igr1= 760, 761, 762, 764, 765, 766,2627,2628,2629, 179,
       180, 181, 183, 184, 185,1549,1550,1551,
 igr2= 758,2625,
 &end
#
#    0 AMB  20-2:3092     0 AMB  20-1:3092   3.50    (#   3092:20   Double Ambig)
 &rst
  ixpk= 3092, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2631,2632, 174,1494,1495,1496,
 igr2=2625, 758,
 &end
#
#   48 VAL  MGX          48 VAL  HB          3.50    (#   3093:20   Unique)
 &rst
  ixpk= 3093, iat=  -1, 758, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 760, 761, 762, 764, 765, 766,
 &end
#
#   52 THR  HA           84 ASN  HB2         4.50    (#   3094:20   Unique)
 &rst
  ixpk= 3094, iat= 820,1369, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:3095    84 ASN  HB3         4.50    (#   3095:20   Single Ambig)
 &rst
  ixpk= 3095, iat=  -1,1370, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 820,1353,
 &end
#
#    0 AMB  20-2:3096   183 ILE  HB          3.50    (#   3096:20   Single Ambig)
 &rst
  ixpk= 3096, iat=  -1,2947, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2943,2962,
 &end
#
#   86 PHE  HE           86 PHE  HB3         6.00    (#   3097:20   Unique)
 &rst
  ixpk= 3097, iat=  -1,1398, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1403,1407,
 &end
#
#   86 PHE  HD           86 PHE  HB3         3.50    (#   3098:20   Unique)
 &rst
  ixpk= 3098, iat=  -1,1398, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1401,1409,
 &end
#
#    6 ASN  HD2+          6 ASN  HB+         3.50    (#   3099:20   Unique)
 &rst
  ixpk= 3099, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=  82,  83,
 igr2=  77,  78,
 &end
#
#    0 AMB  20-2:3100     0 AMB  20-1:3100   4.50    (#   3100:20   Double Ambig)
 &rst
  ixpk= 3100, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=  66,1901,  44,
 igr2=  77,  78,1893,1894,
 &end
#
#    0 AMB  20-2:3101     0 AMB  20-1:3101   4.50    (#   3101:20   Double Ambig)
 &rst
  ixpk= 3101, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=  66,1901,  44,
 igr2=  77,  78,1893,1894,
 &end
#
#    6 ASN  HD2+          6 ASN  HB-         3.50    (#   3102:20   Unique)
 &rst
  ixpk= 3102, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=  82,  83,
 igr2=  77,  78,
 &end
#
#    0 AMB  20-2:3103     0 AMB  20-1:3103   3.50    (#   3103:20   Double Ambig)
 &rst
  ixpk= 3103, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=  82,  83, 709, 710, 851, 860,
 igr2=  77,  78,1467,
 &end
#
#    0 AMB  20-2:3104     6 ASN  HB-         3.50    (#   3104:20   Single Ambig)
 &rst
  ixpk= 3104, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=  82,  83, 709, 710,
 igr2=  77,  78,
 &end
#
#  111 LEU  HN          132 ILE  HB          4.50    (#   3105:20   Unique)
 &rst
  ixpk= 3105, iat=1777,2077, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  110 VAL  HA          132 ILE  HB          3.50    (#   3106:20   Unique)
 &rst
  ixpk= 3106, iat=1763,2077, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   93 ALA  HA           97 PHE  HB+         4.50    (#   3107:20   Unique)
 &rst
  ixpk= 3107, iat=1502,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1559,1560,
 &end
#
#   93 ALA  HA           97 PHE  HB-         4.50    (#   3108:20   Unique)
 &rst
  ixpk= 3108, iat=1502,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1559,1560,
 &end
#
#   20 GLN  HN           23 GLU  HG-         6.00    (#   3109:20   Unique)
 &rst
  ixpk= 3109, iat= 288,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2= 338, 339,
 &end
#
#    0 AMB  20-2:3110     0 AMB  20-1:3110   3.50    (#   3110:20   Double Ambig)
 &rst
  ixpk= 3110, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2363,2962,
 igr2=2370,2371,2947,
 &end
#
#    0 AMB  20-2:3111     0 AMB  20-1:3111   4.50    (#   3111:20   Double Ambig)
 &rst
  ixpk= 3111, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2378,2346,2983,
 igr2=2370,2371,2947,
 &end
#
#    0 AMB  20-2:3112     0 AMB  20-1:3112   3.50    (#   3112:20   Double Ambig)
 &rst
  ixpk= 3112, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 331, 354, 362,
 igr2= 338, 339, 409,
 &end
#
#    0 AMB  20-2:3113   100 GLU  QG          4.50    (#   3113:20   Single Ambig)
 &rst
  ixpk= 3113, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1629,1588,
 igr2=1621,1622,
 &end
#
#  147 SER  HN          146 GLU  HG+         4.50    (#   3114:20   Unique)
 &rst
  ixpk= 3114, iat=2335,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2327,2328,
 &end
#
#  147 SER  HN          146 GLU  HG-         3.50    (#   3115:20   Unique)
 &rst
  ixpk= 3115, iat=2335,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2327,2328,
 &end
#
#   97 PHE  HZ           97 PHE  HB+         6.00    (#   3116:20   Unique)
 &rst
  ixpk= 3116, iat=1567,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1559,1560,
 &end
#
#   84 ASN  HD2-         84 ASN  HB3         3.50    (#   3118:20   Unique)
 &rst
  ixpk= 3118, iat=  -1,1370, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1374,1375,
 &end
#
#    0 AMB  20-2:3119    84 ASN  HB3         4.50    (#   3119:20   Single Ambig)
 &rst
  ixpk= 3119, iat=  -1,1370, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 795, 803, 853, 858,
 &end
#
#   84 ASN  HD2-         84 ASN  HB2         3.50    (#   3120:20   Unique)
 &rst
  ixpk= 3120, iat=  -1,1369, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1374,1375,
 &end
#
#   50 PHE  HD           84 ASN  HB2         6.00    (#   3121:20   Unique)
 &rst
  ixpk= 3121, iat=  -1,1369, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 795, 803,
 &end
#
#   84 ASN  HD2+         84 ASN  HB2         3.50    (#   3123:20   Unique)
 &rst
  ixpk= 3123, iat=  -1,1369, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1374,1375,
 &end
#
#   84 ASN  HD2+         84 ASN  HB3         3.50    (#   3124:20   Unique)
 &rst
  ixpk= 3124, iat=  -1,1370, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1374,1375,
 &end
#
#    0 AMB  20-2:3125    48 VAL  HB          4.50    (#   3125:20   Single Ambig)
 &rst
  ixpk= 3125, iat=  -1, 758, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 746, 789,
 &end
#
#   12 LEU  HA           48 VAL  HB          4.50    (#   3126:20   Unique)
 &rst
  ixpk= 3126, iat= 172, 758, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:3127     0 AMB  20-1:3127   4.50    (#   3127:20   Double Ambig)
 &rst
  ixpk= 3127, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2863,2284,
 igr2=2855,2856,2353,2354,2353,2354,
 &end
#
#  179 LEU  HN          178 GLU  HG-         4.50    (#   3128:20   Unique)
 &rst
  ixpk= 3128, iat=2863,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2855,2856,
 &end
#
#  175 LEU  MDY         178 GLU  HG-         3.50    (#   3129:20   Unique)
 &rst
  ixpk= 3129, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2804,2805,2806,2808,2809,2810,
 igr2=2855,2856,
 &end
#
#    0 AMB  20-2:3130     0 AMB  20-1:3130   3.50    (#   3130:20   Double Ambig)
 &rst
  ixpk= 3130, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.07, r4= 8.82,
 igr1=3005,3006,3007,2401,2402,2403,2405,2406,2407,2804,
      2805,2806,2808,2809,2810,
 igr2=3025,3026,3025,3026,2353,2354,2353,2354,2855,2856,
      
 &end
#
#    0 AMB  20-2:3131   178 GLU  HG-         4.50    (#   3131:20   Single Ambig)
 &rst
  ixpk= 3131, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2931,2932,2931,2932,2928,2929,2870,2606,2607,
 igr2=2855,2856,
 &end
#
#    0 AMB  20-2:3132     0 AMB  20-1:3132   4.50    (#   3132:20   Double Ambig)
 &rst
  ixpk= 3132, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.02, r4= 8.77,
 igr1=2928,2929,2606,2607,2903,2904,2305,2306,
 igr2=2855,2856,2353,2354,
 &end
#
#  164 LYS  QD          178 GLU  HG-         4.50    (#   3133:20   Unique)
 &rst
  ixpk= 3133, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2609,2610,
 igr2=2855,2856,
 &end
#
#  182 LYS  QE          178 GLU  HG-         4.50    (#   3134:20   Unique)
 &rst
  ixpk= 3134, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2934,2935,
 igr2=2855,2856,
 &end
#
#  164 LYS  QE          178 GLU  HG+         3.50    (#   3135:20   Unique)
 &rst
  ixpk= 3135, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2612,2613,
 igr2=2855,2856,
 &end
#
#  179 LEU  HA          178 GLU  HG-         4.50    (#   3136:20   Unique)
 &rst
  ixpk= 3136, iat=2865,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2855,2856,
 &end
#
#  175 LEU  HA          178 GLU  HG-         4.50    (#   3137:20   Unique)
 &rst
  ixpk= 3137, iat=2797,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2855,2856,
 &end
#
#  161 GLU  HB3         161 GLU  QG          2.70    (#   3138:20   Unique)
 &rst
  ixpk= 3138, iat=2553,  -1, r1= 0.00, r2= 1.80, r3= 3.03, r4= 3.78,
 igr2=2555,2556,
 &end
#
#  165 ILE  HG1+        165 ILE  HB          3.50    (#   3139:20   Unique)
 &rst
  ixpk= 3139, iat=  -1,2625, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2631,2632,
 &end
#
#  110 VAL  MG1         110 VAL  HB          3.50    (#   3140:20   Unique)
 &rst
  ixpk= 3140, iat=  -1,1765, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1767,1768,1769,
 &end
#
#    0 AMB  20-2:3141   110 VAL  HB          3.50    (#   3141:20   Single Ambig)
 &rst
  ixpk= 3141, iat=  -1,1765, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1771,1772,1773,1767,1768,1769,
 &end
#
#    7 VAL  MG1         110 VAL  HB          3.50    (#   3142:20   Unique)
 &rst
  ixpk= 3142, iat=  -1,1765, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=  93,  94,  95,
 &end
#
#    0 AMB  20-2:3143   110 VAL  HB          3.50    (#   3143:20   Single Ambig)
 &rst
  ixpk= 3143, iat=  -1,1765, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 124, 125, 126, 128, 129, 130,  91,2060,2061,2062,
      
 &end
#
#    0 AMB  20-2:3145   110 VAL  HB          3.50    (#   3145:20   Single Ambig)
 &rst
  ixpk= 3145, iat=  -1,1765, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 122,1806,1807,
 &end
#
#    9 LEU  HA          110 VAL  HB          3.50    (#   3146:20   Unique)
 &rst
  ixpk= 3146, iat= 117,1765, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:3147   110 VAL  HB          4.50    (#   3147:20   Single Ambig)
 &rst
  ixpk= 3147, iat=  -1,1765, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 134,1796,
 &end
#
#  161 GLU  HN          161 GLU  QG          3.50    (#   3148:20   Unique)
 &rst
  ixpk= 3148, iat=2548,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2555,2556,
 &end
#
#  161 GLU  HA          161 GLU  QG          3.50    (#   3149:20   Unique)
 &rst
  ixpk= 3149, iat=2550,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2555,2556,
 &end
#
#  160 SER  QB          161 GLU  QG          3.50    (#   3150:20   Unique)
 &rst
  ixpk= 3150, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2541,2542,
 igr2=2555,2556,
 &end
#
#    0 AMB  20-2:3151   161 GLU  QG          3.50    (#   3151:20   Single Ambig)
 &rst
  ixpk= 3151, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2514,2515,2514,2515,
 igr2=2555,2556,
 &end
#
#    0 AMB  20-2:3152   178 GLU  HG-         6.00    (#   3152:20   Single Ambig)
 &rst
  ixpk= 3152, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.19, r4=10.94,
 igr1=2872,2873,2874,2876,2877,2878,2872,2873,2874,2876,
      2877,2878,
 igr2=2855,2856,
 &end
#
#    0 AMB  20-2:3153     0 AMB  20-1:3153   4.50    (#   3153:20   Double Ambig)
 &rst
  ixpk= 3153, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.53, r4=10.28,
 igr1=2627,2628,2629,2872,2873,2874,2876,2877,2878,2872,
      2873,2874,2876,2877,2878,
 igr2=2353,2354,2353,2354,2855,2856,
 &end
#
#    0 AMB  20-2:3154    79 MET  HG+         3.50    (#   3154:20   Single Ambig)
 &rst
  ixpk= 3154, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1280,1279,1288,1289,1290,
 igr2=1282,1283,
 &end
#
#    0 AMB  20-2:3155    79 MET  HG-         3.50    (#   3155:20   Single Ambig)
 &rst
  ixpk= 3155, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1280,1279,1288,1289,1290,
 igr2=1282,1283,
 &end
#
#   95 GLU  HB2          95 GLU  QG          3.50    (#   3156:20   Unique)
 &rst
  ixpk= 3156, iat=1528,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1531,1532,
 &end
#
#   91 TYR  HB2          95 GLU  QG          4.50    (#   3157:20   Unique)
 &rst
  ixpk= 3157, iat=1467,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1531,1532,
 &end
#
#   94 THR  MG2          95 GLU  QG          4.50    (#   3158:20   Unique)
 &rst
  ixpk= 3158, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1516,1517,1518,
 igr2=1531,1532,
 &end
#
#   95 GLU  HB3          95 GLU  QG          3.50    (#   3159:20   Unique)
 &rst
  ixpk= 3159, iat=1529,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1531,1532,
 &end
#
#   91 TYR  HB3          95 GLU  QG          6.00    (#   3160:20   Unique)
 &rst
  ixpk= 3160, iat=1468,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1531,1532,
 &end
#
#    0 AMB  20-2:3161    95 GLU  QG          6.00    (#   3161:20   Single Ambig)
 &rst
  ixpk= 3161, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1585,1586,1486,
 igr2=1531,1532,
 &end
#
#   91 TYR  HA           95 GLU  QG          3.50    (#   3162:20   Unique)
 &rst
  ixpk= 3162, iat=1465,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1531,1532,
 &end
#
#   94 THR  HB           95 GLU  QG          4.50    (#   3163:20   Unique)
 &rst
  ixpk= 3163, iat=1514,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1531,1532,
 &end
#
#   94 THR  HN           95 GLU  QG          4.50    (#   3164:20   Unique)
 &rst
  ixpk= 3164, iat=1510,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1531,1532,
 &end
#
#    0 AMB  20-2:3165    95 GLU  QG          6.00    (#   3165:20   Single Ambig)
 &rst
  ixpk= 3165, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1463,1484,1500,
 igr2=1531,1532,
 &end
#
#    0 AMB  20-2:3166    95 GLU  QG          4.50    (#   3166:20   Single Ambig)
 &rst
  ixpk= 3166, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1539,1555,
 igr2=1531,1532,
 &end
#
#    0 AMB  20-2:3167    95 GLU  QG          4.50    (#   3167:20   Single Ambig)
 &rst
  ixpk= 3167, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1471,1480,1473,1478,
 igr2=1531,1532,
 &end
#
#   91 TYR  HD           95 GLU  QG          4.50    (#   3168:20   Unique)
 &rst
  ixpk= 3168, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1471,1480,
 igr2=1531,1532,
 &end
#
#   49 GLN  HE2-         79 MET  HG+         6.00    (#   3169:20   Unique)
 &rst
  ixpk= 3169, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1= 782, 783,
 igr2=1282,1283,
 &end
#
#    0 AMB  20-2:3170     0 AMB  20-1:3170   3.50    (#   3170:20   Double Ambig)
 &rst
  ixpk= 3170, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 300, 301,2279,2280,
 igr2= 295, 296,2274,2275,
 &end
#
#   86 PHE  HA           89 ILE  HB          4.50    (#   3171:20   Unique)
 &rst
  ixpk= 3171, iat=1395,1434, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  101 LEU  MDX         100 GLU  QG          4.50    (#   3174:20   Unique)
 &rst
  ixpk= 3174, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1638,1639,1640,1642,1643,1644,
 igr2=1621,1622,
 &end
#
#  101 LEU  MDY         100 GLU  QG          3.50    (#   3175:20   Unique)
 &rst
  ixpk= 3175, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1638,1639,1640,1642,1643,1644,
 igr2=1621,1622,
 &end
#
#    0 AMB  20-2:3176     0 AMB  20-1:3176   3.50    (#   3176:20   Double Ambig)
 &rst
  ixpk= 3176, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=1636, 393, 394,2727,2728,
 igr2=1621,1622,2712,2713,
 &end
#
#    0 AMB  20-2:3177     0 AMB  20-1:3177   3.50    (#   3177:20   Double Ambig)
 &rst
  ixpk= 3177, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=3005,3006,3007,2401,2402,2403,2405,2406,2407,2804,
      2805,2806,2808,2809,2810,
 igr2=3025,3026,2353,2354,2855,2856,
 &end
#
#    0 AMB  20-2:3178     0 AMB  20-1:3178   4.50    (#   3178:20   Double Ambig)
 &rst
  ixpk= 3178, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.53, r4=10.28,
 igr1=3005,3006,3007,2401,2402,2403,2405,2406,2407,2804,
      2805,2806,2808,2809,2810,
 igr2=3025,3026,2353,2354,2855,2856,
 &end
#
#    0 AMB  20-2:3179     0 AMB  20-1:3179   4.50    (#   3179:20   Double Ambig)
 &rst
  ixpk= 3179, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1=2631,2632,1659,1660,1661,
 igr2=2353,2354,1606,1607,1606,1607,
 &end
#
#    0 AMB  20-2:3180     0 AMB  20-1:3180   3.50    (#   3180:20   Double Ambig)
 &rst
  ixpk= 3180, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.85, r4= 7.60,
 igr1=1690,1691,1690,1691,  68,  69,2300,
 igr2=1606,1607,1606,1607,3025,3026,2353,2354,
 &end
#
#    0 AMB  20-2:3181     0 AMB  20-1:3181   3.50    (#   3181:20   Double Ambig)
 &rst
  ixpk= 3181, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2964,2675,1667,
 igr2=3025,3026,2712,2713,1606,1607,1606,1607,
 &end
#
#    0 AMB  20-2:3182     0 AMB  20-1:3182   4.50    (#   3182:20   Double Ambig)
 &rst
  ixpk= 3182, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2964,1667,
 igr2=3025,3026,1606,1607,
 &end
#
#    0 AMB  20-2:3183     0 AMB  20-1:3183   4.50    (#   3183:20   Double Ambig)
 &rst
  ixpk= 3183, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2601, 136,
 igr2=2625, 758,
 &end
#
#  103 ALA  MB           97 PHE  HB+         4.50    (#   3184:20   Unique)
 &rst
  ixpk= 3184, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1659,1660,1661,
 igr2=1559,1560,
 &end
#
#   95 GLU  HB2          95 GLU  QG          3.50    (#   3186:20   Unique)
 &rst
  ixpk= 3186, iat=1528,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1531,1532,
 &end
#
#   10 VAL  MG2          10 VAL  HB          3.50    (#   3187:20   Unique)
 &rst
  ixpk= 3187, iat=  -1, 138, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 144, 145, 146,
 &end
#
#    0 AMB  20-2:3188    10 VAL  HB          3.50    (#   3188:20   Single Ambig)
 &rst
  ixpk= 3188, iat=  -1, 138, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 140, 141, 142, 124, 125, 126, 128, 129, 130,
 &end
#
#   92 VAL  MG1          10 VAL  HB          3.50    (#   3189:20   Unique)
 &rst
  ixpk= 3189, iat=  -1, 138, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1490,1491,1492,
 &end
#
#    0 AMB  20-2:3190    10 VAL  HB          3.50    (#   3190:20   Single Ambig)
 &rst
  ixpk= 3190, iat=  -1, 138, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,
 &end
#
#  158 PRO  HB2         161 GLU  QG          3.50    (#   3191:20   Unique)
 &rst
  ixpk= 3191, iat=2520,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2555,2556,
 &end
#
#   35 MET  HG+          35 MET  HB3         3.50    (#   3192:20   Unique)
 &rst
  ixpk= 3192, iat=  -1, 549, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 551, 552,
 &end
#
#   35 MET  HG-          35 MET  HB3         3.50    (#   3193:20   Unique)
 &rst
  ixpk= 3193, iat=  -1, 549, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 551, 552,
 &end
#
#   76 VAL  MG2          57 GLU  HG+         4.50    (#   3202:20   Unique)
 &rst
  ixpk= 3202, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1230,1231,1232,
 igr2= 907, 908,
 &end
#
#   23 GLU  HB-          20 GLN  HG+         6.00    (#   3203:20   Unique)
 &rst
  ixpk= 3203, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1= 335, 336,
 igr2= 295, 296,
 &end
#
#   20 GLN  QB           20 GLN  HG+         3.50    (#   3204:20   Unique)
 &rst
  ixpk= 3204, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 292, 293,
 igr2= 295, 296,
 &end
#
#    0 AMB  20-2:3205    20 GLN  HG+         3.50    (#   3205:20   Single Ambig)
 &rst
  ixpk= 3205, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 338, 339, 335, 336,
 igr2= 295, 296,
 &end
#
#    0 AMB  20-2:3206    20 GLN  HG+         4.50    (#   3206:20   Single Ambig)
 &rst
  ixpk= 3206, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 306, 307, 306, 307,
 igr2= 295, 296,
 &end
#
#   20 GLN  HA           20 GLN  HG+         3.50    (#   3207:20   Unique)
 &rst
  ixpk= 3207, iat= 290,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 295, 296,
 &end
#
#   19 LEU  HA           20 GLN  HG+         4.50    (#   3208:20   Unique)
 &rst
  ixpk= 3208, iat= 271,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 295, 296,
 &end
#
#   20 GLN  HE2-         20 GLN  HG+         3.50    (#   3209:20   Unique)
 &rst
  ixpk= 3209, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 300, 301,
 igr2= 295, 296,
 &end
#
#   20 GLN  HE2+         20 GLN  HG+         4.50    (#   3210:20   Unique)
 &rst
  ixpk= 3210, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 300, 301,
 igr2= 295, 296,
 &end
#
#   20 GLN  HN           20 GLN  HG+         3.50    (#   3211:20   Unique)
 &rst
  ixpk= 3211, iat= 288,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 295, 296,
 &end
#
#   20 GLN  HN           20 GLN  HG-         3.50    (#   3212:20   Unique)
 &rst
  ixpk= 3212, iat= 288,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 295, 296,
 &end
#
#    0 AMB  20-2:3213     0 AMB  20-1:3213   3.50    (#   3213:20   Double Ambig)
 &rst
  ixpk= 3213, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 300, 301,2279,2280,
 igr2= 295, 296,2274,2275,
 &end
#
#    0 AMB  20-2:3214     0 AMB  20-1:3214   3.50    (#   3214:20   Double Ambig)
 &rst
  ixpk= 3214, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 290,2286,
 igr2= 295, 296,2274,2275,
 &end
#
#    0 AMB  20-2:3215     0 AMB  20-1:3215   3.50    (#   3215:20   Double Ambig)
 &rst
  ixpk= 3215, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2203,2204,2232, 271,
 igr2=2274,2275, 295, 296,
 &end
#
#    0 AMB  20-2:3216     0 AMB  20-1:3216   3.50    (#   3216:20   Double Ambig)
 &rst
  ixpk= 3216, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2203,2204, 306, 307, 306, 307,
 igr2=2274,2275, 295, 296,
 &end
#
#    0 AMB  20-2:3220    57 GLU  HG-         3.50    (#   3220:20   Single Ambig)
 &rst
  ixpk= 3220, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 871, 872,1171,1172,1173,1175,1176,1177,
 igr2= 907, 908,
 &end
#
#    0 AMB  20-2:3222     0 AMB  20-1:3222   3.50    (#   3222:20   Double Ambig)
 &rst
  ixpk= 3222, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1222,2514,2515,2514,2515,
 igr2= 907, 908,2521,
 &end
#
#    0 AMB  20-2:3223   158 PRO  HB2         3.50    (#   3223:20   Single Ambig)
 &rst
  ixpk= 3223, iat=  -1,2520, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2514,2515,2514,2515,
 &end
#
#  104 ARG  HE           44 GLN  HG-         3.50    (#   3224:20   Unique)
 &rst
  ixpk= 3224, iat=1678,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 704, 705,
 &end
#
#    0 AMB  20-2:3225    44 GLN  HG-         3.50    (#   3225:20   Single Ambig)
 &rst
  ixpk= 3225, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 709, 710,1000,1005,
 igr2= 704, 705,
 &end
#
#   44 GLN  HE2-         44 GLN  HG+         3.50    (#   3226:20   Unique)
 &rst
  ixpk= 3226, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 709, 710,
 igr2= 704, 705,
 &end
#
#    0 AMB  20-2:3227    77 LYS  QB          4.50    (#   3227:20   Single Ambig)
 &rst
  ixpk= 3227, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1222,1277,
 igr2=1240,1241,
 &end
#
#  136 ILE  HA            0 AMB  20-1:3228   3.50    (#   3228:20   Single Ambig)
 &rst
  ixpk= 3228, iat=2158,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2=2603,2604,2603,2604,
 &end
#
#  111 LEU  HA           10 VAL  HB          3.50    (#   3229:20   Unique)
 &rst
  ixpk= 3229, iat=1779, 138, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  164 LYS  HN            0 AMB  20-1:3230   3.50    (#   3230:20   Single Ambig)
 &rst
  ixpk= 3230, iat=2599,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2=2603,2604,2603,2604,
 &end
#
#  165 ILE  HN            0 AMB  20-1:3231   4.50    (#   3231:20   Single Ambig)
 &rst
  ixpk= 3231, iat=2621,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr2=2603,2604,2603,2604,
 &end
#
#   79 MET  HG+          77 LYS  QB          4.50    (#   3232:20   Unique)
 &rst
  ixpk= 3232, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1282,1283,
 igr2=1240,1241,
 &end
#
#    0 AMB  20-2:3234     0 AMB  20-1:3234   3.50    (#   3234:20   Double Ambig)
 &rst
  ixpk= 3234, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1746,1747, 119,2083,2084,
 igr2=1744,  91,
 &end
#
#    0 AMB  20-2:3235     0 AMB  20-1:3235   4.50    (#   3235:20   Double Ambig)
 &rst
  ixpk= 3235, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 714,2249,
 igr2= 704, 705,2274,2275,
 &end
#
#   45 PHE  HN           44 GLN  HG-         4.50    (#   3236:20   Unique)
 &rst
  ixpk= 3236, iat= 714,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 704, 705,
 &end
#
#    0 AMB  20-2:3237     0 AMB  20-1:3237   4.50    (#   3237:20   Double Ambig)
 &rst
  ixpk= 3237, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=2290,2291,2292,1021,1022,1023,
 igr2=2274,2275, 704, 705,
 &end
#
#    0 AMB  20-2:3238    57 GLU  HG-         4.50    (#   3238:20   Single Ambig)
 &rst
  ixpk= 3238, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.14, r4= 7.89,
 igr1=1226,1227,1228, 871, 872, 748, 749, 750,
 igr2= 907, 908,
 &end
#
#    0 AMB  20-2:3239     0 AMB  20-1:3239   3.50    (#   3239:20   Double Ambig)
 &rst
  ixpk= 3239, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1= 774, 775,2496, 488, 489, 490,2552,
 igr2= 907, 908,2521,
 &end
#
#  144 THR  MG2         143 GLN  HG+         4.50    (#   3240:20   Unique)
 &rst
  ixpk= 3240, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2290,2291,2292,
 igr2=2274,2275,
 &end
#
#    0 AMB  20-2:3241    44 GLN  HG-         4.50    (#   3241:20   Single Ambig)
 &rst
  ixpk= 3241, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1719,1720,1721,1017,1018,1019,
 igr2= 704, 705,
 &end
#
#    0 AMB  20-2:3242     0 AMB  20-1:3242   3.50    (#   3242:20   Double Ambig)
 &rst
  ixpk= 3242, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1= 904, 869, 874, 875,2496,
 igr2= 907, 908,2521,
 &end
#
#  161 GLU  HB2         158 PRO  HB2         3.50    (#   3243:20   Unique)
 &rst
  ixpk= 3243, iat=2552,2520, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:3244    20 GLN  HG-         3.50    (#   3244:20   Single Ambig)
 &rst
  ixpk= 3244, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 338, 339, 335, 336,
 igr2= 295, 296,
 &end
#
#    0 AMB  20-2:3245   180 GLN  QG          6.00    (#   3245:20   Single Ambig)
 &rst
  ixpk= 3245, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=2901,2816,
 igr2=2889,2890,
 &end
#
#  171 LYS  HA          171 LYS  HB+         4.50    (#   3246:20   Unique)
 &rst
  ixpk= 3246, iat=2722,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2724,2725,
 &end
#
#  166 LEU  MDY         171 LYS  HB+         3.50    (#   3249:20   Unique)
 &rst
  ixpk= 3249, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2649,2650,2651,2653,2654,2655,
 igr2=2724,2725,
 &end
#
#  166 LEU  MDX         171 LYS  HB+         3.50    (#   3250:20   Unique)
 &rst
  ixpk= 3250, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2649,2650,2651,2653,2654,2655,
 igr2=2724,2725,
 &end
#
#    0 AMB  20-2:3251   180 GLN  QG          3.50    (#   3251:20   Single Ambig)
 &rst
  ixpk= 3251, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2886,2887,2867,2868,2867,2868,
 igr2=2889,2890,
 &end
#
#  180 GLN  HB+         180 GLN  QG          2.70    (#   3252:20   Unique)
 &rst
  ixpk= 3252, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=2886,2887,
 igr2=2889,2890,
 &end
#
#    0 AMB  20-2:3253   180 GLN  QG          4.50    (#   3253:20   Single Ambig)
 &rst
  ixpk= 3253, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 616, 617, 618, 620, 621, 622,2956,2957,2958,
 igr2=2889,2890,
 &end
#
#    0 AMB  20-2:3254     0 AMB  20-1:3254   3.50    (#   3254:20   Double Ambig)
 &rst
  ixpk= 3254, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2836,2687,
 igr2=2889,2890,2724,2725,
 &end
#
#   80 LEU  MDY          17 MET  HB-         4.50    (#   3255:20   Unique)
 &rst
  ixpk= 3255, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1303,1304,1305,1307,1308,1309,
 igr2= 243, 244,
 &end
#
#   80 LEU  MDY          17 MET  HB+         4.50    (#   3256:20   Unique)
 &rst
  ixpk= 3256, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1303,1304,1305,1307,1308,1309,
 igr2= 243, 244,
 &end
#
#   17 MET  HG+          17 MET  HB-         3.50    (#   3257:20   Unique)
 &rst
  ixpk= 3257, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 246, 247,
 igr2= 243, 244,
 &end
#
#   17 MET  HG-          17 MET  HB-         2.70    (#   3258:20   Unique)
 &rst
  ixpk= 3258, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1= 246, 247,
 igr2= 243, 244,
 &end
#
#   17 MET  HG+          17 MET  HB+         3.50    (#   3259:20   Unique)
 &rst
  ixpk= 3259, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 246, 247,
 igr2= 243, 244,
 &end
#
#    0 AMB  20-2:3260     0 AMB  20-1:3260   4.50    (#   3260:20   Double Ambig)
 &rst
  ixpk= 3260, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1296,2787,
 igr2= 243, 244,2724,2725,
 &end
#
#    0 AMB  20-2:3261     0 AMB  20-1:3261   4.50    (#   3261:20   Double Ambig)
 &rst
  ixpk= 3261, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1315,2642,
 igr2= 243, 244,2724,2725,
 &end
#
#   81 LEU  HA           17 MET  HB-         4.50    (#   3262:20   Unique)
 &rst
  ixpk= 3262, iat=1315,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 243, 244,
 &end
#
#    0 AMB  20-2:3263     0 AMB  20-1:3263   3.50    (#   3263:20   Double Ambig)
 &rst
  ixpk= 3263, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=1034,1035, 551, 552,
 igr2=1031,1032, 479, 480,
 &end
#
#   65 LYS  HG-          65 LYS  HB-         3.50    (#   3264:20   Unique)
 &rst
  ixpk= 3264, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1034,1035,
 igr2=1031,1032,
 &end
#
#    0 AMB  20-2:3266    31 MET  HB-         3.50    (#   3266:20   Single Ambig)
 &rst
  ixpk= 3266, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 482, 483,1171,1172,1173,1175,1176,1177,
 igr2= 479, 480,
 &end
#
#    0 AMB  20-2:3269     0 AMB  20-1:3269   3.50    (#   3269:20   Double Ambig)
 &rst
  ixpk= 3269, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2906,2907,1188,1189,
 igr2=2903,2904,1185,1186,
 &end
#
#    0 AMB  20-2:3270     0 AMB  20-1:3270   3.50    (#   3270:20   Double Ambig)
 &rst
  ixpk= 3270, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2906,2907,1188,1189,
 igr2=2903,2904,1185,1186,
 &end
#
#    0 AMB  20-2:3272     0 AMB  20-1:3272   3.50    (#   3272:20   Double Ambig)
 &rst
  ixpk= 3272, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2523,  75,2675,
 igr2=2495,  48,  49,2724,2725,
 &end
#
#    0 AMB  20-2:3273     0 AMB  20-1:3273   6.00    (#   3273:20   Double Ambig)
 &rst
  ixpk= 3273, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.42, r4=10.17,
 igr1=  35, 457,2394,
 igr2=  48,  49, 498, 499,2587,
 &end
#
#    0 AMB  20-2:3274     0 AMB  20-1:3274   3.50    (#   3274:20   Double Ambig)
 &rst
  ixpk= 3274, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2493,  35,
 igr2=2495,  48,  49,
 &end
#
#    0 AMB  20-2:3275    69 PRO  HB2         3.50    (#   3275:20   Single Ambig)
 &rst
  ixpk= 3275, iat=  -1,1114, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1108,1109,1108,1109,
 &end
#
#   32 LYS  HA           69 PRO  HB2         3.50    (#   3276:20   Unique)
 &rst
  ixpk= 3276, iat= 496,1114, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   25 GLN  HA           25 GLN  HG-         3.50    (#   3278:20   Preassigned)
 &rst
  ixpk= 3278, iat= 368,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 373, 374,
 &end
#
#    0 AMB  20-2:3279    25 GLN  HG-         3.50    (#   3279:20   Single Ambig)
 &rst
  ixpk= 3279, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 321, 315,
 igr2= 373, 374,
 &end
#
#    0 AMB  20-2:3280    25 GLN  HG+         3.50    (#   3280:20   Single Ambig)
 &rst
  ixpk= 3280, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 321, 315,
 igr2= 373, 374,
 &end
#
#   98 ARG  HD+          98 ARG  HB-         4.50    (#   3281:20   Unique)
 &rst
  ixpk= 3281, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1585,1586,
 igr2=1579,1580,
 &end
#
#   98 ARG  HD-          98 ARG  HB-         3.50    (#   3282:20   Unique)
 &rst
  ixpk= 3282, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1585,1586,
 igr2=1579,1580,
 &end
#
#    0 AMB  20-2:3283     0 AMB  20-1:3283   3.50    (#   3283:20   Double Ambig)
 &rst
  ixpk= 3283, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 530,1053,
 igr2= 589, 590,1031,1032,
 &end
#
#   25 GLN  HA           25 GLN  HG+         3.50    (#   3284:20   Preassigned)
 &rst
  ixpk= 3284, iat= 368,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 373, 374,
 &end
#
#    0 AMB  20-2:3285     0 AMB  20-1:3285   3.50    (#   3285:20   Double Ambig)
 &rst
  ixpk= 3285, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2493, 980,
 igr2=2496,1031,1032,
 &end
#
#    0 AMB  20-2:3286     0 AMB  20-1:3286   3.50    (#   3286:20   Double Ambig)
 &rst
  ixpk= 3286, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 496, 426,
 igr2=1115, 479, 480,
 &end
#
#    0 AMB  20-2:3287    69 PRO  HB2         3.50    (#   3287:20   Single Ambig)
 &rst
  ixpk= 3287, iat=  -1,1114, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 501, 502,1171,1172,1173,1175,1176,1177,
 &end
#
#    0 AMB  20-2:3288   185 VAL  HB          2.70    (#   3288:20   Single Ambig)
 &rst
  ixpk= 3288, iat=  -1,2987, r1= 0.00, r2= 1.80, r3= 4.09, r4= 4.84,
 igr1=2989,2990,2991,2993,2994,2995,2989,2990,2991,2993,
      2994,2995,
 &end
#
#  101 LEU  MDX          98 ARG  HB+         3.50    (#   3289:20   Unique)
 &rst
  ixpk= 3289, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1638,1639,1640,1642,1643,1644,
 igr2=1579,1580,
 &end
#
#    0 AMB  20-2:3292     0 AMB  20-1:3292   3.50    (#   3292:20   Double Ambig)
 &rst
  ixpk= 3292, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1=1034,1035,1171,1172,1173,1175,1176,1177,
 igr2=1031,1032, 479, 480,
 &end
#
#  137 GLY  HN            0 AMB  20-1:3293   4.50    (#   3293:20   Single Ambig)
 &rst
  ixpk= 3293, iat=2175,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr2=2603,2604,2603,2604,
 &end
#
#    0 AMB  20-2:3294     0 AMB  20-1:3294   4.50    (#   3294:20   Double Ambig)
 &rst
  ixpk= 3294, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 697,2537,
 igr2= 704, 705,2520,
 &end
#
#    0 AMB  20-2:3295     0 AMB  20-1:3295   4.50    (#   3295:20   Double Ambig)
 &rst
  ixpk= 3295, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1=2537,2358,2359,
 igr2=2521,2274,2275,2274,2275,
 &end
#
#   44 GLN  HE2+         44 GLN  HG-         3.50    (#   3296:20   Unique)
 &rst
  ixpk= 3296, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 709, 710,
 igr2= 704, 705,
 &end
#
#   77 LYS  HN           77 LYS  QB          3.50    (#   3297:20   Unique)
 &rst
  ixpk= 3297, iat=1236,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1240,1241,
 &end
#
#   25 GLN  HN           25 GLN  HG+         3.50    (#   3298:20   Unique)
 &rst
  ixpk= 3298, iat= 366,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 373, 374,
 &end
#
#   25 GLN  HE2+         25 GLN  HG+         3.50    (#   3299:20   Unique)
 &rst
  ixpk= 3299, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 378, 379,
 igr2= 373, 374,
 &end
#
#  180 GLN  HE2-        180 GLN  QG          3.50    (#   3300:20   Unique)
 &rst
  ixpk= 3300, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2894,2895,
 igr2=2889,2890,
 &end
#
#  181 LYS  HN          180 GLN  QG          4.50    (#   3301:20   Unique)
 &rst
  ixpk= 3301, iat=2899,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2889,2890,
 &end
#
#    0 AMB  20-2:3302   180 GLN  QG          6.00    (#   3302:20   Single Ambig)
 &rst
  ixpk= 3302, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=2863,2834,
 igr2=2889,2890,
 &end
#
#    0 AMB  20-2:3303   171 LYS  HB+         4.50    (#   3303:20   Single Ambig)
 &rst
  ixpk= 3303, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2720,2671,
 igr2=2724,2725,
 &end
#
#    0 AMB  20-2:3304   180 GLN  QG          3.50    (#   3304:20   Single Ambig)
 &rst
  ixpk= 3304, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.43, r4= 6.18,
 igr1=2894,2895,2826,2824,2828,2822,2830,
 igr2=2889,2890,
 &end
#
#    0 AMB  20-2:3306    25 GLN  HG+         3.50    (#   3306:20   Single Ambig)
 &rst
  ixpk= 3306, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 378, 379, 354, 362,
 igr2= 373, 374,
 &end
#
#    0 AMB  20-2:3307    25 GLN  HG-         3.50    (#   3307:20   Single Ambig)
 &rst
  ixpk= 3307, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 378, 379, 354, 362,
 igr2= 373, 374,
 &end
#
#   25 GLN  HN           25 GLN  HG-         3.50    (#   3308:20   Unique)
 &rst
  ixpk= 3308, iat= 366,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 373, 374,
 &end
#
#    0 AMB  20-2:3309     0 AMB  20-1:3309   2.70    (#   3309:20   Double Ambig)
 &rst
  ixpk= 3309, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.59, r4= 5.34,
 igr1=2593,2594,2595,1188,1189,2589,2590,2591,
 igr2=2587,1185,1186,
 &end
#
#    0 AMB  20-2:3310     0 AMB  20-1:3310   6.00    (#   3310:20   Double Ambig)
 &rst
  ixpk= 3310, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1097,2785,
 igr2=1115,2724,2725,
 &end
#
#    0 AMB  20-2:3312     0 AMB  20-1:3312   3.50    (#   3312:20   Double Ambig)
 &rst
  ixpk= 3312, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 709, 710,1000,1005,
 igr2= 701, 702, 701, 702,
 &end
#
#   44 GLN  HE2-          0 AMB  20-1:3313   3.50    (#   3313:20   Single Ambig)
 &rst
  ixpk= 3313, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 709, 710,
 igr2= 701, 702, 701, 702,
 &end
#
#    0 AMB  20-2:3314     0 AMB  20-1:3314   3.50    (#   3314:20   Double Ambig)
 &rst
  ixpk= 3314, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 709, 710, 160, 164, 162,
 igr2= 701, 702, 701, 702, 551, 552,
 &end
#
#   44 GLN  HE2+         44 GLN  HB-         3.50    (#   3315:20   Unique)
 &rst
  ixpk= 3315, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 709, 710,
 igr2= 701, 702,
 &end
#
#    0 AMB  20-2:3316     0 AMB  20-1:3316   3.50    (#   3316:20   Double Ambig)
 &rst
  ixpk= 3316, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2899,2693,2701,
 igr2=2903,2904, 387, 388,
 &end
#
#   68 ASP  HN           66 TRP  HB3         4.50    (#   3317:20   Unique)
 &rst
  ixpk= 3317, iat=1095,1054, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   68 ASP  HN           66 TRP  HB2         4.50    (#   3318:20   Unique)
 &rst
  ixpk= 3318, iat=1095,1053, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:3319    66 TRP  HB2         6.00    (#   3319:20   Single Ambig)
 &rst
  ixpk= 3319, iat=  -1,1053, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1027,1062,
 &end
#
#  148 GLN  HE2+        148 GLN  HB-         4.50    (#   3320:20   Unique)
 &rst
  ixpk= 3320, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2358,2359,
 igr2=2350,2351,
 &end
#
#    0 AMB  20-2:3321   148 GLN  HB-         4.50    (#   3321:20   Single Ambig)
 &rst
  ixpk= 3321, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2358,2359,2363,2421,
 igr2=2350,2351,
 &end
#
#    0 AMB  20-2:3322   148 GLN  HB+         4.50    (#   3322:20   Single Ambig)
 &rst
  ixpk= 3322, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2358,2359,2363,2421,
 igr2=2350,2351,
 &end
#
#   95 GLU  HN           95 GLU  HB2         3.50    (#   3324:20   Unique)
 &rst
  ixpk= 3324, iat=1524,1528, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:3325     0 AMB  20-1:3325   3.50    (#   3325:20   Double Ambig)
 &rst
  ixpk= 3325, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1539,1565,1569,1563,1571,
 igr2=1528,1749,1750,
 &end
#
#    0 AMB  20-2:3326     0 AMB  20-1:3326   4.50    (#   3326:20   Double Ambig)
 &rst
  ixpk= 3326, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=1213, 494,1458,1459,
 igr2= 874, 875, 504, 505,1440,1441,
 &end
#
#    0 AMB  20-2:3327     0 AMB  20-1:3327   4.50    (#   3327:20   Double Ambig)
 &rst
  ixpk= 3327, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 494,1458,1459,
 igr2= 504, 505,1440,1441,
 &end
#
#    0 AMB  20-2:3328     0 AMB  20-1:3328   3.50    (#   3328:20   Double Ambig)
 &rst
  ixpk= 3328, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 782, 783, 782, 783,2279,2280,
 igr2= 874, 875,2218,2219,
 &end
#
#  130 ASP  HN          129 LYS  QD          4.50    (#   3329:20   Unique)
 &rst
  ixpk= 3329, iat=2042,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2030,2031,
 &end
#
#    0 AMB  20-2:3330     0 AMB  20-1:3330   3.50    (#   3330:20   Double Ambig)
 &rst
  ixpk= 3330, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=  73, 563,
 igr2=  54,  55, 573, 574,
 &end
#
#    0 AMB  20-2:3331   135 ILE  HG1-        4.50    (#   3331:20   Single Ambig)
 &rst
  ixpk= 3331, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2156,1853,
 igr2=2147,2148,
 &end
#
#    0 AMB  20-2:3332   135 ILE  HG1+        4.50    (#   3332:20   Single Ambig)
 &rst
  ixpk= 3332, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2156,1853,
 igr2=2147,2148,
 &end
#
#   66 TRP  HZ2          65 LYS  QD          3.50    (#   3333:20   Unique)
 &rst
  ixpk= 3333, iat=1062,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1037,1038,
 &end
#
#    0 AMB  20-2:3334     0 AMB  20-1:3334   3.50    (#   3334:20   Double Ambig)
 &rst
  ixpk= 3334, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1181,2470,
 igr2=1191,1192,2147,2148,
 &end
#
#    0 AMB  20-2:3335     0 AMB  20-1:3335   6.00    (#   3335:20   Double Ambig)
 &rst
  ixpk= 3335, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.49, r4= 9.24,
 igr1=2899,1133,
 igr2=2909,2910,1191,1192,
 &end
#
#    0 AMB  20-2:3337   109 LYS  QD          6.00    (#   3337:20   Single Ambig)
 &rst
  ixpk= 3337, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=1739,2073,
 igr2=1749,1750,
 &end
#
#   97 PHE  HZ          109 LYS  QD          4.50    (#   3338:20   Unique)
 &rst
  ixpk= 3338, iat=1567,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1749,1750,
 &end
#
#    0 AMB  20-2:3339     0 AMB  20-1:3339   3.50    (#   3339:20   Double Ambig)
 &rst
  ixpk= 3339, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2020,2695,2699,2693,2701,2697,
 igr2=2030,2031,2218,2219,
 &end
#
#    0 AMB  20-2:3340     0 AMB  20-1:3340   3.50    (#   3340:20   Double Ambig)
 &rst
  ixpk= 3340, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 383,2761,2742,2783,
 igr2= 393, 394,2771,2772,
 &end
#
#   75 HIS  HD2          77 LYS  QD          3.50    (#   3342:20   Unique)
 &rst
  ixpk= 3342, iat=1216,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1246,1247,
 &end
#
#    0 AMB  20-2:3343    19 LEU  MDX         3.50    (#   3343:20   Single Ambig)
 &rst
  ixpk= 3343, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 354, 362, 269,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#    0 AMB  20-2:3344     0 AMB  20-1:3344   3.50    (#   3344:20   Double Ambig)
 &rst
  ixpk= 3344, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 585, 346,
 igr2= 595, 596, 278, 279, 280, 282, 283, 284,
 &end
#
#   16 SER  HG           19 LEU  MDX         4.50    (#   3345:20   Unique)
 &rst
  ixpk= 3345, iat= 235,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#   15 GLY  HN           19 LEU  MDX         4.50    (#   3346:20   Unique)
 &rst
  ixpk= 3346, iat= 221,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#    0 AMB  20-2:3348    19 LEU  MDX         3.50    (#   3348:20   Single Ambig)
 &rst
  ixpk= 3348, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2695,2699,2697,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#   27 ILE  HN           19 LEU  MDX         4.50    (#   3349:20   Unique)
 &rst
  ixpk= 3349, iat= 405,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#   20 GLN  HN           23 GLU  HB+         6.00    (#   3350:20   Unique)
 &rst
  ixpk= 3350, iat= 288,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2= 335, 336,
 &end
#
#    0 AMB  20-2:3351   114 ILE  HG1-        4.50    (#   3351:20   Single Ambig)
 &rst
  ixpk= 3351, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2156,1853,
 igr2=1844,1845,
 &end
#
#  183 ILE  HN          183 ILE  HG1+        3.50    (#   3352:20   Preassigned)
 &rst
  ixpk= 3352, iat=2943,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2953,2954,
 &end
#
#    0 AMB  20-2:3353   183 ILE  HG1+        4.50    (#   3353:20   Single Ambig)
 &rst
  ixpk= 3353, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2921,2983,
 igr2=2953,2954,
 &end
#
#    0 AMB  20-2:3354     9 LEU  HG          3.50    (#   3354:20   Single Ambig)
 &rst
  ixpk= 3354, iat=  -1, 122, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 134,1796,
 &end
#
#   20 GLN  HN           19 LEU  MDY         3.50    (#   3355:20   Unique)
 &rst
  ixpk= 3355, iat= 288,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#  169 PHE  HD           19 LEU  MDY         3.50    (#   3356:20   Unique)
 &rst
  ixpk= 3356, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2693,2701,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#    0 AMB  20-2:3357     0 AMB  20-1:3357   3.50    (#   3357:20   Double Ambig)
 &rst
  ixpk= 3357, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1=2695,2699,2697, 467,
 igr2= 278, 279, 280, 282, 283, 284,2166,2167,
 &end
#
#    0 AMB  20-2:3358     0 AMB  20-1:3358   3.50    (#   3358:20   Double Ambig)
 &rst
  ixpk= 3358, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2073,2621,1739,
 igr2=2083,2084,2609,2610,
 &end
#
#    0 AMB  20-2:3359     0 AMB  20-1:3359   3.50    (#   3359:20   Double Ambig)
 &rst
  ixpk= 3359, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.47, r4= 7.22,
 igr1= 354, 362, 269,2124,2133,
 igr2= 278, 279, 280, 282, 283, 284,2166,2167,
 &end
#
#  106 ASP  HN          105 PRO  QG          3.50    (#   3360:20   Unique)
 &rst
  ixpk= 3360, iat=1703,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1693,1694,
 &end
#
#  186 ILE  HN          186 ILE  HG1-        3.50    (#   3361:20   Unique)
 &rst
  ixpk= 3361, iat=2999,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=3009,3010,
 &end
#
#  183 ILE  HN          183 ILE  HG1-        3.50    (#   3362:20   Preassigned)
 &rst
  ixpk= 3362, iat=2943,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2953,2954,
 &end
#
#    0 AMB  20-2:3363    19 LEU  MDY         4.50    (#   3363:20   Single Ambig)
 &rst
  ixpk= 3363, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 346, 209,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#    0 AMB  20-2:3368     0 AMB  20-1:3368   4.50    (#   3368:20   Double Ambig)
 &rst
  ixpk= 3368, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1524,2182,
 igr2=1582,1583,2647,
 &end
#
#    0 AMB  20-2:3369     0 AMB  20-1:3369   6.00    (#   3369:20   Double Ambig)
 &rst
  ixpk= 3369, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.19, r4=10.94,
 igr1= 170,1777,
 igr2=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,
 &end
#
#    0 AMB  20-2:3370     0 AMB  20-1:3370   4.50    (#   3370:20   Double Ambig)
 &rst
  ixpk= 3370, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.39, r4= 9.14,
 igr1=1796,2137, 134,
 igr2=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,2166,2167,
 &end
#
#    0 AMB  20-2:3371     9 LEU  MDX         6.00    (#   3371:20   Single Ambig)
 &rst
  ixpk= 3371, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1= 134,1796,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:3372     9 LEU  MDX         6.00    (#   3372:20   Single Ambig)
 &rst
  ixpk= 3372, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1= 150, 115,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:3373     9 LEU  MDX         3.50    (#   3373:20   Single Ambig)
 &rst
  ixpk= 3373, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 724, 728, 162, 160, 164,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:3376   175 LEU  HG          4.50    (#   3376:20   Single Ambig)
 &rst
  ixpk= 3376, iat=  -1,2802, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2795,2848,
 &end
#
#    0 AMB  20-2:3378     0 AMB  20-1:3378   3.50    (#   3378:20   Double Ambig)
 &rst
  ixpk= 3378, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1=1563,1571,1332,2020,
 igr2=2064,2065,1322,1323,1324,1326,1327,1328,
 &end
#
#   81 LEU  HN           81 LEU  MDX         3.50    (#   3379:20   Unique)
 &rst
  ixpk= 3379, iat=1313,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1322,1323,1324,1326,1327,1328,
 &end
#
#    0 AMB  20-2:3380     0 AMB  20-1:3380   4.50    (#   3380:20   Double Ambig)
 &rst
  ixpk= 3380, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.18, r4= 8.93,
 igr1= 832,2116,
 igr2=1322,1323,1324,1326,1327,1328,1786,1787,1788,1790,
      1791,1792,1786,1787,1788,1790,1791,1792,
 &end
#
#    0 AMB  20-2:3383     0 AMB  20-1:3383   3.50    (#   3383:20   Double Ambig)
 &rst
  ixpk= 3383, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2720,2894,2895,2671,2257,2261,
 igr2=2727,2728, 614,2399,
 &end
#
#    0 AMB  20-2:3384    73 LEU  MDX         4.50    (#   3384:20   Single Ambig)
 &rst
  ixpk= 3384, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=1162, 199, 203,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#   28 LEU  HN           28 LEU  MDX         3.50    (#   3386:20   Unique)
 &rst
  ixpk= 3386, iat= 424,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:3387    28 LEU  MDX         4.50    (#   3387:20   Single Ambig)
 &rst
  ixpk= 3387, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1= 378, 379, 199, 203,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:3388    73 LEU  MDX         4.50    (#   3388:20   Single Ambig)
 &rst
  ixpk= 3388, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 494,1143,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#    0 AMB  20-2:3390     0 AMB  20-1:3390   4.50    (#   3390:20   Double Ambig)
 &rst
  ixpk= 3390, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1=1575, 378, 379,
 igr2=1638,1639,1640,1642,1643,1644, 431,
 &end
#
#    0 AMB  20-2:3391   101 LEU  MDX         4.50    (#   3391:20   Single Ambig)
 &rst
  ixpk= 3391, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1588,1629,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:3392     0 AMB  20-1:3392   4.50    (#   3392:20   Double Ambig)
 &rst
  ixpk= 3392, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.84, r4= 8.59,
 igr1= 356, 360,1539, 358,
 igr2= 431,1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:3394    28 LEU  HG          4.50    (#   3394:20   Single Ambig)
 &rst
  ixpk= 3394, iat=  -1, 431, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 378, 379, 199, 203, 354, 362,
 &end
#
#    0 AMB  20-2:3395    28 LEU  HG          6.00    (#   3395:20   Single Ambig)
 &rst
  ixpk= 3395, iat=  -1, 431, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1= 356, 360, 358,
 &end
#
#  148 GLN  HE2-        165 ILE  HG1-        6.00    (#   3397:20   Unique)
 &rst
  ixpk= 3397, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=2358,2359,
 igr2=2631,2632,
 &end
#
#   83 THR  HN           82 LEU  MDX         3.50    (#   3398:20   Unique)
 &rst
  ixpk= 3398, iat=1351,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1341,1342,1343,1345,1346,1347,
 &end
#
#    0 AMB  20-2:3399   175 LEU  MDX         4.50    (#   3399:20   Single Ambig)
 &rst
  ixpk= 3399, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2848,2795,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:3402     0 AMB  20-1:3402   3.50    (#   3402:20   Double Ambig)
 &rst
  ixpk= 3402, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2720,2671, 925, 929,
 igr2=2727,2728,1169,
 &end
#
#   82 LEU  HN           82 LEU  MDX         3.50    (#   3403:20   Preassigned)
 &rst
  ixpk= 3403, iat=1332,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1341,1342,1343,1345,1346,1347,
 &end
#
#    0 AMB  20-2:3404   166 LEU  MDX         4.50    (#   3404:20   Single Ambig)
 &rst
  ixpk= 3404, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2742,2783,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#   29 ASP  HN           28 LEU  MDX         6.00    (#   3406:20   Unique)
 &rst
  ixpk= 3406, iat= 443,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:3407   166 LEU  MDX         4.50    (#   3407:20   Single Ambig)
 &rst
  ixpk= 3407, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2659,2640,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  20-2:3408     0 AMB  20-1:3408   4.50    (#   3408:20   Double Ambig)
 &rst
  ixpk= 3408, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=2795, 607,
 igr2=2649,2650,2651,2653,2654,2655, 616, 617, 618, 620,
       621, 622,
 &end
#
#    0 AMB  20-2:3409     0 AMB  20-1:3409   3.50    (#   3409:20   Double Ambig)
 &rst
  ixpk= 3409, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.84, r4= 8.59,
 igr1=2894,2895, 726, 724, 728, 201,2671,
 igr2= 616, 617, 618, 620, 621, 622, 433, 434, 435, 437,
       438, 439,2649,2650,2651,2653,2654,2655,
 &end
#
#  157 LYS  HN          157 LYS  HG-         4.50    (#   3410:20   Unique)
 &rst
  ixpk= 3410, iat=2491,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2498,2499,
 &end
#
#   76 VAL  MG1           0 AMB  20-1:3411   3.50    (#   3411:20   Single Ambig)
 &rst
  ixpk= 3411, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1226,1227,1228,
 igr2=1224,1262,
 &end
#
#   76 VAL  MG2          76 VAL  HB          3.50    (#   3412:20   Unique)
 &rst
  ixpk= 3412, iat=  -1,1224, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1230,1231,1232,
 &end
#
#    0 AMB  20-2:3413     0 AMB  20-1:3413   3.50    (#   3413:20   Double Ambig)
 &rst
  ixpk= 3413, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.14, r4= 7.89,
 igr1=2649,2650,2651,2653,2654,2655, 433, 434, 435, 437,
       438, 439,1303,1304,1305,1307,1308,1309,
 igr2=2730,2731,1224,1262,
 &end
#
#    0 AMB  20-2:3414     0 AMB  20-1:3414   3.50    (#   3414:20   Double Ambig)
 &rst
  ixpk= 3414, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.43, r4= 6.18,
 igr1= 433, 434, 435, 437, 438, 439,1301,
 igr2=1224,1262,
 &end
#
#    0 AMB  20-2:3417    96 VAL  HB          3.50    (#   3417:20   Single Ambig)
 &rst
  ixpk= 3417, iat=  -1,1543, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1549,1550,1551, 140, 141, 142, 760, 761, 762, 764,
       765, 766,
 &end
#
#    0 AMB  20-2:3418    96 VAL  HB          3.50    (#   3418:20   Single Ambig)
 &rst
  ixpk= 3418, iat=  -1,1543, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1545,1546,1547, 144, 145, 146,
 &end
#
#    0 AMB  20-2:3419     0 AMB  20-1:3419   3.50    (#   3419:20   Double Ambig)
 &rst
  ixpk= 3419, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1021,1022,1023,3009,3010,
 igr2=1015,2987,
 &end
#
#   32 LYS  QE           32 LYS  HB-         4.50    (#   3420:20   Unique)
 &rst
  ixpk= 3420, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 507, 508,
 igr2= 498, 499,
 &end
#
#    0 AMB  20-2:3421     0 AMB  20-1:3421   3.50    (#   3421:20   Double Ambig)
 &rst
  ixpk= 3421, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.14, r4= 7.89,
 igr1=  57,  58,2311,2312,2774,2775, 396, 397,2690,
 igr2=  48,  49,2302,2303,2765,2766, 387, 388,
 &end
#
#   44 GLN  HG+           0 AMB  20-1:3422   3.50    (#   3422:20   Single Ambig)
 &rst
  ixpk= 3422, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 704, 705,
 igr2= 701, 702, 701, 702,
 &end
#
#    0 AMB  20-2:3423    32 LYS  HB-         3.50    (#   3423:20   Single Ambig)
 &rst
  ixpk= 3423, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 501, 502,1171,1172,1173,1175,1176,1177,
 igr2= 498, 499,
 &end
#
#    0 AMB  20-2:3424     0 AMB  20-1:3424   3.50    (#   3424:20   Double Ambig)
 &rst
  ixpk= 3424, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1=2186,2906,2907,2989,2990,2991,2993,2994,2995,2989,
      2990,2991,2993,2994,2995,
 igr2=2212,2213,2925,2926,
 &end
#
#    0 AMB  20-2:3425     0 AMB  20-1:3425   2.70    (#   3425:20   Double Ambig)
 &rst
  ixpk= 3425, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.91, r4= 5.66,
 igr1=2727,2728,2305,2306,2768,2769,
 igr2=2730,2731,2302,2303,2765,2766,
 &end
#
#    0 AMB  20-2:3426     0 AMB  20-1:3426   2.70    (#   3426:20   Double Ambig)
 &rst
  ixpk= 3426, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.24, r4= 4.99,
 igr1=2305,2306,2305,2306,1167,
 igr2=2302,2303,1224,
 &end
#
#    0 AMB  20-2:3428   105 PRO  HB3         3.50    (#   3428:20   Single Ambig)
 &rst
  ixpk= 3428, iat=  -1,1697, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1690,1691,1690,1691,
 &end
#
#    0 AMB  20-2:3429     0 AMB  20-1:3429   3.50    (#   3429:20   Double Ambig)
 &rst
  ixpk= 3429, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.85, r4= 7.60,
 igr1= 994, 995, 971, 972,1029,1108,1109,1117,
 igr2= 701, 702, 701, 702,1015, 551, 552,
 &end
#
#   61 SER  HA           64 VAL  HB          3.50    (#   3430:20   Unique)
 &rst
  ixpk= 3430, iat= 969,1015, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:3431     0 AMB  20-1:3431   3.50    (#   3431:20   Double Ambig)
 &rst
  ixpk= 3431, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 306, 307,1183,
 igr2= 312,1224,
 &end
#
#    0 AMB  20-2:3432     0 AMB  20-1:3432   2.70    (#   3432:20   Double Ambig)
 &rst
  ixpk= 3432, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.59, r4= 5.34,
 igr1=1017,1018,1019,1490,1491,1492, 760, 761, 762, 764,
       765, 766,
 igr2=1015,1543,
 &end
#
#   21 PRO  QG           21 PRO  HB3         2.70    (#   3433:20   Unique)
 &rst
  ixpk= 3433, iat=  -1, 313, r1= 0.00, r2= 1.80, r3= 3.03, r4= 3.78,
 igr1= 309, 310,
 &end
#
#   35 MET  HB3          35 MET  HG-         6.00    (#   3436:20   Unique)
 &rst
  ixpk= 3436, iat= 549,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2= 551, 552,
 &end
#
#   21 PRO  HD+          21 PRO  HB3         4.50    (#   3437:20   Unique)
 &rst
  ixpk= 3437, iat=  -1, 313, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 306, 307,
 &end
#
#    0 AMB  20-2:3438    21 PRO  HB3         3.50    (#   3438:20   Single Ambig)
 &rst
  ixpk= 3438, iat=  -1, 313, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 306, 307, 306, 307,
 &end
#
#   72 LEU  MDX          66 TRP  HB3         4.50    (#   3440:20   Unique)
 &rst
  ixpk= 3440, iat=  -1,1054, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#   72 LEU  MDX          66 TRP  HB2         4.50    (#   3441:20   Unique)
 &rst
  ixpk= 3441, iat=  -1,1053, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#   72 LEU  MDY          66 TRP  HB2         3.50    (#   3442:20   Unique)
 &rst
  ixpk= 3442, iat=  -1,1053, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#   72 LEU  MDY          66 TRP  HB3         3.50    (#   3443:20   Unique)
 &rst
  ixpk= 3443, iat=  -1,1054, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#   71 ALA  MB           66 TRP  HB3         4.50    (#   3444:20   Unique)
 &rst
  ixpk= 3444, iat=  -1,1054, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1137,1138,1139,
 &end
#
#    0 AMB  20-2:3445    66 TRP  HB3         4.50    (#   3445:20   Single Ambig)
 &rst
  ixpk= 3445, iat=  -1,1054, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1150,1031,1032,
 &end
#
#   68 ASP  QB           66 TRP  HB3         3.50    (#   3446:20   Unique)
 &rst
  ixpk= 3446, iat=  -1,1054, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1099,1100,
 &end
#
#   68 ASP  QB           66 TRP  HB2         4.50    (#   3447:20   Unique)
 &rst
  ixpk= 3447, iat=  -1,1053, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1099,1100,
 &end
#
#   34 VAL  MG2          34 VAL  HB          3.50    (#   3448:20   Unique)
 &rst
  ixpk= 3448, iat=  -1, 532, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 538, 539, 540,
 &end
#
#   92 VAL  MG2          92 VAL  HB          3.50    (#   3449:20   Unique)
 &rst
  ixpk= 3449, iat=  -1,1488, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1494,1495,1496,
 &end
#
#   92 VAL  MG1          92 VAL  HB          3.50    (#   3450:20   Unique)
 &rst
  ixpk= 3450, iat=  -1,1488, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1490,1491,1492,
 &end
#
#    0 AMB  20-2:3451    92 VAL  HB          3.50    (#   3451:20   Single Ambig)
 &rst
  ixpk= 3451, iat=  -1,1488, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 179, 180, 181, 183, 184, 185,1436,1437,1438, 140,
       141, 142,2060,2061,2062,1549,1550,1551,
 &end
#
#   89 ILE  HA           92 VAL  HB          3.50    (#   3452:20   Unique)
 &rst
  ixpk= 3452, iat=1432,1488, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  153 LYS  HG+         153 LYS  HB+         3.50    (#   3453:20   Unique)
 &rst
  ixpk= 3453, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2435,2436,
 igr2=2432,2433,
 &end
#
#   67 LYS  HG+          67 LYS  QB          3.50    (#   3454:20   Unique)
 &rst
  ixpk= 3454, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1080,1081,
 igr2=1077,1078,
 &end
#
#   67 LYS  HG-          67 LYS  QB          3.50    (#   3455:20   Unique)
 &rst
  ixpk= 3455, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1080,1081,
 igr2=1077,1078,
 &end
#
#    0 AMB  20-2:3456   133 ARG  HB2         3.50    (#   3456:20   Single Ambig)
 &rst
  ixpk= 3456, iat=  -1,2096, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1828,1829,1830,2060,2061,2062,1436,1437,1438,
 &end
#
#  153 LYS  HG-         153 LYS  HB+         3.50    (#   3457:20   Unique)
 &rst
  ixpk= 3457, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2435,2436,
 igr2=2432,2433,
 &end
#
#  153 LYS  HG-         153 LYS  HB-         3.50    (#   3458:20   Unique)
 &rst
  ixpk= 3458, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2435,2436,
 igr2=2432,2433,
 &end
#
#  153 LYS  HG+         153 LYS  HB-         3.50    (#   3459:20   Unique)
 &rst
  ixpk= 3459, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2435,2436,
 igr2=2432,2433,
 &end
#
#    0 AMB  20-2:3460     0 AMB  20-1:3460   3.50    (#   3460:20   Double Ambig)
 &rst
  ixpk= 3460, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.27, r4= 7.02,
 igr1=1982,1983,1984,1825,1826,2079,2080,2081,2150,2151,
      2152,
 igr2=2096,2432,2433,
 &end
#
#  153 LYS  HE+         153 LYS  HB+         4.50    (#   3461:20   Unique)
 &rst
  ixpk= 3461, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2441,2442,
 igr2=2432,2433,
 &end
#
#  153 LYS  HE+         153 LYS  HB-         4.50    (#   3462:20   Unique)
 &rst
  ixpk= 3462, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2441,2442,
 igr2=2432,2433,
 &end
#
#    0 AMB  20-2:3463     0 AMB  20-1:3463   3.50    (#   3463:20   Double Ambig)
 &rst
  ixpk= 3463, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 477,2567,2568,
 igr2= 532,2552,
 &end
#
#   67 LYS  QB           66 TRP  HB3         6.00    (#   3467:20   Unique)
 &rst
  ixpk= 3467, iat=  -1,1054, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1077,1078,
 &end
#
#    0 AMB  20-2:3468     0 AMB  20-1:3468   3.50    (#   3468:20   Double Ambig)
 &rst
  ixpk= 3468, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2531,2532,2533,1188,1189,
 igr2=2416,1207,1208,
 &end
#
#   34 VAL  MG1          34 VAL  HB          3.50    (#   3469:20   Unique)
 &rst
  ixpk= 3469, iat=  -1, 532, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 534, 535, 536,
 &end
#
#  161 GLU  QG          161 GLU  HB2         2.70    (#   3470:20   Unique)
 &rst
  ixpk= 3470, iat=  -1,2552, r1= 0.00, r2= 1.80, r3= 3.03, r4= 3.78,
 igr1=2555,2556,
 &end
#
#    0 AMB  20-2:3471    31 MET  HG+         3.50    (#   3471:20   Single Ambig)
 &rst
  ixpk= 3471, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 465, 469, 160, 164, 162,
 igr2= 482, 483,
 &end
#
#    0 AMB  20-2:3472     0 AMB  20-1:3472   4.50    (#   3472:20   Double Ambig)
 &rst
  ixpk= 3472, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=3033, 494,
 igr2=3022,3023, 482, 483,
 &end
#
#  118 GLU  HG+         118 GLU  HB3         2.70    (#   3473:20   Unique)
 &rst
  ixpk= 3473, iat=  -1,1891, r1= 0.00, r2= 1.80, r3= 3.03, r4= 3.78,
 igr1=1893,1894,
 &end
#
#   31 MET  HB-          31 MET  HG+         3.50    (#   3475:20   Unique)
 &rst
  ixpk= 3475, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 479, 480,
 igr2= 482, 483,
 &end
#
#  161 GLU  QG          161 GLU  HB3         3.50    (#   3476:20   Unique)
 &rst
  ixpk= 3476, iat=  -1,2553, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2555,2556,
 &end
#
#  148 GLN  HG-         148 GLN  HB+         2.70    (#   3477:20   Unique)
 &rst
  ixpk= 3477, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=2353,2354,
 igr2=2350,2351,
 &end
#
#    0 AMB  20-2:3478    31 MET  HG+         3.50    (#   3478:20   Single Ambig)
 &rst
  ixpk= 3478, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 479, 480, 488, 489, 490,
 igr2= 482, 483,
 &end
#
#    0 AMB  20-2:3479    31 MET  HG-         3.50    (#   3479:20   Single Ambig)
 &rst
  ixpk= 3479, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 479, 480, 488, 489, 490,
 igr2= 482, 483,
 &end
#
#    0 AMB  20-2:3480    31 MET  HG-         3.50    (#   3480:20   Single Ambig)
 &rst
  ixpk= 3480, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1847,1848,1849,1844,1845,
 igr2= 482, 483,
 &end
#
#  148 GLN  HG-         148 GLN  HB-         3.50    (#   3483:20   Unique)
 &rst
  ixpk= 3483, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2353,2354,
 igr2=2350,2351,
 &end
#
#    0 AMB  20-2:3484     0 AMB  20-1:3484   3.50    (#   3484:20   Double Ambig)
 &rst
  ixpk= 3484, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1188,1189,2531,2532,2533,
 igr2=1207,1208,2415,
 &end
#
#    0 AMB  20-2:3486    17 MET  HG+         3.50    (#   3486:20   Single Ambig)
 &rst
  ixpk= 3486, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1= 243, 244, 252, 253, 254,
 igr2= 246, 247,
 &end
#
#   17 MET  HB-          17 MET  HG+         3.50    (#   3487:20   Unique)
 &rst
  ixpk= 3487, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 243, 244,
 igr2= 246, 247,
 &end
#
#   80 LEU  QB           17 MET  HG-         4.50    (#   3491:20   Unique)
 &rst
  ixpk= 3491, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1298,1299,
 igr2= 246, 247,
 &end
#
#    0 AMB  20-2:3492    17 MET  HG+         4.50    (#   3492:20   Single Ambig)
 &rst
  ixpk= 3492, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 258, 300, 301,
 igr2= 246, 247,
 &end
#
#    0 AMB  20-2:3493     0 AMB  20-1:3493   3.50    (#   3493:20   Double Ambig)
 &rst
  ixpk= 3493, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1= 258,2970,2979, 300, 301,
 igr2= 246, 247,3022,3023,
 &end
#
#    0 AMB  20-2:3495    89 ILE  HG1-        4.50    (#   3495:20   Single Ambig)
 &rst
  ixpk= 3495, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1436,1437,1438,1828,1829,1830,
 igr2=1440,1441,
 &end
#
#    0 AMB  20-2:3496     0 AMB  20-1:3496   3.50    (#   3496:20   Double Ambig)
 &rst
  ixpk= 3496, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=1678, 782, 783,  82,  83,
 igr2=1669,1670, 774, 775,
 &end
#
#    0 AMB  20-2:3497    49 GLN  QB          3.50    (#   3497:20   Single Ambig)
 &rst
  ixpk= 3497, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 770, 787,
 igr2= 774, 775,
 &end
#
#  175 LEU  MDY         178 GLU  QB          3.50    (#   3500:20   Unique)
 &rst
  ixpk= 3500, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2804,2805,2806,2808,2809,2810,
 igr2=2852,2853,
 &end
#
#  175 LEU  MDX         178 GLU  QB          3.50    (#   3501:20   Unique)
 &rst
  ixpk= 3501, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2804,2805,2806,2808,2809,2810,
 igr2=2852,2853,
 &end
#
#    0 AMB  20-2:3502     0 AMB  20-1:3502   2.70    (#   3502:20   Double Ambig)
 &rst
  ixpk= 3502, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.51, r4= 7.26,
 igr1=2221,2222,  57,  58,2441,2442,2033,2034, 877, 878,
       396, 397, 641, 642,
 igr2=2218,2219,  54,  55,2438,2439,2030,2031, 874, 875,
       393, 394,1083,1084,
 &end
#
#    0 AMB  20-2:3505     0 AMB  20-1:3505   2.70    (#   3505:20   Double Ambig)
 &rst
  ixpk= 3505, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.03, r4= 5.78,
 igr1=2435,2436, 871, 872,2677,2678,2679,
 igr2=2438,2439, 874, 875,2218,2219,
 &end
#
#    0 AMB  20-2:3507    89 ILE  HG1+        3.50    (#   3507:20   Single Ambig)
 &rst
  ixpk= 3507, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 179, 180, 181, 183, 184, 185,1436,1437,1438,1828,
      1829,1830,
 igr2=1440,1441,
 &end
#
#    0 AMB  20-2:3508   178 GLU  QB          6.00    (#   3508:20   Single Ambig)
 &rst
  ixpk= 3508, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.71, r4=10.46,
 igr1=2606,2607,2903,2904,2928,2929,2840,2841,2842,
 igr2=2852,2853,
 &end
#
#    0 AMB  20-2:3509     0 AMB  20-1:3509   4.50    (#   3509:20   Double Ambig)
 &rst
  ixpk= 3509, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.75, r4= 9.50,
 igr1=2677,2678,2679,1659,1660,1661,2840,2841,2842,
 igr2=2709,2710,1603,1604,2852,2853,
 &end
#
#  168 THR  MG2         140 LYS  HD+         3.50    (#   3513:20   Unique)
 &rst
  ixpk= 3513, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2677,2678,2679,
 igr2=2218,2219,
 &end
#
#   32 LYS  QE           32 LYS  HD-         3.50    (#   3514:20   Unique)
 &rst
  ixpk= 3514, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 507, 508,
 igr2= 504, 505,
 &end
#
#    0 AMB  20-2:3516     0 AMB  20-1:3516   4.50    (#   3516:20   Double Ambig)
 &rst
  ixpk= 3516, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=1638,1639,1640,1642,1643,1644, 415, 416,
 igr2=1582,1583,2749,
 &end
#
#  153 LYS  HG-         153 LYS  QD          3.50    (#   3517:20   Unique)
 &rst
  ixpk= 3517, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2435,2436,
 igr2=2438,2439,
 &end
#
#    0 AMB  20-2:3518     0 AMB  20-1:3518   3.50    (#   3518:20   Double Ambig)
 &rst
  ixpk= 3518, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 871, 872,2186,
 igr2= 874, 875,2218,2219,
 &end
#
#    0 AMB  20-2:3519     0 AMB  20-1:3519   3.50    (#   3519:20   Double Ambig)
 &rst
  ixpk= 3519, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.53, r4= 7.28,
 igr1=2143,2144,2145,2906,2907,1188,1189,
 igr2=2147,2148,2909,2910,1191,1192,
 &end
#
#   65 LYS  HG+          65 LYS  QD          2.70    (#   3520:20   Unique)
 &rst
  ixpk= 3520, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=1034,1035,
 igr2=1037,1038,
 &end
#
#    0 AMB  20-2:3521    65 LYS  QD          3.50    (#   3521:20   Single Ambig)
 &rst
  ixpk= 3521, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1040,1041,1040,1041,
 igr2=1037,1038,
 &end
#
#    0 AMB  20-2:3522     0 AMB  20-1:3522   4.50    (#   3522:20   Double Ambig)
 &rst
  ixpk= 3522, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=2733,2734, 396, 397,2612,2613,
 igr2=2709,2710,2852,2853,
 &end
#
#   65 LYS  HG-          65 LYS  QD          3.50    (#   3524:20   Unique)
 &rst
  ixpk= 3524, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1034,1035,
 igr2=1037,1038,
 &end
#
#    0 AMB  20-2:3525     0 AMB  20-1:3525   2.70    (#   3525:20   Double Ambig)
 &rst
  ixpk= 3525, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.08, r4= 7.83,
 igr1=2221,2222,1249,1250,2311,2312,  57,  58,2441,2442,
      2033,2034, 877, 878, 396, 397, 641, 642,
 igr2=2218,2219,1246,1247,2308,2309,  54,  55,2438,2439,
      2030,2031, 874, 875, 393, 394,1083,1084,
 &end
#
#    0 AMB  20-2:3528     0 AMB  20-1:3528   3.50    (#   3528:20   Double Ambig)
 &rst
  ixpk= 3528, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1125,1126, 295, 296, 295, 296, 507, 508, 323, 324,
       323, 324,
 igr2=1111,1112, 335, 336,
 &end
#
#    0 AMB  20-2:3529     0 AMB  20-1:3529   3.50    (#   3529:20   Double Ambig)
 &rst
  ixpk= 3529, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2327,2328, 350,1125,1126,
 igr2=2324,2325, 335, 336,1111,1112,
 &end
#
#    0 AMB  20-2:3530     0 AMB  20-1:3530   3.50    (#   3530:20   Double Ambig)
 &rst
  ixpk= 3530, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2327,2328,2370,2371,1114,
 igr2=2324,2325,2367,2368,1111,1112,
 &end
#
#  146 GLU  HG-         146 GLU  QB          3.50    (#   3531:20   Unique)
 &rst
  ixpk= 3531, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2327,2328,
 igr2=2324,2325,
 &end
#
#  170 GLU  HG+         170 GLU  QB          2.70    (#   3532:20   Unique)
 &rst
  ixpk= 3532, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=2712,2713,
 igr2=2709,2710,
 &end
#
#    0 AMB  20-2:3533    57 GLU  HB3         6.00    (#   3533:20   Single Ambig)
 &rst
  ixpk= 3533, iat=  -1, 905, r1= 0.00, r2= 1.80, r3= 8.49, r4= 9.24,
 igr1= 748, 749, 750,1226,1227,1228, 871, 872,
 &end
#
#   76 VAL  MG2          57 GLU  HB3         4.50    (#   3534:20   Unique)
 &rst
  ixpk= 3534, iat=  -1, 905, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1230,1231,1232,
 &end
#
#   73 LEU  MDY          57 GLU  HB3         3.50    (#   3535:20   Unique)
 &rst
  ixpk= 3535, iat=  -1, 905, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1171,1172,1173,1175,1176,1177,
 &end
#
#    0 AMB  20-2:3537   113 ILE  HG1+        3.50    (#   3537:20   Single Ambig)
 &rst
  ixpk= 3537, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.86, r4= 6.61,
 igr1= 179, 180, 181, 183, 184, 185,1443,1444,1445,1440,
      1441,
 igr2=1825,1826,
 &end
#
#    0 AMB  20-2:3538     0 AMB  20-1:3538   3.50    (#   3538:20   Double Ambig)
 &rst
  ixpk= 3538, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.27, r4= 8.02,
 igr1=2912,2913,1194,1195, 576, 577, 576, 577,2454,2455,
      
 igr2=2909,2910,1191,1192, 504, 505,2147,2148,
 &end
#
#   67 LYS  HA           67 LYS  HD-         4.50    (#   3539:20   Unique)
 &rst
  ixpk= 3539, iat=1075,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1083,1084,
 &end
#
#    0 AMB  20-2:3540     0 AMB  20-1:3540   3.50    (#   3540:20   Double Ambig)
 &rst
  ixpk= 3540, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=1086,1087, 877, 878,
 igr2=1083,1084, 874, 875,
 &end
#
#    0 AMB  20-2:3541     0 AMB  20-1:3541   3.50    (#   3541:20   Double Ambig)
 &rst
  ixpk= 3541, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1075, 333,2689,
 igr2=1083,1084, 393, 394,
 &end
#
#  136 ILE  MD1         114 ILE  HG1+        3.50    (#   3542:20   Unique)
 &rst
  ixpk= 3542, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2169,2170,2171,
 igr2=1844,1845,
 &end
#
#    0 AMB  20-2:3543     0 AMB  20-1:3543   3.50    (#   3543:20   Double Ambig)
 &rst
  ixpk= 3543, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2370,2371,1871,
 igr2=2367,2368,2218,2219,
 &end
#
#  138 ILE  MD1         138 ILE  HG1+        3.50    (#   3544:20   Unique)
 &rst
  ixpk= 3544, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2195,2196,2197,
 igr2=2192,2193,
 &end
#
#    9 LEU  MDY         112 ILE  HG1+        3.50    (#   3545:20   Unique)
 &rst
  ixpk= 3545, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 124, 125, 126, 128, 129, 130,
 igr2=1806,1807,
 &end
#
#  186 ILE  HB          186 ILE  HG1+        3.50    (#   3546:20   Unique)
 &rst
  ixpk= 3546, iat=3003,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=3009,3010,
 &end
#
#    0 AMB  20-2:3547     0 AMB  20-1:3547   2.70    (#   3547:20   Double Ambig)
 &rst
  ixpk= 3547, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.09, r4= 4.84,
 igr1=2925,2926,2947,
 igr2=2931,2932,2953,2954,
 &end
#
#    0 AMB  20-2:3548     0 AMB  20-1:3548   3.50    (#   3548:20   Double Ambig)
 &rst
  ixpk= 3548, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=1621,1622, 350, 323, 324,
 igr2=1636, 276, 292, 293,
 &end
#
#    0 AMB  20-2:3549    20 GLN  QB          3.50    (#   3549:20   Single Ambig)
 &rst
  ixpk= 3549, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 295, 296, 295, 296, 323, 324,
 igr2= 292, 293,
 &end
#
#    0 AMB  20-2:3550   105 PRO  QG          2.70    (#   3550:20   Single Ambig)
 &rst
  ixpk= 3550, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.96, r4= 4.71,
 igr1=1697,1606,1607,1606,1607,
 igr2=1693,1694,
 &end
#
#    0 AMB  20-2:3553     0 AMB  20-1:3553   3.50    (#   3553:20   Double Ambig)
 &rst
  ixpk= 3553, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.98, r4= 6.73,
 igr1=2724,2725,1579,1580,1973,
 igr2=2647,1582,1583,1979,1980,
 &end
#
#    0 AMB  20-2:3554   166 LEU  HG          2.70    (#   3554:20   Single Ambig)
 &rst
  ixpk= 3554, iat=  -1,2647, r1= 0.00, r2= 1.80, r3= 3.89, r4= 4.64,
 igr1=2162,2163,2164,2649,2650,2651,2653,2654,2655,
 &end
#
#  182 LYS  QE          182 LYS  HD-         3.50    (#   3555:20   Unique)
 &rst
  ixpk= 3555, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2934,2935,
 igr2=2931,2932,
 &end
#
#   57 GLU  HG+          57 GLU  HB3         3.50    (#   3556:20   Unique)
 &rst
  ixpk= 3556, iat=  -1, 905, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 907, 908,
 &end
#
#  153 LYS  HG-         153 LYS  QD          3.50    (#   3557:20   Unique)
 &rst
  ixpk= 3557, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2435,2436,
 igr2=2438,2439,
 &end
#
#    0 AMB  20-2:3558     0 AMB  20-1:3558   3.50    (#   3558:20   Double Ambig)
 &rst
  ixpk= 3558, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.14, r4= 7.89,
 igr1= 907, 908, 576, 577,1282,1283,2046,2047,
 igr2= 904, 573, 574, 504, 505, 874, 875,2030,2031,
 &end
#
#   65 LYS  HE+          65 LYS  QD          3.50    (#   3559:20   Unique)
 &rst
  ixpk= 3559, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1040,1041,
 igr2=1037,1038,
 &end
#
#    0 AMB  20-2:3560     0 AMB  20-1:3560   2.70    (#   3560:20   Double Ambig)
 &rst
  ixpk= 3560, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.29, r4= 5.04,
 igr1=2221,2222,2774,2775,
 igr2=2218,2219,2771,2772,
 &end
#
#   69 PRO  HG+          32 LYS  HD-         4.50    (#   3561:20   Unique)
 &rst
  ixpk= 3561, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1111,1112,
 igr2= 504, 505,
 &end
#
#   71 ALA  HA           74 LYS  QD          3.50    (#   3562:20   Unique)
 &rst
  ixpk= 3562, iat=1135,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1191,1192,
 &end
#
#    0 AMB  20-2:3563    65 LYS  QD          6.00    (#   3563:20   Single Ambig)
 &rst
  ixpk= 3563, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1029, 971, 972,
 igr2=1037,1038,
 &end
#
#   62 ASP  HA           65 LYS  QD          4.50    (#   3564:20   Unique)
 &rst
  ixpk= 3564, iat= 980,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1037,1038,
 &end
#
#  109 LYS  QE          109 LYS  QD          3.50    (#   3565:20   Preassigned)
 &rst
  ixpk= 3565, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1752,1753,
 igr2=1749,1750,
 &end
#
#    0 AMB  20-2:3566     0 AMB  20-1:3566   3.50    (#   3566:20   Double Ambig)
 &rst
  ixpk= 3566, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1559,1560,1486,
 igr2=1749,1750,1528,
 &end
#
#  131 ILE  HA          109 LYS  QD          4.50    (#   3567:20   Unique)
 &rst
  ixpk= 3567, iat=2056,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1749,1750,
 &end
#
#   95 GLU  HA           95 GLU  HB2         3.50    (#   3568:20   Unique)
 &rst
  ixpk= 3568, iat=1526,1528, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:3572     0 AMB  20-1:3572   3.50    (#   3572:20   Double Ambig)
 &rst
  ixpk= 3572, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2763,1990,
 igr2=2771,2772,2030,2031,
 &end
#
#    0 AMB  20-2:3573     0 AMB  20-1:3573   3.50    (#   3573:20   Double Ambig)
 &rst
  ixpk= 3573, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.04, r4= 7.79,
 igr1= 565,2024,2025,2024,2025,1108,1109,1108,1109,  68,
        69,
 igr2= 573, 574,2030,2031,  54,  55,
 &end
#
#    0 AMB  20-2:3574    19 LEU  MDX         3.50    (#   3574:20   Single Ambig)
 &rst
  ixpk= 3574, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 350,1871,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#    0 AMB  20-2:3576     0 AMB  20-1:3576   3.50    (#   3576:20   Double Ambig)
 &rst
  ixpk= 3576, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 276,2166,2167,
 igr2= 278, 279, 280, 282, 283, 284,1844,1845,
 &end
#
#   36 LYS  QB           37 LYS  QD          3.50    (#   3577:20   Unique)
 &rst
  ixpk= 3577, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 567, 568,
 igr2= 595, 596,
 &end
#
#    0 AMB  20-2:3578     0 AMB  20-1:3578   3.50    (#   3578:20   Double Ambig)
 &rst
  ixpk= 3578, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1= 348, 232, 233, 587,
 igr2= 278, 279, 280, 282, 283, 284, 595, 596,
 &end
#
#   18 SER  HB+          19 LEU  MDX         3.50    (#   3579:20   Unique)
 &rst
  ixpk= 3579, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 262, 263,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#    0 AMB  20-2:3580    19 LEU  MDX         3.50    (#   3580:20   Single Ambig)
 &rst
  ixpk= 3580, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 271, 223, 224,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#   15 GLY  HA+          19 LEU  MDX         3.50    (#   3581:20   Unique)
 &rst
  ixpk= 3581, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 223, 224,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#    9 LEU  MDX           9 LEU  HG          3.50    (#   3583:20   Unique)
 &rst
  ixpk= 3583, iat=  -1, 122, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 124, 125, 126, 128, 129, 130,
 &end
#
#    9 LEU  MDY           9 LEU  HG          3.50    (#   3584:20   Unique)
 &rst
  ixpk= 3584, iat=  -1, 122, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 124, 125, 126, 128, 129, 130,
 &end
#
#   37 LYS  QE           37 LYS  QD          3.50    (#   3586:20   Unique)
 &rst
  ixpk= 3586, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 598, 599,
 igr2= 595, 596,
 &end
#
#    0 AMB  20-2:3587    19 LEU  MDY         3.50    (#   3587:20   Single Ambig)
 &rst
  ixpk= 3587, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 271, 223, 224,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#  105 PRO  HD+         105 PRO  QG          3.50    (#   3591:20   Unique)
 &rst
  ixpk= 3591, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1690,1691,
 igr2=1693,1694,
 &end
#
#    0 AMB  20-2:3592   105 PRO  QG          3.50    (#   3592:20   Single Ambig)
 &rst
  ixpk= 3592, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1690,1691,1690,1691,
 igr2=1693,1694,
 &end
#
#    0 AMB  20-2:3593   105 PRO  QG          4.50    (#   3593:20   Single Ambig)
 &rst
  ixpk= 3593, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1705,1667,
 igr2=1693,1694,
 &end
#
#   98 ARG  HD+          98 ARG  HG+         3.50    (#   3594:20   Unique)
 &rst
  ixpk= 3594, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1585,1586,
 igr2=1582,1583,
 &end
#
#   98 ARG  HD+          98 ARG  HG-         3.50    (#   3595:20   Unique)
 &rst
  ixpk= 3595, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1585,1586,
 igr2=1582,1583,
 &end
#
#   98 ARG  HD-          98 ARG  HG+         3.50    (#   3596:20   Unique)
 &rst
  ixpk= 3596, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1585,1586,
 igr2=1582,1583,
 &end
#
#   98 ARG  HD+          98 ARG  HG-         3.50    (#   3597:20   Unique)
 &rst
  ixpk= 3597, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1585,1586,
 igr2=1582,1583,
 &end
#
#   98 ARG  HD-          98 ARG  HG-         3.50    (#   3598:20   Unique)
 &rst
  ixpk= 3598, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1585,1586,
 igr2=1582,1583,
 &end
#
#    0 AMB  20-2:3599     0 AMB  20-1:3599   3.50    (#   3599:20   Double Ambig)
 &rst
  ixpk= 3599, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.49, r4= 8.24,
 igr1=1440,1441, 179, 180, 181, 183, 184, 185,
 igr2=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,
 &end
#
#    0 AMB  20-2:3600     0 AMB  20-1:3600   2.70    (#   3600:20   Double Ambig)
 &rst
  ixpk= 3600, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.33, r4= 8.08,
 igr1=1744,2060,2061,2062, 179, 180, 181, 183, 184, 185,
      1436,1437,1438,1828,1829,1830, 140, 141, 142,2872,
      2873,2874,2876,2877,2878,
 igr2=2064,2065,1786,1787,1788,1790,1791,1792,1786,1787,
      1788,1790,1791,1792,2166,2167,
 &end
#
#   12 LEU  HB3           0 AMB  20-1:3602   3.50    (#   3602:20   Single Ambig)
 &rst
  ixpk= 3602, iat= 175,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr2=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,
 &end
#
#   92 VAL  HB            0 AMB  20-1:3603   3.50    (#   3603:20   Single Ambig)
 &rst
  ixpk= 3603, iat=1488,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr2=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,
 &end
#
#    0 AMB  20-2:3604     0 AMB  20-1:3604   3.50    (#   3604:20   Double Ambig)
 &rst
  ixpk= 3604, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1432,2102,2103,
 igr2=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,
 &end
#
#    0 AMB  20-2:3605     0 AMB  20-1:3605   3.50    (#   3605:20   Double Ambig)
 &rst
  ixpk= 3605, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1779,1817,
 igr2=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,
 &end
#
#    0 AMB  20-2:3606     0 AMB  20-1:3606   3.50    (#   3606:20   Double Ambig)
 &rst
  ixpk= 3606, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.85, r4= 7.60,
 igr1=2094,2139,1836,1798,
 igr2=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,2166,2167,
 &end
#
#  151 LEU  MDX         151 LEU  HG          3.50    (#   3607:20   Unique)
 &rst
  ixpk= 3607, iat=  -1,2399, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2401,2402,2403,2405,2406,2407,
 &end
#
#  172 LEU  MDY         172 LEU  HG          3.50    (#   3608:20   Preassigned)
 &rst
  ixpk= 3608, iat=  -1,2749, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2751,2752,2753,2755,2756,2757,
 &end
#
#  165 ILE  MD1         165 ILE  HG1+        3.50    (#   3609:20   Unique)
 &rst
  ixpk= 3609, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2634,2635,2636,
 igr2=2631,2632,
 &end
#
#   72 LEU  MDX          72 LEU  HG          3.50    (#   3610:20   Unique)
 &rst
  ixpk= 3610, iat=  -1,1150, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:3612     0 AMB  20-1:3612   3.50    (#   3612:20   Double Ambig)
 &rst
  ixpk= 3612, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=1502, 518, 445,1123,
 igr2=2064,2065, 501, 502,
 &end
#
#    0 AMB  20-2:3613     0 AMB  20-1:3613   3.50    (#   3613:20   Double Ambig)
 &rst
  ixpk= 3613, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.47, r4= 7.22,
 igr1= 822,1108,1109,1108,1109,
 igr2=1322,1323,1324,1326,1327,1328, 501, 502,
 &end
#
#    0 AMB  20-2:3614     0 AMB  20-1:3614   3.50    (#   3614:20   Double Ambig)
 &rst
  ixpk= 3614, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2056, 811, 812,
 igr2=2064,2065,1322,1323,1324,1326,1327,1328,
 &end
#
#   81 LEU  HA           81 LEU  MDX         3.50    (#   3615:20   Unique)
 &rst
  ixpk= 3615, iat=1315,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1322,1323,1324,1326,1327,1328,
 &end
#
#    0 AMB  20-2:3617    36 LYS  HG-         3.50    (#   3617:20   Single Ambig)
 &rst
  ixpk= 3617, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1111,1112, 567, 568,
 igr2= 570, 571,
 &end
#
#    0 AMB  20-2:3618    73 LEU  MDX         3.50    (#   3618:20   Single Ambig)
 &rst
  ixpk= 3618, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 488, 489, 490,1166,1115, 557, 558, 559, 479, 480,
      
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#   25 GLN  HA           28 LEU  HG          3.50    (#   3623:20   Unique)
 &rst
  ixpk= 3623, iat= 368, 431, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   28 LEU  HB+          28 LEU  HG          3.50    (#   3624:20   Unique)
 &rst
  ixpk= 3624, iat=  -1, 431, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 428, 429,
 &end
#
#   32 LYS  QE           32 LYS  HG+         3.50    (#   3625:20   Unique)
 &rst
  ixpk= 3625, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 507, 508,
 igr2= 501, 502,
 &end
#
#    0 AMB  20-2:3626     0 AMB  20-1:3626   3.50    (#   3626:20   Double Ambig)
 &rst
  ixpk= 3626, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 530,1381, 791, 680, 213, 214,
 igr2= 614, 177,
 &end
#
#   28 LEU  MDY          73 LEU  MDX         3.50    (#   3627:20   Unique)
 &rst
  ixpk= 3627, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 433, 434, 435, 437, 438, 439,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#   80 LEU  HG           80 LEU  MDX         3.50    (#   3628:20   Unique)
 &rst
  ixpk= 3628, iat=1301,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#   80 LEU  QB           80 LEU  MDX         3.50    (#   3629:20   Unique)
 &rst
  ixpk= 3629, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1298,1299,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#    0 AMB  20-2:3630    80 LEU  MDX         3.50    (#   3630:20   Single Ambig)
 &rst
  ixpk= 3630, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 243, 244, 243, 244,1262,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#   80 LEU  HA           80 LEU  MDX         3.50    (#   3631:20   Unique)
 &rst
  ixpk= 3631, iat=1296,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#   78 HIS  HB3          80 LEU  MDX         4.50    (#   3632:20   Unique)
 &rst
  ixpk= 3632, iat=1263,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#    0 AMB  20-2:3633    80 LEU  MDX         4.50    (#   3633:20   Single Ambig)
 &rst
  ixpk= 3633, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 241, 306, 307,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#    0 AMB  20-2:3634    73 LEU  MDX         3.50    (#   3634:20   Single Ambig)
 &rst
  ixpk= 3634, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 496, 426,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#   70 ASP  HA           73 LEU  MDX         4.50    (#   3635:20   Unique)
 &rst
  ixpk= 3635, iat=1123,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#   73 LEU  HA           73 LEU  MDX         4.50    (#   3636:20   Unique)
 &rst
  ixpk= 3636, iat=1164,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#   73 LEU  HB3          73 LEU  MDX         3.50    (#   3638:20   Preassigned)
 &rst
  ixpk= 3638, iat=1167,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#   47 ALA  MB           73 LEU  MDX         4.50    (#   3639:20   Unique)
 &rst
  ixpk= 3639, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 748, 749, 750,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#   37 LYS  QE           37 LYS  QG          3.50    (#   3641:20   Unique)
 &rst
  ixpk= 3641, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 598, 599,
 igr2= 592, 593,
 &end
#
#    0 AMB  20-2:3642    28 LEU  HG          4.50    (#   3642:20   Single Ambig)
 &rst
  ixpk= 3642, iat=  -1, 431, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 409, 370, 371,1224,
 &end
#
#    0 AMB  20-2:3643     0 AMB  20-1:3643   3.50    (#   3643:20   Double Ambig)
 &rst
  ixpk= 3643, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.47, r4= 7.22,
 igr1=1634,2353,2354,2353,2354,
 igr2=1638,1639,1640,1642,1643,1644,2631,2632,
 &end
#
#    0 AMB  20-2:3644     0 AMB  20-1:3644   3.50    (#   3644:20   Double Ambig)
 &rst
  ixpk= 3644, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1579,1580,2350,2351,1618,1619,
 igr2=1638,1639,1640,1642,1643,1644,2631,2632,
 &end
#
#   96 VAL  HA          101 LEU  MDX         3.50    (#   3645:20   Unique)
 &rst
  ixpk= 3645, iat=1541,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#  175 LEU  HA          175 LEU  MDX         4.50    (#   3648:20   Preassigned)
 &rst
  ixpk= 3648, iat=2797,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#  178 GLU  QB          175 LEU  MDX         4.50    (#   3653:20   Unique)
 &rst
  ixpk= 3653, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2852,2853,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:3654   175 LEU  MDX         3.50    (#   3654:20   Single Ambig)
 &rst
  ixpk= 3654, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2802,2603,2604,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:3655   175 LEU  MDX         3.50    (#   3655:20   Single Ambig)
 &rst
  ixpk= 3655, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.53, r4= 7.28,
 igr1=2800,2609,2610,2603,2604,2603,2604,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#  125 ILE  HB          125 ILE  HG1-        3.50    (#   3657:20   Unique)
 &rst
  ixpk= 3657, iat=1973,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1979,1980,
 &end
#
#   98 ARG  HB+          98 ARG  HG-         3.50    (#   3658:20   Unique)
 &rst
  ixpk= 3658, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1579,1580,
 igr2=1582,1583,
 &end
#
#    0 AMB  20-2:3659     0 AMB  20-1:3659   3.50    (#   3659:20   Double Ambig)
 &rst
  ixpk= 3659, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.72, r4= 7.47,
 igr1=2663,2664,2663,2664,1559,1560,2454,2455,1959,1960,
      
 igr2=2647,1582,1583,1979,1980,
 &end
#
#    0 AMB  20-2:3661     0 AMB  20-1:3661   3.50    (#   3661:20   Double Ambig)
 &rst
  ixpk= 3661, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2724,2725,2396,2709,2710,
 igr2=2727,2728,2399,
 &end
#
#   31 MET  HE           28 LEU  HG          4.50    (#   3662:20   Unique)
 &rst
  ixpk= 3662, iat=  -1, 431, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 488, 489, 490,
 &end
#
#    0 AMB  20-2:3664     0 AMB  20-1:3664   2.70    (#   3664:20   Double Ambig)
 &rst
  ixpk= 3664, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.15, r4= 5.90,
 igr1=1336,1337, 874, 875,1339, 869,
 igr2=1341,1342,1343,1345,1346,1347, 871, 872,
 &end
#
#    0 AMB  20-2:3665     0 AMB  20-1:3665   3.50    (#   3665:20   Double Ambig)
 &rst
  ixpk= 3665, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.80, r4= 7.55,
 igr1= 428, 429,2625,1633,2350,2351,
 igr2= 431,2631,2632,1638,1639,1640,1642,1643,1644,
 &end
#
#  100 GLU  QG          101 LEU  MDX         3.50    (#   3666:20   Unique)
 &rst
  ixpk= 3666, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1621,1622,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:3667   101 LEU  MDX         3.50    (#   3667:20   Single Ambig)
 &rst
  ixpk= 3667, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1585,1586, 939, 940,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:3668     0 AMB  20-1:3668   4.50    (#   3668:20   Double Ambig)
 &rst
  ixpk= 3668, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1= 939, 940, 351,
 igr2=1638,1639,1640,1642,1643,1644, 431,
 &end
#
#    0 AMB  20-2:3669    32 LYS  HG-         4.50    (#   3669:20   Single Ambig)
 &rst
  ixpk= 3669, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 507, 508,1125,1126,
 igr2= 501, 502,
 &end
#
#  171 LYS  QE          171 LYS  HG+         3.50    (#   3670:20   Unique)
 &rst
  ixpk= 3670, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2733,2734,
 igr2=2727,2728,
 &end
#
#    0 AMB  20-2:3671     0 AMB  20-1:3671   4.50    (#   3671:20   Double Ambig)
 &rst
  ixpk= 3671, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.18, r4= 8.93,
 igr1=2663,2664,2663,2664, 576, 577,
 igr2=2727,2728, 501, 502, 570, 571,
 &end
#
#    0 AMB  20-2:3672    37 LYS  QG          3.50    (#   3672:20   Single Ambig)
 &rst
  ixpk= 3672, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 589, 590, 589, 590,
 igr2= 592, 593,
 &end
#
#    0 AMB  20-2:3675     0 AMB  20-1:3675   3.50    (#   3675:20   Double Ambig)
 &rst
  ixpk= 3675, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 396, 397,2733,2734,
 igr2= 390, 391,2727,2728,
 &end
#
#   55 LYS  HE-          55 LYS  HG+         3.50    (#   3677:20   Unique)
 &rst
  ixpk= 3677, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 877, 878,
 igr2= 871, 872,
 &end
#
#   55 LYS  HE+          55 LYS  HG-         3.50    (#   3678:20   Unique)
 &rst
  ixpk= 3678, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 877, 878,
 igr2= 871, 872,
 &end
#
#   55 LYS  HE-          55 LYS  HG-         3.50    (#   3679:20   Unique)
 &rst
  ixpk= 3679, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 877, 878,
 igr2= 871, 872,
 &end
#
#    0 AMB  20-2:3680     0 AMB  20-1:3680   3.50    (#   3680:20   Double Ambig)
 &rst
  ixpk= 3680, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=  57,  58,2504,2505, 396, 397,
 igr2=  51,  52,2498,2499, 390, 391,
 &end
#
#   67 LYS  QB           67 LYS  HG+         3.50    (#   3681:20   Preassigned)
 &rst
  ixpk= 3681, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1077,1078,
 igr2=1080,1081,
 &end
#
#    0 AMB  20-2:3682    55 LYS  HG+         3.50    (#   3682:20   Single Ambig)
 &rst
  ixpk= 3682, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 874, 875, 869,
 igr2= 871, 872,
 &end
#
#    0 AMB  20-2:3683     0 AMB  20-1:3683   3.50    (#   3683:20   Double Ambig)
 &rst
  ixpk= 3683, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1= 868,1917,1918,1919,
 igr2= 871, 872,1341,1342,1343,1345,1346,1347,
 &end
#
#    0 AMB  20-2:3685    82 LEU  MDX         3.50    (#   3685:20   Single Ambig)
 &rst
  ixpk= 3685, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1336,1337,1318,
 igr2=1341,1342,1343,1345,1346,1347,
 &end
#
#   95 GLU  HA          101 LEU  MDX         6.00    (#   3686:20   Unique)
 &rst
  ixpk= 3686, iat=1526,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:3687    73 LEU  MDX         4.50    (#   3687:20   Single Ambig)
 &rst
  ixpk= 3687, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1114, 905,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#  174 ASP  HB3         166 LEU  MDX         6.00    (#   3688:20   Unique)
 &rst
  ixpk= 3688, iat=2788,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#   76 VAL  MG1          28 LEU  MDX         3.50    (#   3689:20   Unique)
 &rst
  ixpk= 3689, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1226,1227,1228,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#   19 LEU  HB-          80 LEU  MDX         3.50    (#   3690:20   Unique)
 &rst
  ixpk= 3690, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 273, 274,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#   28 LEU  MDY          28 LEU  HG          3.50    (#   3691:20   Unique)
 &rst
  ixpk= 3691, iat=  -1, 431, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:3692     0 AMB  20-1:3692   3.50    (#   3692:20   Double Ambig)
 &rst
  ixpk= 3692, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=2634,2635,2636,1545,1546,1547,
 igr2=2631,2632,1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:3693     0 AMB  20-1:3693   3.50    (#   3693:20   Double Ambig)
 &rst
  ixpk= 3693, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2722,2348,
 igr2=2727,2728,2399,
 &end
#
#  171 LYS  HA          171 LYS  HG-         3.50    (#   3694:20   Preassigned)
 &rst
  ixpk= 3694, iat=2722,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2727,2728,
 &end
#
#    0 AMB  20-2:3695     0 AMB  20-1:3695   3.50    (#   3695:20   Double Ambig)
 &rst
  ixpk= 3695, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1315,2177,2178,
 igr2=1320,2631,2632,
 &end
#
#    0 AMB  20-2:3697     0 AMB  20-1:3697   3.50    (#   3697:20   Double Ambig)
 &rst
  ixpk= 3697, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 518, 992,
 igr2= 570, 571,1150,
 &end
#
#   38 LEU  HA           38 LEU  HG          3.50    (#   3698:20   Unique)
 &rst
  ixpk= 3698, iat= 609, 614, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  176 PHE  HA          175 LEU  HG          3.50    (#   3699:20   Unique)
 &rst
  ixpk= 3699, iat=2816,2802, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:3700     0 AMB  20-1:3700   3.50    (#   3700:20   Double Ambig)
 &rst
  ixpk= 3700, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2816, 445,1123,
 igr2=2870, 501, 502,1169,
 &end
#
#    0 AMB  20-2:3701     0 AMB  20-1:3701   2.70    (#   3701:20   Double Ambig)
 &rst
  ixpk= 3701, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.66, r4= 6.41,
 igr1=1767,1768,1769,2804,2805,2806,2808,2809,2810,1341,
      1342,1343,1345,1346,1347,1825,1826,
 igr2=1806,1807,2870,1339, 177,
 &end
#
#    0 AMB  20-2:3702     0 AMB  20-1:3702   2.70    (#   3702:20   Double Ambig)
 &rst
  ixpk= 3702, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.82, r4= 6.57,
 igr1=1767,1768,1769,2804,2805,2806,2808,2809,2810,1809,
      1810,1811,1341,1342,1343,1345,1346,1347,1825,1826,
      
 igr2=1806,1807,2870,1339, 177,
 &end
#
#    0 AMB  20-2:3705   172 LEU  HG          3.50    (#   3705:20   Single Ambig)
 &rst
  ixpk= 3705, iat=  -1,2749, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2649,2650,2651,2653,2654,2655,2751,2752,2753,2755,
      2756,2757,
 &end
#
#  138 ILE  MD1         172 LEU  HG          6.00    (#   3706:20   Unique)
 &rst
  ixpk= 3706, iat=  -1,2749, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=2195,2196,2197,
 &end
#
#    0 AMB  20-2:3707   172 LEU  HG          3.50    (#   3707:20   Single Ambig)
 &rst
  ixpk= 3707, iat=  -1,2749, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2746,2747, 387, 388,2724,2725,
 &end
#
#    0 AMB  20-2:3708     9 LEU  MDX         4.50    (#   3708:20   Single Ambig)
 &rst
  ixpk= 3708, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 117, 152,1779,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:3709     9 LEU  MDX         4.50    (#   3709:20   Single Ambig)
 &rst
  ixpk= 3709, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1800, 681,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:3710     9 LEU  MDX         3.50    (#   3710:20   Single Ambig)
 &rst
  ixpk= 3710, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 119,1802,1803,1804,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:3712     9 LEU  MDX         3.50    (#   3712:20   Single Ambig)
 &rst
  ixpk= 3712, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 122,1806,1807,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:3713    19 LEU  MDY         3.50    (#   3713:20   Single Ambig)
 &rst
  ixpk= 3713, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 350,1871,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#    0 AMB  20-2:3714    19 LEU  MDY         4.50    (#   3714:20   Single Ambig)
 &rst
  ixpk= 3714, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1= 335, 336,2192,2193,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#   18 SER  HB+          19 LEU  MDY         4.50    (#   3715:20   Unique)
 &rst
  ixpk= 3715, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 262, 263,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#    0 AMB  20-2:3716    19 LEU  MDY         3.50    (#   3716:20   Single Ambig)
 &rst
  ixpk= 3716, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 348, 232, 233,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#    0 AMB  20-2:3717    19 LEU  MDY         4.50    (#   3717:20   Single Ambig)
 &rst
  ixpk= 3717, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 333, 211,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#  186 ILE  HA          186 ILE  HG1-        3.50    (#   3721:20   Unique)
 &rst
  ixpk= 3721, iat=3001,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=3009,3010,
 &end
#
#    0 AMB  20-2:3722    21 PRO  QG          3.50    (#   3722:20   Single Ambig)
 &rst
  ixpk= 3722, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 306, 307, 306, 307,
 igr2= 309, 310,
 &end
#
#   21 PRO  HD-          21 PRO  QG          3.50    (#   3723:20   Unique)
 &rst
  ixpk= 3723, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 306, 307,
 igr2= 309, 310,
 &end
#
#    0 AMB  20-2:3724   113 ILE  HG1-        3.50    (#   3724:20   Single Ambig)
 &rst
  ixpk= 3724, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.86, r4= 6.61,
 igr1= 179, 180, 181, 183, 184, 185,1443,1444,1445,1440,
      1441,
 igr2=1825,1826,
 &end
#
#  182 LYS  HA            0 AMB  20-1:3725   4.50    (#   3725:20   Single Ambig)
 &rst
  ixpk= 3725, iat=2923,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr2=2931,2932,3009,3010,
 &end
#
#  182 LYS  HA          182 LYS  HD+         4.50    (#   3726:20   Unique)
 &rst
  ixpk= 3726, iat=2923,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2931,2932,
 &end
#
#    0 AMB  20-2:3727     0 AMB  20-1:3727   3.50    (#   3727:20   Double Ambig)
 &rst
  ixpk= 3727, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1= 213, 214, 213, 214, 193, 194,
 igr2= 278, 279, 280, 282, 283, 284,1844,1845,
 &end
#
#    0 AMB  20-2:3728     0 AMB  20-1:3728   3.50    (#   3728:20   Double Ambig)
 &rst
  ixpk= 3728, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 193, 194, 351,
 igr2=1844,1845, 278, 279, 280, 282, 283, 284,
 &end
#
#   69 PRO  HD+          69 PRO  HG+         3.50    (#   3730:20   Unique)
 &rst
  ixpk= 3730, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1108,1109,
 igr2=1111,1112,
 &end
#
#   68 ASP  HA           69 PRO  HG-         4.50    (#   3731:20   Unique)
 &rst
  ixpk= 3731, iat=1097,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1111,1112,
 &end
#
#    0 AMB  20-2:3733   178 GLU  QB          3.50    (#   3733:20   Single Ambig)
 &rst
  ixpk= 3733, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2850,2838,
 igr2=2852,2853,
 &end
#
#  109 LYS  HG-         109 LYS  QD          2.70    (#   3735:20   Unique)
 &rst
  ixpk= 3735, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=1746,1747,
 igr2=1749,1750,
 &end
#
#    0 AMB  20-2:3737   109 LYS  QD          3.50    (#   3737:20   Single Ambig)
 &rst
  ixpk= 3737, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2064,2065,1743,
 igr2=1749,1750,
 &end
#
#   66 TRP  HE1          65 LYS  QD          4.50    (#   3739:20   Unique)
 &rst
  ixpk= 3739, iat=1059,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1037,1038,
 &end
#
#    0 AMB  20-2:3744     0 AMB  20-1:3744   3.50    (#   3744:20   Double Ambig)
 &rst
  ixpk= 3744, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2208, 637,1073,
 igr2=2218,2219,1083,1084,
 &end
#
#   16 SER  HN           19 LEU  MDX         4.50    (#   3745:20   Unique)
 &rst
  ixpk= 3745, iat= 228,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#   20 GLN  HN           19 LEU  MDX         4.50    (#   3746:20   Unique)
 &rst
  ixpk= 3746, iat= 288,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#    0 AMB  20-2:3747    19 LEU  MDX         3.50    (#   3747:20   Single Ambig)
 &rst
  ixpk= 3747, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2695,2699,2697,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#   20 GLN  HN           23 GLU  HB-         4.50    (#   3748:20   Unique)
 &rst
  ixpk= 3748, iat= 288,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 335, 336,
 &end
#
#   77 LYS  HN            0 AMB  20-1:3749   6.00    (#   3749:20   Single Ambig)
 &rst
  ixpk= 3749, iat=1236,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr2=1246,1247, 874, 875,
 &end
#
#  113 ILE  HA          114 ILE  HG1+        6.00    (#   3750:20   Unique)
 &rst
  ixpk= 3750, iat=1817,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1844,1845,
 &end
#
#   68 ASP  HA           69 PRO  HG+         4.50    (#   3751:20   Unique)
 &rst
  ixpk= 3751, iat=1097,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1111,1112,
 &end
#
#   22 ASP  HN           21 PRO  QG          4.50    (#   3755:20   Unique)
 &rst
  ixpk= 3755, iat= 319,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 309, 310,
 &end
#
#   20 GLN  HN            0 AMB  20-1:3756   3.50    (#   3756:20   Single Ambig)
 &rst
  ixpk= 3756, iat= 288,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 292, 293, 276,
 &end
#
#    0 AMB  20-2:3757     9 LEU  HG          6.00    (#   3757:20   Single Ambig)
 &rst
  ixpk= 3757, iat=  -1, 122, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1= 160, 164, 162, 726,
 &end
#
#   22 ASP  HA           25 GLN  HB-         3.50    (#   3758:20   Unique)
 &rst
  ixpk= 3758, iat= 321,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 370, 371,
 &end
#
#  138 ILE  HN          138 ILE  HG1-        6.00    (#   3760:20   Unique)
 &rst
  ixpk= 3760, iat=2182,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=2192,2193,
 &end
#
#  116 ASP  HB3          19 LEU  MDY         3.50    (#   3762:20   Unique)
 &rst
  ixpk= 3762, iat=1872,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#  138 ILE  MG2         138 ILE  HG1-        3.50    (#   3763:20   Unique)
 &rst
  ixpk= 3763, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2188,2189,2190,
 igr2=2192,2193,
 &end
#
#  138 ILE  MG2         138 ILE  HG1+        3.50    (#   3765:20   Unique)
 &rst
  ixpk= 3765, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2188,2189,2190,
 igr2=2192,2193,
 &end
#
#  138 ILE  MG2           0 AMB  20-1:3766   4.50    (#   3766:20   Single Ambig)
 &rst
  ixpk= 3766, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2188,2189,2190,
 igr2=2192,2193,2647,
 &end
#
#   20 GLN  HA           21 PRO  QG          4.50    (#   3767:20   Unique)
 &rst
  ixpk= 3767, iat= 290,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 309, 310,
 &end
#
#    0 AMB  20-2:3770     0 AMB  20-1:3770   4.50    (#   3770:20   Double Ambig)
 &rst
  ixpk= 3770, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 117,1779, 152,1389,
 igr2=1806,1807, 177,
 &end
#
#    0 AMB  20-2:3771     0 AMB  20-1:3771   4.50    (#   3771:20   Double Ambig)
 &rst
  ixpk= 3771, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1800,2987,
 igr2=1806,1807,3009,3010,
 &end
#
#  186 ILE  HB          186 ILE  HG1-        3.50    (#   3772:20   Unique)
 &rst
  ixpk= 3772, iat=3003,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=3009,3010,
 &end
#
#  134 TYR  HB2         112 ILE  HG1-        4.50    (#   3774:20   Unique)
 &rst
  ixpk= 3774, iat=2120,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1806,1807,
 &end
#
#   63 TYR  HA           72 LEU  MDX         3.50    (#   3776:20   Unique)
 &rst
  ixpk= 3776, iat= 992,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:3777    72 LEU  MDX         3.50    (#   3777:20   Single Ambig)
 &rst
  ixpk= 3777, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1145,1117, 994, 995,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   72 LEU  HG           72 LEU  MDX         3.50    (#   3778:20   Unique)
 &rst
  ixpk= 3778, iat=1150,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:3782   175 LEU  HG          4.50    (#   3782:20   Single Ambig)
 &rst
  ixpk= 3782, iat=  -1,2802, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2852,2853,2855,2856,
 &end
#
#    0 AMB  20-2:3783     0 AMB  20-1:3783   3.50    (#   3783:20   Double Ambig)
 &rst
  ixpk= 3783, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.58, r4= 7.33,
 igr1= 179, 180, 181, 183, 184, 185,  97,  98,  99, 335,
       336,
 igr2= 177,3009,3010, 276,
 &end
#
#    0 AMB  20-2:3784     0 AMB  20-1:3784   3.50    (#   3784:20   Double Ambig)
 &rst
  ixpk= 3784, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1526,2452,
 igr2=1582,1583,1979,1980,
 &end
#
#  175 LEU  MDY         175 LEU  HG          2.70    (#   3785:20   Unique)
 &rst
  ixpk= 3785, iat=  -1,2802, r1= 0.00, r2= 1.80, r3= 3.64, r4= 4.39,
 igr1=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:3786   175 LEU  HG          2.70    (#   3786:20   Single Ambig)
 &rst
  ixpk= 3786, iat=  -1,2802, r1= 0.00, r2= 1.80, r3= 3.89, r4= 4.64,
 igr1=2804,2805,2806,2808,2809,2810,2169,2170,2171,
 &end
#
#    0 AMB  20-2:3787     0 AMB  20-1:3787   3.50    (#   3787:20   Double Ambig)
 &rst
  ixpk= 3787, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 576, 577,1053,
 igr2= 570, 571,1150,
 &end
#
#   36 LYS  HE-          36 LYS  HG-         3.50    (#   3788:20   Unique)
 &rst
  ixpk= 3788, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 576, 577,
 igr2= 570, 571,
 &end
#
#    0 AMB  20-2:3789    72 LEU  MDX         4.50    (#   3789:20   Single Ambig)
 &rst
  ixpk= 3789, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1053, 983,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   68 ASP  QB           72 LEU  MDX         4.50    (#   3790:20   Unique)
 &rst
  ixpk= 3790, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1099,1100,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:3791    72 LEU  MDX         4.50    (#   3791:20   Single Ambig)
 &rst
  ixpk= 3791, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1075,1054,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   45 PHE  HB2          72 LEU  MDX         4.50    (#   3792:20   Unique)
 &rst
  ixpk= 3792, iat= 718,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   35 MET  HE           72 LEU  MDX         6.00    (#   3794:20   Unique)
 &rst
  ixpk= 3794, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.71, r4=10.46,
 igr1= 557, 558, 559,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   72 LEU  HB3          72 LEU  MDX         3.50    (#   3797:20   Unique)
 &rst
  ixpk= 3797, iat=1148,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   80 LEU  MDX          80 LEU  HG          3.50    (#   3798:20   Unique)
 &rst
  ixpk= 3798, iat=  -1,1301, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1303,1304,1305,1307,1308,1309,
 &end
#
#   80 LEU  MDY          80 LEU  HG          3.50    (#   3799:20   Unique)
 &rst
  ixpk= 3799, iat=  -1,1301, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1303,1304,1305,1307,1308,1309,
 &end
#
#   25 GLN  HG-          28 LEU  HG          4.50    (#   3800:20   Unique)
 &rst
  ixpk= 3800, iat=  -1, 431, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 373, 374,
 &end
#
#  158 PRO  HB3         158 PRO  HG+         3.50    (#   3801:20   Unique)
 &rst
  ixpk= 3801, iat=2521,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2517,2518,
 &end
#
#  158 PRO  HB2         158 PRO  HG+         4.50    (#   3802:20   Unique)
 &rst
  ixpk= 3802, iat=2520,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2517,2518,
 &end
#
#    0 AMB  20-2:3803   158 PRO  HG+         3.50    (#   3803:20   Single Ambig)
 &rst
  ixpk= 3803, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2514,2515,2514,2515,
 igr2=2517,2518,
 &end
#
#    0 AMB  20-2:3804    26 LYS  HG+         3.50    (#   3804:20   Single Ambig)
 &rst
  ixpk= 3804, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 385,2707,
 igr2= 390, 391,
 &end
#
#    0 AMB  20-2:3805     0 AMB  20-1:3805   3.50    (#   3805:20   Double Ambig)
 &rst
  ixpk= 3805, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 385,2707,2482,
 igr2= 390, 391,2498,2499,
 &end
#
#  157 LYS  HA          157 LYS  HG-         3.50    (#   3806:20   Unique)
 &rst
  ixpk= 3806, iat=2493,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2498,2499,
 &end
#
#  157 LYS  HA          157 LYS  HG+         3.50    (#   3807:20   Unique)
 &rst
  ixpk= 3807, iat=2493,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2498,2499,
 &end
#
#    0 AMB  20-2:3808    80 LEU  MDY         3.50    (#   3808:20   Single Ambig)
 &rst
  ixpk= 3808, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 241, 306, 307,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#   80 LEU  HA           80 LEU  MDY         3.50    (#   3809:20   Unique)
 &rst
  ixpk= 3809, iat=1296,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#    0 AMB  20-2:3810    10 VAL  MG2         3.50    (#   3810:20   Single Ambig)
 &rst
  ixpk= 3810, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 108,1488,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  20-2:3811    80 LEU  MDY         3.50    (#   3811:20   Single Ambig)
 &rst
  ixpk= 3811, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 243, 244,1262,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#   10 VAL  HB           10 VAL  MG2         3.50    (#   3812:20   Unique)
 &rst
  ixpk= 3812, iat= 138,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 144, 145, 146,
 &end
#
#   80 LEU  QB           80 LEU  MDY         3.50    (#   3813:20   Unique)
 &rst
  ixpk= 3813, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1298,1299,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#   80 LEU  HG           80 LEU  MDY         3.50    (#   3814:20   Unique)
 &rst
  ixpk= 3814, iat=1301,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#   28 LEU  HA           28 LEU  MDX         4.50    (#   3816:20   Unique)
 &rst
  ixpk= 3816, iat= 426,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:3818    28 LEU  MDX         6.00    (#   3818:20   Single Ambig)
 &rst
  ixpk= 3818, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=11.44, r4=12.19,
 igr1=1171,1172,1173,1175,1176,1177, 428, 429,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:3819     0 AMB  20-1:3819   3.50    (#   3819:20   Double Ambig)
 &rst
  ixpk= 3819, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=2644,2645,2647,2192,2193,2606,2607,2606,2607,1169,
       589, 590, 589, 590,1167,
 igr2=2649,2650,2651,2653,2654,2655, 433, 434, 435, 437,
       438, 439, 616, 617, 618, 620, 621, 622,
 &end
#
#    0 AMB  20-2:3820    28 LEU  MDX         3.50    (#   3820:20   Single Ambig)
 &rst
  ixpk= 3820, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 409,1224,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:3821     0 AMB  20-1:3821   3.50    (#   3821:20   Double Ambig)
 &rst
  ixpk= 3821, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.69, r4= 9.44,
 igr1=2603,2604,2603,2604,2724,2725, 614, 611, 612, 488,
       489, 490,2800,
 igr2=2649,2650,2651,2653,2654,2655, 616, 617, 618, 620,
       621, 622, 433, 434, 435, 437, 438, 439,
 &end
#
#   28 LEU  HB+          28 LEU  MDX         3.50    (#   3822:20   Unique)
 &rst
  ixpk= 3822, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 428, 429,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:3823     0 AMB  20-1:3823   3.50    (#   3823:20   Double Ambig)
 &rst
  ixpk= 3823, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=1334, 866,
 igr2=1341,1342,1343,1345,1346,1347, 871, 872,
 &end
#
#    0 AMB  20-2:3824     0 AMB  20-1:3824   3.50    (#   3824:20   Double Ambig)
 &rst
  ixpk= 3824, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 820, 888,
 igr2=1341,1342,1343,1345,1346,1347, 871, 872,
 &end
#
#   64 VAL  HA           67 LYS  HG+         4.50    (#   3825:20   Unique)
 &rst
  ixpk= 3825, iat=1013,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1080,1081,
 &end
#
#   64 VAL  HA           67 LYS  HG-         4.50    (#   3826:20   Unique)
 &rst
  ixpk= 3826, iat=1013,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1080,1081,
 &end
#
#    0 AMB  20-2:3830     0 AMB  20-1:3830   3.50    (#   3830:20   Double Ambig)
 &rst
  ixpk= 3830, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2724,2725, 681, 409,1224,
 igr2=2649,2650,2651,2653,2654,2655, 616, 617, 618, 620,
       621, 622, 433, 434, 435, 437, 438, 439,
 &end
#
#  169 PHE  HA          166 LEU  MDX         4.50    (#   3831:20   Unique)
 &rst
  ixpk= 3831, iat=2687,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  20-2:3832     0 AMB  20-1:3832   3.50    (#   3832:20   Double Ambig)
 &rst
  ixpk= 3832, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2744, 368,
 igr2=2649,2650,2651,2653,2654,2655, 433, 434, 435, 437,
       438, 439,
 &end
#
#    0 AMB  20-2:3833   165 ILE  HG1+        3.50    (#   3833:20   Single Ambig)
 &rst
  ixpk= 3833, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2627,2628,2629,2589,2590,2591,
 igr2=2631,2632,
 &end
#
#    0 AMB  20-2:3837     0 AMB  20-1:3837   3.50    (#   3837:20   Double Ambig)
 &rst
  ixpk= 3837, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2514,2515,2514,2515,
 igr2=2517,2518,2517,2518,
 &end
#
#  158 PRO  HB2           0 AMB  20-1:3838   4.50    (#   3838:20   Single Ambig)
 &rst
  ixpk= 3838, iat=2520,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr2=2517,2518,2517,2518,
 &end
#
#  158 PRO  HB3           0 AMB  20-1:3839   3.50    (#   3839:20   Single Ambig)
 &rst
  ixpk= 3839, iat=2521,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2=2517,2518,2517,2518,
 &end
#
#   30 PHE  QB          172 LEU  MDX         3.50    (#   3840:20   Unique)
 &rst
  ixpk= 3840, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 459, 460,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#   27 ILE  HA          172 LEU  MDX         3.50    (#   3841:20   Unique)
 &rst
  ixpk= 3841, iat= 407,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#  179 LEU  HA          179 LEU  MDX         3.50    (#   3842:20   Preassigned)
 &rst
  ixpk= 3842, iat=2865,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2872,2873,2874,2876,2877,2878,
 &end
#
#  172 LEU  HA          172 LEU  MDX         3.50    (#   3843:20   Unique)
 &rst
  ixpk= 3843, iat=2744,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:3844   172 LEU  MDX         3.50    (#   3844:20   Single Ambig)
 &rst
  ixpk= 3844, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2690, 396, 397,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#   89 ILE  HA           12 LEU  MDX         3.50    (#   3845:20   Unique)
 &rst
  ixpk= 3845, iat=1432,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#   85 THR  MG2          12 LEU  MDX         3.50    (#   3849:20   Unique)
 &rst
  ixpk= 3849, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1385,1386,1387,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:3850    12 LEU  MDX         3.50    (#   3850:20   Single Ambig)
 &rst
  ixpk= 3850, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1494,1495,1496, 174,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:3851    12 LEU  MDX         3.50    (#   3851:20   Single Ambig)
 &rst
  ixpk= 3851, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1440,1441, 177,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#   12 LEU  HB3          12 LEU  MDX         3.50    (#   3852:20   Preassigned)
 &rst
  ixpk= 3852, iat= 175,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#   65 LYS  HB+          65 LYS  HG+         3.50    (#   3853:20   Unique)
 &rst
  ixpk= 3853, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1031,1032,
 igr2=1034,1035,
 &end
#
#   92 VAL  HB           12 LEU  MDX         4.50    (#   3854:20   Unique)
 &rst
  ixpk= 3854, iat=1488,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:3855    12 LEU  MDX         4.50    (#   3855:20   Single Ambig)
 &rst
  ixpk= 3855, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1422,1468,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:3856    12 LEU  MDX         4.50    (#   3856:20   Single Ambig)
 &rst
  ixpk= 3856, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 791,1381,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#   50 PHE  HB3          12 LEU  MDX         4.50    (#   3857:20   Unique)
 &rst
  ixpk= 3857, iat= 792,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:3858    12 LEU  MDX         6.00    (#   3858:20   Single Ambig)
 &rst
  ixpk= 3858, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1= 211,1486,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#   65 LYS  HA           65 LYS  HG-         3.50    (#   3859:20   Preassigned)
 &rst
  ixpk= 3859, iat=1029,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1034,1035,
 &end
#
#    0 AMB  20-2:3860    10 VAL  MG2         6.00    (#   3860:20   Single Ambig)
 &rst
  ixpk= 3860, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.65, r4= 9.40,
 igr1=1486,1559,1560,
 igr2= 144, 145, 146,
 &end
#
#   92 VAL  MG1          10 VAL  MG2         3.50    (#   3863:20   Unique)
 &rst
  ixpk= 3863, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1490,1491,1492,
 igr2= 144, 145, 146,
 &end
#
#  172 LEU  HG          172 LEU  MDX         3.50    (#   3866:20   Unique)
 &rst
  ixpk= 3866, iat=2749,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:3867   172 LEU  MDX         2.70    (#   3867:20   Single Ambig)
 &rst
  ixpk= 3867, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.37, r4= 5.12,
 igr1=2746,2747,2647,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#   92 VAL  HB           92 VAL  MG2         3.50    (#   3868:20   Preassigned)
 &rst
  ixpk= 3868, iat=1488,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1494,1495,1496,
 &end
#
#    0 AMB  20-2:3869    92 VAL  MG2         3.50    (#   3869:20   Single Ambig)
 &rst
  ixpk= 3869, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1468,1422,
 igr2=1494,1495,1496,
 &end
#
#    0 AMB  20-2:3870    92 VAL  MG2         6.00    (#   3870:20   Single Ambig)
 &rst
  ixpk= 3870, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1541,1502,
 igr2=1494,1495,1496,
 &end
#
#   91 TYR  HB2          92 VAL  MG2         4.50    (#   3871:20   Unique)
 &rst
  ixpk= 3871, iat=1467,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1494,1495,1496,
 &end
#
#    0 AMB  20-2:3872    92 VAL  MG2         3.50    (#   3872:20   Single Ambig)
 &rst
  ixpk= 3872, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1543, 175, 847, 848,
 igr2=1494,1495,1496,
 &end
#
#    0 AMB  20-2:3873    92 VAL  MG2         2.70    (#   3873:20   Single Ambig)
 &rst
  ixpk= 3873, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.09, r4= 5.84,
 igr1= 760, 761, 762, 764, 765, 766, 179, 180, 181, 183,
       184, 185,1549,1550,1551,
 igr2=1494,1495,1496,
 &end
#
#    0 AMB  20-2:3874    92 VAL  MG2         3.50    (#   3874:20   Single Ambig)
 &rst
  ixpk= 3874, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 140, 141, 142,1549,1550,1551,
 igr2=1494,1495,1496,
 &end
#
#   55 LYS  HA           55 LYS  HG+         3.50    (#   3875:20   Preassigned)
 &rst
  ixpk= 3875, iat= 866,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 871, 872,
 &end
#
#    0 AMB  20-2:3878    65 LYS  HG+         3.50    (#   3878:20   Single Ambig)
 &rst
  ixpk= 3878, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1037,1038,1031,1032,
 igr2=1034,1035,
 &end
#
#   65 LYS  HA           65 LYS  HG+         3.50    (#   3879:20   Unique)
 &rst
  ixpk= 3879, iat=1029,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1034,1035,
 &end
#
#  176 PHE  HA          179 LEU  MDX         3.50    (#   3880:20   Unique)
 &rst
  ixpk= 3880, iat=2816,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2872,2873,2874,2876,2877,2878,
 &end
#
#   30 PHE  HA          172 LEU  MDX         6.00    (#   3881:20   Unique)
 &rst
  ixpk= 3881, iat= 457,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#   48 VAL  HB           12 LEU  MDY         4.50    (#   3882:20   Unique)
 &rst
  ixpk= 3882, iat= 758,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#   96 VAL  HA           10 VAL  MG2         6.00    (#   3883:20   Unique)
 &rst
  ixpk= 3883, iat=1541,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  20-2:3884    12 LEU  MDX         2.70    (#   3884:20   Single Ambig)
 &rst
  ixpk= 3884, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.84, r4= 6.59,
 igr1=1424,1425,1426,1825,1826,1786,1787,1788,1790,1791,
      1792,1786,1787,1788,1790,1791,1792,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#  113 ILE  HG1+         12 LEU  MDX         4.50    (#   3885:20   Unique)
 &rst
  ixpk= 3885, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1825,1826,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:3886    65 LYS  HG-         3.50    (#   3886:20   Single Ambig)
 &rst
  ixpk= 3886, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1037,1038,1031,1032,
 igr2=1034,1035,
 &end
#
#  159 ALA  MB          157 LYS  QD          3.50    (#   3888:20   Unique)
 &rst
  ixpk= 3888, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2531,2532,2533,
 igr2=2501,2502,
 &end
#
#    0 AMB  20-2:3889   164 LYS  HG-         4.50    (#   3889:20   Single Ambig)
 &rst
  ixpk= 3889, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2649,2650,2651,2653,2654,2655,2162,2163,2164,
 igr2=2606,2607,
 &end
#
#   66 TRP  HA           65 LYS  HG-         4.50    (#   3891:20   Unique)
 &rst
  ixpk= 3891, iat=1051,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1034,1035,
 &end
#
#  165 ILE  MD1         151 LEU  MDX         3.50    (#   3892:20   Unique)
 &rst
  ixpk= 3892, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2634,2635,2636,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#  135 ILE  MG2         151 LEU  MDX         3.50    (#   3893:20   Unique)
 &rst
  ixpk= 3893, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2143,2144,2145,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#  163 VAL  MG1         151 LEU  MDX         4.50    (#   3895:20   Unique)
 &rst
  ixpk= 3895, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2589,2590,2591,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#    0 AMB  20-2:3896   151 LEU  MDX         4.50    (#   3896:20   Single Ambig)
 &rst
  ixpk= 3896, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2350,2351,2587,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#    0 AMB  20-2:3897   151 LEU  MDX         3.50    (#   3897:20   Single Ambig)
 &rst
  ixpk= 3897, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2147,2148,1859,1860,1861,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#    0 AMB  20-2:3898   151 LEU  MDX         3.50    (#   3898:20   Single Ambig)
 &rst
  ixpk= 3898, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2147,2148,2397,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#  151 LEU  HG          151 LEU  MDX         3.50    (#   3899:20   Unique)
 &rst
  ixpk= 3899, iat=2399,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#    0 AMB  20-2:3900   151 LEU  MDX         3.50    (#   3900:20   Single Ambig)
 &rst
  ixpk= 3900, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2177,2178,2353,2354,2353,2354,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#    0 AMB  20-2:3902   151 LEU  MDX         4.50    (#   3902:20   Single Ambig)
 &rst
  ixpk= 3902, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2394,1888,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#  137 GLY  HA+         151 LEU  MDX         3.50    (#   3903:20   Unique)
 &rst
  ixpk= 3903, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2177,2178,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#   65 LYS  HE+          65 LYS  HG-         3.50    (#   3905:20   Unique)
 &rst
  ixpk= 3905, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1040,1041,
 igr2=1034,1035,
 &end
#
#    0 AMB  20-2:3906    65 LYS  HG-         3.50    (#   3906:20   Single Ambig)
 &rst
  ixpk= 3906, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1040,1041,1040,1041,
 igr2=1034,1035,
 &end
#
#    0 AMB  20-2:3907    12 LEU  MDX         3.50    (#   3907:20   Single Ambig)
 &rst
  ixpk= 3907, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1784,1434,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:3908   175 LEU  MDY         3.50    (#   3908:20   Single Ambig)
 &rst
  ixpk= 3908, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2852,2853,2855,2856,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:3909   175 LEU  MDY         2.70    (#   3909:20   Single Ambig)
 &rst
  ixpk= 3909, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.37, r4= 5.12,
 igr1=2802,2603,2604,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:3910   175 LEU  MDY         2.70    (#   3910:20   Single Ambig)
 &rst
  ixpk= 3910, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.03, r4= 5.78,
 igr1=2800,2609,2610,2603,2604,2603,2604,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:3914   173 LYS  QG          2.70    (#   3914:20   Single Ambig)
 &rst
  ixpk= 3914, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.82, r4= 4.57,
 igr1=2765,2766,2765,2766,
 igr2=2768,2769,
 &end
#
#    0 AMB  20-2:3915   182 LYS  HG-         3.50    (#   3915:20   Single Ambig)
 &rst
  ixpk= 3915, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2934,2935,2912,2913,
 igr2=2928,2929,
 &end
#
#    0 AMB  20-2:3916     0 AMB  20-1:3916   2.70    (#   3916:20   Double Ambig)
 &rst
  ixpk= 3916, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.99, r4= 5.74,
 igr1=2302,2303,2302,2303,2925,2926,2370,2371,2903,2904,
      
 igr2=2305,2306,2928,2929,
 &end
#
#    0 AMB  20-2:3917     0 AMB  20-1:3917   3.50    (#   3917:20   Double Ambig)
 &rst
  ixpk= 3917, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=2612,2613,2311,2312,1249,1250, 877, 878,
 igr2=2606,2607,2305,2306,1243,1244,
 &end
#
#   65 LYS  HE+          65 LYS  HG+         3.50    (#   3918:20   Unique)
 &rst
  ixpk= 3918, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1040,1041,
 igr2=1034,1035,
 &end
#
#    0 AMB  20-2:3919    65 LYS  HG+         3.50    (#   3919:20   Single Ambig)
 &rst
  ixpk= 3919, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1040,1041,1040,1041,
 igr2=1034,1035,
 &end
#
#    4 LYS  HA            4 LYS  QG          3.50    (#   3920:20   Unique)
 &rst
  ixpk= 3920, iat=  46,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  51,  52,
 &end
#
#  182 LYS  HA          182 LYS  HG-         3.50    (#   3921:20   Unique)
 &rst
  ixpk= 3921, iat=2923,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2928,2929,
 &end
#
#  175 LEU  HA          175 LEU  MDY         3.50    (#   3922:20   Preassigned)
 &rst
  ixpk= 3922, iat=2797,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:3924    96 VAL  MG2         2.70    (#   3924:20   Single Ambig)
 &rst
  ixpk= 3924, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.91, r4= 5.66,
 igr1= 760, 761, 762, 764, 765, 766, 892, 893, 894,1490,
      1491,1492,
 igr2=1549,1550,1551,
 &end
#
#    0 AMB  20-2:3925    92 VAL  MG1         3.50    (#   3925:20   Single Ambig)
 &rst
  ixpk= 3925, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 144, 145, 146,1545,1546,1547,
 igr2=1490,1491,1492,
 &end
#
#   92 VAL  HA           96 VAL  MG2         3.50    (#   3926:20   Unique)
 &rst
  ixpk= 3926, iat=1486,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1549,1550,1551,
 &end
#
#    0 AMB  20-2:3927     0 AMB  20-1:3927   3.50    (#   3927:20   Double Ambig)
 &rst
  ixpk= 3927, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1502,2816,
 igr2=1490,1491,1492,2804,2805,2806,2808,2809,2810,
 &end
#
#   11 PHE  QB           47 ALA  MB          3.50    (#   3928:20   Unique)
 &rst
  ixpk= 3928, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 154, 155,
 igr2= 748, 749, 750,
 &end
#
#   96 VAL  HB           92 VAL  MG1         3.50    (#   3930:20   Unique)
 &rst
  ixpk= 3930, iat=1543,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1490,1491,1492,
 &end
#
#   96 VAL  HB           96 VAL  MG2         3.50    (#   3931:20   Unique)
 &rst
  ixpk= 3931, iat=1543,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1549,1550,1551,
 &end
#
#    0 AMB  20-2:3932    96 VAL  MG2         3.50    (#   3932:20   Single Ambig)
 &rst
  ixpk= 3932, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=1494,1495,1496,1638,1639,1640,1642,1643,1644,
 igr2=1549,1550,1551,
 &end
#
#    0 AMB  20-2:3933   166 LEU  MDY         2.70    (#   3933:20   Single Ambig)
 &rst
  ixpk= 3933, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.25, r4= 6.00,
 igr1=2644,2645,2647,2192,2193,2606,2607,2606,2607,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  20-2:3934    12 LEU  MDY         3.50    (#   3934:20   Single Ambig)
 &rst
  ixpk= 3934, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1440,1441, 177,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#   74 LYS  QE           74 LYS  HG-         3.50    (#   3935:20   Preassigned)
 &rst
  ixpk= 3935, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1194,1195,
 igr2=1188,1189,
 &end
#
#   50 PHE  HB3          12 LEU  MDY         3.50    (#   3936:20   Unique)
 &rst
  ixpk= 3936, iat= 792,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#  175 LEU  HA          166 LEU  MDY         4.50    (#   3937:20   Unique)
 &rst
  ixpk= 3937, iat=2797,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#  171 LYS  HA          166 LEU  MDY         4.50    (#   3938:20   Unique)
 &rst
  ixpk= 3938, iat=2722,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#   96 VAL  HA           96 VAL  MG2         4.50    (#   3939:20   Unique)
 &rst
  ixpk= 3939, iat=1541,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1549,1550,1551,
 &end
#
#    0 AMB  20-2:3940    96 VAL  MG2         4.50    (#   3940:20   Single Ambig)
 &rst
  ixpk= 3940, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 888,1526,
 igr2=1549,1550,1551,
 &end
#
#  173 LYS  QE          173 LYS  QG          3.50    (#   3941:20   Unique)
 &rst
  ixpk= 3941, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2774,2775,
 igr2=2768,2769,
 &end
#
#  182 LYS  HB+         182 LYS  HG+         2.70    (#   3942:20   Preassigned)
 &rst
  ixpk= 3942, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=2925,2926,
 igr2=2928,2929,
 &end
#
#    0 AMB  20-2:3943    74 LYS  HG+         2.70    (#   3943:20   Single Ambig)
 &rst
  ixpk= 3943, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.82, r4= 4.57,
 igr1=1185,1186,1191,1192,
 igr2=1188,1189,
 &end
#
#    0 AMB  20-2:3944     0 AMB  20-1:3944   2.70    (#   3944:20   Double Ambig)
 &rst
  ixpk= 3944, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.88, r4= 5.63,
 igr1= 387, 388, 387, 388,2495,1280,1318,
 igr2= 390, 391,2498,2499,1320,
 &end
#
#    0 AMB  20-2:3945   173 LYS  QG          2.70    (#   3945:20   Single Ambig)
 &rst
  ixpk= 3945, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.09, r4= 4.84,
 igr1=2771,2772,2746,2747, 393, 394,
 igr2=2768,2769,
 &end
#
#    0 AMB  20-2:3946     0 AMB  20-1:3946   2.70    (#   3946:20   Double Ambig)
 &rst
  ixpk= 3946, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=2609,2610,2308,2309,2302,2303,1240,1241,2925,2926,
      1246,1247,2603,2604,2603,2604,
 igr2=2606,2607,2305,2306,1243,1244,2928,2929,
 &end
#
#    0 AMB  20-2:3947   182 LYS  HG-         3.50    (#   3947:20   Single Ambig)
 &rst
  ixpk= 3947, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2906,2907,2953,2954,
 igr2=2928,2929,
 &end
#
#    0 AMB  20-2:3948     0 AMB  20-1:3948   2.70    (#   3948:20   Double Ambig)
 &rst
  ixpk= 3948, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.69, r4= 6.44,
 igr1=2804,2805,2806,2808,2809,2810,2186,2906,2907,2166,
      2167,
 igr2=2606,2607,2215,2216,2928,2929,2928,2929,
 &end
#
#    0 AMB  20-2:3954    64 VAL  MG2         3.50    (#   3954:20   Single Ambig)
 &rst
  ixpk= 3954, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1=1015, 704, 705, 701, 702, 701, 702,
 igr2=1021,1022,1023,
 &end
#
#   64 VAL  HA           64 VAL  MG2         3.50    (#   3955:20   Preassigned)
 &rst
  ixpk= 3955, iat=1013,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1021,1022,1023,
 &end
#
#    0 AMB  20-2:3956     0 AMB  20-1:3956   6.00    (#   3956:20   Double Ambig)
 &rst
  ixpk= 3956, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.19, r4=10.94,
 igr1=1500,1484,
 igr2=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,
 &end
#
#    0 AMB  20-2:3957     0 AMB  20-1:3957   3.50    (#   3957:20   Double Ambig)
 &rst
  ixpk= 3957, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 828, 172,
 igr2=1339, 177,
 &end
#
#    0 AMB  20-2:3958     0 AMB  20-1:3958   4.50    (#   3958:20   Double Ambig)
 &rst
  ixpk= 3958, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.18, r4= 8.93,
 igr1= 828, 839, 172,
 igr2=1322,1323,1324,1326,1327,1328,1786,1787,1788,1790,
      1791,1792,
 &end
#
#   72 LEU  HN           72 LEU  MDX         4.50    (#   3959:20   Unique)
 &rst
  ixpk= 3959, iat=1143,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   67 LYS  HN           72 LEU  MDX         6.00    (#   3960:20   Unique)
 &rst
  ixpk= 3960, iat=1073,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   63 TYR  HN           72 LEU  MDX         6.00    (#   3961:20   Unique)
 &rst
  ixpk= 3961, iat= 990,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   71 ALA  HN           72 LEU  MDX         6.00    (#   3962:20   Unique)
 &rst
  ixpk= 3962, iat=1133,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   68 ASP  HN           72 LEU  MDX         3.50    (#   3963:20   Unique)
 &rst
  ixpk= 3963, iat=1095,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:3964    72 LEU  MDX         3.50    (#   3964:20   Single Ambig)
 &rst
  ixpk= 3964, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 998,1007, 925, 929,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   52 THR  HG1          82 LEU  MDX         4.50    (#   3968:20   Unique)
 &rst
  ixpk= 3968, iat= 828,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1341,1342,1343,1345,1346,1347,
 &end
#
#   80 LEU  HN           80 LEU  MDY         4.50    (#   3970:20   Unique)
 &rst
  ixpk= 3970, iat=1294,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#   78 HIS  HE1          80 LEU  MDY         4.50    (#   3972:20   Unique)
 &rst
  ixpk= 3972, iat=1268,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#   78 HIS  HE1          80 LEU  MDY         6.00    (#   3973:20   Unique)
 &rst
  ixpk= 3973, iat=1268,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#   20 GLN  HE2+         80 LEU  MDY         4.50    (#   3974:20   Unique)
 &rst
  ixpk= 3974, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 300, 301,
 igr2=1303,1304,1305,1307,1308,1309,
 &end
#
#    0 AMB  20-2:3975     0 AMB  20-1:3975   3.50    (#   3975:20   Double Ambig)
 &rst
  ixpk= 3975, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1= 957, 961, 269,
 igr2= 144, 145, 146,1303,1304,1305,1307,1308,1309,
 &end
#
#  138 ILE  MG2         166 LEU  MDX         6.00    (#   3977:20   Unique)
 &rst
  ixpk= 3977, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.71, r4=10.46,
 igr1=2188,2189,2190,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  20-2:3979    12 LEU  MDX         4.50    (#   3979:20   Single Ambig)
 &rst
  ixpk= 3979, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 797, 801, 799,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#  113 ILE  HA           12 LEU  MDX         4.50    (#   3980:20   Unique)
 &rst
  ixpk= 3980, iat=1817,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#   12 LEU  HA           12 LEU  MDX         4.50    (#   3981:20   Unique)
 &rst
  ixpk= 3981, iat= 172,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#   12 LEU  HN           12 LEU  MDX         6.00    (#   3983:20   Unique)
 &rst
  ixpk= 3983, iat= 170,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:3984    12 LEU  MDX         6.00    (#   3984:20   Single Ambig)
 &rst
  ixpk= 3984, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1= 189, 754,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#   92 VAL  HN           12 LEU  MDX         6.00    (#   3985:20   Unique)
 &rst
  ixpk= 3985, iat=1484,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:3986    12 LEU  MDX         4.50    (#   3986:20   Single Ambig)
 &rst
  ixpk= 3986, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1430,1420,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#   46 ALA  HN           10 VAL  MG2         4.50    (#   3987:20   Unique)
 &rst
  ixpk= 3987, iat= 734,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  20-2:3988     0 AMB  20-1:3988   4.50    (#   3988:20   Double Ambig)
 &rst
  ixpk= 3988, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 150,1258,
 igr2= 144, 145, 146,1303,1304,1305,1307,1308,1309,
 &end
#
#    0 AMB  20-2:3989    55 LYS  HG-         4.50    (#   3989:20   Single Ambig)
 &rst
  ixpk= 3989, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 886, 900,1236,
 igr2= 871, 872,
 &end
#
#    0 AMB  20-2:3990    12 LEU  MDY         3.50    (#   3990:20   Single Ambig)
 &rst
  ixpk= 3990, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 189, 754,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:3991    55 LYS  HG+         4.50    (#   3991:20   Single Ambig)
 &rst
  ixpk= 3991, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 886,1236,
 igr2= 871, 872,
 &end
#
#  158 PRO  HA          158 PRO  HG+         4.50    (#   3993:20   Unique)
 &rst
  ixpk= 3993, iat=2523,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2517,2518,
 &end
#
#  161 GLU  HN          158 PRO  HG+         4.50    (#   3994:20   Unique)
 &rst
  ixpk= 3994, iat=2548,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2517,2518,
 &end
#
#  161 GLU  HN            0 AMB  20-1:3995   4.50    (#   3995:20   Single Ambig)
 &rst
  ixpk= 3995, iat=2548,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr2=2517,2518,2517,2518,
 &end
#
#  154 PHE  HB+         151 LEU  MDX         6.00    (#   3996:20   Unique)
 &rst
  ixpk= 3996, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1=2454,2455,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#    0 AMB  20-2:3997   151 LEU  MDX         4.50    (#   3997:20   Single Ambig)
 &rst
  ixpk= 3997, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2257,2261,2259,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#  138 ILE  HN          151 LEU  MDX         6.00    (#   3998:20   Unique)
 &rst
  ixpk= 3998, iat=2182,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#  151 LEU  HN          151 LEU  MDX         4.50    (#   3999:20   Unique)
 &rst
  ixpk= 3999, iat=2392,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#    0 AMB  20-2:4000     0 AMB  20-1:4000   4.50    (#   4000:20   Double Ambig)
 &rst
  ixpk= 4000, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=1062,1027,1449,
 igr2=1034,1035, 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:4001    12 LEU  MDY         4.50    (#   4001:20   Single Ambig)
 &rst
  ixpk= 4001, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1430,1420,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#   92 VAL  HN           12 LEU  MDY         4.50    (#   4002:20   Unique)
 &rst
  ixpk= 4002, iat=1484,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#  180 GLN  HN            0 AMB  20-1:4004   4.50    (#   4004:20   Single Ambig)
 &rst
  ixpk= 4004, iat=2882,  -1, r1= 0.00, r2= 1.80, r3= 6.99, r4= 7.74,
 igr2=2906,2907,2872,2873,2874,2876,2877,2878,2872,2873,
      2874,2876,2877,2878,
 &end
#
#    0 AMB  20-2:4005    47 ALA  MB          3.50    (#   4005:20   Single Ambig)
 &rst
  ixpk= 4005, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 150, 770,
 igr2= 748, 749, 750,
 &end
#
#   77 LYS  HN           77 LYS  HG-         6.00    (#   4006:20   Unique)
 &rst
  ixpk= 4006, iat=1236,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1243,1244,
 &end
#
#   77 LYS  HN           77 LYS  HG+         6.00    (#   4007:20   Unique)
 &rst
  ixpk= 4007, iat=1236,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1243,1244,
 &end
#
#    0 AMB  20-2:4008     0 AMB  20-1:4008   3.50    (#   4008:20   Double Ambig)
 &rst
  ixpk= 4008, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2042,2621,
 igr2=2027,2028,2606,2607,
 &end
#
#    0 AMB  20-2:4009     0 AMB  20-1:4009   6.00    (#   4009:20   Double Ambig)
 &rst
  ixpk= 4009, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.49, r4= 9.24,
 igr1=2320,2137,
 igr2=2305,2306,2606,2607,
 &end
#
#  182 LYS  HN          182 LYS  HG-         3.50    (#   4010:20   Unique)
 &rst
  ixpk= 4010, iat=2921,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2928,2929,
 &end
#
#    0 AMB  20-2:4011   175 LEU  MDY         3.50    (#   4011:20   Single Ambig)
 &rst
  ixpk= 4011, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2848,2795,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:4012    65 LYS  HG+         3.50    (#   4012:20   Single Ambig)
 &rst
  ixpk= 4012, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1062,1027,
 igr2=1034,1035,
 &end
#
#  179 LEU  HN          175 LEU  MDY         4.50    (#   4013:20   Unique)
 &rst
  ixpk= 4013, iat=2863,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#   66 TRP  HN           65 LYS  HG+         4.50    (#   4014:20   Unique)
 &rst
  ixpk= 4014, iat=1049,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1034,1035,
 &end
#
#   12 LEU  HA           12 LEU  MDY         3.50    (#   4015:20   Unique)
 &rst
  ixpk= 4015, iat= 172,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#   50 PHE  HA           12 LEU  MDY         4.50    (#   4016:20   Unique)
 &rst
  ixpk= 4016, iat= 789,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:4017   151 LEU  MDX         6.00    (#   4017:20   Single Ambig)
 &rst
  ixpk= 4017, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.90, r4=11.65,
 igr1=2460,2464,2458,2466,2255,2263,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#   12 LEU  HN           12 LEU  MDY         6.00    (#   4019:20   Unique)
 &rst
  ixpk= 4019, iat= 170,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#  135 ILE  HA          151 LEU  MDX         6.00    (#   4022:20   Unique)
 &rst
  ixpk= 4022, iat=2139,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#  172 LEU  HA          175 LEU  MDY         4.50    (#   4023:20   Unique)
 &rst
  ixpk= 4023, iat=2744,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:4027     0 AMB  20-1:4027   6.00    (#   4027:20   Double Ambig)
 &rst
  ixpk= 4027, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.71, r4=10.46,
 igr1= 756, 902, 917,
 igr2= 748, 749, 750,1494,1495,1496,
 &end
#
#    0 AMB  20-2:4028   166 LEU  MDY         3.50    (#   4028:20   Single Ambig)
 &rst
  ixpk= 4028, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2158,2184,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#  166 LEU  HA          166 LEU  MDY         3.50    (#   4029:20   Preassigned)
 &rst
  ixpk= 4029, iat=2642,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#  113 ILE  HA           12 LEU  MDY         6.00    (#   4030:20   Unique)
 &rst
  ixpk= 4030, iat=1817,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#   11 PHE  HD           47 ALA  MB          3.50    (#   4031:20   Unique)
 &rst
  ixpk= 4031, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 158, 166,
 igr2= 748, 749, 750,
 &end
#
#    0 AMB  20-2:4032    47 ALA  MB          3.50    (#   4032:20   Single Ambig)
 &rst
  ixpk= 4032, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 925, 929, 197, 205,
 igr2= 748, 749, 750,
 &end
#
#    0 AMB  20-2:4039   157 LYS  QD          2.70    (#   4039:20   Single Ambig)
 &rst
  ixpk= 4039, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.82, r4= 4.57,
 igr1=2498,2499,2498,2499,
 igr2=2501,2502,
 &end
#
#  178 GLU  HG+         175 LEU  MDY         3.50    (#   4041:20   Unique)
 &rst
  ixpk= 4041, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2855,2856,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:4042    12 LEU  MDY         3.50    (#   4042:20   Single Ambig)
 &rst
  ixpk= 4042, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 791,1381,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#  134 TYR  HD          179 LEU  MDX         3.50    (#   4044:20   Unique)
 &rst
  ixpk= 4044, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2124,2133,
 igr2=2872,2873,2874,2876,2877,2878,
 &end
#
#  179 LEU  HN          179 LEU  MDX         3.50    (#   4045:20   Unique)
 &rst
  ixpk= 4045, iat=2863,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2872,2873,2874,2876,2877,2878,
 &end
#
#  180 GLN  HN          179 LEU  MDX         4.50    (#   4046:20   Unique)
 &rst
  ixpk= 4046, iat=2882,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=2872,2873,2874,2876,2877,2878,
 &end
#
#   75 HIS  HN           74 LYS  HG+         6.00    (#   4047:20   Unique)
 &rst
  ixpk= 4047, iat=1203,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1188,1189,
 &end
#
#    0 AMB  20-2:4050   166 LEU  MDY         4.50    (#   4050:20   Single Ambig)
 &rst
  ixpk= 4050, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2659,2640,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  20-2:4051   166 LEU  MDY         4.50    (#   4051:20   Single Ambig)
 &rst
  ixpk= 4051, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2742,2783,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#   28 LEU  HA           28 LEU  MDY         3.50    (#   4053:20   Unique)
 &rst
  ixpk= 4053, iat= 426,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:4054     0 AMB  20-1:4054   4.50    (#   4054:20   Double Ambig)
 &rst
  ixpk= 4054, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2230,2137,
 igr2=2215,2216,2606,2607,
 &end
#
#  182 LYS  HA          182 LYS  HG+         4.50    (#   4055:20   Unique)
 &rst
  ixpk= 4055, iat=2923,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2928,2929,
 &end
#
#  130 ASP  HB-         129 LYS  QG          3.50    (#   4056:20   Unique)
 &rst
  ixpk= 4056, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2046,2047,
 igr2=2027,2028,
 &end
#
#   95 GLU  HN           96 VAL  MG2         4.50    (#   4057:20   Unique)
 &rst
  ixpk= 4057, iat=1524,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1549,1550,1551,
 &end
#
#    0 AMB  20-2:4058    96 VAL  MG2         4.50    (#   4058:20   Single Ambig)
 &rst
  ixpk= 4058, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1484,1500,
 igr2=1549,1550,1551,
 &end
#
#    0 AMB  20-2:4059    96 VAL  MG2         4.50    (#   4059:20   Single Ambig)
 &rst
  ixpk= 4059, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1473,1478,1471,1480,
 igr2=1549,1550,1551,
 &end
#
#   91 TYR  HD           96 VAL  MG2         6.00    (#   4060:20   Unique)
 &rst
  ixpk= 4060, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1471,1480,
 igr2=1549,1550,1551,
 &end
#
#    0 AMB  20-2:4061    92 VAL  MG1         3.50    (#   4061:20   Single Ambig)
 &rst
  ixpk= 4061, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1565,1569,1563,1571,
 igr2=1490,1491,1492,
 &end
#
#    0 AMB  20-2:4062     0 AMB  20-1:4062   4.50    (#   4062:20   Double Ambig)
 &rst
  ixpk= 4062, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1=1567,1133,
 igr2=1490,1491,1492,1188,1189,
 &end
#
#    0 AMB  20-2:4063     9 LEU  MDY         3.50    (#   4063:20   Single Ambig)
 &rst
  ixpk= 4063, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 134,1796,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#   45 PHE  HD            9 LEU  MDY         3.50    (#   4064:20   Unique)
 &rst
  ixpk= 4064, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 722, 730,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    9 LEU  HA            9 LEU  MDY         3.50    (#   4065:20   Preassigned)
 &rst
  ixpk= 4065, iat= 117,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#   35 MET  HG+           9 LEU  MDY         4.50    (#   4066:20   Unique)
 &rst
  ixpk= 4066, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 551, 552,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:4067     9 LEU  MDY         3.50    (#   4067:20   Single Ambig)
 &rst
  ixpk= 4067, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1800, 681,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:4068    47 ALA  MB          4.50    (#   4068:20   Single Ambig)
 &rst
  ixpk= 4068, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1164, 136,
 igr2= 748, 749, 750,
 &end
#
#    0 AMB  20-2:4069    34 VAL  MG2         4.50    (#   4069:20   Single Ambig)
 &rst
  ixpk= 4069, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 516, 585,
 igr2= 538, 539, 540,
 &end
#
#  120 THR  HB          120 THR  MG2         2.70    (#   4072:20   Preassigned)
 &rst
  ixpk= 4072, iat=1915,  -1, r1= 0.00, r2= 1.80, r3= 3.24, r4= 3.99,
 igr2=1917,1918,1919,
 &end
#
#   83 THR  HA           83 THR  MG2         3.50    (#   4073:20   Unique)
 &rst
  ixpk= 4073, iat=1353,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1357,1358,1359,
 &end
#
#    0 AMB  20-2:4074   120 THR  MG2         4.50    (#   4074:20   Single Ambig)
 &rst
  ixpk= 4074, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1903,1367,
 igr2=1917,1918,1919,
 &end
#
#    0 AMB  20-2:4075    81 LEU  MDY         4.50    (#   4075:20   Single Ambig)
 &rst
  ixpk= 4075, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 828, 839,
 igr2=1322,1323,1324,1326,1327,1328,
 &end
#
#   73 LEU  HA           73 LEU  MDY         2.70    (#   4076:20   Unique)
 &rst
  ixpk= 4076, iat=1164,  -1, r1= 0.00, r2= 1.80, r3= 3.64, r4= 4.39,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#   46 ALA  HN            9 LEU  MDY         6.00    (#   4077:20   Unique)
 &rst
  ixpk= 4077, iat= 734,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:4078     9 LEU  MDY         4.50    (#   4078:20   Single Ambig)
 &rst
  ixpk= 4078, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 150, 115,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#   29 ASP  HN           28 LEU  MDY         4.50    (#   4079:20   Unique)
 &rst
  ixpk= 4079, iat= 443,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:4080     0 AMB  20-1:4080   3.50    (#   4080:20   Double Ambig)
 &rst
  ixpk= 4080, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1236, 886,
 igr2=1230,1231,1232, 892, 893, 894,
 &end
#
#   83 THR  HN          120 THR  MG2         3.50    (#   4081:20   Unique)
 &rst
  ixpk= 4081, iat=1351,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1917,1918,1919,
 &end
#
#   65 LYS  HN           64 VAL  MG2         4.50    (#   4082:20   Unique)
 &rst
  ixpk= 4082, iat=1027,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1021,1022,1023,
 &end
#
#   63 TYR  HD           64 VAL  MG2         3.50    (#   4083:20   Unique)
 &rst
  ixpk= 4083, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 998,1007,
 igr2=1021,1022,1023,
 &end
#
#   44 GLN  HE2+         64 VAL  MG2         6.00    (#   4084:20   Unique)
 &rst
  ixpk= 4084, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 709, 710,
 igr2=1021,1022,1023,
 &end
#
#    0 AMB  20-2:4085    34 VAL  MG2         3.50    (#   4085:20   Single Ambig)
 &rst
  ixpk= 4085, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1= 467, 465, 469, 463, 471,
 igr2= 538, 539, 540,
 &end
#
#    0 AMB  20-2:4086    34 VAL  MG2         3.50    (#   4086:20   Single Ambig)
 &rst
  ixpk= 4086, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2822,2830, 467, 465, 469,
 igr2= 538, 539, 540,
 &end
#
#    0 AMB  20-2:4087    34 VAL  MG2         3.50    (#   4087:20   Single Ambig)
 &rst
  ixpk= 4087, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1=2822,2830,2824,2828, 160, 164, 162,
 igr2= 538, 539, 540,
 &end
#
#   25 GLN  HE2+         28 LEU  MDY         6.00    (#   4088:20   Unique)
 &rst
  ixpk= 4088, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1= 378, 379,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#   27 ILE  HN           28 LEU  MDY         6.00    (#   4089:20   Unique)
 &rst
  ixpk= 4089, iat= 405,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#   28 LEU  HN           28 LEU  MDY         3.50    (#   4090:20   Unique)
 &rst
  ixpk= 4090, iat= 424,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#   10 VAL  HA            9 LEU  MDY         4.50    (#   4092:20   Unique)
 &rst
  ixpk= 4092, iat= 136,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#   73 LEU  HA           28 LEU  MDY         4.50    (#   4093:20   Unique)
 &rst
  ixpk= 4093, iat=1164,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#   96 VAL  HA          101 LEU  MDY         3.50    (#   4094:20   Unique)
 &rst
  ixpk= 4094, iat=1541,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:4095    64 VAL  MG2         3.50    (#   4095:20   Single Ambig)
 &rst
  ixpk= 4095, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 969,1650,1651,
 igr2=1021,1022,1023,
 &end
#
#   73 LEU  HA           76 VAL  MG2         3.50    (#   4096:20   Unique)
 &rst
  ixpk= 4096, iat=1164,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1230,1231,1232,
 &end
#
#    0 AMB  20-2:4097    92 VAL  MG1         3.50    (#   4097:20   Single Ambig)
 &rst
  ixpk= 4097, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1500,1484,
 igr2=1490,1491,1492,
 &end
#
#    0 AMB  20-2:4098     0 AMB  20-1:4098   2.70    (#   4098:20   Double Ambig)
 &rst
  ixpk= 4098, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.84, r4= 7.59,
 igr1=  48,  49,2609,2610,  54,  55,2308,2309,2302,2303,
      1240,1241,2925,2926,1246,1247,2603,2604,2603,2604,
      2030,2031,
 igr2=  51,  52,2606,2607,2305,2306,1243,1244,2928,2929,
      2027,2028,
 &end
#
#    0 AMB  20-2:4099    47 ALA  MB          3.50    (#   4099:20   Single Ambig)
 &rst
  ixpk= 4099, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 904, 488, 489, 490,
 igr2= 748, 749, 750,
 &end
#
#   74 LYS  HB+          74 LYS  HG-         3.50    (#   4100:20   Unique)
 &rst
  ixpk= 4100, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1185,1186,
 igr2=1188,1189,
 &end
#
#    0 AMB  20-2:4102    47 ALA  MB          4.50    (#   4102:20   Single Ambig)
 &rst
  ixpk= 4102, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 736, 772,
 igr2= 748, 749, 750,
 &end
#
#  172 LEU  HA          166 LEU  MDY         3.50    (#   4104:20   Unique)
 &rst
  ixpk= 4104, iat=2744,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  20-2:4106    34 VAL  MG2         4.50    (#   4106:20   Single Ambig)
 &rst
  ixpk= 4106, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 544, 475,
 igr2= 538, 539, 540,
 &end
#
#  112 ILE  HA            9 LEU  MDY         4.50    (#   4109:20   Unique)
 &rst
  ixpk= 4109, iat=1798,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:4110    92 VAL  MG1         2.70    (#   4110:20   Single Ambig)
 &rst
  ixpk= 4110, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.09, r4= 5.84,
 igr1= 140, 141, 142,2060,2061,2062,1549,1550,1551, 179,
       180, 181, 183, 184, 185,
 igr2=1490,1491,1492,
 &end
#
#   31 MET  HA           34 VAL  MG2         3.50    (#   4111:20   Unique)
 &rst
  ixpk= 4111, iat= 477,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 538, 539, 540,
 &end
#
#   33 ASP  QB           34 VAL  MG2         4.50    (#   4112:20   Unique)
 &rst
  ixpk= 4112, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 520, 521,
 igr2= 538, 539, 540,
 &end
#
#    0 AMB  20-2:4113    34 VAL  MG2         6.00    (#   4113:20   Single Ambig)
 &rst
  ixpk= 4113, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1= 482, 483, 551, 552,
 igr2= 538, 539, 540,
 &end
#
#   34 VAL  HB           34 VAL  MG2         3.50    (#   4115:20   Preassigned)
 &rst
  ixpk= 4115, iat= 532,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 538, 539, 540,
 &end
#
#   37 LYS  QD           34 VAL  MG2         4.50    (#   4116:20   Unique)
 &rst
  ixpk= 4116, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 595, 596,
 igr2= 538, 539, 540,
 &end
#
#    7 VAL  MG1           9 LEU  MDY         3.50    (#   4120:20   Unique)
 &rst
  ixpk= 4120, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=  93,  94,  95,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#   73 LEU  MDX          28 LEU  MDY         3.50    (#   4121:20   Unique)
 &rst
  ixpk= 4121, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1171,1172,1173,1175,1176,1177,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:4123    28 LEU  MDY         3.50    (#   4123:20   Single Ambig)
 &rst
  ixpk= 4123, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1171,1172,1173,1175,1176,1177, 428, 429,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:4124     0 AMB  20-1:4124   3.50    (#   4124:20   Double Ambig)
 &rst
  ixpk= 4124, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=1171,1172,1173,1175,1176,1177,1809,1810,1811, 534,
       535, 536, 411, 412, 413,
 igr2= 433, 434, 435, 437, 438, 439, 124, 125, 126, 128,
       129, 130,
 &end
#
#   76 VAL  MG1          28 LEU  MDY         3.50    (#   4125:20   Unique)
 &rst
  ixpk= 4125, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1226,1227,1228,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:4126    28 LEU  MDY         3.50    (#   4126:20   Single Ambig)
 &rst
  ixpk= 4126, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 431,1230,1231,1232,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#   28 LEU  HB+          28 LEU  MDY         3.50    (#   4128:20   Unique)
 &rst
  ixpk= 4128, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 428, 429,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#   25 GLN  HA           28 LEU  MDY         3.50    (#   4129:20   Unique)
 &rst
  ixpk= 4129, iat= 368,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:4130    28 LEU  MDY         3.50    (#   4130:20   Single Ambig)
 &rst
  ixpk= 4130, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1169,1167,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#   34 VAL  HA           34 VAL  MG2         3.50    (#   4133:20   Unique)
 &rst
  ixpk= 4133, iat= 530,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 538, 539, 540,
 &end
#
#  176 PHE  HB+          34 VAL  MG2         4.50    (#   4135:20   Unique)
 &rst
  ixpk= 4135, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2818,2819,
 igr2= 538, 539, 540,
 &end
#
#    0 AMB  20-2:4137     9 LEU  MDY         3.50    (#   4137:20   Single Ambig)
 &rst
  ixpk= 4137, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 719, 154, 155,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#   44 GLN  HG+          64 VAL  MG2         3.50    (#   4138:20   Unique)
 &rst
  ixpk= 4138, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 704, 705,
 igr2=1021,1022,1023,
 &end
#
#    0 AMB  20-2:4139    76 VAL  MG1         3.50    (#   4139:20   Single Ambig)
 &rst
  ixpk= 4139, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1224,1262,
 igr2=1226,1227,1228,
 &end
#
#    0 AMB  20-2:4140     0 AMB  20-1:4140   3.50    (#   4140:20   Double Ambig)
 &rst
  ixpk= 4140, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=2438,2439, 774, 775,
 igr2=2435,2436,1226,1227,1228,
 &end
#
#    0 AMB  20-2:4141    64 VAL  MG2         3.50    (#   4141:20   Single Ambig)
 &rst
  ixpk= 4141, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 994, 995, 971, 972,
 igr2=1021,1022,1023,
 &end
#
#   76 VAL  HB           76 VAL  MG2         3.50    (#   4142:20   Unique)
 &rst
  ixpk= 4142, iat=1224,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1230,1231,1232,
 &end
#
#    0 AMB  20-2:4143    76 VAL  MG1         3.50    (#   4143:20   Single Ambig)
 &rst
  ixpk= 4143, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 356, 360, 358,
 igr2=1226,1227,1228,
 &end
#
#   58 PHE  HE           73 LEU  MDY         3.50    (#   4144:20   Unique)
 &rst
  ixpk= 4144, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 925, 929,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#    0 AMB  20-2:4145    73 LEU  MDY         3.50    (#   4145:20   Single Ambig)
 &rst
  ixpk= 4145, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 925, 929, 923, 931, 201, 927,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#    0 AMB  20-2:4146    92 VAL  MG1         3.50    (#   4146:20   Single Ambig)
 &rst
  ixpk= 4146, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1565,1569,1555,
 igr2=1490,1491,1492,
 &end
#
#   57 GLU  HG-          76 VAL  MG2         3.50    (#   4147:20   Unique)
 &rst
  ixpk= 4147, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 907, 908,
 igr2=1230,1231,1232,
 &end
#
#   74 LYS  QE           74 LYS  HG+         3.50    (#   4148:20   Preassigned)
 &rst
  ixpk= 4148, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1194,1195,
 igr2=1188,1189,
 &end
#
#   89 ILE  HA           92 VAL  MG1         6.00    (#   4149:20   Unique)
 &rst
  ixpk= 4149, iat=1432,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1490,1491,1492,
 &end
#
#  132 ILE  HB          110 VAL  MG2         3.50    (#   4150:20   Unique)
 &rst
  ixpk= 4150, iat=2077,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1771,1772,1773,
 &end
#
#    0 AMB  20-2:4151    73 LEU  MDY         3.50    (#   4151:20   Single Ambig)
 &rst
  ixpk= 4151, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1114, 905,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#   45 PHE  HA            9 LEU  MDY         6.00    (#   4153:20   Unique)
 &rst
  ixpk= 4153, iat= 716,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:4154    28 LEU  MDY         3.50    (#   4154:20   Single Ambig)
 &rst
  ixpk= 4154, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.53, r4= 7.28,
 igr1= 199, 203, 201, 197, 205, 354, 362,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:4155     9 LEU  MDY         3.50    (#   4155:20   Single Ambig)
 &rst
  ixpk= 4155, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 158, 166, 726,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:4156     9 LEU  MDY         3.50    (#   4156:20   Single Ambig)
 &rst
  ixpk= 4156, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 122,1806,1807,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:4157     9 LEU  MDY         3.50    (#   4157:20   Single Ambig)
 &rst
  ixpk= 4157, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 119,1802,1803,1804,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:4159   153 LYS  HG-         3.50    (#   4159:20   Single Ambig)
 &rst
  ixpk= 4159, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2438,2439,2432,2433,
 igr2=2435,2436,
 &end
#
#  153 LYS  HE-         153 LYS  HG-         6.00    (#   4160:20   Unique)
 &rst
  ixpk= 4160, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=2441,2442,
 igr2=2435,2436,
 &end
#
#  153 LYS  HE+         153 LYS  HG-         6.00    (#   4161:20   Unique)
 &rst
  ixpk= 4161, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=2441,2442,
 igr2=2435,2436,
 &end
#
#    0 AMB  20-2:4162     7 VAL  MG1         4.50    (#   4162:20   Single Ambig)
 &rst
  ixpk= 4162, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=  87, 709, 710,
 igr2=  93,  94,  95,
 &end
#
#  111 LEU  HN          110 VAL  MG2         4.50    (#   4163:20   Unique)
 &rst
  ixpk= 4163, iat=1777,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1771,1772,1773,
 &end
#
#    0 AMB  20-2:4164     0 AMB  20-1:4164   3.50    (#   4164:20   Double Ambig)
 &rst
  ixpk= 4164, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=1739,2073,1294,
 igr2=1771,1772,1773,1322,1323,1324,1326,1327,1328,
 &end
#
#   77 LYS  HN           76 VAL  MG1         3.50    (#   4165:20   Unique)
 &rst
  ixpk= 4165, iat=1236,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1226,1227,1228,
 &end
#
#    0 AMB  20-2:4166   155 ALA  MB          4.50    (#   4166:20   Single Ambig)
 &rst
  ixpk= 4166, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2583,2428,2548,
 igr2=2474,2475,2476,
 &end
#
#  152 HIS  HN          155 ALA  MB          6.00    (#   4167:20   Unique)
 &rst
  ixpk= 4167, iat=2411,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2474,2475,2476,
 &end
#
#    0 AMB  20-2:4168   155 ALA  MB          4.50    (#   4168:20   Single Ambig)
 &rst
  ixpk= 4168, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2137,2599,
 igr2=2474,2475,2476,
 &end
#
#  134 TYR  HA          155 ALA  MB          4.50    (#   4169:20   Unique)
 &rst
  ixpk= 4169, iat=2118,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2474,2475,2476,
 &end
#
#    0 AMB  20-2:4170   155 ALA  MB          6.00    (#   4170:20   Single Ambig)
 &rst
  ixpk= 4170, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2139,2094,
 igr2=2474,2475,2476,
 &end
#
#  162 PHE  HB-         155 ALA  MB          3.50    (#   4171:20   Unique)
 &rst
  ixpk= 4171, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2567,2568,
 igr2=2474,2475,2476,
 &end
#
#    0 AMB  20-2:4172   155 ALA  MB          3.50    (#   4172:20   Single Ambig)
 &rst
  ixpk= 4172, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2531,2532,2533,2150,2151,2152,
 igr2=2474,2475,2476,
 &end
#
#    0 AMB  20-2:4173   155 ALA  MB          3.50    (#   4173:20   Single Ambig)
 &rst
  ixpk= 4173, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2141,2097,
 igr2=2474,2475,2476,
 &end
#
#    0 AMB  20-2:4174   155 ALA  MB          4.50    (#   4174:20   Single Ambig)
 &rst
  ixpk= 4174, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2504,2505,2454,2455,
 igr2=2474,2475,2476,
 &end
#
#    0 AMB  20-2:4175   155 ALA  MB          4.50    (#   4175:20   Single Ambig)
 &rst
  ixpk= 4175, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1=2504,2505,2484,2485,2416,
 igr2=2474,2475,2476,
 &end
#
#    0 AMB  20-2:4176   155 ALA  MB          4.50    (#   4176:20   Single Ambig)
 &rst
  ixpk= 4176, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2493,2565,2452,
 igr2=2474,2475,2476,
 &end
#
#    0 AMB  20-2:4177     0 AMB  20-1:4177   2.70    (#   4177:20   Double Ambig)
 &rst
  ixpk= 4177, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.51, r4= 6.26,
 igr1=1317,1169,1167,1320, 498, 499,
 igr2=1322,1323,1324,1326,1327,1328,1171,1172,1173,1175,
      1176,1177,
 &end
#
#    0 AMB  20-2:4178     0 AMB  20-1:4178   2.70    (#   4178:20   Double Ambig)
 &rst
  ixpk= 4178, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.89, r4= 6.64,
 igr1= 488, 489, 490,1166,1765,2083,2084, 557, 558, 559,
       479, 480,
 igr2=1171,1172,1173,1175,1176,1177,1771,1772,1773,
 &end
#
#    0 AMB  20-2:4179    76 VAL  MG2         3.50    (#   4179:20   Single Ambig)
 &rst
  ixpk= 4179, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1= 774, 775, 904, 488, 489, 490,1166,
 igr2=1230,1231,1232,
 &end
#
#  101 LEU  HG          101 LEU  MDY         2.70    (#   4180:20   Unique)
 &rst
  ixpk= 4180, iat=1636,  -1, r1= 0.00, r2= 1.80, r3= 3.64, r4= 4.39,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:4181    76 VAL  MG2         4.50    (#   4181:20   Single Ambig)
 &rst
  ixpk= 4181, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1= 905, 777, 778,
 igr2=1230,1231,1232,
 &end
#
#   64 VAL  HB           64 VAL  MG1         3.50    (#   4182:20   Unique)
 &rst
  ixpk= 4182, iat=1015,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1017,1018,1019,
 &end
#
#   12 LEU  HA           48 VAL  MGX         4.50    (#   4183:20   Unique)
 &rst
  ixpk= 4183, iat= 172,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#    0 AMB  20-2:4184    48 VAL  MGX         4.50    (#   4184:20   Single Ambig)
 &rst
  ixpk= 4184, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 789, 746,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#  108 THR  HG1         108 THR  MG2         3.50    (#   4185:20   Unique)
 &rst
  ixpk= 4185, iat=1735,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1731,1732,1733,
 &end
#
#   85 THR  HG1          83 THR  MG2         3.50    (#   4186:20   Unique)
 &rst
  ixpk= 4186, iat=1389,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1357,1358,1359,
 &end
#
#    0 AMB  20-2:4187   110 VAL  MG2         4.50    (#   4187:20   Single Ambig)
 &rst
  ixpk= 4187, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 117,1779,
 igr2=1771,1772,1773,
 &end
#
#  162 PHE  HN          155 ALA  MB          4.50    (#   4188:20   Unique)
 &rst
  ixpk= 4188, iat=2563,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2474,2475,2476,
 &end
#
#  109 LYS  HN          108 THR  MG2         3.50    (#   4190:20   Unique)
 &rst
  ixpk= 4190, iat=1739,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1731,1732,1733,
 &end
#
#    0 AMB  20-2:4191    48 VAL  MGX         3.50    (#   4191:20   Single Ambig)
 &rst
  ixpk= 4191, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 864, 770,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#  102 GLY  HN          101 LEU  MDY         4.50    (#   4192:20   Unique)
 &rst
  ixpk= 4192, iat=1648,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#   98 ARG  HN          101 LEU  MDY         4.50    (#   4193:20   Unique)
 &rst
  ixpk= 4193, iat=1575,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#    8 ASP  HN          110 VAL  MG2         4.50    (#   4194:20   Unique)
 &rst
  ixpk= 4194, iat= 103,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1771,1772,1773,
 &end
#
#    0 AMB  20-2:4196    72 LEU  MDY         3.50    (#   4196:20   Single Ambig)
 &rst
  ixpk= 4196, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1145,1117, 994, 995,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   28 LEU  MDY          76 VAL  MG1         3.50    (#   4197:20   Unique)
 &rst
  ixpk= 4197, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 433, 434, 435, 437, 438, 439,
 igr2=1226,1227,1228,
 &end
#
#    0 AMB  20-2:4199    76 VAL  MG2         3.50    (#   4199:20   Single Ambig)
 &rst
  ixpk= 4199, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 201,1220,
 igr2=1230,1231,1232,
 &end
#
#    0 AMB  20-2:4200    73 LEU  MDY         3.50    (#   4200:20   Single Ambig)
 &rst
  ixpk= 4200, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1162, 927, 199, 203,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#    0 AMB  20-2:4201    56 THR  MG2         3.50    (#   4201:20   Single Ambig)
 &rst
  ixpk= 4201, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 915, 744,
 igr2= 892, 893, 894,
 &end
#
#    0 AMB  20-2:4202   101 LEU  MDY         3.50    (#   4202:20   Single Ambig)
 &rst
  ixpk= 4202, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1588,1629,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:4203   101 LEU  MDY         3.50    (#   4203:20   Single Ambig)
 &rst
  ixpk= 4203, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1588,1629,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:4204    38 LEU  MDY         3.50    (#   4204:20   Single Ambig)
 &rst
  ixpk= 4204, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2894,2895, 726, 724, 728,
 igr2= 616, 617, 618, 620, 621, 622,
 &end
#
#    0 AMB  20-2:4205   172 LEU  MDY         4.50    (#   4205:20   Single Ambig)
 &rst
  ixpk= 4205, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2742, 405,2761,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:4207     0 AMB  20-1:4207   3.50    (#   4207:20   Double Ambig)
 &rst
  ixpk= 4207, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.93, r4= 7.68,
 igr1= 356, 360, 358, 465, 469,
 igr2= 433, 434, 435, 437, 438, 439,2751,2752,2753,2755,
      2756,2757,
 &end
#
#    0 AMB  20-2:4208    73 LEU  MDY         3.50    (#   4208:20   Single Ambig)
 &rst
  ixpk= 4208, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 494,1143,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#    0 AMB  20-2:4209    48 VAL  MGX         3.50    (#   4209:20   Single Ambig)
 &rst
  ixpk= 4209, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1473,1478,1471,1480,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#   91 TYR  HD           48 VAL  MGX         3.50    (#   4210:20   Unique)
 &rst
  ixpk= 4210, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1471,1480,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#    0 AMB  20-2:4211     0 AMB  20-1:4211   3.50    (#   4211:20   Double Ambig)
 &rst
  ixpk= 4211, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2450, 358, 201,
 igr2=2435,2436,1226,1227,1228,
 &end
#
#    0 AMB  20-2:4212     0 AMB  20-1:4212   3.50    (#   4212:20   Double Ambig)
 &rst
  ixpk= 4212, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=2450, 199, 203, 201,
 igr2=2435,2436,1226,1227,1228,
 &end
#
#   50 PHE  HZ           83 THR  MG2         3.50    (#   4213:20   Unique)
 &rst
  ixpk= 4213, iat= 799,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1357,1358,1359,
 &end
#
#   50 PHE  HE           83 THR  MG2         3.50    (#   4214:20   Unique)
 &rst
  ixpk= 4214, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 797, 801,
 igr2=1357,1358,1359,
 &end
#
#    0 AMB  20-2:4216     0 AMB  20-1:4216   3.50    (#   4216:20   Double Ambig)
 &rst
  ixpk= 4216, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 886, 900,
 igr2= 760, 761, 762, 764, 765, 766, 892, 893, 894,
 &end
#
#    0 AMB  20-2:4217     0 AMB  20-1:4217   3.50    (#   4217:20   Double Ambig)
 &rst
  ixpk= 4217, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2428, 782, 783,
 igr2=2435,2436,1226,1227,1228,
 &end
#
#    0 AMB  20-2:4218   172 LEU  MDY         2.70    (#   4218:20   Single Ambig)
 &rst
  ixpk= 4218, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.25, r4= 6.00,
 igr1=2649,2650,2651,2653,2654,2655,2162,2163,2164,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#  138 ILE  MD1         172 LEU  MDY         3.50    (#   4219:20   Unique)
 &rst
  ixpk= 4219, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2195,2196,2197,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#   34 VAL  MG2           9 LEU  MDY         3.50    (#   4220:20   Unique)
 &rst
  ixpk= 4220, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 538, 539, 540,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:4221   172 LEU  MDY         3.50    (#   4221:20   Single Ambig)
 &rst
  ixpk= 4221, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 415, 416,1847,1848,1849,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#  114 ILE  MG2         172 LEU  MDY         3.50    (#   4222:20   Unique)
 &rst
  ixpk= 4222, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1840,1841,1842,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:4223   172 LEU  MDY         3.50    (#   4223:20   Single Ambig)
 &rst
  ixpk= 4223, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2746,2747,2647,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#  172 LEU  HG          172 LEU  MDY         3.50    (#   4224:20   Unique)
 &rst
  ixpk= 4224, iat=2749,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:4225   172 LEU  MDY         3.50    (#   4225:20   Single Ambig)
 &rst
  ixpk= 4225, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 387, 388,2746,2747,2800,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:4226   172 LEU  MDY         3.50    (#   4226:20   Single Ambig)
 &rst
  ixpk= 4226, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 387, 388,2799,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:4227     9 LEU  MDY         3.50    (#   4227:20   Single Ambig)
 &rst
  ixpk= 4227, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1800, 681,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#   30 PHE  QB          172 LEU  MDY         3.50    (#   4228:20   Unique)
 &rst
  ixpk= 4228, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 459, 460,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#  172 LEU  HA          172 LEU  MDY         3.50    (#   4229:20   Preassigned)
 &rst
  ixpk= 4229, iat=2744,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#   27 ILE  HA          172 LEU  MDY         3.50    (#   4230:20   Unique)
 &rst
  ixpk= 4230, iat= 407,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:4231     0 AMB  20-1:4231   3.50    (#   4231:20   Double Ambig)
 &rst
  ixpk= 4231, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2744, 368,
 igr2=2751,2752,2753,2755,2756,2757, 433, 434, 435, 437,
       438, 439,
 &end
#
#   57 GLU  HG+          76 VAL  MG1         4.50    (#   4232:20   Unique)
 &rst
  ixpk= 4232, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 907, 908,
 igr2=1226,1227,1228,
 &end
#
#   57 GLU  HG-          76 VAL  MG1         4.50    (#   4233:20   Unique)
 &rst
  ixpk= 4233, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 907, 908,
 igr2=1226,1227,1228,
 &end
#
#    0 AMB  20-2:4234    64 VAL  MG2         3.50    (#   4234:20   Single Ambig)
 &rst
  ixpk= 4234, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1086,1087, 951, 952, 951, 952,
 igr2=1021,1022,1023,
 &end
#
#    0 AMB  20-2:4236    38 LEU  MDY         3.50    (#   4236:20   Single Ambig)
 &rst
  ixpk= 4236, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 614, 611, 612,
 igr2= 616, 617, 618, 620, 621, 622,
 &end
#
#    0 AMB  20-2:4237   163 VAL  MG2         3.50    (#   4237:20   Single Ambig)
 &rst
  ixpk= 4237, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2474,2475,2476,2397,
 igr2=2593,2594,2595,
 &end
#
#    0 AMB  20-2:4238     0 AMB  20-1:4238   3.50    (#   4238:20   Double Ambig)
 &rst
  ixpk= 4238, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 433, 434, 435, 437, 438, 439,  93,  94,  95,1148,
      
 igr2=1171,1172,1173,1175,1176,1177,1771,1772,1773,
 &end
#
#   57 GLU  HG+          76 VAL  MG2         3.50    (#   4239:20   Unique)
 &rst
  ixpk= 4239, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 907, 908,
 igr2=1230,1231,1232,
 &end
#
#    0 AMB  20-2:4240     0 AMB  20-1:4240   3.50    (#   4240:20   Double Ambig)
 &rst
  ixpk= 4240, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1= 907, 908,1282,1283,
 igr2=1171,1172,1173,1175,1176,1177,1322,1323,1324,1326,
      1327,1328,
 &end
#
#    0 AMB  20-2:4241     0 AMB  20-1:4241   3.50    (#   4241:20   Double Ambig)
 &rst
  ixpk= 4241, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.19, r4= 7.94,
 igr1= 907, 908,1282,1283, 107,
 igr2=1171,1172,1173,1175,1176,1177,1322,1323,1324,1326,
      1327,1328,1771,1772,1773,
 &end
#
#    0 AMB  20-2:4242     0 AMB  20-1:4242   2.70    (#   4242:20   Double Ambig)
 &rst
  ixpk= 4242, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1=1731,1732,1733,1230,1231,1232,2083,2084, 748, 749,
       750,
 igr2=1771,1772,1773,1171,1172,1173,1175,1176,1177,
 &end
#
#   28 LEU  MDY          76 VAL  MG2         3.50    (#   4244:20   Unique)
 &rst
  ixpk= 4244, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 433, 434, 435, 437, 438, 439,
 igr2=1230,1231,1232,
 &end
#
#   28 LEU  MDY          73 LEU  MDY         3.50    (#   4245:20   Unique)
 &rst
  ixpk= 4245, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 433, 434, 435, 437, 438, 439,
 igr2=1171,1172,1173,1175,1176,1177,
 &end
#
#  135 ILE  MG2         155 ALA  MB          3.50    (#   4246:20   Unique)
 &rst
  ixpk= 4246, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2143,2144,2145,
 igr2=2474,2475,2476,
 &end
#
#    0 AMB  20-2:4247   172 LEU  MDY         2.70    (#   4247:20   Single Ambig)
 &rst
  ixpk= 4247, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.25, r4= 6.00,
 igr1=2649,2650,2651,2653,2654,2655,2169,2170,2171,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#  150 THR  HN          150 THR  MG2         3.50    (#   4249:20   Preassigned)
 &rst
  ixpk= 4249, iat=2378,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2384,2385,2386,
 &end
#
#   85 THR  HN           83 THR  MG2         4.50    (#   4250:20   Unique)
 &rst
  ixpk= 4250, iat=1379,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1357,1358,1359,
 &end
#
#    0 AMB  20-2:4251    83 THR  MG2         4.50    (#   4251:20   Single Ambig)
 &rst
  ixpk= 4251, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=1379,1867,1901,
 igr2=1357,1358,1359,
 &end
#
#  121 ASP  HN            0 AMB  20-1:4252   4.50    (#   4252:20   Single Ambig)
 &rst
  ixpk= 4252, iat=1925,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1917,1918,1919,1357,1358,1359,
 &end
#
#  120 THR  HN            0 AMB  20-1:4253   3.50    (#   4253:20   Single Ambig)
 &rst
  ixpk= 4253, iat=1911,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1917,1918,1919,1357,1358,1359,
 &end
#
#  110 VAL  HN          108 THR  MG2         4.50    (#   4254:20   Unique)
 &rst
  ixpk= 4254, iat=1761,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1731,1732,1733,
 &end
#
#    0 AMB  20-2:4255    56 THR  MG2         3.50    (#   4255:20   Single Ambig)
 &rst
  ixpk= 4255, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 900, 886,
 igr2= 892, 893, 894,
 &end
#
#    0 AMB  20-2:4256     7 VAL  MG1         3.50    (#   4256:20   Single Ambig)
 &rst
  ixpk= 4256, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 103, 115,
 igr2=  93,  94,  95,
 &end
#
#   43 TYR  HE            7 VAL  MG1         4.50    (#   4258:20   Unique)
 &rst
  ixpk= 4258, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 686, 691,
 igr2=  93,  94,  95,
 &end
#
#   44 GLN  HE2-          7 VAL  MG1         4.50    (#   4259:20   Unique)
 &rst
  ixpk= 4259, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 709, 710,
 igr2=  93,  94,  95,
 &end
#
#  163 VAL  HN          163 VAL  MG2         3.50    (#   4260:20   Unique)
 &rst
  ixpk= 4260, iat=2583,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2593,2594,2595,
 &end
#
#  152 HIS  HN          163 VAL  MG2         4.50    (#   4261:20   Unique)
 &rst
  ixpk= 4261, iat=2411,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2593,2594,2595,
 &end
#
#   67 LYS  HN           72 LEU  MDY         6.00    (#   4262:20   Unique)
 &rst
  ixpk= 4262, iat=1073,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   63 TYR  HN           72 LEU  MDY         4.50    (#   4263:20   Unique)
 &rst
  ixpk= 4263, iat= 990,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   59 ASP  HN           72 LEU  MDY         6.00    (#   4264:20   Unique)
 &rst
  ixpk= 4264, iat= 935,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#  135 ILE  HN          163 VAL  MG2         4.50    (#   4266:20   Unique)
 &rst
  ixpk= 4266, iat=2137,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2593,2594,2595,
 &end
#
#    0 AMB  20-2:4267    52 THR  MG2         4.50    (#   4267:20   Single Ambig)
 &rst
  ixpk= 4267, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=1374,1375,1332,
 igr2= 824, 825, 826,
 &end
#
#    0 AMB  20-2:4268     0 AMB  20-1:4268   3.50    (#   4268:20   Double Ambig)
 &rst
  ixpk= 4268, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 782, 783,2848,
 igr2=1226,1227,1228,2840,2841,2842,
 &end
#
#  152 HIS  HD2         163 VAL  MG2         3.50    (#   4269:20   Unique)
 &rst
  ixpk= 4269, iat=2424,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2593,2594,2595,
 &end
#
#  152 HIS  HD2         163 VAL  MG2         4.50    (#   4270:20   Unique)
 &rst
  ixpk= 4270, iat=2424,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2593,2594,2595,
 &end
#
#    0 AMB  20-2:4271   163 VAL  MG2         3.50    (#   4271:20   Single Ambig)
 &rst
  ixpk= 4271, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2470,2450,
 igr2=2593,2594,2595,
 &end
#
#  162 PHE  HN          163 VAL  MG2         4.50    (#   4274:20   Unique)
 &rst
  ixpk= 4274, iat=2563,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2593,2594,2595,
 &end
#
#   66 TRP  HN           72 LEU  MDY         4.50    (#   4275:20   Unique)
 &rst
  ixpk= 4275, iat=1049,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:4276     0 AMB  20-1:4276   4.50    (#   4276:20   Double Ambig)
 &rst
  ixpk= 4276, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1= 607,1027,
 igr2= 616, 617, 618, 620, 621, 622,1152,1153,1154,1156,
      1157,1158,
 &end
#
#   66 TRP  HD1          72 LEU  MDY         4.50    (#   4278:20   Unique)
 &rst
  ixpk= 4278, iat=1057,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   71 ALA  HN           72 LEU  MDY         4.50    (#   4279:20   Unique)
 &rst
  ixpk= 4279, iat=1133,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   83 THR  HN           82 LEU  MDY         3.50    (#   4280:20   Unique)
 &rst
  ixpk= 4280, iat=1351,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1341,1342,1343,1345,1346,1347,
 &end
#
#    0 AMB  20-2:4281     0 AMB  20-1:4281   3.50    (#   4281:20   Double Ambig)
 &rst
  ixpk= 4281, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.60, r4= 7.35,
 igr1=1332, 475,1567,
 igr2=1322,1323,1324,1326,1327,1328,1171,1172,1173,1175,
      1176,1177,1771,1772,1773,
 &end
#
#   43 TYR  HA            7 VAL  MG1         4.50    (#   4284:20   Unique)
 &rst
  ixpk= 4284, iat= 678,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=  93,  94,  95,
 &end
#
#    9 LEU  HA            7 VAL  MG1         4.50    (#   4285:20   Unique)
 &rst
  ixpk= 4285, iat= 117,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=  93,  94,  95,
 &end
#
#   85 THR  MG2          83 THR  MG2         3.50    (#   4286:20   Unique)
 &rst
  ixpk= 4286, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1385,1386,1387,
 igr2=1357,1358,1359,
 &end
#
#    0 AMB  20-2:4287    83 THR  MG2         4.50    (#   4287:20   Single Ambig)
 &rst
  ixpk= 4287, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 213, 214, 213, 214,
 igr2=1357,1358,1359,
 &end
#
#    0 AMB  20-2:4288    83 THR  MG2         4.50    (#   4288:20   Single Ambig)
 &rst
  ixpk= 4288, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 211,1383,
 igr2=1357,1358,1359,
 &end
#
#    0 AMB  20-2:4290    52 THR  MG2         3.50    (#   4290:20   Single Ambig)
 &rst
  ixpk= 4290, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 836, 837,1369, 834,
 igr2= 824, 825, 826,
 &end
#
#   81 LEU  HA           81 LEU  MDY         3.50    (#   4291:20   Preassigned)
 &rst
  ixpk= 4291, iat=1315,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1322,1323,1324,1326,1327,1328,
 &end
#
#  108 THR  HB          108 THR  MG2         3.50    (#   4292:20   Preassigned)
 &rst
  ixpk= 4292, iat=1729,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1731,1732,1733,
 &end
#
#   72 LEU  HG           72 LEU  MDY         4.50    (#   4295:20   Unique)
 &rst
  ixpk= 4295, iat=1150,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#  163 VAL  HB          163 VAL  MG2         3.50    (#   4296:20   Preassigned)
 &rst
  ixpk= 4296, iat=2587,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2593,2594,2595,
 &end
#
#    0 AMB  20-2:4297   163 VAL  MG2         4.50    (#   4297:20   Single Ambig)
 &rst
  ixpk= 4297, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2399,2141,
 igr2=2593,2594,2595,
 &end
#
#    0 AMB  20-2:4298     0 AMB  20-1:4298   2.70    (#   4298:20   Double Ambig)
 &rst
  ixpk= 4298, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.05, r4= 6.80,
 igr1=1771,1772,1773,1341,1342,1343,1345,1346,1347,1322,
      1323,1324,1326,1327,1328,1322,1323,1324,1326,1327,
      1328,
 igr2=1731,1732,1733, 824, 825, 826,
 &end
#
#    0 AMB  20-2:4299    72 LEU  MDY         6.00    (#   4299:20   Single Ambig)
 &rst
  ixpk= 4299, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1=1097, 917,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#  135 ILE  HA          163 VAL  MG2         6.00    (#   4300:20   Unique)
 &rst
  ixpk= 4300, iat=2139,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2593,2594,2595,
 &end
#
#   60 PHE  HA           64 VAL  MG2         6.00    (#   4301:20   Unique)
 &rst
  ixpk= 4301, iat= 949,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1021,1022,1023,
 &end
#
#   83 THR  HG1          83 THR  MG2         4.50    (#   4302:20   Unique)
 &rst
  ixpk= 4302, iat=1361,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1357,1358,1359,
 &end
#
#   59 ASP  HA           46 ALA  MB          3.50    (#   4303:20   Unique)
 &rst
  ixpk= 4303, iat= 937,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 738, 739, 740,
 &end
#
#    0 AMB  20-2:4304   163 VAL  MG2         3.50    (#   4304:20   Single Ambig)
 &rst
  ixpk= 4304, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2413,2529,2567,2568,
 igr2=2593,2594,2595,
 &end
#
#  162 PHE  HB-         163 VAL  MG2         4.50    (#   4305:20   Unique)
 &rst
  ixpk= 4305, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2567,2568,
 igr2=2593,2594,2595,
 &end
#
#   58 PHE  HB-          72 LEU  MDY         3.50    (#   4306:20   Unique)
 &rst
  ixpk= 4306, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 919, 920,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:4307    72 LEU  MDY         3.50    (#   4307:20   Single Ambig)
 &rst
  ixpk= 4307, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1075,1054,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   63 TYR  HA           72 LEU  MDY         4.50    (#   4308:20   Unique)
 &rst
  ixpk= 4308, iat= 992,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   62 ASP  HA           72 LEU  MDY         3.50    (#   4310:20   Unique)
 &rst
  ixpk= 4310, iat= 980,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   82 LEU  HA           82 LEU  MDY         3.50    (#   4311:20   Preassigned)
 &rst
  ixpk= 4311, iat=1334,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1341,1342,1343,1345,1346,1347,
 &end
#
#    0 AMB  20-2:4312   150 THR  MG2         3.50    (#   4312:20   Single Ambig)
 &rst
  ixpk= 4312, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2337,2382,
 igr2=2384,2385,2386,
 &end
#
#  150 THR  HA          150 THR  MG2         3.50    (#   4313:20   Unique)
 &rst
  ixpk= 4313, iat=2380,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2384,2385,2386,
 &end
#
#   59 ASP  HB-          56 THR  MG2         3.50    (#   4314:20   Unique)
 &rst
  ixpk= 4314, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 939, 940,
 igr2= 892, 893, 894,
 &end
#
#   59 ASP  HB+          56 THR  MG2         3.50    (#   4315:20   Unique)
 &rst
  ixpk= 4315, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 939, 940,
 igr2= 892, 893, 894,
 &end
#
#    0 AMB  20-2:4316     0 AMB  20-1:4316   3.50    (#   4316:20   Double Ambig)
 &rst
  ixpk= 4316, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 822,1727,
 igr2=1322,1323,1324,1326,1327,1328,1771,1772,1773,
 &end
#
#  108 THR  HN            7 VAL  MG1         6.00    (#   4317:20   Unique)
 &rst
  ixpk= 4317, iat=1725,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=  93,  94,  95,
 &end
#
#    0 AMB  20-2:4319   163 VAL  MG2         6.00    (#   4319:20   Single Ambig)
 &rst
  ixpk= 4319, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2480,2537,
 igr2=2593,2594,2595,
 &end
#
#  101 LEU  HA          101 LEU  MDY         3.50    (#   4320:20   Preassigned)
 &rst
  ixpk= 4320, iat=1631,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#   56 THR  HA           48 VAL  MGX         3.50    (#   4321:20   Unique)
 &rst
  ixpk= 4321, iat= 888,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#    0 AMB  20-2:4322   155 ALA  MB          3.50    (#   4322:20   Single Ambig)
 &rst
  ixpk= 4322, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2567,2568,2472,2529,2413,
 igr2=2474,2475,2476,
 &end
#
#   38 LEU  HA           38 LEU  MDY         3.50    (#   4324:20   Unique)
 &rst
  ixpk= 4324, iat= 609,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 616, 617, 618, 620, 621, 622,
 &end
#
#    0 AMB  20-2:4325    72 LEU  MDY         3.50    (#   4325:20   Single Ambig)
 &rst
  ixpk= 4325, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 919, 920, 982,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:4326    94 THR  MG2         3.50    (#   4326:20   Single Ambig)
 &rst
  ixpk= 4326, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1514,1451,
 igr2=1516,1517,1518,
 &end
#
#    0 AMB  20-2:4327    96 VAL  MG1         4.50    (#   4327:20   Single Ambig)
 &rst
  ixpk= 4327, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=1486,1559,1560,
 igr2=1545,1546,1547,
 &end
#
#    0 AMB  20-2:4328    46 ALA  MB          4.50    (#   4328:20   Single Ambig)
 &rst
  ixpk= 4328, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.47, r4= 8.22,
 igr1= 939, 940, 951, 952, 951, 952, 719,
 igr2= 738, 739, 740,
 &end
#
#   59 ASP  HB-          46 ALA  MB          6.00    (#   4329:20   Unique)
 &rst
  ixpk= 4329, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 939, 940,
 igr2= 738, 739, 740,
 &end
#
#   10 VAL  HA           46 ALA  MB          6.00    (#   4330:20   Unique)
 &rst
  ixpk= 4330, iat= 136,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 738, 739, 740,
 &end
#
#   60 PHE  HA           46 ALA  MB          4.50    (#   4333:20   Unique)
 &rst
  ixpk= 4333, iat= 949,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2= 738, 739, 740,
 &end
#
#    0 AMB  20-2:4334   110 VAL  MG1         3.50    (#   4334:20   Single Ambig)
 &rst
  ixpk= 4334, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 117,1779,
 igr2=1767,1768,1769,
 &end
#
#    0 AMB  20-2:4335    64 VAL  MG1         3.50    (#   4335:20   Single Ambig)
 &rst
  ixpk= 4335, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1029, 971, 972,
 igr2=1017,1018,1019,
 &end
#
#  140 LYS  QE          168 THR  MG2         3.50    (#   4336:20   Unique)
 &rst
  ixpk= 4336, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2221,2222,
 igr2=2677,2678,2679,
 &end
#
#  118 GLU  HG+         150 THR  MG2         4.50    (#   4338:20   Unique)
 &rst
  ixpk= 4338, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1893,1894,
 igr2=2384,2385,2386,
 &end
#
#    0 AMB  20-2:4340   150 THR  MG2         4.50    (#   4340:20   Single Ambig)
 &rst
  ixpk= 4340, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2339,2340,2322,
 igr2=2384,2385,2386,
 &end
#
#   35 MET  HA           34 VAL  MG1         3.50    (#   4341:20   Unique)
 &rst
  ixpk= 4341, iat= 546,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 534, 535, 536,
 &end
#
#    0 AMB  20-2:4342   163 VAL  MG1         4.50    (#   4342:20   Single Ambig)
 &rst
  ixpk= 4342, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1=2413,2529,2539,2567,2568,
 igr2=2589,2590,2591,
 &end
#
#   31 MET  HA           34 VAL  MG1         4.50    (#   4343:20   Unique)
 &rst
  ixpk= 4343, iat= 477,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2= 534, 535, 536,
 &end
#
#  144 THR  HB          144 THR  MG2         3.50    (#   4344:20   Unique)
 &rst
  ixpk= 4344, iat=2288,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2290,2291,2292,
 &end
#
#  144 THR  HA          144 THR  MG2         3.50    (#   4345:20   Unique)
 &rst
  ixpk= 4345, iat=2286,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2290,2291,2292,
 &end
#
#   10 VAL  HA           10 VAL  MG1         3.50    (#   4346:20   Preassigned)
 &rst
  ixpk= 4346, iat= 136,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 140, 141, 142,
 &end
#
#    0 AMB  20-2:4347    10 VAL  MG1         4.50    (#   4347:20   Single Ambig)
 &rst
  ixpk= 4347, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1779, 152,
 igr2= 140, 141, 142,
 &end
#
#   12 LEU  HA           10 VAL  MG1         6.00    (#   4348:20   Unique)
 &rst
  ixpk= 4348, iat= 172,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 140, 141, 142,
 &end
#
#   47 ALA  HA           10 VAL  MG1         4.50    (#   4349:20   Unique)
 &rst
  ixpk= 4349, iat= 746,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2= 140, 141, 142,
 &end
#
#   85 THR  HG1          85 THR  MG2         3.50    (#   4350:20   Unique)
 &rst
  ixpk= 4350, iat=1389,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1385,1386,1387,
 &end
#
#   85 THR  HB           85 THR  MG2         3.50    (#   4352:20   Preassigned)
 &rst
  ixpk= 4352, iat=1383,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1385,1386,1387,
 &end
#
#  184 TYR  QB          185 VAL  MGX         3.50    (#   4353:20   Unique)
 &rst
  ixpk= 4353, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2966,2967,
 igr2=2989,2990,2991,2993,2994,2995,
 &end
#
#    0 AMB  20-2:4354   168 THR  MG2         3.50    (#   4354:20   Single Ambig)
 &rst
  ixpk= 4354, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2663,2664,2663,2664,
 igr2=2677,2678,2679,
 &end
#
#    0 AMB  20-2:4355    88 ALA  MB          3.50    (#   4355:20   Single Ambig)
 &rst
  ixpk= 4355, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 791,1381,
 igr2=1424,1425,1426,
 &end
#
#   50 PHE  HB3          88 ALA  MB          3.50    (#   4356:20   Unique)
 &rst
  ixpk= 4356, iat= 792,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1424,1425,1426,
 &end
#
#   92 VAL  HA           10 VAL  MG1         6.00    (#   4357:20   Unique)
 &rst
  ixpk= 4357, iat=1486,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 140, 141, 142,
 &end
#
#    0 AMB  20-2:4358    10 VAL  MG1         4.50    (#   4358:20   Single Ambig)
 &rst
  ixpk= 4358, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1= 154, 155,1432,
 igr2= 140, 141, 142,
 &end
#
#  107 ALA  HA            7 VAL  MG2         4.50    (#   4359:20   Unique)
 &rst
  ixpk= 4359, iat=1717,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=  97,  98,  99,
 &end
#
#    0 AMB  20-2:4360     7 VAL  MG2         3.50    (#   4360:20   Single Ambig)
 &rst
  ixpk= 4360, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1729,  37,  38,  68,  69,
 igr2=  97,  98,  99,
 &end
#
#   43 TYR  HA            7 VAL  MG2         4.50    (#   4362:20   Unique)
 &rst
  ixpk= 4362, iat= 678,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=  97,  98,  99,
 &end
#
#   12 LEU  HA           48 VAL  MGY         6.00    (#   4363:20   Unique)
 &rst
  ixpk= 4363, iat= 172,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#    0 AMB  20-2:4364    48 VAL  MGY         4.50    (#   4364:20   Single Ambig)
 &rst
  ixpk= 4364, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 789, 746,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#  110 VAL  HA          110 VAL  MG1         3.50    (#   4365:20   Preassigned)
 &rst
  ixpk= 4365, iat=1763,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1767,1768,1769,
 &end
#
#   41 THR  HB           41 THR  MG2         3.50    (#   4367:20   Unique)
 &rst
  ixpk= 4367, iat= 655,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 657, 658, 659,
 &end
#
#  108 THR  HB            7 VAL  MG1         3.50    (#   4369:20   Unique)
 &rst
  ixpk= 4369, iat=1729,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=  93,  94,  95,
 &end
#
#   46 ALA  HA           46 ALA  MB          3.50    (#   4370:20   Preassigned)
 &rst
  ixpk= 4370, iat= 736,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 738, 739, 740,
 &end
#
#    0 AMB  20-2:4371    56 THR  MG2         3.50    (#   4371:20   Single Ambig)
 &rst
  ixpk= 4371, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 917, 756, 902,
 igr2= 892, 893, 894,
 &end
#
#    0 AMB  20-2:4372   108 THR  MG2         3.50    (#   4372:20   Single Ambig)
 &rst
  ixpk= 4372, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=  97,  98,  99,  93,  94,  95,
 igr2=1731,1732,1733,
 &end
#
#    0 AMB  20-2:4373    56 THR  MG2         3.50    (#   4373:20   Single Ambig)
 &rst
  ixpk= 4373, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1545,1546,1547, 738, 739, 740,
 igr2= 892, 893, 894,
 &end
#
#    0 AMB  20-2:4374     0 AMB  20-1:4374   3.50    (#   4374:20   Double Ambig)
 &rst
  ixpk= 4374, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2886,2887,1083,1084,
 igr2=2840,2841,2842,1021,1022,1023,
 &end
#
#    0 AMB  20-2:4375     0 AMB  20-1:4375   3.50    (#   4375:20   Double Ambig)
 &rst
  ixpk= 4375, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.00, r4= 7.75,
 igr1=2438,2439,2432,2433,2083,2084,1336,1337,
 igr2=2435,2436,1731,1732,1733, 824, 825, 826,
 &end
#
#    0 AMB  20-2:4376     0 AMB  20-1:4376   3.50    (#   4376:20   Double Ambig)
 &rst
  ixpk= 4376, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2432,2433,2432,2433,1336,1337,
 igr2=2435,2436, 824, 825, 826,
 &end
#
#    0 AMB  20-2:4377     0 AMB  20-1:4377   3.50    (#   4377:20   Double Ambig)
 &rst
  ixpk= 4377, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1224,2367,2368,
 igr2=1230,1231,1232,2435,2436,
 &end
#
#    0 AMB  20-2:4378     0 AMB  20-1:4378   3.50    (#   4378:20   Double Ambig)
 &rst
  ixpk= 4378, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.98, r4= 6.73,
 igr1=1336,1337,2367,2368,1318,
 igr2= 824, 825, 826,2435,2436,
 &end
#
#    0 AMB  20-2:4380   150 THR  MG2         4.50    (#   4380:20   Single Ambig)
 &rst
  ixpk= 4380, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2363,2335,
 igr2=2384,2385,2386,
 &end
#
#  151 LEU  HN          150 THR  MG2         4.50    (#   4381:20   Unique)
 &rst
  ixpk= 4381, iat=2392,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2384,2385,2386,
 &end
#
#  153 LYS  HE-         150 THR  MG2         4.50    (#   4382:20   Unique)
 &rst
  ixpk= 4382, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2441,2442,
 igr2=2384,2385,2386,
 &end
#
#  153 LYS  HE+         150 THR  MG2         4.50    (#   4383:20   Unique)
 &rst
  ixpk= 4383, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2441,2442,
 igr2=2384,2385,2386,
 &end
#
#  146 GLU  HG+         150 THR  MG2         6.00    (#   4384:20   Unique)
 &rst
  ixpk= 4384, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2327,2328,
 igr2=2384,2385,2386,
 &end
#
#    0 AMB  20-2:4385   150 THR  MG2         3.50    (#   4385:20   Single Ambig)
 &rst
  ixpk= 4385, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1893,1894,1891,
 igr2=2384,2385,2386,
 &end
#
#   96 VAL  HB           96 VAL  MG1         3.50    (#   4391:20   Unique)
 &rst
  ixpk= 4391, iat=1543,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1545,1546,1547,
 &end
#
#    0 AMB  20-2:4394    46 ALA  MB          6.00    (#   4394:20   Single Ambig)
 &rst
  ixpk= 4394, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1= 955, 963, 925, 929,
 igr2= 738, 739, 740,
 &end
#
#   47 ALA  HA           46 ALA  MB          6.00    (#   4395:20   Unique)
 &rst
  ixpk= 4395, iat= 746,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 738, 739, 740,
 &end
#
#   45 PHE  HA           46 ALA  MB          4.50    (#   4396:20   Unique)
 &rst
  ixpk= 4396, iat= 716,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2= 738, 739, 740,
 &end
#
#   91 TYR  HE           96 VAL  MG1         6.00    (#   4399:20   Unique)
 &rst
  ixpk= 4399, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1473,1478,
 igr2=1545,1546,1547,
 &end
#
#   60 PHE  HZ           46 ALA  MB          4.50    (#   4401:20   Unique)
 &rst
  ixpk= 4401, iat= 959,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2= 738, 739, 740,
 &end
#
#   60 PHE  HN           46 ALA  MB          6.00    (#   4403:20   Unique)
 &rst
  ixpk= 4403, iat= 947,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 738, 739, 740,
 &end
#
#    0 AMB  20-2:4406    46 ALA  MB          6.00    (#   4406:20   Single Ambig)
 &rst
  ixpk= 4406, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 935, 754,
 igr2= 738, 739, 740,
 &end
#
#    0 AMB  20-2:4407    96 VAL  MG1         6.00    (#   4407:20   Single Ambig)
 &rst
  ixpk= 4407, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 744, 915,
 igr2=1545,1546,1547,
 &end
#
#   59 ASP  HB+          96 VAL  MG1         6.00    (#   4409:20   Unique)
 &rst
  ixpk= 4409, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 939, 940,
 igr2=1545,1546,1547,
 &end
#
#    0 AMB  20-2:4412   110 VAL  MG1         4.50    (#   4412:20   Single Ambig)
 &rst
  ixpk= 4412, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=1796, 134,2116,
 igr2=1767,1768,1769,
 &end
#
#  111 LEU  HN          110 VAL  MG1         3.50    (#   4413:20   Unique)
 &rst
  ixpk= 4413, iat=1777,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1767,1768,1769,
 &end
#
#    0 AMB  20-2:4414    96 VAL  MG1         4.50    (#   4414:20   Single Ambig)
 &rst
  ixpk= 4414, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 957, 961, 955, 963,
 igr2=1545,1546,1547,
 &end
#
#   60 PHE  HZ           96 VAL  MG1         4.50    (#   4415:20   Unique)
 &rst
  ixpk= 4415, iat= 959,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1545,1546,1547,
 &end
#
#    0 AMB  20-2:4418     0 AMB  20-1:4418   3.50    (#   4418:20   Double Ambig)
 &rst
  ixpk= 4418, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.80, r4= 7.55,
 igr1=2631,2632, 589, 590, 589, 590,2474,2475,2476,
 igr2=2589,2590,2591, 534, 535, 536,
 &end
#
#    0 AMB  20-2:4420   163 VAL  MG1         3.50    (#   4420:20   Single Ambig)
 &rst
  ixpk= 4420, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2631,2632,2143,2144,2145,
 igr2=2589,2590,2591,
 &end
#
#  146 GLU  HG-         144 THR  MG2         3.50    (#   4422:20   Unique)
 &rst
  ixpk= 4422, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2327,2328,
 igr2=2290,2291,2292,
 &end
#
#  178 GLU  QB          177 THR  MG2         4.50    (#   4423:20   Unique)
 &rst
  ixpk= 4423, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2852,2853,
 igr2=2840,2841,2842,
 &end
#
#    0 AMB  20-2:4424   177 THR  MG2         3.50    (#   4424:20   Single Ambig)
 &rst
  ixpk= 4424, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2909,2910,2903,2904,2886,2887,
 igr2=2840,2841,2842,
 &end
#
#    0 AMB  20-2:4425   144 THR  MG2         4.50    (#   4425:20   Single Ambig)
 &rst
  ixpk= 4425, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=2274,2275,2274,2275,2271,2272,2271,2272,
 igr2=2290,2291,2292,
 &end
#
#  110 VAL  HB          110 VAL  MG1         3.50    (#   4426:20   Unique)
 &rst
  ixpk= 4426, iat=1765,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1767,1768,1769,
 &end
#
#  112 ILE  HG1+        110 VAL  MG1         3.50    (#   4427:20   Unique)
 &rst
  ixpk= 4427, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1806,1807,
 igr2=1767,1768,1769,
 &end
#
#   65 LYS  HB-          64 VAL  MG1         4.50    (#   4429:20   Unique)
 &rst
  ixpk= 4429, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1031,1032,
 igr2=1017,1018,1019,
 &end
#
#  170 GLU  QB          168 THR  MG2         3.50    (#   4431:20   Unique)
 &rst
  ixpk= 4431, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2709,2710,
 igr2=2677,2678,2679,
 &end
#
#  151 LEU  MDX         163 VAL  MG1         3.50    (#   4432:20   Unique)
 &rst
  ixpk= 4432, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2401,2402,2403,2405,2406,2407,
 igr2=2589,2590,2591,
 &end
#
#    0 AMB  20-2:4433    34 VAL  MG1         3.50    (#   4433:20   Single Ambig)
 &rst
  ixpk= 4433, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 726,2894,2895,
 igr2= 534, 535, 536,
 &end
#
#    0 AMB  20-2:4434    34 VAL  MG1         3.50    (#   4434:20   Single Ambig)
 &rst
  ixpk= 4434, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 162, 724, 728, 726,2824,2828, 160, 164,
 igr2= 534, 535, 536,
 &end
#
#   65 LYS  HN           64 VAL  MG1         3.50    (#   4435:20   Unique)
 &rst
  ixpk= 4435, iat=1027,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1017,1018,1019,
 &end
#
#  164 LYS  HN          163 VAL  MG1         3.50    (#   4436:20   Unique)
 &rst
  ixpk= 4436, iat=2599,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2589,2590,2591,
 &end
#
#  143 GLN  HN          144 THR  MG2         4.50    (#   4437:20   Unique)
 &rst
  ixpk= 4437, iat=2267,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2290,2291,2292,
 &end
#
#   85 THR  MG2         119 ALA  MB          3.50    (#   4438:20   Preassigned)
 &rst
  ixpk= 4438, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1385,1386,1387,
 igr2=1905,1906,1907,
 &end
#
#   86 PHE  HN          119 ALA  MB          4.50    (#   4439:20   Unique)
 &rst
  ixpk= 4439, iat=1393,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1905,1906,1907,
 &end
#
#   85 THR  HB          119 ALA  MB          3.50    (#   4441:20   Unique)
 &rst
  ixpk= 4441, iat=1383,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1905,1906,1907,
 &end
#
#    0 AMB  20-2:4442   119 ALA  MB          3.50    (#   4442:20   Single Ambig)
 &rst
  ixpk= 4442, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1929,1930,1929,1930,1397,1381,
 igr2=1905,1906,1907,
 &end
#
#  122 SER  HA          119 ALA  MB          4.50    (#   4443:20   Unique)
 &rst
  ixpk= 4443, iat=1939,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1905,1906,1907,
 &end
#
#    0 AMB  20-2:4444   119 ALA  MB          4.50    (#   4444:20   Single Ambig)
 &rst
  ixpk= 4444, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2382,1888,
 igr2=1905,1906,1907,
 &end
#
#    0 AMB  20-2:4445   119 ALA  MB          4.50    (#   4445:20   Single Ambig)
 &rst
  ixpk= 4445, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1913,1355,
 igr2=1905,1906,1907,
 &end
#
#   85 THR  HG1         119 ALA  MB          3.50    (#   4446:20   Unique)
 &rst
  ixpk= 4446, iat=1389,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1905,1906,1907,
 &end
#
#   86 PHE  HE          119 ALA  MB          3.50    (#   4449:20   Unique)
 &rst
  ixpk= 4449, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1403,1407,
 igr2=1905,1906,1907,
 &end
#
#  121 ASP  HN          119 ALA  MB          3.50    (#   4450:20   Unique)
 &rst
  ixpk= 4450, iat=1925,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1905,1906,1907,
 &end
#
#    0 AMB  20-2:4451   119 ALA  MB          3.50    (#   4451:20   Single Ambig)
 &rst
  ixpk= 4451, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1401,1409,1403,1407,
 igr2=1905,1906,1907,
 &end
#
#   85 THR  HN          119 ALA  MB          3.50    (#   4452:20   Unique)
 &rst
  ixpk= 4452, iat=1379,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1905,1906,1907,
 &end
#
#    0 AMB  20-2:4455   119 ALA  MB          3.50    (#   4455:20   Single Ambig)
 &rst
  ixpk= 4455, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2462,2460,2464,
 igr2=1905,1906,1907,
 &end
#
#    0 AMB  20-2:4456   119 ALA  MB          3.50    (#   4456:20   Single Ambig)
 &rst
  ixpk= 4456, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2462,2460,2464,
 igr2=1905,1906,1907,
 &end
#
#    0 AMB  20-2:4457   107 ALA  MB          3.50    (#   4457:20   Single Ambig)
 &rst
  ixpk= 4457, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=  82,  83,1678,
 igr2=1719,1720,1721,
 &end
#
#    8 ASP  HN          107 ALA  MB          3.50    (#   4458:20   Unique)
 &rst
  ixpk= 4458, iat= 103,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1719,1720,1721,
 &end
#
#  104 ARG  HN          107 ALA  MB          4.50    (#   4459:20   Unique)
 &rst
  ixpk= 4459, iat=1665,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1719,1720,1721,
 &end
#
#    0 AMB  20-2:4460   107 ALA  MB          3.50    (#   4460:20   Single Ambig)
 &rst
  ixpk= 4460, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 709, 710,  82,  83,
 igr2=1719,1720,1721,
 &end
#
#    0 AMB  20-2:4461   107 ALA  MB          3.50    (#   4461:20   Single Ambig)
 &rst
  ixpk= 4461, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 709, 710,  87,
 igr2=1719,1720,1721,
 &end
#
#  133 ARG  HE          128 ALA  MB          4.50    (#   4462:20   Unique)
 &rst
  ixpk= 4462, iat=2105,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2014,2015,2016,
 &end
#
#  127 ALA  HN          128 ALA  MB          6.00    (#   4465:20   Unique)
 &rst
  ixpk= 4465, iat=2000,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2014,2015,2016,
 &end
#
#  146 GLU  HN          144 THR  MG2         4.50    (#   4466:20   Unique)
 &rst
  ixpk= 4466, iat=2320,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2290,2291,2292,
 &end
#
#   86 PHE  HN           85 THR  MG2         6.00    (#   4467:20   Unique)
 &rst
  ixpk= 4467, iat=1393,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1385,1386,1387,
 &end
#
#  169 PHE  HN          168 THR  MG2         3.50    (#   4468:20   Preassigned)
 &rst
  ixpk= 4468, iat=2685,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2677,2678,2679,
 &end
#
#   11 PHE  HN           10 VAL  MG1         3.50    (#   4470:20   Unique)
 &rst
  ixpk= 4470, iat= 150,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 140, 141, 142,
 &end
#
#    0 AMB  20-2:4471    10 VAL  MG1         4.50    (#   4471:20   Single Ambig)
 &rst
  ixpk= 4471, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 134,1796,
 igr2= 140, 141, 142,
 &end
#
#   12 LEU  HN           10 VAL  MG1         6.00    (#   4472:20   Unique)
 &rst
  ixpk= 4472, iat= 170,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 140, 141, 142,
 &end
#
#    0 AMB  20-2:4473    10 VAL  MG1         6.00    (#   4473:20   Single Ambig)
 &rst
  ixpk= 4473, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 754, 189,
 igr2= 140, 141, 142,
 &end
#
#    0 AMB  20-2:4475     7 VAL  MG2         4.50    (#   4475:20   Single Ambig)
 &rst
  ixpk= 4475, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=  66, 103,
 igr2=  97,  98,  99,
 &end
#
#   50 PHE  HE           85 THR  MG2         4.50    (#   4477:20   Unique)
 &rst
  ixpk= 4477, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 797, 801,
 igr2=1385,1386,1387,
 &end
#
#    0 AMB  20-2:4478    85 THR  MG2         4.50    (#   4478:20   Single Ambig)
 &rst
  ixpk= 4478, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2458,2466,2460,2464,
 igr2=1385,1386,1387,
 &end
#
#    0 AMB  20-2:4480    85 THR  MG2         6.00    (#   4480:20   Single Ambig)
 &rst
  ixpk= 4480, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1430,1420,
 igr2=1385,1386,1387,
 &end
#
#    0 AMB  20-2:4481     0 AMB  20-1:4481   4.50    (#   4481:20   Double Ambig)
 &rst
  ixpk= 4481, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.79, r4= 8.54,
 igr1= 770,2175, 787,
 igr2= 760, 761, 762, 764, 765, 766,2589,2590,2591,
 &end
#
#    0 AMB  20-2:4482    48 VAL  MGY         3.50    (#   4482:20   Single Ambig)
 &rst
  ixpk= 4482, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 864, 770,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#    0 AMB  20-2:4483    10 VAL  MG1         6.00    (#   4483:20   Single Ambig)
 &rst
  ixpk= 4483, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1=1565,1569,1563,1571,
 igr2= 140, 141, 142,
 &end
#
#    0 AMB  20-2:4484    10 VAL  MG1         6.00    (#   4484:20   Single Ambig)
 &rst
  ixpk= 4484, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.65, r4= 9.40,
 igr1=1565,1569,1555,
 igr2= 140, 141, 142,
 &end
#
#    0 AMB  20-2:4485   185 VAL  MGX         3.50    (#   4485:20   Single Ambig)
 &rst
  ixpk= 4485, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2999,2962,3033,
 igr2=2989,2990,2991,2993,2994,2995,
 &end
#
#   40 ASN  HD2-         41 THR  MG2         4.50    (#   4487:20   Unique)
 &rst
  ixpk= 4487, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 646, 647,
 igr2= 657, 658, 659,
 &end
#
#    0 AMB  20-2:4489    94 THR  MG2         6.00    (#   4489:20   Single Ambig)
 &rst
  ixpk= 4489, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1500,1463,
 igr2=1516,1517,1518,
 &end
#
#   41 THR  HN           41 THR  MG2         6.00    (#   4490:20   Preassigned)
 &rst
  ixpk= 4490, iat= 651,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 657, 658, 659,
 &end
#
#    0 AMB  20-2:4492   151 LEU  MDY         3.50    (#   4492:20   Single Ambig)
 &rst
  ixpk= 4492, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2460,2464,2458,2466,2255,2263,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#  107 ALA  HN          107 ALA  MB          3.50    (#   4493:20   Unique)
 &rst
  ixpk= 4493, iat=1715,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1719,1720,1721,
 &end
#
#  151 LEU  HN          151 LEU  MDY         3.50    (#   4494:20   Unique)
 &rst
  ixpk= 4494, iat=2392,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#    0 AMB  20-2:4497     0 AMB  20-1:4497   4.50    (#   4497:20   Double Ambig)
 &rst
  ixpk= 4497, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2249, 789,
 igr2=2401,2402,2403,2405,2406,2407,1424,1425,1426,
 &end
#
#  119 ALA  MB           85 THR  MG2         4.50    (#   4498:20   Unique)
 &rst
  ixpk= 4498, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=1905,1906,1907,
 igr2=1385,1386,1387,
 &end
#
#   86 PHE  HA           85 THR  MG2         6.00    (#   4500:20   Unique)
 &rst
  ixpk= 4500, iat=1395,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1385,1386,1387,
 &end
#
#    0 AMB  20-2:4502    85 THR  MG2         6.00    (#   4502:20   Single Ambig)
 &rst
  ixpk= 4502, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1903,1367,
 igr2=1385,1386,1387,
 &end
#
#   86 PHE  HD           85 THR  MG2         6.00    (#   4504:20   Unique)
 &rst
  ixpk= 4504, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1401,1409,
 igr2=1385,1386,1387,
 &end
#
#    0 AMB  20-2:4505    85 THR  MG2         4.50    (#   4505:20   Single Ambig)
 &rst
  ixpk= 4505, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.79, r4= 8.54,
 igr1=1443,1444,1445, 179, 180, 181, 183, 184, 185,
 igr2=1385,1386,1387,
 &end
#
#    6 ASN  HB-           7 VAL  MG2         4.50    (#   4511:20   Unique)
 &rst
  ixpk= 4511, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=  77,  78,
 igr2=  97,  98,  99,
 &end
#
#   10 VAL  HB           10 VAL  MG1         3.50    (#   4515:20   Unique)
 &rst
  ixpk= 4515, iat= 138,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 140, 141, 142,
 &end
#
#   92 VAL  HB           10 VAL  MG1         6.00    (#   4517:20   Unique)
 &rst
  ixpk= 4517, iat=1488,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 140, 141, 142,
 &end
#
#   56 THR  HA           48 VAL  MGY         4.50    (#   4519:20   Unique)
 &rst
  ixpk= 4519, iat= 888,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#    0 AMB  20-2:4520     7 VAL  MG2         6.00    (#   4520:20   Single Ambig)
 &rst
  ixpk= 4520, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1=  68,  69, 669, 670,
 igr2=  97,  98,  99,
 &end
#
#    3 SER  HA            7 VAL  MG2         6.00    (#   4521:20   Unique)
 &rst
  ixpk= 4521, iat=  35,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=  97,  98,  99,
 &end
#
#  140 LYS  HD+         168 THR  MG2         3.50    (#   4524:20   Unique)
 &rst
  ixpk= 4524, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2218,2219,
 igr2=2677,2678,2679,
 &end
#
#  140 LYS  HD-         168 THR  MG2         3.50    (#   4525:20   Unique)
 &rst
  ixpk= 4525, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2218,2219,
 igr2=2677,2678,2679,
 &end
#
#   12 LEU  MDX          88 ALA  MB          3.50    (#   4528:20   Unique)
 &rst
  ixpk= 4528, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 179, 180, 181, 183, 184, 185,
 igr2=1424,1425,1426,
 &end
#
#  115 THR  MG2         151 LEU  MDY         3.50    (#   4529:20   Unique)
 &rst
  ixpk= 4529, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1859,1860,1861,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#  151 LEU  HG          151 LEU  MDY         3.50    (#   4531:20   Unique)
 &rst
  ixpk= 4531, iat=2399,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#    0 AMB  20-2:4532     0 AMB  20-1:4532   3.50    (#   4532:20   Double Ambig)
 &rst
  ixpk= 4532, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.80, r4= 7.55,
 igr1=2987,2353,2354,
 igr2=2989,2990,2991,2993,2994,2995,2989,2990,2991,2993,
      2994,2995,2401,2402,2403,2405,2406,2407,
 &end
#
#  104 ARG  QB          107 ALA  MB          3.50    (#   4533:20   Unique)
 &rst
  ixpk= 4533, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1669,1670,
 igr2=1719,1720,1721,
 &end
#
#    6 ASN  HB-         107 ALA  MB          3.50    (#   4534:20   Unique)
 &rst
  ixpk= 4534, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  77,  78,
 igr2=1719,1720,1721,
 &end
#
#    6 ASN  HB+         107 ALA  MB          3.50    (#   4535:20   Unique)
 &rst
  ixpk= 4535, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  77,  78,
 igr2=1719,1720,1721,
 &end
#
#    0 AMB  20-2:4539   107 ALA  MB          4.50    (#   4539:20   Single Ambig)
 &rst
  ixpk= 4539, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1=1729,1690,1691,1690,1691,
 igr2=1719,1720,1721,
 &end
#
#    0 AMB  20-2:4541    88 ALA  MB          4.50    (#   4541:20   Single Ambig)
 &rst
  ixpk= 4541, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1370,1432,
 igr2=1424,1425,1426,
 &end
#
#    0 AMB  20-2:4542    88 ALA  MB          4.50    (#   4542:20   Single Ambig)
 &rst
  ixpk= 4542, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1369,1383,
 igr2=1424,1425,1426,
 &end
#
#  131 ILE  MD1         128 ALA  MB          4.50    (#   4543:20   Unique)
 &rst
  ixpk= 4543, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2067,2068,2069,
 igr2=2014,2015,2016,
 &end
#
#    0 AMB  20-2:4544   128 ALA  MB          3.50    (#   4544:20   Single Ambig)
 &rst
  ixpk= 4544, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1436,1437,1438,2060,2061,2062,
 igr2=2014,2015,2016,
 &end
#
#   89 ILE  MD1         128 ALA  MB          4.50    (#   4545:20   Unique)
 &rst
  ixpk= 4545, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=1443,1444,1445,
 igr2=2014,2015,2016,
 &end
#
#   93 ALA  MB          128 ALA  MB          3.50    (#   4546:20   Unique)
 &rst
  ixpk= 4546, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1504,1505,1506,
 igr2=2014,2015,2016,
 &end
#
#  131 ILE  HB          128 ALA  MB          3.50    (#   4547:20   Unique)
 &rst
  ixpk= 4547, iat=2058,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2014,2015,2016,
 &end
#
#    0 AMB  20-2:4548   128 ALA  MB          4.50    (#   4548:20   Single Ambig)
 &rst
  ixpk= 4548, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1782,2097,
 igr2=2014,2015,2016,
 &end
#
#   92 VAL  HB          128 ALA  MB          6.00    (#   4549:20   Unique)
 &rst
  ixpk= 4549, iat=1488,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2014,2015,2016,
 &end
#
#  125 ILE  HB          128 ALA  MB          3.50    (#   4550:20   Unique)
 &rst
  ixpk= 4550, iat=1973,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2014,2015,2016,
 &end
#
#   89 ILE  HA          128 ALA  MB          6.00    (#   4552:20   Unique)
 &rst
  ixpk= 4552, iat=1432,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2014,2015,2016,
 &end
#
#  133 ARG  QD          128 ALA  MB          4.50    (#   4553:20   Unique)
 &rst
  ixpk= 4553, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2102,2103,
 igr2=2014,2015,2016,
 &end
#
#    0 AMB  20-2:4554   128 ALA  MB          3.50    (#   4554:20   Single Ambig)
 &rst
  ixpk= 4554, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1451,1990,
 igr2=2014,2015,2016,
 &end
#
#   89 ILE  HA          125 ILE  MG2         6.00    (#   4557:20   Unique)
 &rst
  ixpk= 4557, iat=1432,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1975,1976,1977,
 &end
#
#   86 PHE  HB3         125 ILE  MG2         6.00    (#   4558:20   Unique)
 &rst
  ixpk= 4558, iat=1398,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1975,1976,1977,
 &end
#
#    0 AMB  20-2:4559   114 ILE  MG2         3.50    (#   4559:20   Single Ambig)
 &rst
  ixpk= 4559, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2160,1838,1844,1845,
 igr2=1840,1841,1842,
 &end
#
#   89 ILE  HB          125 ILE  MG2         3.50    (#   4560:20   Unique)
 &rst
  ixpk= 4560, iat=1434,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1975,1976,1977,
 &end
#
#   89 ILE  MG2         125 ILE  MG2         3.50    (#   4561:20   Unique)
 &rst
  ixpk= 4561, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1436,1437,1438,
 igr2=1975,1976,1977,
 &end
#
#   89 ILE  MD1         125 ILE  MG2         3.50    (#   4562:20   Unique)
 &rst
  ixpk= 4562, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1443,1444,1445,
 igr2=1975,1976,1977,
 &end
#
#  172 LEU  MDY         114 ILE  MG2         3.50    (#   4568:20   Unique)
 &rst
  ixpk= 4568, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2751,2752,2753,2755,2756,2757,
 igr2=1840,1841,1842,
 &end
#
#    0 AMB  20-2:4569   114 ILE  MG2         3.50    (#   4569:20   Single Ambig)
 &rst
  ixpk= 4569, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2169,2170,2171, 411, 412, 413,
 igr2=1840,1841,1842,
 &end
#
#    0 AMB  20-2:4570   125 ILE  MG2         3.50    (#   4570:20   Single Ambig)
 &rst
  ixpk= 4570, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2454,2455,1397,
 igr2=1975,1976,1977,
 &end
#
#   86 PHE  HA          125 ILE  MG2         3.50    (#   4571:20   Unique)
 &rst
  ixpk= 4571, iat=1395,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1975,1976,1977,
 &end
#
#   27 ILE  HA          114 ILE  MG2         4.50    (#   4572:20   Unique)
 &rst
  ixpk= 4572, iat= 407,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1840,1841,1842,
 &end
#
#    0 AMB  20-2:4573   135 ILE  MG2         3.50    (#   4573:20   Single Ambig)
 &rst
  ixpk= 4573, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2097,2587,1819,
 igr2=2143,2144,2145,
 &end
#
#    0 AMB  20-2:4574   135 ILE  MG2         3.50    (#   4574:20   Single Ambig)
 &rst
  ixpk= 4574, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2141,2399,
 igr2=2143,2144,2145,
 &end
#
#    0 AMB  20-2:4575   135 ILE  MG2         3.50    (#   4575:20   Single Ambig)
 &rst
  ixpk= 4575, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=2150,2151,2152,2401,2402,2403,2405,2406,2407,
 igr2=2143,2144,2145,
 &end
#
#    0 AMB  20-2:4576   135 ILE  MG2         3.50    (#   4576:20   Single Ambig)
 &rst
  ixpk= 4576, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2593,2594,2595,2589,2590,2591,
 igr2=2143,2144,2145,
 &end
#
#    0 AMB  20-2:4577     0 AMB  20-1:4577   4.50    (#   4577:20   Double Ambig)
 &rst
  ixpk= 4577, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.58, r4= 9.33,
 igr1=1443,1444,1445,2195,2196,2197,2192,2193,
 igr2=1975,1976,1977,1840,1841,1842,
 &end
#
#  154 PHE  HB+         135 ILE  MG2         4.50    (#   4578:20   Unique)
 &rst
  ixpk= 4578, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2454,2455,
 igr2=2143,2144,2145,
 &end
#
#  154 PHE  HB-         135 ILE  MG2         3.50    (#   4579:20   Unique)
 &rst
  ixpk= 4579, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2454,2455,
 igr2=2143,2144,2145,
 &end
#
#  103 ALA  HA          103 ALA  MB          3.50    (#   4581:20   Preassigned)
 &rst
  ixpk= 4581, iat=1657,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1659,1660,1661,
 &end
#
#   74 LYS  QE           71 ALA  MB          4.50    (#   4582:20   Unique)
 &rst
  ixpk= 4582, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1194,1195,
 igr2=1137,1138,1139,
 &end
#
#   66 TRP  HB3          71 ALA  MB          3.50    (#   4583:20   Unique)
 &rst
  ixpk= 4583, iat=1054,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1137,1138,1139,
 &end
#
#  114 ILE  HG1+        112 ILE  MG2         3.50    (#   4584:20   Unique)
 &rst
  ixpk= 4584, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1844,1845,
 igr2=1802,1803,1804,
 &end
#
#    0 AMB  20-2:4585   103 ALA  MB          4.50    (#   4585:20   Single Ambig)
 &rst
  ixpk= 4585, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1603,1604,1579,1580,
 igr2=1659,1660,1661,
 &end
#
#    0 AMB  20-2:4586   103 ALA  MB          4.50    (#   4586:20   Single Ambig)
 &rst
  ixpk= 4586, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=1606,1607,1606,1607, 108,1634,
 igr2=1659,1660,1661,
 &end
#
#   72 LEU  MDX          71 ALA  MB          6.00    (#   4588:20   Unique)
 &rst
  ixpk= 4588, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.71, r4=10.46,
 igr1=1152,1153,1154,1156,1157,1158,
 igr2=1137,1138,1139,
 &end
#
#    0 AMB  20-2:4590   115 THR  MG2         3.50    (#   4590:20   Single Ambig)
 &rst
  ixpk= 4590, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=2150,2151,2152,2401,2402,2403,2405,2406,2407,
 igr2=1859,1860,1861,
 &end
#
#  131 ILE  MD1          93 ALA  MB          3.50    (#   4591:20   Unique)
 &rst
  ixpk= 4591, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2067,2068,2069,
 igr2=1504,1505,1506,
 &end
#
#    0 AMB  20-2:4592    93 ALA  MB          4.50    (#   4592:20   Single Ambig)
 &rst
  ixpk= 4592, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=1436,1437,1438,2060,2061,2062,
 igr2=1504,1505,1506,
 &end
#
#  186 ILE  HB          186 ILE  MG2         2.70    (#   4593:20   Preassigned)
 &rst
  ixpk= 4593, iat=3003,  -1, r1= 0.00, r2= 1.80, r3= 3.24, r4= 3.99,
 igr2=3005,3006,3007,
 &end
#
#    0 AMB  20-2:4594     0 AMB  20-1:4594   3.50    (#   4594:20   Double Ambig)
 &rst
  ixpk= 4594, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=3009,3010,2083,2084,
 igr2=3005,3006,3007,2079,2080,2081,
 &end
#
#  162 PHE  HB-         132 ILE  MG2         6.00    (#   4595:20   Unique)
 &rst
  ixpk= 4595, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2567,2568,
 igr2=2079,2080,2081,
 &end
#
#    0 AMB  20-2:4596   132 ILE  MG2         3.50    (#   4596:20   Single Ambig)
 &rst
  ixpk= 4596, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2484,2485,2120,
 igr2=2079,2080,2081,
 &end
#
#  133 ARG  QD          131 ILE  MG2         4.50    (#   4597:20   Unique)
 &rst
  ixpk= 4597, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2102,2103,
 igr2=2060,2061,2062,
 &end
#
#  132 ILE  HB          131 ILE  MG2         6.00    (#   4599:20   Unique)
 &rst
  ixpk= 4599, iat=2077,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2060,2061,2062,
 &end
#
#  111 LEU  HB3         131 ILE  MG2         3.50    (#   4600:20   Unique)
 &rst
  ixpk= 4600, iat=1782,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2060,2061,2062,
 &end
#
#    0 AMB  20-2:4601   131 ILE  MG2         3.50    (#   4601:20   Single Ambig)
 &rst
  ixpk= 4601, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2058,1784,
 igr2=2060,2061,2062,
 &end
#
#    0 AMB  20-2:4602   131 ILE  MG2         3.50    (#   4602:20   Single Ambig)
 &rst
  ixpk= 4602, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1781,2064,2065,1743,
 igr2=2060,2061,2062,
 &end
#
#    7 VAL  MG2         186 ILE  MG2         4.50    (#   4603:20   Unique)
 &rst
  ixpk= 4603, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=  97,  98,  99,
 igr2=3005,3006,3007,
 &end
#
#   10 VAL  MG2         131 ILE  MG2         4.50    (#   4604:20   Unique)
 &rst
  ixpk= 4604, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1= 144, 145, 146,
 igr2=2060,2061,2062,
 &end
#
#    0 AMB  20-2:4605   131 ILE  MG2         3.50    (#   4605:20   Single Ambig)
 &rst
  ixpk= 4605, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1490,1491,1492,1746,1747,
 igr2=2060,2061,2062,
 &end
#
#    0 AMB  20-2:4606   131 ILE  MG2         3.50    (#   4606:20   Single Ambig)
 &rst
  ixpk= 4606, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.53, r4= 7.28,
 igr1=2064,2065,1786,1787,1788,1790,1791,1792,1786,1787,
      1788,1790,1791,1792,
 igr2=2060,2061,2062,
 &end
#
#    0 AMB  20-2:4607   131 ILE  MG2         3.50    (#   4607:20   Single Ambig)
 &rst
  ixpk= 4607, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2067,2068,2069,1749,1750,
 igr2=2060,2061,2062,
 &end
#
#    0 AMB  20-2:4608   115 THR  MG2         3.50    (#   4608:20   Single Ambig)
 &rst
  ixpk= 4608, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=2401,2402,2403,2405,2406,2407,1385,1386,1387,
 igr2=1859,1860,1861,
 &end
#
#  137 GLY  HA-         115 THR  MG2         3.50    (#   4609:20   Unique)
 &rst
  ixpk= 4609, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2177,2178,
 igr2=1859,1860,1861,
 &end
#
#    0 AMB  20-2:4610   115 THR  MG2         4.50    (#   4610:20   Single Ambig)
 &rst
  ixpk= 4610, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1= 213, 214, 213, 214,1381,
 igr2=1859,1860,1861,
 &end
#
#  172 LEU  MDY         136 ILE  MG2         4.50    (#   4611:20   Unique)
 &rst
  ixpk= 4611, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2751,2752,2753,2755,2756,2757,
 igr2=2162,2163,2164,
 &end
#
#  138 ILE  HG1-        136 ILE  MG2         3.50    (#   4612:20   Unique)
 &rst
  ixpk= 4612, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2192,2193,
 igr2=2162,2163,2164,
 &end
#
#    0 AMB  20-2:4613   136 ILE  MG2         3.50    (#   4613:20   Single Ambig)
 &rst
  ixpk= 4613, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.60, r4= 7.35,
 igr1=2649,2650,2651,2653,2654,2655,2169,2170,2171,2804,
      2805,2806,2808,2809,2810,
 igr2=2162,2163,2164,
 &end
#
#    0 AMB  20-2:4614   136 ILE  MG2         3.50    (#   4614:20   Single Ambig)
 &rst
  ixpk= 4614, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=2804,2805,2806,2808,2809,2810,1840,1841,1842,
 igr2=2162,2163,2164,
 &end
#
#    0 AMB  20-2:4615   136 ILE  MG2         3.50    (#   4615:20   Single Ambig)
 &rst
  ixpk= 4615, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1=2647,2644,2645,2192,2193,2606,2607,
 igr2=2162,2163,2164,
 &end
#
#    0 AMB  20-2:4616   136 ILE  MG2         3.50    (#   4616:20   Single Ambig)
 &rst
  ixpk= 4616, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2166,2167,2603,2604,
 igr2=2162,2163,2164,
 &end
#
#    0 AMB  20-2:4617   136 ILE  MG2         3.50    (#   4617:20   Single Ambig)
 &rst
  ixpk= 4617, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2603,2604,2603,2604,
 igr2=2162,2163,2164,
 &end
#
#    0 AMB  20-2:4618   136 ILE  MG2         3.50    (#   4618:20   Single Ambig)
 &rst
  ixpk= 4618, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2160,2799,
 igr2=2162,2163,2164,
 &end
#
#  137 GLY  HA-         136 ILE  MG2         6.00    (#   4619:20   Unique)
 &rst
  ixpk= 4619, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2177,2178,
 igr2=2162,2163,2164,
 &end
#
#    0 AMB  20-2:4620     0 AMB  20-1:4620   3.50    (#   4620:20   Double Ambig)
 &rst
  ixpk= 4620, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.27, r4= 9.02,
 igr1=2166,2167,2804,2805,2806,2808,2809,2810,1975,1976,
      1977,1786,1787,1788,1790,1791,1792,1786,1787,1788,
      1790,1791,1792,1840,1841,1842,1982,1983,1984,
 igr2=2162,2163,2164,1436,1437,1438,
 &end
#
#  125 ILE  HB           89 ILE  MG2         3.50    (#   4621:20   Unique)
 &rst
  ixpk= 4621, iat=1973,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1436,1437,1438,
 &end
#
#   89 ILE  MD1          89 ILE  MG2         3.50    (#   4622:20   Unique)
 &rst
  ixpk= 4622, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1443,1444,1445,
 igr2=1436,1437,1438,
 &end
#
#  183 ILE  HG1+        183 ILE  MG2         3.50    (#   4623:20   Unique)
 &rst
  ixpk= 4623, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2953,2954,
 igr2=2949,2950,2951,
 &end
#
#  186 ILE  HG1-        183 ILE  MG2         3.50    (#   4624:20   Unique)
 &rst
  ixpk= 4624, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=3009,3010,
 igr2=2949,2950,2951,
 &end
#
#    7 VAL  MG2         183 ILE  MG2         3.50    (#   4625:20   Unique)
 &rst
  ixpk= 4625, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=  97,  98,  99,
 igr2=2949,2950,2951,
 &end
#
#    0 AMB  20-2:4626     0 AMB  20-1:4626   3.50    (#   4626:20   Double Ambig)
 &rst
  ixpk= 4626, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=  68,  69,2484,2485,
 igr2=3005,3006,3007,2079,2080,2081,
 &end
#
#  132 ILE  HG1-        132 ILE  MG2         2.70    (#   4628:20   Unique)
 &rst
  ixpk= 4628, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.64, r4= 4.39,
 igr1=2083,2084,
 igr2=2079,2080,2081,
 &end
#
#    0 AMB  20-2:4629    27 ILE  MG2         3.50    (#   4629:20   Single Ambig)
 &rst
  ixpk= 4629, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 433, 434, 435, 437, 438, 439,2751,2752,2753,2755,
      2756,2757,
 igr2= 411, 412, 413,
 &end
#
#  128 ALA  MB           89 ILE  MG2         3.50    (#   4630:20   Unique)
 &rst
  ixpk= 4630, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2014,2015,2016,
 igr2=1436,1437,1438,
 &end
#
#  112 ILE  HB          112 ILE  MG2         3.50    (#   4631:20   Unique)
 &rst
  ixpk= 4631, iat=1800,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1802,1803,1804,
 &end
#
#    0 AMB  20-2:4632   115 THR  MG2         3.50    (#   4632:20   Single Ambig)
 &rst
  ixpk= 4632, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1821,1822,1823,2150,2151,2152,
 igr2=1859,1860,1861,
 &end
#
#    0 AMB  20-2:4633   112 ILE  MG2         4.50    (#   4633:20   Single Ambig)
 &rst
  ixpk= 4633, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2120, 154, 155,
 igr2=1802,1803,1804,
 &end
#
#  134 TYR  HB3         112 ILE  MG2         6.00    (#   4634:20   Unique)
 &rst
  ixpk= 4634, iat=2121,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1802,1803,1804,
 &end
#
#    0 AMB  20-2:4635   159 ALA  MB          3.50    (#   4635:20   Single Ambig)
 &rst
  ixpk= 4635, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2416,2504,2505,
 igr2=2531,2532,2533,
 &end
#
#  152 HIS  HB2         159 ALA  MB          6.00    (#   4636:20   Unique)
 &rst
  ixpk= 4636, iat=2415,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2531,2532,2533,
 &end
#
#    9 LEU  MDY         112 ILE  MG2         4.50    (#   4637:20   Unique)
 &rst
  ixpk= 4637, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 124, 125, 126, 128, 129, 130,
 igr2=1802,1803,1804,
 &end
#
#  165 ILE  MD1         165 ILE  MG2         3.50    (#   4638:20   Unique)
 &rst
  ixpk= 4638, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2634,2635,2636,
 igr2=2627,2628,2629,
 &end
#
#   90 ASN  QB           89 ILE  MG2         6.00    (#   4639:20   Unique)
 &rst
  ixpk= 4639, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1453,1454,
 igr2=1436,1437,1438,
 &end
#
#    0 AMB  20-2:4640    27 ILE  MG2         3.50    (#   4640:20   Single Ambig)
 &rst
  ixpk= 4640, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 193, 194, 193, 194,
 igr2= 411, 412, 413,
 &end
#
#    0 AMB  20-2:4641    27 ILE  MG2         3.50    (#   4641:20   Single Ambig)
 &rst
  ixpk= 4641, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 409,1838,
 igr2= 411, 412, 413,
 &end
#
#    0 AMB  20-2:4642    27 ILE  MG2         2.70    (#   4642:20   Single Ambig)
 &rst
  ixpk= 4642, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.37, r4= 5.12,
 igr1= 415, 416,1847,1848,1849, 431,
 igr2= 411, 412, 413,
 &end
#
#    0 AMB  20-2:4643    27 ILE  MG2         3.50    (#   4643:20   Single Ambig)
 &rst
  ixpk= 4643, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1840,1841,1842, 431, 278, 279, 280, 282, 283, 284,
      
 igr2= 411, 412, 413,
 &end
#
#    0 AMB  20-2:4644   112 ILE  MG2         2.70    (#   4644:20   Single Ambig)
 &rst
  ixpk= 4644, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.59, r4= 5.34,
 igr1=1809,1810,1811,2169,2170,2171,2166,2167,
 igr2=1802,1803,1804,
 &end
#
#    0 AMB  20-2:4645   112 ILE  MG2         2.70    (#   4645:20   Single Ambig)
 &rst
  ixpk= 4645, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.09, r4= 5.84,
 igr1=2169,2170,2171,2872,2873,2874,2876,2877,2878,2872,
      2873,2874,2876,2877,2878,
 igr2=1802,1803,1804,
 &end
#
#   89 ILE  HB           89 ILE  MG2         3.50    (#   4646:20   Unique)
 &rst
  ixpk= 4646, iat=1434,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1436,1437,1438,
 &end
#
#   89 ILE  HG1+         89 ILE  MG2         3.50    (#   4647:20   Unique)
 &rst
  ixpk= 4647, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1440,1441,
 igr2=1436,1437,1438,
 &end
#
#    0 AMB  20-2:4648   165 ILE  MG2         3.50    (#   4648:20   Single Ambig)
 &rst
  ixpk= 4648, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2251,2271,2272,
 igr2=2627,2628,2629,
 &end
#
#    0 AMB  20-2:4649   165 ILE  MG2         3.50    (#   4649:20   Single Ambig)
 &rst
  ixpk= 4649, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2353,2354,2353,2354,
 igr2=2627,2628,2629,
 &end
#
#  165 ILE  HB          165 ILE  MG2         3.50    (#   4650:20   Unique)
 &rst
  ixpk= 4650, iat=2625,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2627,2628,2629,
 &end
#
#   24 PHE  HB2          27 ILE  MG2         6.00    (#   4651:20   Unique)
 &rst
  ixpk= 4651, iat= 350,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 411, 412, 413,
 &end
#
#  165 ILE  HG1+        165 ILE  MG2         3.50    (#   4652:20   Unique)
 &rst
  ixpk= 4652, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2631,2632,
 igr2=2627,2628,2629,
 &end
#
#  183 ILE  HA          183 ILE  MG2         3.50    (#   4653:20   Preassigned)
 &rst
  ixpk= 4653, iat=2945,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2949,2950,2951,
 &end
#
#   43 TYR  HE            7 VAL  MG2         4.50    (#   4654:20   Unique)
 &rst
  ixpk= 4654, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 686, 691,
 igr2=  97,  98,  99,
 &end
#
#  165 ILE  HN          163 VAL  MG1         4.50    (#   4655:20   Unique)
 &rst
  ixpk= 4655, iat=2621,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2589,2590,2591,
 &end
#
#  152 HIS  HD2         163 VAL  MG1         3.50    (#   4656:20   Unique)
 &rst
  ixpk= 4656, iat=2424,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2589,2590,2591,
 &end
#
#   87 GLY  HN           88 ALA  MB          4.50    (#   4657:20   Unique)
 &rst
  ixpk= 4657, iat=1413,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1424,1425,1426,
 &end
#
#    0 AMB  20-2:4658   151 LEU  MDY         6.00    (#   4658:20   Single Ambig)
 &rst
  ixpk= 4658, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1=2156,1853,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#    7 VAL  HA          107 ALA  MB          3.50    (#   4660:20   Unique)
 &rst
  ixpk= 4660, iat=  89,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1719,1720,1721,
 &end
#
#  151 LEU  HA          151 LEU  MDY         3.50    (#   4661:20   Preassigned)
 &rst
  ixpk= 4661, iat=2394,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#  137 GLY  HA+         151 LEU  MDY         3.50    (#   4662:20   Unique)
 &rst
  ixpk= 4662, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2177,2178,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#   54 TYR  HA           48 VAL  MGY         4.50    (#   4663:20   Unique)
 &rst
  ixpk= 4663, iat= 845,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#  185 VAL  HN          185 VAL  MGX         3.50    (#   4664:20   Preassigned)
 &rst
  ixpk= 4664, iat=2983,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=2989,2990,2991,2993,2994,2995,
 &end
#
#   86 PHE  HA          119 ALA  MB          6.00    (#   4665:20   Unique)
 &rst
  ixpk= 4665, iat=1395,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1905,1906,1907,
 &end
#
#   89 ILE  MD1         119 ALA  MB          6.00    (#   4666:20   Unique)
 &rst
  ixpk= 4666, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.65, r4= 9.40,
 igr1=1443,1444,1445,
 igr2=1905,1906,1907,
 &end
#
#  125 ILE  HA          128 ALA  MB          6.00    (#   4667:20   Unique)
 &rst
  ixpk= 4667, iat=1971,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2014,2015,2016,
 &end
#
#  114 ILE  HA          114 ILE  MG2         3.50    (#   4668:20   Unique)
 &rst
  ixpk= 4668, iat=1836,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1840,1841,1842,
 &end
#
#    0 AMB  20-2:4669   125 ILE  MG2         4.50    (#   4669:20   Single Ambig)
 &rst
  ixpk= 4669, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2458,2466,2105,1948,
 igr2=1975,1976,1977,
 &end
#
#  154 PHE  HA          125 ILE  MG2         6.00    (#   4670:20   Unique)
 &rst
  ixpk= 4670, iat=2452,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1975,1976,1977,
 &end
#
#    0 AMB  20-2:4671   125 ILE  MG2         4.50    (#   4671:20   Single Ambig)
 &rst
  ixpk= 4671, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1969,1988,
 igr2=1975,1976,1977,
 &end
#
#    0 AMB  20-2:4672   114 ILE  MG2         3.50    (#   4672:20   Single Ambig)
 &rst
  ixpk= 4672, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1853,2156,
 igr2=1840,1841,1842,
 &end
#
#   90 ASN  HD2+        125 ILE  MG2         4.50    (#   4676:20   Unique)
 &rst
  ixpk= 4676, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1458,1459,
 igr2=1975,1976,1977,
 &end
#
#   86 PHE  HD          125 ILE  MG2         3.50    (#   4677:20   Unique)
 &rst
  ixpk= 4677, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1401,1409,
 igr2=1975,1976,1977,
 &end
#
#    0 AMB  20-2:4678     0 AMB  20-1:4678   3.50    (#   4678:20   Double Ambig)
 &rst
  ixpk= 4678, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1403,1407, 463, 471,
 igr2=1975,1976,1977,1840,1841,1842,
 &end
#
#  128 ALA  HA          128 ALA  MB          3.50    (#   4681:20   Preassigned)
 &rst
  ixpk= 4681, iat=2012,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2014,2015,2016,
 &end
#
#   86 PHE  HD          125 ILE  MG2         3.50    (#   4682:20   Unique)
 &rst
  ixpk= 4682, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1401,1409,
 igr2=1975,1976,1977,
 &end
#
#   89 ILE  HG1-        128 ALA  MB          6.00    (#   4683:20   Unique)
 &rst
  ixpk= 4683, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1440,1441,
 igr2=2014,2015,2016,
 &end
#
#  114 ILE  HN          114 ILE  MG2         4.50    (#   4685:20   Unique)
 &rst
  ixpk= 4685, iat=1834,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1840,1841,1842,
 &end
#
#    0 AMB  20-2:4686     0 AMB  20-1:4686   3.50    (#   4686:20   Double Ambig)
 &rst
  ixpk= 4686, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1853,2156,
 igr2=1840,1841,1842,2143,2144,2145,
 &end
#
#    0 AMB  20-2:4687   135 ILE  MG2         3.50    (#   4687:20   Single Ambig)
 &rst
  ixpk= 4687, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2599,1815,
 igr2=2143,2144,2145,
 &end
#
#   13 PHE  HA          114 ILE  MG2         6.00    (#   4688:20   Unique)
 &rst
  ixpk= 4688, iat= 191,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1840,1841,1842,
 &end
#
#  115 THR  HA          114 ILE  MG2         6.00    (#   4689:20   Unique)
 &rst
  ixpk= 4689, iat=1855,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1840,1841,1842,
 &end
#
#  134 TYR  HA          135 ILE  MG2         4.50    (#   4690:20   Unique)
 &rst
  ixpk= 4690, iat=2118,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2143,2144,2145,
 &end
#
#    0 AMB  20-2:4692   135 ILE  MG2         4.50    (#   4692:20   Single Ambig)
 &rst
  ixpk= 4692, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2472,2567,2568,2413,
 igr2=2143,2144,2145,
 &end
#
#    0 AMB  20-2:4693   125 ILE  MG2         4.50    (#   4693:20   Single Ambig)
 &rst
  ixpk= 4693, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1451,1415,1416,1990,
 igr2=1975,1976,1977,
 &end
#
#    0 AMB  20-2:4695   135 ILE  MG2         4.50    (#   4695:20   Single Ambig)
 &rst
  ixpk= 4695, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2158,2177,2178,
 igr2=2143,2144,2145,
 &end
#
#    0 AMB  20-2:4696   125 ILE  MG2         6.00    (#   4696:20   Single Ambig)
 &rst
  ixpk= 4696, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1430,1420,
 igr2=1975,1976,1977,
 &end
#
#    0 AMB  20-2:4697   135 ILE  MG2         4.50    (#   4697:20   Single Ambig)
 &rst
  ixpk= 4697, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2470,2450,
 igr2=2143,2144,2145,
 &end
#
#    0 AMB  20-2:4698   125 ILE  MG2         4.50    (#   4698:20   Single Ambig)
 &rst
  ixpk= 4698, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2105,1964,1965,
 igr2=1975,1976,1977,
 &end
#
#  154 PHE  HD          135 ILE  MG2         4.50    (#   4699:20   Unique)
 &rst
  ixpk= 4699, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2458,2466,
 igr2=2143,2144,2145,
 &end
#
#    0 AMB  20-2:4701   135 ILE  MG2         3.50    (#   4701:20   Single Ambig)
 &rst
  ixpk= 4701, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2474,2475,2476,2147,2148,2397,
 igr2=2143,2144,2145,
 &end
#
#  125 ILE  HG1+        125 ILE  MG2         3.50    (#   4702:20   Unique)
 &rst
  ixpk= 4702, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1979,1980,
 igr2=1975,1976,1977,
 &end
#
#  151 LEU  HB2         135 ILE  MG2         4.50    (#   4703:20   Unique)
 &rst
  ixpk= 4703, iat=2396,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2143,2144,2145,
 &end
#
#  151 LEU  MDX         135 ILE  MG2         3.50    (#   4704:20   Unique)
 &rst
  ixpk= 4704, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2401,2402,2403,2405,2406,2407,
 igr2=2143,2144,2145,
 &end
#
#  135 ILE  HG1-        135 ILE  MG2         3.50    (#   4705:20   Unique)
 &rst
  ixpk= 4705, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2147,2148,
 igr2=2143,2144,2145,
 &end
#
#  135 ILE  HG1-        135 ILE  MG2         3.50    (#   4706:20   Unique)
 &rst
  ixpk= 4706, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2147,2148,
 igr2=2143,2144,2145,
 &end
#
#  151 LEU  HA          135 ILE  MG2         6.00    (#   4707:20   Unique)
 &rst
  ixpk= 4707, iat=2394,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2143,2144,2145,
 &end
#
#    0 AMB  20-2:4708   128 ALA  MB          3.50    (#   4708:20   Single Ambig)
 &rst
  ixpk= 4708, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1451,1502,
 igr2=2014,2015,2016,
 &end
#
#   77 LYS  HN           79 MET  HE          6.00    (#   4709:20   Unique)
 &rst
  ixpk= 4709, iat=1236,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1288,1289,1290,
 &end
#
#    0 AMB  20-2:4710    79 MET  HE          4.50    (#   4710:20   Single Ambig)
 &rst
  ixpk= 4710, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 807, 221,
 igr2=1288,1289,1290,
 &end
#
#    0 AMB  20-2:4711    79 MET  HE          4.50    (#   4711:20   Single Ambig)
 &rst
  ixpk= 4711, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1= 782, 783, 818,
 igr2=1288,1289,1290,
 &end
#
#   49 GLN  HE2-         79 MET  HE          4.50    (#   4712:20   Unique)
 &rst
  ixpk= 4712, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 782, 783,
 igr2=1288,1289,1290,
 &end
#
#   54 TYR  HN           79 MET  HE          6.00    (#   4713:20   Unique)
 &rst
  ixpk= 4713, iat= 843,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1288,1289,1290,
 &end
#
#   81 LEU  HN           79 MET  HE          6.00    (#   4714:20   Unique)
 &rst
  ixpk= 4714, iat=1313,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1288,1289,1290,
 &end
#
#    0 AMB  20-2:4715    79 MET  HE          4.50    (#   4715:20   Single Ambig)
 &rst
  ixpk= 4715, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=1271, 795, 803,
 igr2=1288,1289,1290,
 &end
#
#    0 AMB  20-2:4716    79 MET  HE          4.50    (#   4716:20   Single Ambig)
 &rst
  ixpk= 4716, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 789, 814,
 igr2=1288,1289,1290,
 &end
#
#   54 TYR  HA           79 MET  HE          3.50    (#   4717:20   Unique)
 &rst
  ixpk= 4717, iat= 845,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1288,1289,1290,
 &end
#
#    0 AMB  20-2:4718    79 MET  HE          4.50    (#   4718:20   Single Ambig)
 &rst
  ixpk= 4718, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 809, 866,
 igr2=1288,1289,1290,
 &end
#
#   49 GLN  HA           79 MET  HE          4.50    (#   4722:20   Unique)
 &rst
  ixpk= 4722, iat= 772,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1288,1289,1290,
 &end
#
#   51 SER  HB+          79 MET  HE          4.50    (#   4723:20   Unique)
 &rst
  ixpk= 4723, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 811, 812,
 igr2=1288,1289,1290,
 &end
#
#    0 AMB  20-2:4724    79 MET  HE          4.50    (#   4724:20   Single Ambig)
 &rst
  ixpk= 4724, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 811, 812, 836, 837,
 igr2=1288,1289,1290,
 &end
#
#   55 LYS  HE+          79 MET  HE          4.50    (#   4725:20   Unique)
 &rst
  ixpk= 4725, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 877, 878,
 igr2=1288,1289,1290,
 &end
#
#    0 AMB  20-2:4726    79 MET  HE          4.50    (#   4726:20   Single Ambig)
 &rst
  ixpk= 4726, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1= 877, 878, 791,
 igr2=1288,1289,1290,
 &end
#
#   79 MET  HG+          79 MET  HE          3.50    (#   4727:20   Preassigned)
 &rst
  ixpk= 4727, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1282,1283,
 igr2=1288,1289,1290,
 &end
#
#   79 MET  HG-          79 MET  HE          3.50    (#   4728:20   Preassigned)
 &rst
  ixpk= 4728, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1282,1283,
 igr2=1288,1289,1290,
 &end
#
#   49 GLN  QG           79 MET  HE          3.50    (#   4729:20   Unique)
 &rst
  ixpk= 4729, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 777, 778,
 igr2=1288,1289,1290,
 &end
#
#   54 TYR  HB+          79 MET  HE          6.00    (#   4730:20   Unique)
 &rst
  ixpk= 4730, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 847, 848,
 igr2=1288,1289,1290,
 &end
#
#   55 LYS  HB2          79 MET  HE          2.70    (#   4731:20   Unique)
 &rst
  ixpk= 4731, iat= 868,  -1, r1= 0.00, r2= 1.80, r3= 3.24, r4= 3.99,
 igr2=1288,1289,1290,
 &end
#
#   55 LYS  HG-          79 MET  HE          4.50    (#   4733:20   Unique)
 &rst
  ixpk= 4733, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 871, 872,
 igr2=1288,1289,1290,
 &end
#
#    0 AMB  20-2:4734    79 MET  HE          3.50    (#   4734:20   Single Ambig)
 &rst
  ixpk= 4734, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1= 869, 874, 875, 874, 875,
 igr2=1288,1289,1290,
 &end
#
#   90 ASN  HA           93 ALA  MB          3.50    (#   4736:20   Unique)
 &rst
  ixpk= 4736, iat=1451,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1504,1505,1506,
 &end
#
#   90 ASN  QB           93 ALA  MB          4.50    (#   4737:20   Unique)
 &rst
  ixpk= 4737, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1453,1454,
 igr2=1504,1505,1506,
 &end
#
#    0 AMB  20-2:4738    93 ALA  MB          6.00    (#   4738:20   Single Ambig)
 &rst
  ixpk= 4738, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.65, r4= 9.40,
 igr1=1563,1571,2020,
 igr2=1504,1505,1506,
 &end
#
#    0 AMB  20-2:4739    93 ALA  MB          6.00    (#   4739:20   Single Ambig)
 &rst
  ixpk= 4739, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1539,1555,
 igr2=1504,1505,1506,
 &end
#
#    0 AMB  20-2:4741   103 ALA  MB          3.50    (#   4741:20   Single Ambig)
 &rst
  ixpk= 4741, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1557,1577,
 igr2=1659,1660,1661,
 &end
#
#   98 ARG  HN          103 ALA  MB          3.50    (#   4743:20   Unique)
 &rst
  ixpk= 4743, iat=1575,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1659,1660,1661,
 &end
#
#    0 AMB  20-2:4744   103 ALA  MB          3.50    (#   4744:20   Single Ambig)
 &rst
  ixpk= 4744, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 955, 963,1565,1569,
 igr2=1659,1660,1661,
 &end
#
#   60 PHE  HE          103 ALA  MB          3.50    (#   4745:20   Unique)
 &rst
  ixpk= 4745, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 957, 961,
 igr2=1659,1660,1661,
 &end
#
#    0 AMB  20-2:4746    79 MET  HE          3.50    (#   4746:20   Single Ambig)
 &rst
  ixpk= 4746, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 864, 770,
 igr2=1288,1289,1290,
 &end
#
#   66 TRP  HB2          71 ALA  MB          4.50    (#   4747:20   Unique)
 &rst
  ixpk= 4747, iat=1053,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1137,1138,1139,
 &end
#
#   68 ASP  HA           71 ALA  MB          4.50    (#   4748:20   Unique)
 &rst
  ixpk= 4748, iat=1097,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1137,1138,1139,
 &end
#
#  110 VAL  HA          132 ILE  MG2         4.50    (#   4749:20   Unique)
 &rst
  ixpk= 4749, iat=1763,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2079,2080,2081,
 &end
#
#  156 SER  HG          132 ILE  MG2         4.50    (#   4750:20   Unique)
 &rst
  ixpk= 4750, iat=2487,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2079,2080,2081,
 &end
#
#  128 ALA  HA          131 ILE  MG2         6.00    (#   4751:20   Unique)
 &rst
  ixpk= 4751, iat=2012,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2060,2061,2062,
 &end
#
#  110 VAL  HA          131 ILE  MG2         4.50    (#   4753:20   Unique)
 &rst
  ixpk= 4753, iat=1763,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2060,2061,2062,
 &end
#
#  111 LEU  HA          131 ILE  MG2         4.50    (#   4754:20   Unique)
 &rst
  ixpk= 4754, iat=1779,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2060,2061,2062,
 &end
#
#  133 ARG  HA          131 ILE  MG2         4.50    (#   4755:20   Unique)
 &rst
  ixpk= 4755, iat=2094,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2060,2061,2062,
 &end
#
#  137 GLY  HA+         115 THR  MG2         4.50    (#   4756:20   Unique)
 &rst
  ixpk= 4756, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2177,2178,
 igr2=1859,1860,1861,
 &end
#
#  133 ARG  HN          132 ILE  MG2         3.50    (#   4757:20   Preassigned)
 &rst
  ixpk= 4757, iat=2092,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2079,2080,2081,
 &end
#
#  111 LEU  HN          131 ILE  MG2         3.50    (#   4759:20   Unique)
 &rst
  ixpk= 4759, iat=1777,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2060,2061,2062,
 &end
#
#    0 AMB  20-2:4760   131 ILE  MG2         4.50    (#   4760:20   Single Ambig)
 &rst
  ixpk= 4760, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2116, 134,1796,
 igr2=2060,2061,2062,
 &end
#
#    0 AMB  20-2:4761   131 ILE  MG2         4.50    (#   4761:20   Single Ambig)
 &rst
  ixpk= 4761, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2092,1761,
 igr2=2060,2061,2062,
 &end
#
#  132 ILE  HN          131 ILE  MG2         3.50    (#   4762:20   Unique)
 &rst
  ixpk= 4762, iat=2073,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2060,2061,2062,
 &end
#
#  187 GLU  HN          186 ILE  MG2         3.50    (#   4763:20   Unique)
 &rst
  ixpk= 4763, iat=3018,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=3005,3006,3007,
 &end
#
#    0 AMB  20-2:4764    71 ALA  MB          3.50    (#   4764:20   Single Ambig)
 &rst
  ixpk= 4764, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1095,1162,1181,
 igr2=1137,1138,1139,
 &end
#
#  134 TYR  HD          132 ILE  MG2         3.50    (#   4765:20   Unique)
 &rst
  ixpk= 4765, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2124,2133,
 igr2=2079,2080,2081,
 &end
#
#    0 AMB  20-2:4766   132 ILE  MG2         3.50    (#   4766:20   Single Ambig)
 &rst
  ixpk= 4766, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2573,2577,2575,
 igr2=2079,2080,2081,
 &end
#
#    0 AMB  20-2:4767     0 AMB  20-1:4767   4.50    (#   4767:20   Double Ambig)
 &rst
  ixpk= 4767, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1= 686, 691,2571,2579,
 igr2=3005,3006,3007,2079,2080,2081,
 &end
#
#   97 PHE  HZ          131 ILE  MG2         4.50    (#   4769:20   Unique)
 &rst
  ixpk= 4769, iat=1567,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2060,2061,2062,
 &end
#
#   97 PHE  HE          131 ILE  MG2         3.50    (#   4770:20   Unique)
 &rst
  ixpk= 4770, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1565,1569,
 igr2=2060,2061,2062,
 &end
#
#  166 LEU  HN          136 ILE  MG2         4.50    (#   4772:20   Unique)
 &rst
  ixpk= 4772, iat=2640,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2162,2163,2164,
 &end
#
#  137 GLY  HN          136 ILE  MG2         3.50    (#   4773:20   Unique)
 &rst
  ixpk= 4773, iat=2175,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2162,2163,2164,
 &end
#
#  138 ILE  HN          136 ILE  MG2         6.00    (#   4774:20   Unique)
 &rst
  ixpk= 4774, iat=2182,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2162,2163,2164,
 &end
#
#    0 AMB  20-2:4775   183 ILE  MG2         4.50    (#   4775:20   Single Ambig)
 &rst
  ixpk= 4775, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2962,3033,2999,
 igr2=2949,2950,2951,
 &end
#
#    0 AMB  20-2:4776   183 ILE  MG2         4.50    (#   4776:20   Single Ambig)
 &rst
  ixpk= 4776, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2999,2943,
 igr2=2949,2950,2951,
 &end
#
#    0 AMB  20-2:4777     0 AMB  20-1:4777   4.50    (#   4777:20   Double Ambig)
 &rst
  ixpk= 4777, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 475, 424, 544,
 igr2= 488, 489, 490, 557, 558, 559,
 &end
#
#    0 AMB  20-2:4778    31 MET  HE          3.50    (#   4778:20   Single Ambig)
 &rst
  ixpk= 4778, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 158, 166, 424,
 igr2= 488, 489, 490,
 &end
#
#    0 AMB  20-2:4779     0 AMB  20-1:4779   3.50    (#   4779:20   Double Ambig)
 &rst
  ixpk= 4779, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 998,1007, 158, 166,
 igr2= 557, 558, 559, 488, 489, 490,
 &end
#
#    0 AMB  20-2:4780   115 THR  MG2         3.50    (#   4780:20   Single Ambig)
 &rst
  ixpk= 4780, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2257,2261,2259, 799,
 igr2=1859,1860,1861,
 &end
#
#    0 AMB  20-2:4781     0 AMB  20-1:4781   4.50    (#   4781:20   Double Ambig)
 &rst
  ixpk= 4781, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.93, r4= 8.68,
 igr1= 799,1964,1965, 797, 801,
 igr2=1859,1860,1861,2004,2005,2006,
 &end
#
#  117 GLY  HN          115 THR  MG2         4.50    (#   4782:20   Unique)
 &rst
  ixpk= 4782, iat=1879,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1859,1860,1861,
 &end
#
#    0 AMB  20-2:4783   115 THR  MG2         4.50    (#   4783:20   Single Ambig)
 &rst
  ixpk= 4783, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1867,1901,
 igr2=1859,1860,1861,
 &end
#
#  115 THR  HN          115 THR  MG2         3.50    (#   4785:20   Preassigned)
 &rst
  ixpk= 4785, iat=1853,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1859,1860,1861,
 &end
#
#   93 ALA  HA          131 ILE  MG2         4.50    (#   4786:20   Unique)
 &rst
  ixpk= 4786, iat=1502,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2060,2061,2062,
 &end
#
#  138 ILE  MG2         136 ILE  MG2         6.00    (#   4787:20   Unique)
 &rst
  ixpk= 4787, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.65, r4= 9.40,
 igr1=2188,2189,2190,
 igr2=2162,2163,2164,
 &end
#
#    0 AMB  20-2:4788   136 ILE  MG2         4.50    (#   4788:20   Single Ambig)
 &rst
  ixpk= 4788, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1836,2139,
 igr2=2162,2163,2164,
 &end
#
#   90 ASN  HN           89 ILE  MG2         4.50    (#   4790:20   Unique)
 &rst
  ixpk= 4790, iat=1449,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1436,1437,1438,
 &end
#
#  184 TYR  HA          183 ILE  MG2         4.50    (#   4791:20   Unique)
 &rst
  ixpk= 4791, iat=2964,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2949,2950,2951,
 &end
#
#  115 THR  HA          115 THR  MG2         4.50    (#   4792:20   Preassigned)
 &rst
  ixpk= 4792, iat=1855,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1859,1860,1861,
 &end
#
#  116 ASP  HA          115 THR  MG2         6.00    (#   4793:20   Unique)
 &rst
  ixpk= 4793, iat=1869,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1859,1860,1861,
 &end
#
#    0 AMB  20-2:4794   115 THR  MG2         4.50    (#   4794:20   Single Ambig)
 &rst
  ixpk= 4794, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=1836,2139,1903,
 igr2=1859,1860,1861,
 &end
#
#    0 AMB  20-2:4795   115 THR  MG2         6.00    (#   4795:20   Single Ambig)
 &rst
  ixpk= 4795, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1389,1817,
 igr2=1859,1860,1861,
 &end
#
#    0 AMB  20-2:4796     0 AMB  20-1:4796   3.50    (#   4796:20   Double Ambig)
 &rst
  ixpk= 4796, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1= 927, 160, 164, 199, 203, 201, 197, 205,
 igr2= 557, 558, 559, 488, 489, 490,
 &end
#
#  128 ALA  HN          127 ALA  MB          3.50    (#   4797:20   Unique)
 &rst
  ixpk= 4797, iat=2010,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2004,2005,2006,
 &end
#
#    0 AMB  20-2:4798     0 AMB  20-1:4798   4.50    (#   4798:20   Double Ambig)
 &rst
  ixpk= 4798, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1= 494,1143, 455,1121,
 igr2= 488, 489, 490, 557, 558, 559,
 &end
#
#   27 ILE  HN           27 ILE  MG2         4.50    (#   4799:20   Unique)
 &rst
  ixpk= 4799, iat= 405,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2= 411, 412, 413,
 &end
#
#    0 AMB  20-2:4800   165 ILE  MG2         3.50    (#   4800:20   Single Ambig)
 &rst
  ixpk= 4800, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2640,2659,
 igr2=2627,2628,2629,
 &end
#
#   13 PHE  HA           27 ILE  MG2         4.50    (#   4801:20   Unique)
 &rst
  ixpk= 4801, iat= 191,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2= 411, 412, 413,
 &end
#
#    0 AMB  20-2:4802   159 ALA  MB          4.50    (#   4802:20   Single Ambig)
 &rst
  ixpk= 4802, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2583,2548,2428,
 igr2=2531,2532,2533,
 &end
#
#  112 ILE  HA          112 ILE  MG2         3.50    (#   4804:20   Preassigned)
 &rst
  ixpk= 4804, iat=1798,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1802,1803,1804,
 &end
#
#    0 AMB  20-2:4805   112 ILE  MG2         4.50    (#   4805:20   Single Ambig)
 &rst
  ixpk= 4805, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 152,1817,
 igr2=1802,1803,1804,
 &end
#
#  134 TYR  HD          112 ILE  MG2         3.50    (#   4807:20   Unique)
 &rst
  ixpk= 4807, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2124,2133,
 igr2=1802,1803,1804,
 &end
#
#  113 ILE  HN          112 ILE  MG2         3.50    (#   4808:20   Unique)
 &rst
  ixpk= 4808, iat=1815,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1802,1803,1804,
 &end
#
#    0 AMB  20-2:4809   112 ILE  MG2         3.50    (#   4809:20   Single Ambig)
 &rst
  ixpk= 4809, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1834,1796,2137,
 igr2=1802,1803,1804,
 &end
#
#    0 AMB  20-2:4810    27 ILE  MG2         3.50    (#   4810:20   Single Ambig)
 &rst
  ixpk= 4810, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 424, 463, 471,
 igr2= 411, 412, 413,
 &end
#
#   13 PHE  HD           27 ILE  MG2         3.50    (#   4811:20   Unique)
 &rst
  ixpk= 4811, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 197, 205,
 igr2= 411, 412, 413,
 &end
#
#    0 AMB  20-2:4812   113 ILE  MG2         3.50    (#   4812:20   Single Ambig)
 &rst
  ixpk= 4812, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2139,1836,
 igr2=1821,1822,1823,
 &end
#
#  114 ILE  HN          113 ILE  MG2         3.50    (#   4813:20   Unique)
 &rst
  ixpk= 4813, iat=1834,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1821,1822,1823,
 &end
#
#  142 PHE  HD          165 ILE  MG2         6.00    (#   4814:20   Unique)
 &rst
  ixpk= 4814, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2255,2263,
 igr2=2627,2628,2629,
 &end
#
#   27 ILE  HN           27 ILE  MG2         6.00    (#   4815:20   Unique)
 &rst
  ixpk= 4815, iat= 405,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 411, 412, 413,
 &end
#
#   35 MET  HG-          35 MET  HE          3.50    (#   4816:20   Unique)
 &rst
  ixpk= 4816, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 551, 552,
 igr2= 557, 558, 559,
 &end
#
#   72 LEU  MDX          35 MET  HE          3.50    (#   4817:20   Unique)
 &rst
  ixpk= 4817, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1152,1153,1154,1156,1157,1158,
 igr2= 557, 558, 559,
 &end
#
#    0 AMB  20-2:4818     0 AMB  20-1:4818   3.50    (#   4818:20   Double Ambig)
 &rst
  ixpk= 4818, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.32, r4= 8.07,
 igr1= 479, 480,1152,1153,1154,1156,1157,1158,1171,1172,
      1173,1175,1176,1177,
 igr2= 488, 489, 490, 557, 558, 559,
 &end
#
#    0 AMB  20-2:4820     0 AMB  20-1:4820   3.50    (#   4820:20   Double Ambig)
 &rst
  ixpk= 4820, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 549,1169,
 igr2= 557, 558, 559, 488, 489, 490,
 &end
#
#    0 AMB  20-2:4821     0 AMB  20-1:4821   3.50    (#   4821:20   Double Ambig)
 &rst
  ixpk= 4821, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 718, 482, 483, 551, 552,
 igr2= 557, 558, 559, 488, 489, 490,
 &end
#
#   31 MET  HA           31 MET  HE          4.50    (#   4822:20   Unique)
 &rst
  ixpk= 4822, iat= 477,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2= 488, 489, 490,
 &end
#
#    0 AMB  20-2:4823     0 AMB  20-1:4823   4.50    (#   4823:20   Double Ambig)
 &rst
  ixpk= 4823, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 154, 155, 719,
 igr2= 488, 489, 490, 557, 558, 559,
 &end
#
#    0 AMB  20-2:4824     0 AMB  20-1:4824   3.50    (#   4824:20   Double Ambig)
 &rst
  ixpk= 4824, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 154, 155, 719,
 igr2= 488, 489, 490, 557, 558, 559,
 &end
#
#    0 AMB  20-2:4825     0 AMB  20-1:4825   3.50    (#   4825:20   Double Ambig)
 &rst
  ixpk= 4825, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 426, 496,
 igr2= 488, 489, 490, 557, 558, 559,
 &end
#
#    0 AMB  20-2:4826    35 MET  HE          3.50    (#   4826:20   Single Ambig)
 &rst
  ixpk= 4826, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1108,1109,1108,1109, 994, 995,
 igr2= 557, 558, 559,
 &end
#
#    0 AMB  20-2:4827    35 MET  HE          3.50    (#   4827:20   Single Ambig)
 &rst
  ixpk= 4827, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1117,1108,1109, 994, 995,
 igr2= 557, 558, 559,
 &end
#
#    0 AMB  20-2:4828   115 THR  MG2         4.50    (#   4828:20   Single Ambig)
 &rst
  ixpk= 4828, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=1819,2160,1838,
 igr2=1859,1860,1861,
 &end
#
#    0 AMB  20-2:4829     0 AMB  20-1:4829   3.50    (#   4829:20   Double Ambig)
 &rst
  ixpk= 4829, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1451,1857,
 igr2=2004,2005,2006,1859,1860,1861,1504,1505,1506,
 &end
#
#  127 ALA  HA          127 ALA  MB          2.70    (#   4830:20   Preassigned)
 &rst
  ixpk= 4830, iat=2002,  -1, r1= 0.00, r2= 1.80, r3= 3.24, r4= 3.99,
 igr2=2004,2005,2006,
 &end
#
#  132 ILE  HA          132 ILE  MG2         3.50    (#   4831:20   Unique)
 &rst
  ixpk= 4831, iat=2075,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2079,2080,2081,
 &end
#
#    0 AMB  20-2:4832   112 ILE  MG2         3.50    (#   4832:20   Single Ambig)
 &rst
  ixpk= 4832, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1806,1807,2166,2167,
 igr2=1802,1803,1804,
 &end
#
#    0 AMB  20-2:4833    35 MET  HE          3.50    (#   4833:20   Single Ambig)
 &rst
  ixpk= 4833, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1111,1112,1115, 548,
 igr2= 557, 558, 559,
 &end
#
#    0 AMB  20-2:4834    89 ILE  MG2         4.50    (#   4834:20   Single Ambig)
 &rst
  ixpk= 4834, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2012,2452,
 igr2=1436,1437,1438,
 &end
#
#   90 ASN  HA           89 ILE  MG2         4.50    (#   4835:20   Unique)
 &rst
  ixpk= 4835, iat=1451,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1436,1437,1438,
 &end
#
#    0 AMB  20-2:4836     0 AMB  20-1:4836   4.50    (#   4836:20   Double Ambig)
 &rst
  ixpk= 4836, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1395,2744,
 igr2=1436,1437,1438,2162,2163,2164,
 &end
#
#   45 PHE  HA           35 MET  HE          6.00    (#   4838:20   Unique)
 &rst
  ixpk= 4838, iat= 716,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 557, 558, 559,
 &end
#
#  125 ILE  HA           89 ILE  MG2         6.00    (#   4841:20   Unique)
 &rst
  ixpk= 4841, iat=1971,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1436,1437,1438,
 &end
#
#  129 LYS  HN           89 ILE  MG2         6.00    (#   4842:20   Unique)
 &rst
  ixpk= 4842, iat=2020,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1436,1437,1438,
 &end
#
#    0 AMB  20-2:4843    27 ILE  MG2         3.50    (#   4843:20   Single Ambig)
 &rst
  ixpk= 4843, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 356, 360, 358,
 igr2= 411, 412, 413,
 &end
#
#    0 AMB  20-2:4844    89 ILE  MG2         6.00    (#   4844:20   Single Ambig)
 &rst
  ixpk= 4844, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.65, r4= 9.40,
 igr1=1500,1463,1484,
 igr2=1436,1437,1438,
 &end
#
#  138 ILE  MG2         138 ILE  MD1         3.50    (#   4848:20   Unique)
 &rst
  ixpk= 4848, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2188,2189,2190,
 igr2=2195,2196,2197,
 &end
#
#  172 LEU  MDY         138 ILE  MD1         3.50    (#   4849:20   Unique)
 &rst
  ixpk= 4849, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2751,2752,2753,2755,2756,2757,
 igr2=2195,2196,2197,
 &end
#
#  138 ILE  HG1+        138 ILE  MD1         3.50    (#   4850:20   Preassigned)
 &rst
  ixpk= 4850, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2192,2193,
 igr2=2195,2196,2197,
 &end
#
#  115 THR  HB          113 ILE  MG2         4.50    (#   4866:20   Unique)
 &rst
  ixpk= 4866, iat=1857,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1821,1822,1823,
 &end
#
#   85 THR  MG2         113 ILE  MG2         6.00    (#   4867:20   Unique)
 &rst
  ixpk= 4867, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.65, r4= 9.40,
 igr1=1385,1386,1387,
 igr2=1821,1822,1823,
 &end
#
#    0 AMB  20-2:4868   113 ILE  MG2         6.00    (#   4868:20   Single Ambig)
 &rst
  ixpk= 4868, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1853,2156,
 igr2=1821,1822,1823,
 &end
#
#    0 AMB  20-2:4869   112 ILE  MG2         3.50    (#   4869:20   Single Ambig)
 &rst
  ixpk= 4869, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2124,2133, 160, 164,
 igr2=1802,1803,1804,
 &end
#
#    0 AMB  20-2:4873   113 ILE  MG2         3.50    (#   4873:20   Single Ambig)
 &rst
  ixpk= 4873, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1= 179, 180, 181, 183, 184, 185,1443,1444,1445,
 igr2=1821,1822,1823,
 &end
#
#    0 AMB  20-2:4875   183 ILE  MG2         3.50    (#   4875:20   Single Ambig)
 &rst
  ixpk= 4875, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=3009,3010, 614, 611, 612,
 igr2=2949,2950,2951,
 &end
#
#    0 AMB  20-2:4876     0 AMB  20-1:4876   3.50    (#   4876:20   Double Ambig)
 &rst
  ixpk= 4876, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.04, r4= 7.79,
 igr1= 411, 412, 413,1171,1172,1173,1175,1176,1177, 482,
       483,
 igr2= 488, 489, 490, 557, 558, 559,
 &end
#
#   73 LEU  MDY           0 AMB  20-1:4878   3.50    (#   4878:20   Single Ambig)
 &rst
  ixpk= 4878, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1171,1172,1173,1175,1176,1177,
 igr2= 488, 489, 490, 557, 558, 559,
 &end
#
#  169 PHE  HD           27 ILE  MD1         3.50    (#   4881:20   Unique)
 &rst
  ixpk= 4881, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2693,2701,
 igr2= 418, 419, 420,
 &end
#
#  138 ILE  HN          138 ILE  MD1         4.50    (#   4882:20   Unique)
 &rst
  ixpk= 4882, iat=2182,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2195,2196,2197,
 &end
#
#  139 GLY  HN          138 ILE  MD1         6.00    (#   4883:20   Unique)
 &rst
  ixpk= 4883, iat=2201,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2195,2196,2197,
 &end
#
#    0 AMB  20-2:4884    89 ILE  MD1         3.50    (#   4884:20   Single Ambig)
 &rst
  ixpk= 4884, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1430,1420,
 igr2=1443,1444,1445,
 &end
#
#  169 PHE  HD          138 ILE  MD1         3.50    (#   4885:20   Unique)
 &rst
  ixpk= 4885, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2693,2701,
 igr2=2195,2196,2197,
 &end
#
#  169 PHE  HE          138 ILE  MD1         3.50    (#   4886:20   Unique)
 &rst
  ixpk= 4886, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2695,2699,
 igr2=2195,2196,2197,
 &end
#
#  138 ILE  HA          138 ILE  MD1         4.50    (#   4888:20   Unique)
 &rst
  ixpk= 4888, iat=2184,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2195,2196,2197,
 &end
#
#  169 PHE  HA          138 ILE  MD1         4.50    (#   4891:20   Unique)
 &rst
  ixpk= 4891, iat=2687,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2195,2196,2197,
 &end
#
#   86 PHE  HA           89 ILE  MD1         4.50    (#   4892:20   Unique)
 &rst
  ixpk= 4892, iat=1395,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1443,1444,1445,
 &end
#
#    0 AMB  20-2:4893    89 ILE  MD1         3.50    (#   4893:20   Single Ambig)
 &rst
  ixpk= 4893, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2102,2103,1432,
 igr2=1443,1444,1445,
 &end
#
#    0 AMB  20-2:4894    89 ILE  MD1         3.50    (#   4894:20   Single Ambig)
 &rst
  ixpk= 4894, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2454,2455,1381,
 igr2=1443,1444,1445,
 &end
#
#   27 ILE  HG1-        138 ILE  MD1         4.50    (#   4897:20   Unique)
 &rst
  ixpk= 4897, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 415, 416,
 igr2=2195,2196,2197,
 &end
#
#    0 AMB  20-2:4898   138 ILE  MD1         4.50    (#   4898:20   Single Ambig)
 &rst
  ixpk= 4898, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2160,1838,
 igr2=2195,2196,2197,
 &end
#
#   89 ILE  HB           89 ILE  MD1         3.50    (#   4899:20   Unique)
 &rst
  ixpk= 4899, iat=1434,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1443,1444,1445,
 &end
#
#   89 ILE  HG1+         89 ILE  MD1         3.50    (#   4900:20   Preassigned)
 &rst
  ixpk= 4900, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1440,1441,
 igr2=1443,1444,1445,
 &end
#
#    0 AMB  20-2:4901   138 ILE  MD1         3.50    (#   4901:20   Single Ambig)
 &rst
  ixpk= 4901, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2649,2650,2651,2653,2654,2655,2751,2752,2753,2755,
      2756,2757,
 igr2=2195,2196,2197,
 &end
#
#    0 AMB  20-2:4908   125 ILE  MD1         3.50    (#   4908:20   Single Ambig)
 &rst
  ixpk= 4908, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2105,2458,2466,
 igr2=1982,1983,1984,
 &end
#
#   27 ILE  HA           27 ILE  MD1         3.50    (#   4910:20   Preassigned)
 &rst
  ixpk= 4910, iat= 407,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 418, 419, 420,
 &end
#
#    0 AMB  20-2:4911    27 ILE  MD1         4.50    (#   4911:20   Single Ambig)
 &rst
  ixpk= 4911, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 333, 459, 460,2689,
 igr2= 418, 419, 420,
 &end
#
#    0 AMB  20-2:4912    27 ILE  MD1         4.50    (#   4912:20   Single Ambig)
 &rst
  ixpk= 4912, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1= 193, 194, 193, 194, 213, 214, 213, 214,
 igr2= 418, 419, 420,
 &end
#
#    0 AMB  20-2:4915    27 ILE  MD1         4.50    (#   4915:20   Single Ambig)
 &rst
  ixpk= 4915, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 387, 388,1844,1845,
 igr2= 418, 419, 420,
 &end
#
#    0 AMB  20-2:4916    27 ILE  MD1         4.50    (#   4916:20   Single Ambig)
 &rst
  ixpk= 4916, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 387, 388,2746,2747,
 igr2= 418, 419, 420,
 &end
#
#   27 ILE  HG1-         27 ILE  MD1         3.50    (#   4917:20   Unique)
 &rst
  ixpk= 4917, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 415, 416,
 igr2= 418, 419, 420,
 &end
#
#  172 LEU  MDY          27 ILE  MD1         3.50    (#   4918:20   Unique)
 &rst
  ixpk= 4918, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2751,2752,2753,2755,2756,2757,
 igr2= 418, 419, 420,
 &end
#
#  154 PHE  HD          125 ILE  MD1         4.50    (#   4919:20   Unique)
 &rst
  ixpk= 4919, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2458,2466,
 igr2=1982,1983,1984,
 &end
#
#  133 ARG  HE          125 ILE  MD1         3.50    (#   4920:20   Unique)
 &rst
  ixpk= 4920, iat=2105,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1982,1983,1984,
 &end
#
#  133 ARG  QD          125 ILE  MD1         3.50    (#   4922:20   Unique)
 &rst
  ixpk= 4922, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2102,2103,
 igr2=1982,1983,1984,
 &end
#
#    0 AMB  20-2:4923   125 ILE  MD1         4.50    (#   4923:20   Single Ambig)
 &rst
  ixpk= 4923, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1971,1957,
 igr2=1982,1983,1984,
 &end
#
#  154 PHE  HA          125 ILE  MD1         3.50    (#   4924:20   Unique)
 &rst
  ixpk= 4924, iat=2452,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1982,1983,1984,
 &end
#
#    0 AMB  20-2:4925   125 ILE  MD1         4.50    (#   4925:20   Single Ambig)
 &rst
  ixpk= 4925, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1990,2472,
 igr2=1982,1983,1984,
 &end
#
#  125 ILE  HB          125 ILE  MD1         3.50    (#   4927:20   Preassigned)
 &rst
  ixpk= 4927, iat=1973,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1982,1983,1984,
 &end
#
#    0 AMB  20-2:4928   138 ILE  MG2         6.00    (#   4928:20   Single Ambig)
 &rst
  ixpk= 4928, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2640,2659,
 igr2=2188,2189,2190,
 &end
#
#  169 PHE  HN          138 ILE  MG2         6.00    (#   4929:20   Unique)
 &rst
  ixpk= 4929, iat=2685,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2188,2189,2190,
 &end
#
#  140 LYS  HN          138 ILE  MG2         6.00    (#   4930:20   Unique)
 &rst
  ixpk= 4930, iat=2208,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2188,2189,2190,
 &end
#
#    0 AMB  20-2:4931   138 ILE  MG2         3.50    (#   4931:20   Single Ambig)
 &rst
  ixpk= 4931, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2693,2701,2695,2699,2697,
 igr2=2188,2189,2190,
 &end
#
#    0 AMB  20-2:4932   138 ILE  MG2         4.50    (#   4932:20   Single Ambig)
 &rst
  ixpk= 4932, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2695,2699,2697,2671,
 igr2=2188,2189,2190,
 &end
#
#  133 ARG  HE           89 ILE  MD1         6.00    (#   4933:20   Unique)
 &rst
  ixpk= 4933, iat=2105,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1443,1444,1445,
 &end
#
#    0 AMB  20-2:4934    89 ILE  MD1         4.50    (#   4934:20   Single Ambig)
 &rst
  ixpk= 4934, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2458,2466,2105,
 igr2=1443,1444,1445,
 &end
#
#  114 ILE  HN          114 ILE  MD1         4.50    (#   4936:20   Unique)
 &rst
  ixpk= 4936, iat=1834,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1847,1848,1849,
 &end
#
#   13 PHE  HA          114 ILE  MD1         4.50    (#   4937:20   Unique)
 &rst
  ixpk= 4937, iat= 191,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1847,1848,1849,
 &end
#
#    0 AMB  20-2:4938   114 ILE  MD1         3.50    (#   4938:20   Single Ambig)
 &rst
  ixpk= 4938, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 463, 471, 158, 166,
 igr2=1847,1848,1849,
 &end
#
#    0 AMB  20-2:4939   114 ILE  MD1         3.50    (#   4939:20   Single Ambig)
 &rst
  ixpk= 4939, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1= 160, 164, 197, 205, 162,
 igr2=1847,1848,1849,
 &end
#
#   14 ASP  HN          114 ILE  MD1         6.00    (#   4940:20   Unique)
 &rst
  ixpk= 4940, iat= 209,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1847,1848,1849,
 &end
#
#    0 AMB  20-2:4941   114 ILE  MD1         3.50    (#   4941:20   Single Ambig)
 &rst
  ixpk= 4941, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 465, 469, 158, 166,
 igr2=1847,1848,1849,
 &end
#
#  169 PHE  HD          138 ILE  MG2         4.50    (#   4942:20   Unique)
 &rst
  ixpk= 4942, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2693,2701,
 igr2=2188,2189,2190,
 &end
#
#  154 PHE  HB+         125 ILE  MD1         3.50    (#   4943:20   Unique)
 &rst
  ixpk= 4943, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2454,2455,
 igr2=1982,1983,1984,
 &end
#
#  154 PHE  HB-         125 ILE  MD1         3.50    (#   4944:20   Unique)
 &rst
  ixpk= 4944, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2454,2455,
 igr2=1982,1983,1984,
 &end
#
#    0 AMB  20-2:4946   138 ILE  MG2         4.50    (#   4946:20   Single Ambig)
 &rst
  ixpk= 4946, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2203,2204,2661,
 igr2=2188,2189,2190,
 &end
#
#    0 AMB  20-2:4947   138 ILE  MG2         3.50    (#   4947:20   Single Ambig)
 &rst
  ixpk= 4947, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2687,2203,2204,
 igr2=2188,2189,2190,
 &end
#
#  169 PHE  HB2         138 ILE  MG2         6.00    (#   4948:20   Unique)
 &rst
  ixpk= 4948, iat=2689,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2188,2189,2190,
 &end
#
#  154 PHE  HA           89 ILE  MD1         4.50    (#   4949:20   Unique)
 &rst
  ixpk= 4949, iat=2452,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1443,1444,1445,
 &end
#
#  154 PHE  HB-          89 ILE  MD1         4.50    (#   4950:20   Unique)
 &rst
  ixpk= 4950, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2454,2455,
 igr2=1443,1444,1445,
 &end
#
#    0 AMB  20-2:4951   114 ILE  MD1         3.50    (#   4951:20   Single Ambig)
 &rst
  ixpk= 4951, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 193, 194, 193, 194,
 igr2=1847,1848,1849,
 &end
#
#    0 AMB  20-2:4952   114 ILE  MD1         3.50    (#   4952:20   Single Ambig)
 &rst
  ixpk= 4952, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 154, 155, 459, 460,
 igr2=1847,1848,1849,
 &end
#
#    0 AMB  20-2:4953   114 ILE  MD1         4.50    (#   4953:20   Single Ambig)
 &rst
  ixpk= 4953, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 407, 426,
 igr2=1847,1848,1849,
 &end
#
#  114 ILE  HA          114 ILE  MD1         4.50    (#   4954:20   Unique)
 &rst
  ixpk= 4954, iat=1836,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1847,1848,1849,
 &end
#
#  113 ILE  HA          114 ILE  MD1         6.00    (#   4955:20   Unique)
 &rst
  ixpk= 4955, iat=1817,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1847,1848,1849,
 &end
#
#    0 AMB  20-2:4956   114 ILE  MD1         4.50    (#   4956:20   Single Ambig)
 &rst
  ixpk= 4956, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 152,1817,
 igr2=1847,1848,1849,
 &end
#
#    0 AMB  20-2:4957   125 ILE  MD1         2.70    (#   4957:20   Single Ambig)
 &rst
  ixpk= 4957, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.37, r4= 5.12,
 igr1=1436,1437,1438,1828,1829,1830,
 igr2=1982,1983,1984,
 &end
#
#   89 ILE  MD1         125 ILE  MD1         3.50    (#   4958:20   Unique)
 &rst
  ixpk= 4958, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1443,1444,1445,
 igr2=1982,1983,1984,
 &end
#
#  133 ARG  HB3         125 ILE  MD1         4.50    (#   4959:20   Unique)
 &rst
  ixpk= 4959, iat=2097,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1982,1983,1984,
 &end
#
#  125 ILE  HG1+        125 ILE  MD1         3.50    (#   4960:20   Unique)
 &rst
  ixpk= 4960, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1979,1980,
 igr2=1982,1983,1984,
 &end
#
#  128 ALA  MB          125 ILE  MD1         3.50    (#   4961:20   Unique)
 &rst
  ixpk= 4961, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2014,2015,2016,
 igr2=1982,1983,1984,
 &end
#
#    0 AMB  20-2:4962   125 ILE  MD1         4.50    (#   4962:20   Single Ambig)
 &rst
  ixpk= 4962, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2096,1434,
 igr2=1982,1983,1984,
 &end
#
#   85 THR  MG2          89 ILE  MD1         3.50    (#   4963:20   Unique)
 &rst
  ixpk= 4963, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1385,1386,1387,
 igr2=1443,1444,1445,
 &end
#
#    0 AMB  20-2:4964    89 ILE  MD1         3.50    (#   4964:20   Single Ambig)
 &rst
  ixpk= 4964, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1975,1976,1977,1825,1826,1982,1983,1984,
 igr2=1443,1444,1445,
 &end
#
#  138 ILE  HG1+        138 ILE  MG2         3.50    (#   4965:20   Preassigned)
 &rst
  ixpk= 4965, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2192,2193,
 igr2=2188,2189,2190,
 &end
#
#    0 AMB  20-2:4968   138 ILE  MG2         3.50    (#   4968:20   Single Ambig)
 &rst
  ixpk= 4968, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=2649,2650,2651,2653,2654,2655,2162,2163,2164,
 igr2=2188,2189,2190,
 &end
#
#  138 ILE  MD1         138 ILE  MG2         3.50    (#   4969:20   Unique)
 &rst
  ixpk= 4969, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2195,2196,2197,
 igr2=2188,2189,2190,
 &end
#
#  138 ILE  HG1-        138 ILE  MG2         3.50    (#   4970:20   Unique)
 &rst
  ixpk= 4970, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2192,2193,
 igr2=2188,2189,2190,
 &end
#
#  172 LEU  MDY         138 ILE  MG2         4.50    (#   4971:20   Unique)
 &rst
  ixpk= 4971, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2751,2752,2753,2755,2756,2757,
 igr2=2188,2189,2190,
 &end
#
#  172 LEU  MDY         114 ILE  MD1         3.50    (#   4972:20   Unique)
 &rst
  ixpk= 4972, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2751,2752,2753,2755,2756,2757,
 igr2=1847,1848,1849,
 &end
#
#    0 AMB  20-2:4974   114 ILE  MD1         2.70    (#   4974:20   Single Ambig)
 &rst
  ixpk= 4974, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.59, r4= 5.34,
 igr1= 411, 412, 413, 482, 483,2169,2170,2171,
 igr2=1847,1848,1849,
 &end
#
#    0 AMB  20-2:4975   114 ILE  MD1         3.50    (#   4975:20   Single Ambig)
 &rst
  ixpk= 4975, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1844,1845,1838,
 igr2=1847,1848,1849,
 &end
#
#    0 AMB  20-2:4976   114 ILE  MD1         3.50    (#   4976:20   Single Ambig)
 &rst
  ixpk= 4976, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 482, 483,1800,
 igr2=1847,1848,1849,
 &end
#
#  183 ILE  HB          183 ILE  MG2         3.50    (#   4978:20   Preassigned)
 &rst
  ixpk= 4978, iat=2947,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2949,2950,2951,
 &end
#
#    0 AMB  20-2:4980   135 ILE  MD1         4.50    (#   4980:20   Single Ambig)
 &rst
  ixpk= 4980, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1857,2472,
 igr2=2150,2151,2152,
 &end
#
#  135 ILE  HA          135 ILE  MD1         3.50    (#   4981:20   Preassigned)
 &rst
  ixpk= 4981, iat=2139,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2150,2151,2152,
 &end
#
#  136 ILE  HA          136 ILE  MD1         4.50    (#   4982:20   Unique)
 &rst
  ixpk= 4982, iat=2158,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2169,2170,2171,
 &end
#
#    0 AMB  20-2:4983   136 ILE  MD1         6.00    (#   4983:20   Single Ambig)
 &rst
  ixpk= 4983, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1836,2139,
 igr2=2169,2170,2171,
 &end
#
#    0 AMB  20-2:4984   135 ILE  MD1         4.50    (#   4984:20   Single Ambig)
 &rst
  ixpk= 4984, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2156,1853,
 igr2=2150,2151,2152,
 &end
#
#    0 AMB  20-2:4985   135 ILE  MD1         4.50    (#   4985:20   Single Ambig)
 &rst
  ixpk= 4985, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1853,1815,
 igr2=2150,2151,2152,
 &end
#
#    0 AMB  20-2:4986   135 ILE  MD1         6.00    (#   4986:20   Single Ambig)
 &rst
  ixpk= 4986, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2137,1834,
 igr2=2150,2151,2152,
 &end
#
#    0 AMB  20-2:4987   135 ILE  MD1         3.50    (#   4987:20   Single Ambig)
 &rst
  ixpk= 4987, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2470,2259,2450,2257,2261, 799,
 igr2=2150,2151,2152,
 &end
#
#    0 AMB  20-2:4988   135 ILE  MD1         4.50    (#   4988:20   Single Ambig)
 &rst
  ixpk= 4988, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2458,2466,2460,2464,
 igr2=2150,2151,2152,
 &end
#
#  151 LEU  HA          135 ILE  MD1         4.50    (#   4990:20   Unique)
 &rst
  ixpk= 4990, iat=2394,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2150,2151,2152,
 &end
#
#    0 AMB  20-2:4991   136 ILE  MD1         3.50    (#   4991:20   Single Ambig)
 &rst
  ixpk= 4991, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 467, 465, 469,
 igr2=2169,2170,2171,
 &end
#
#  134 TYR  HD          136 ILE  MD1         4.50    (#   4992:20   Unique)
 &rst
  ixpk= 4992, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2124,2133,
 igr2=2169,2170,2171,
 &end
#
#  136 ILE  HN          136 ILE  MD1         6.00    (#   4993:20   Preassigned)
 &rst
  ixpk= 4993, iat=2156,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2169,2170,2171,
 &end
#
#  113 ILE  HN          113 ILE  MD1         4.50    (#   4995:20   Unique)
 &rst
  ixpk= 4995, iat=1815,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1828,1829,1830,
 &end
#
#    0 AMB  20-2:4996   113 ILE  MD1         4.50    (#   4996:20   Single Ambig)
 &rst
  ixpk= 4996, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1817,1779,
 igr2=1828,1829,1830,
 &end
#
#    0 AMB  20-2:4997   113 ILE  MD1         4.50    (#   4997:20   Single Ambig)
 &rst
  ixpk= 4997, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2094,2139,1798,
 igr2=1828,1829,1830,
 &end
#
#   93 ALA  HA          131 ILE  MD1         3.50    (#   5001:20   Unique)
 &rst
  ixpk= 5001, iat=1502,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2067,2068,2069,
 &end
#
#  128 ALA  HA          131 ILE  MD1         3.50    (#   5002:20   Unique)
 &rst
  ixpk= 5002, iat=2012,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2067,2068,2069,
 &end
#
#  131 ILE  HN          131 ILE  MD1         4.50    (#   5003:20   Unique)
 &rst
  ixpk= 5003, iat=2054,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2067,2068,2069,
 &end
#
#    0 AMB  20-2:5004   131 ILE  MD1         4.50    (#   5004:20   Single Ambig)
 &rst
  ixpk= 5004, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1500,2010,
 igr2=2067,2068,2069,
 &end
#
#    0 AMB  20-2:5005   131 ILE  MD1         4.50    (#   5005:20   Single Ambig)
 &rst
  ixpk= 5005, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1567,2020,
 igr2=2067,2068,2069,
 &end
#
#   97 PHE  HE          131 ILE  MD1         3.50    (#   5006:20   Unique)
 &rst
  ixpk= 5006, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1565,1569,
 igr2=2067,2068,2069,
 &end
#
#  186 ILE  HN          186 ILE  MD1         4.50    (#   5007:20   Unique)
 &rst
  ixpk= 5007, iat=2999,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=3012,3013,3014,
 &end
#
#  186 ILE  HA          186 ILE  MD1         4.50    (#   5008:20   Unique)
 &rst
  ixpk= 5008, iat=3001,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=3012,3013,3014,
 &end
#
#    0 AMB  20-2:5009   131 ILE  MD1         3.50    (#   5009:20   Single Ambig)
 &rst
  ixpk= 5009, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1563,1571,1565,1569,
 igr2=2067,2068,2069,
 &end
#
#  172 LEU  MDY         136 ILE  MD1         4.50    (#   5010:20   Unique)
 &rst
  ixpk= 5010, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2751,2752,2753,2755,2756,2757,
 igr2=2169,2170,2171,
 &end
#
#    0 AMB  20-2:5011   135 ILE  MD1         3.50    (#   5011:20   Single Ambig)
 &rst
  ixpk= 5011, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=2401,2402,2403,2405,2406,2407,1385,1386,1387,
 igr2=2150,2151,2152,
 &end
#
#    0 AMB  20-2:5013    27 ILE  MD1         3.50    (#   5013:20   Single Ambig)
 &rst
  ixpk= 5013, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2195,2196,2197, 335, 336,
 igr2= 418, 419, 420,
 &end
#
#  172 LEU  MDX          27 ILE  MD1         2.70    (#   5014:20   Unique)
 &rst
  ixpk= 5014, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.37, r4= 5.12,
 igr1=2751,2752,2753,2755,2756,2757,
 igr2= 418, 419, 420,
 &end
#
#  135 ILE  MG2         135 ILE  MD1         3.50    (#   5015:20   Unique)
 &rst
  ixpk= 5015, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2143,2144,2145,
 igr2=2150,2151,2152,
 &end
#
#    0 AMB  20-2:5016   136 ILE  MD1         3.50    (#   5016:20   Single Ambig)
 &rst
  ixpk= 5016, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1844,1845,1802,1803,1804,1847,1848,1849,
 igr2=2169,2170,2171,
 &end
#
#  135 ILE  HG1-        135 ILE  MD1         3.50    (#   5017:20   Unique)
 &rst
  ixpk= 5017, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2147,2148,
 igr2=2150,2151,2152,
 &end
#
#    0 AMB  20-2:5018   135 ILE  MD1         3.50    (#   5018:20   Single Ambig)
 &rst
  ixpk= 5018, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2147,2148,2397,
 igr2=2150,2151,2152,
 &end
#
#  136 ILE  HG1+        136 ILE  MD1         3.50    (#   5019:20   Unique)
 &rst
  ixpk= 5019, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2166,2167,
 igr2=2169,2170,2171,
 &end
#
#  136 ILE  HB          136 ILE  MD1         3.50    (#   5020:20   Preassigned)
 &rst
  ixpk= 5020, iat=2160,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2169,2170,2171,
 &end
#
#    0 AMB  20-2:5021   135 ILE  MD1         4.50    (#   5021:20   Single Ambig)
 &rst
  ixpk= 5021, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2396,1905,1906,1907,
 igr2=2150,2151,2152,
 &end
#
#  154 PHE  HB+         135 ILE  MD1         3.50    (#   5022:20   Unique)
 &rst
  ixpk= 5022, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2454,2455,
 igr2=2150,2151,2152,
 &end
#
#    0 AMB  20-2:5023   135 ILE  MD1         3.50    (#   5023:20   Single Ambig)
 &rst
  ixpk= 5023, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1819,1825,1826,
 igr2=2150,2151,2152,
 &end
#
#    0 AMB  20-2:5024   135 ILE  MD1         3.50    (#   5024:20   Single Ambig)
 &rst
  ixpk= 5024, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2399,2141,1825,1826,
 igr2=2150,2151,2152,
 &end
#
#  154 PHE  HB-         135 ILE  MD1         3.50    (#   5025:20   Unique)
 &rst
  ixpk= 5025, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2454,2455,
 igr2=2150,2151,2152,
 &end
#
#   85 THR  MG2         113 ILE  MD1         4.50    (#   5036:20   Unique)
 &rst
  ixpk= 5036, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=1385,1386,1387,
 igr2=1828,1829,1830,
 &end
#
#    0 AMB  20-2:5037   113 ILE  MD1         3.50    (#   5037:20   Single Ambig)
 &rst
  ixpk= 5037, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=1443,1444,1445, 179, 180, 181, 183, 184, 185,
 igr2=1828,1829,1830,
 &end
#
#    0 AMB  20-2:5040   113 ILE  MD1         3.50    (#   5040:20   Single Ambig)
 &rst
  ixpk= 5040, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1440,1441,2147,2148,2096,
 igr2=1828,1829,1830,
 &end
#
#    0 AMB  20-2:5041   113 ILE  MD1         3.50    (#   5041:20   Single Ambig)
 &rst
  ixpk= 5041, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2141,2097,1825,1826,
 igr2=1828,1829,1830,
 &end
#
#   12 LEU  HB3         113 ILE  MD1         4.50    (#   5042:20   Unique)
 &rst
  ixpk= 5042, iat= 175,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1828,1829,1830,
 &end
#
#  154 PHE  HB-         113 ILE  MD1         6.00    (#   5043:20   Unique)
 &rst
  ixpk= 5043, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2454,2455,
 igr2=1828,1829,1830,
 &end
#
#    0 AMB  20-2:5044   113 ILE  MD1         4.50    (#   5044:20   Single Ambig)
 &rst
  ixpk= 5044, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2454,2455,2121,
 igr2=1828,1829,1830,
 &end
#
#    0 AMB  20-2:5045   113 ILE  MD1         4.50    (#   5045:20   Single Ambig)
 &rst
  ixpk= 5045, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2102,2103,1432,2120,
 igr2=1828,1829,1830,
 &end
#
#    0 AMB  20-2:5046   131 ILE  MD1         3.50    (#   5046:20   Single Ambig)
 &rst
  ixpk= 5046, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=1746,1747,1490,1491,1492,
 igr2=2067,2068,2069,
 &end
#
#    9 LEU  MDY         112 ILE  MD1         3.50    (#   5047:20   Unique)
 &rst
  ixpk= 5047, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 124, 125, 126, 128, 129, 130,
 igr2=1809,1810,1811,
 &end
#
#  186 ILE  HB          186 ILE  MD1         3.50    (#   5049:20   Unique)
 &rst
  ixpk= 5049, iat=3003,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=3012,3013,3014,
 &end
#
#  186 ILE  HG1+        186 ILE  MD1         3.50    (#   5051:20   Unique)
 &rst
  ixpk= 5051, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=3009,3010,
 igr2=3012,3013,3014,
 &end
#
#  183 ILE  HA          186 ILE  MD1         4.50    (#   5052:20   Unique)
 &rst
  ixpk= 5052, iat=2945,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=3012,3013,3014,
 &end
#
#  186 ILE  HG1-        186 ILE  MD1         2.70    (#   5053:20   Unique)
 &rst
  ixpk= 5053, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.64, r4= 4.39,
 igr1=3009,3010,
 igr2=3012,3013,3014,
 &end
#
#    0 AMB  20-2:5054   131 ILE  MD1         3.50    (#   5054:20   Single Ambig)
 &rst
  ixpk= 5054, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2064,2065,1504,1505,1506,1743,
 igr2=2067,2068,2069,
 &end
#
#    0 AMB  20-2:5055   131 ILE  MD1         3.50    (#   5055:20   Single Ambig)
 &rst
  ixpk= 5055, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2014,2015,2016,1746,1747,
 igr2=2067,2068,2069,
 &end
#
#  131 ILE  HA          131 ILE  MD1         4.50    (#   5056:20   Preassigned)
 &rst
  ixpk= 5056, iat=2056,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2067,2068,2069,
 &end
#
#  130 ASP  HB+         131 ILE  MD1         4.50    (#   5057:20   Unique)
 &rst
  ixpk= 5057, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2046,2047,
 igr2=2067,2068,2069,
 &end
#
#    0 AMB  20-2:5058   131 ILE  MD1         2.70    (#   5058:20   Single Ambig)
 &rst
  ixpk= 5058, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.09, r4= 4.84,
 igr1=2060,2061,2062,1744,
 igr2=2067,2068,2069,
 &end
#
#  112 ILE  HA          112 ILE  MD1         3.50    (#   5061:20   Preassigned)
 &rst
  ixpk= 5061, iat=1798,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1809,1810,1811,
 &end
#
#  134 TYR  HB3         112 ILE  MD1         3.50    (#   5062:20   Unique)
 &rst
  ixpk= 5062, iat=2121,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1809,1810,1811,
 &end
#
#    0 AMB  20-2:5063   183 ILE  MD1         4.50    (#   5063:20   Single Ambig)
 &rst
  ixpk= 5063, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2943,2962,
 igr2=2956,2957,2958,
 &end
#
#    0 AMB  20-2:5064   132 ILE  MD1         3.50    (#   5064:20   Single Ambig)
 &rst
  ixpk= 5064, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2073,1739,
 igr2=2086,2087,2088,
 &end
#
#    0 AMB  20-2:5065   112 ILE  MD1         4.50    (#   5065:20   Single Ambig)
 &rst
  ixpk= 5065, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1796, 134,
 igr2=1809,1810,1811,
 &end
#
#  133 ARG  HN          132 ILE  MD1         4.50    (#   5066:20   Unique)
 &rst
  ixpk= 5066, iat=2092,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2086,2087,2088,
 &end
#
#  183 ILE  HA          183 ILE  MD1         4.50    (#   5068:20   Preassigned)
 &rst
  ixpk= 5068, iat=2945,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2956,2957,2958,
 &end
#
#  180 GLN  HA          183 ILE  MD1         4.50    (#   5069:20   Unique)
 &rst
  ixpk= 5069, iat=2884,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2956,2957,2958,
 &end
#
#  134 TYR  HB2         112 ILE  MD1         3.50    (#   5070:20   Unique)
 &rst
  ixpk= 5070, iat=2120,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1809,1810,1811,
 &end
#
#    0 AMB  20-2:5071   183 ILE  MD1         6.00    (#   5071:20   Single Ambig)
 &rst
  ixpk= 5071, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.65, r4= 9.40,
 igr1= 467, 726,2899,
 igr2=2956,2957,2958,
 &end
#
#  180 GLN  HE2+        183 ILE  MD1         4.50    (#   5072:20   Unique)
 &rst
  ixpk= 5072, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2894,2895,
 igr2=2956,2957,2958,
 &end
#
#  132 ILE  HG1-        132 ILE  MD1         2.70    (#   5073:20   Unique)
 &rst
  ixpk= 5073, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.64, r4= 4.39,
 igr1=2083,2084,
 igr2=2086,2087,2088,
 &end
#
#  132 ILE  HG1+        132 ILE  MD1         3.50    (#   5074:20   Unique)
 &rst
  ixpk= 5074, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2083,2084,
 igr2=2086,2087,2088,
 &end
#
#    0 AMB  20-2:5075   112 ILE  MD1         2.70    (#   5075:20   Single Ambig)
 &rst
  ixpk= 5075, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.37, r4= 5.12,
 igr1=1806,1807,2953,2954,2867,2868,
 igr2=1809,1810,1811,
 &end
#
#  183 ILE  HG1-        183 ILE  MD1         3.50    (#   5076:20   Unique)
 &rst
  ixpk= 5076, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2953,2954,
 igr2=2956,2957,2958,
 &end
#
#    0 AMB  20-2:5077   112 ILE  MD1         2.70    (#   5077:20   Single Ambig)
 &rst
  ixpk= 5077, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.39, r4= 6.14,
 igr1= 124, 125, 126, 128, 129, 130,2872,2873,2874,2876,
      2877,2878,2872,2873,2874,2876,2877,2878,2956,2957,
      2958,
 igr2=1809,1810,1811,
 &end
#
#  180 GLN  QG          183 ILE  MD1         4.50    (#   5078:20   Unique)
 &rst
  ixpk= 5078, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2889,2890,
 igr2=2956,2957,2958,
 &end
#
#  183 ILE  HB          183 ILE  MD1         3.50    (#   5079:20   Unique)
 &rst
  ixpk= 5079, iat=2947,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2956,2957,2958,
 &end
#
#  112 ILE  HB          112 ILE  MD1         3.50    (#   5080:20   Unique)
 &rst
  ixpk= 5080, iat=1800,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1809,1810,1811,
 &end
#
#  132 ILE  HB          132 ILE  MD1         3.50    (#   5081:20   Unique)
 &rst
  ixpk= 5081, iat=2077,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2086,2087,2088,
 &end
#
#    0 AMB  20-2:5082   183 ILE  MD1         3.50    (#   5082:20   Single Ambig)
 &rst
  ixpk= 5082, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2953,2954,2867,2868,2867,2868,
 igr2=2956,2957,2958,
 &end
#
#  110 VAL  HA          132 ILE  MD1         4.50    (#   5083:20   Unique)
 &rst
  ixpk= 5083, iat=1763,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2086,2087,2088,
 &end
#
#    0 AMB  20-2:5084   112 ILE  MD1         4.50    (#   5084:20   Single Ambig)
 &rst
  ixpk= 5084, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1= 152, 117,1779,
 igr2=1809,1810,1811,
 &end
#
#    0 AMB  20-2:5085   112 ILE  MD1         3.50    (#   5085:20   Single Ambig)
 &rst
  ixpk= 5085, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1= 467, 158, 166, 465, 469,
 igr2=1809,1810,1811,
 &end
#
#    0 AMB  20-2:5086   112 ILE  MD1         3.50    (#   5086:20   Single Ambig)
 &rst
  ixpk= 5086, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 160, 164,2124,2133,
 igr2=1809,1810,1811,
 &end
#
#    0 AMB  20-2:5087   132 ILE  MD1         4.50    (#   5087:20   Single Ambig)
 &rst
  ixpk= 5087, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2075,2056,
 igr2=2086,2087,2088,
 &end
#
#  164 LYS  HN          165 ILE  MD1         6.00    (#   5088:20   Unique)
 &rst
  ixpk= 5088, iat=2599,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2634,2635,2636,
 &end
#
#  166 LEU  HN          165 ILE  MD1         4.50    (#   5089:20   Unique)
 &rst
  ixpk= 5089, iat=2640,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2634,2635,2636,
 &end
#
#  137 GLY  HN          165 ILE  MD1         3.50    (#   5091:20   Unique)
 &rst
  ixpk= 5091, iat=2175,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2634,2635,2636,
 &end
#
#  165 ILE  HN          165 ILE  MD1         4.50    (#   5092:20   Unique)
 &rst
  ixpk= 5092, iat=2621,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2634,2635,2636,
 &end
#
#    0 AMB  20-2:5093   165 ILE  MD1         6.00    (#   5093:20   Single Ambig)
 &rst
  ixpk= 5093, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.65, r4= 9.40,
 igr1=2346,2421,2247,
 igr2=2634,2635,2636,
 &end
#
#  142 PHE  HD          165 ILE  MD1         6.00    (#   5095:20   Unique)
 &rst
  ixpk= 5095, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2255,2263,
 igr2=2634,2635,2636,
 &end
#
#  142 PHE  HD          165 ILE  MD1         4.50    (#   5096:20   Unique)
 &rst
  ixpk= 5096, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2255,2263,
 igr2=2634,2635,2636,
 &end
#
#  142 PHE  HA          165 ILE  MD1         6.00    (#   5097:20   Unique)
 &rst
  ixpk= 5097, iat=2249,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2634,2635,2636,
 &end
#
#  165 ILE  HA          165 ILE  MD1         3.50    (#   5098:20   Unique)
 &rst
  ixpk= 5098, iat=2623,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2634,2635,2636,
 &end
#
#  142 PHE  HB3         165 ILE  MD1         4.50    (#   5101:20   Unique)
 &rst
  ixpk= 5101, iat=2252,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2634,2635,2636,
 &end
#
#    0 AMB  20-2:5102   165 ILE  MD1         3.50    (#   5102:20   Single Ambig)
 &rst
  ixpk= 5102, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2623,2177,2178,
 igr2=2634,2635,2636,
 &end
#
#  142 PHE  HB2         165 ILE  MD1         4.50    (#   5103:20   Unique)
 &rst
  ixpk= 5103, iat=2251,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2634,2635,2636,
 &end
#
#    0 AMB  20-2:5104   165 ILE  MD1         3.50    (#   5104:20   Single Ambig)
 &rst
  ixpk= 5104, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2353,2354,2353,2354,2177,2178,
 igr2=2634,2635,2636,
 &end
#
#    0 AMB  20-2:5105   165 ILE  MD1         3.50    (#   5105:20   Single Ambig)
 &rst
  ixpk= 5105, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2350,2351,2350,2351,2396,
 igr2=2634,2635,2636,
 &end
#
#    0 AMB  20-2:5106   165 ILE  MD1         3.50    (#   5106:20   Single Ambig)
 &rst
  ixpk= 5106, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2350,2351,2625,
 igr2=2634,2635,2636,
 &end
#
#    0 AMB  20-2:5107   165 ILE  MD1         4.50    (#   5107:20   Single Ambig)
 &rst
  ixpk= 5107, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1=2399,2603,2604,2603,2604,
 igr2=2634,2635,2636,
 &end
#
#  165 ILE  HG1+        165 ILE  MD1         3.50    (#   5108:20   Unique)
 &rst
  ixpk= 5108, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2631,2632,
 igr2=2634,2635,2636,
 &end
#
#  165 ILE  HG1-        165 ILE  MD1         3.50    (#   5109:20   Unique)
 &rst
  ixpk= 5109, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2631,2632,
 igr2=2634,2635,2636,
 &end
#
#  151 LEU  MDY         165 ILE  MD1         3.50    (#   5110:20   Unique)
 &rst
  ixpk= 5110, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2401,2402,2403,2405,2406,2407,
 igr2=2634,2635,2636,
 &end
#
#    0 AMB  20-2:5111   165 ILE  MD1         3.50    (#   5111:20   Single Ambig)
 &rst
  ixpk= 5111, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2627,2628,2629,2589,2590,2591,
 igr2=2634,2635,2636,
 &end
#
#  151 LEU  MDX         165 ILE  MD1         3.50    (#   5112:20   Unique)
 &rst
  ixpk= 5112, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2401,2402,2403,2405,2406,2407,
 igr2=2634,2635,2636,
 &end
#
#   80 LEU  MDX          78 HIS  HB3         4.50    (#   5115:20   Unique)
 &rst
  ixpk= 5115, iat=  -1,1263, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1303,1304,1305,1307,1308,1309,
 &end
#
#  133 ARG  HA          111 LEU  HB3         3.50    (#   5116:20   Unique)
 &rst
  ixpk= 5116, iat=2094,1782, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:5117   111 LEU  HB2         4.50    (#   5117:20   Single Ambig)
 &rst
  ixpk= 5117, iat=  -1,1781, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2094,1798,
 &end
#
#  110 VAL  HA          111 LEU  HB2         6.00    (#   5118:20   Unique)
 &rst
  ixpk= 5118, iat=1763,1781, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   92 VAL  MG1         111 LEU  HB3         4.50    (#   5119:20   Unique)
 &rst
  ixpk= 5119, iat=  -1,1782, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1490,1491,1492,
 &end
#
#    0 AMB  20-2:5120   111 LEU  HB3         3.50    (#   5120:20   Single Ambig)
 &rst
  ixpk= 5120, iat=  -1,1782, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,
 &end
#
#    0 AMB  20-2:5121   111 LEU  HB2         3.50    (#   5121:20   Single Ambig)
 &rst
  ixpk= 5121, iat=  -1,1781, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1490,1491,1492,1825,1826,
 &end
#
#    0 AMB  20-2:5122   111 LEU  HB2         3.50    (#   5122:20   Single Ambig)
 &rst
  ixpk= 5122, iat=  -1,1781, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,
 &end
#
#  131 ILE  MG2         111 LEU  HB2         3.50    (#   5123:20   Unique)
 &rst
  ixpk= 5123, iat=  -1,1781, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2060,2061,2062,
 &end
#
#  131 ILE  MG2         111 LEU  HB3         3.50    (#   5124:20   Unique)
 &rst
  ixpk= 5124, iat=  -1,1782, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2060,2061,2062,
 &end
#
#   32 LYS  HG-          69 PRO  HD-         4.50    (#   5125:20   Unique)
 &rst
  ixpk= 5125, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 501, 502,
 igr2=1108,1109,
 &end
#
#    0 AMB  20-2:5126    69 PRO  HD+         3.50    (#   5126:20   Single Ambig)
 &rst
  ixpk= 5126, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1099,1100,1125,1126,
 igr2=1108,1109,
 &end
#
#    0 AMB  20-2:5127     0 AMB  20-1:5127   3.50    (#   5127:20   Double Ambig)
 &rst
  ixpk= 5127, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2517,2518,2517,2518,
 igr2=2514,2515,2514,2515,
 &end
#
#    0 AMB  20-2:5128   158 PRO  HD+         3.50    (#   5128:20   Single Ambig)
 &rst
  ixpk= 5128, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2517,2518,2517,2518,
 igr2=2514,2515,
 &end
#
#  158 PRO  HB2           0 AMB  20-1:5129   4.50    (#   5129:20   Single Ambig)
 &rst
  ixpk= 5129, iat=2520,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr2=2514,2515,2514,2515,
 &end
#
#    0 AMB  20-2:5130   158 PRO  HD+         4.50    (#   5130:20   Single Ambig)
 &rst
  ixpk= 5130, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2552,2495,
 igr2=2514,2515,
 &end
#
#  158 PRO  HB3         158 PRO  HD+         4.50    (#   5131:20   Unique)
 &rst
  ixpk= 5131, iat=2521,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2514,2515,
 &end
#
#  158 PRO  HB3           0 AMB  20-1:5132   4.50    (#   5132:20   Single Ambig)
 &rst
  ixpk= 5132, iat=2521,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr2=2514,2515,2514,2515,
 &end
#
#  162 PHE  HE          158 PRO  HD+         4.50    (#   5134:20   Unique)
 &rst
  ixpk= 5134, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2573,2577,
 igr2=2514,2515,
 &end
#
#    0 AMB  20-2:5135     0 AMB  20-1:5135   4.50    (#   5135:20   Double Ambig)
 &rst
  ixpk= 5135, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2552,2495,
 igr2=2514,2515,2514,2515,
 &end
#
#    0 AMB  20-2:5136     0 AMB  20-1:5136   4.50    (#   5136:20   Double Ambig)
 &rst
  ixpk= 5136, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2553,2498,2499,
 igr2=2514,2515,2514,2515,
 &end
#
#   86 PHE  HD           85 THR  HB          6.00    (#   5137:20   Unique)
 &rst
  ixpk= 5137, iat=  -1,1383, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1401,1409,
 &end
#
#   89 ILE  MD1          85 THR  HB          6.00    (#   5139:20   Unique)
 &rst
  ixpk= 5139, iat=  -1,1383, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1443,1444,1445,
 &end
#
#   86 PHE  HA           85 THR  HB          6.00    (#   5140:20   Unique)
 &rst
  ixpk= 5140, iat=1395,1383, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5141    85 THR  HA          4.50    (#   5141:20   Single Ambig)
 &rst
  ixpk= 5141, iat=  -1,1381, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1367,1903,
 &end
#
#   84 ASN  HN           52 THR  HA          6.00    (#   5142:20   Unique)
 &rst
  ixpk= 5142, iat=1365, 820, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5143    92 VAL  HA          4.50    (#   5143:20   Single Ambig)
 &rst
  ixpk= 5143, iat=  -1,1486, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1541,1502,1451,
 &end
#
#    0 AMB  20-2:5144   150 THR  HA          3.50    (#   5144:20   Single Ambig)
 &rst
  ixpk= 5144, iat=  -1,2380, r1= 0.00, r2= 1.80, r3= 4.84, r4= 5.59,
 igr1=2384,2385,2386,2438,2439,2432,2433,
 &end
#
#    0 AMB  20-2:5145     0 AMB  20-1:5145   4.50    (#   5145:20   Double Ambig)
 &rst
  ixpk= 5145, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1075,1585,1586,1486,
 igr2= 630, 631,1541,
 &end
#
#    0 AMB  20-2:5146     0 AMB  20-1:5146   6.00    (#   5146:20   Double Ambig)
 &rst
  ixpk= 5146, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.19, r4=10.94,
 igr1= 951, 952, 951, 952, 939, 940,2966,2967,
 igr2= 971, 972,2945,
 &end
#
#  157 LYS  HA          158 PRO  HA          3.50    (#   5148:20   Unique)
 &rst
  ixpk= 5148, iat=2493,2523, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:5149     0 AMB  20-1:5149   6.00    (#   5149:20   Double Ambig)
 &rst
  ixpk= 5149, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.42, r4=10.17,
 igr1= 980,2964,2286,
 igr2= 971, 972,2945,2339,2340,
 &end
#
#  102 GLY  HA+          61 SER  HB+         4.50    (#   5150:20   Unique)
 &rst
  ixpk= 5150, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1650,1651,
 igr2= 971, 972,
 &end
#
#  172 LEU  MDY         169 PHE  HA          6.00    (#   5152:20   Unique)
 &rst
  ixpk= 5152, iat=  -1,2687, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:5153   136 ILE  HA          3.50    (#   5153:20   Single Ambig)
 &rst
  ixpk= 5153, iat=  -1,2158, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2603,2604,2603,2604,
 &end
#
#    0 AMB  20-2:5154     0 AMB  20-1:5154   3.50    (#   5154:20   Double Ambig)
 &rst
  ixpk= 5154, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1= 760, 761, 762, 764, 765, 766,2169,2170,2171,2649,
      2650,2651,2653,2654,2655,2804,2805,2806,2808,2809,
      2810,
 igr2= 756,2158,2184,
 &end
#
#    0 AMB  20-2:5155     0 AMB  20-1:5155   4.50    (#   5155:20   Double Ambig)
 &rst
  ixpk= 5155, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.14, r4= 7.89,
 igr1= 748, 749, 750,1226,1227,1228, 592, 593,
 igr2=1164, 609,
 &end
#
#    0 AMB  20-2:5156     0 AMB  20-1:5156   3.50    (#   5156:20   Double Ambig)
 &rst
  ixpk= 5156, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2498,2499, 292, 293,
 igr2=2493, 290,
 &end
#
#    0 AMB  20-2:5157     0 AMB  20-1:5157   3.50    (#   5157:20   Double Ambig)
 &rst
  ixpk= 5157, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2498,2499,2498,2499, 589, 590,
 igr2=2493, 609,
 &end
#
#    0 AMB  20-2:5158     0 AMB  20-1:5158   3.50    (#   5158:20   Double Ambig)
 &rst
  ixpk= 5158, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1167,1169, 589, 590,
 igr2=1164, 609,
 &end
#
#   65 LYS  HG+          62 ASP  HA          4.50    (#   5159:20   Unique)
 &rst
  ixpk= 5159, iat=  -1, 980, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1034,1035,
 &end
#
#   65 LYS  HG-          62 ASP  HA          6.00    (#   5160:20   Unique)
 &rst
  ixpk= 5160, iat=  -1, 980, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1034,1035,
 &end
#
#    0 AMB  20-2:5161   112 ILE  HA          4.50    (#   5161:20   Single Ambig)
 &rst
  ixpk= 5161, iat=  -1,1798, r1= 0.00, r2= 1.80, r3= 7.53, r4= 8.28,
 igr1=1825,1826,1809,1810,1811,1786,1787,1788,1790,1791,
      1792,1786,1787,1788,1790,1791,1792,1767,1768,1769,
      2166,2167,
 &end
#
#  172 LEU  MDY          30 PHE  HA          6.00    (#   5162:20   Unique)
 &rst
  ixpk= 5162, iat=  -1, 457, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2751,2752,2753,2755,2756,2757,
 &end
#
#   34 VAL  MG2          30 PHE  HA          4.50    (#   5163:20   Unique)
 &rst
  ixpk= 5163, iat=  -1, 457, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 538, 539, 540,
 &end
#
#    0 AMB  20-2:5164     7 VAL  HA          3.50    (#   5164:20   Single Ambig)
 &rst
  ixpk= 5164, iat=  -1,  89, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=  93,  94,  95,  97,  98,  99,
 &end
#
#    0 AMB  20-2:5165    96 VAL  HA          4.50    (#   5165:20   Single Ambig)
 &rst
  ixpk= 5165, iat=  -1,1541, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1529,1636,
 &end
#
#  102 GLY  HN           99 GLU  HA          3.50    (#   5166:20   Unique)
 &rst
  ixpk= 5166, iat=1648,1601, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:5167    16 SER  HA          4.50    (#   5167:20   Single Ambig)
 &rst
  ixpk= 5167, iat=  -1, 230, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1294, 221,
 &end
#
#    0 AMB  20-2:5168     0 AMB  20-1:5168   3.50    (#   5168:20   Double Ambig)
 &rst
  ixpk= 5168, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1500,2010,2834,
 igr2=1451,1990,2763,
 &end
#
#  129 LYS  HN          127 ALA  HA          4.50    (#   5169:20   Unique)
 &rst
  ixpk= 5169, iat=2020,2002, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    6 ASN  HD2-        107 ALA  HA          4.50    (#   5170:20   Unique)
 &rst
  ixpk= 5170, iat=  -1,1717, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=  82,  83,
 &end
#
#    6 ASN  HD2+        107 ALA  HA          4.50    (#   5171:20   Unique)
 &rst
  ixpk= 5171, iat=  -1,1717, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=  82,  83,
 &end
#
#  128 ALA  HN          129 LYS  HA          6.00    (#   5172:20   Unique)
 &rst
  ixpk= 5172, iat=2010,2022, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   34 VAL  MG2          31 MET  HA          4.50    (#   5173:20   Unique)
 &rst
  ixpk= 5173, iat=  -1, 477, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 538, 539, 540,
 &end
#
#  114 ILE  MD1          31 MET  HA          4.50    (#   5174:20   Unique)
 &rst
  ixpk= 5174, iat=  -1, 477, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1847,1848,1849,
 &end
#
#    0 AMB  20-2:5175   138 ILE  HA          4.50    (#   5175:20   Single Ambig)
 &rst
  ixpk= 5175, iat=  -1,2184, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2203,2204,2687,
 &end
#
#    0 AMB  20-2:5176   115 THR  HA          6.00    (#   5176:20   Single Ambig)
 &rst
  ixpk= 5176, iat=  -1,1855, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1869, 191,
 &end
#
#  103 ALA  HA           99 GLU  HA          4.50    (#   5177:20   Unique)
 &rst
  ixpk= 5177, iat=1657,1601, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:5178    31 MET  HA          3.50    (#   5178:20   Single Ambig)
 &rst
  ixpk= 5178, iat=  -1, 477, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1= 465, 469, 158, 166, 467,
 &end
#
#    0 AMB  20-2:5179    31 MET  HA          4.50    (#   5179:20   Single Ambig)
 &rst
  ixpk= 5179, iat=  -1, 477, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 162, 160, 164,
 &end
#
#   84 ASN  HN           51 SER  HA          3.50    (#   5181:20   Unique)
 &rst
  ixpk= 5181, iat=1365, 809, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   68 ASP  HN           66 TRP  HA          6.00    (#   5182:20   Unique)
 &rst
  ixpk= 5182, iat=1095,1051, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   74 LYS  QE           71 ALA  HA          4.50    (#   5183:20   Unique)
 &rst
  ixpk= 5183, iat=  -1,1135, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1194,1195,
 &end
#
#   10 VAL  HA           47 ALA  HA          4.50    (#   5184:20   Unique)
 &rst
  ixpk= 5184, iat= 136, 746, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:5185   121 ASP  HA          4.50    (#   5185:20   Single Ambig)
 &rst
  ixpk= 5185, iat=  -1,1927, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1367,1903,
 &end
#
#  103 ALA  HA          104 ARG  HA          4.50    (#   5186:20   Unique)
 &rst
  ixpk= 5186, iat=1657,1667, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:5187   104 ARG  HA          2.70    (#   5187:20   Single Ambig)
 &rst
  ixpk= 5187, iat=  -1,1667, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=1690,1691,1690,1691,
 &end
#
#  119 ALA  HA          118 GLU  HA          4.50    (#   5189:20   Unique)
 &rst
  ixpk= 5189, iat=1903,1888, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   56 THR  HA           57 GLU  HA          6.00    (#   5190:20   Unique)
 &rst
  ixpk= 5190, iat= 888, 902, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5191     0 AMB  20-1:5191   4.50    (#   5191:20   Double Ambig)
 &rst
  ixpk= 5191, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 426, 496, 407,
 igr2= 445,1123,
 &end
#
#    0 AMB  20-2:5192   152 HIS  HA          3.50    (#   5192:20   Single Ambig)
 &rst
  ixpk= 5192, iat=  -1,2413, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2416,2504,2505,
 &end
#
#   65 LYS  HA           66 TRP  HA          6.00    (#   5193:20   Unique)
 &rst
  ixpk= 5193, iat=1029,1051, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   59 ASP  HN           62 ASP  HA          6.00    (#   5194:20   Unique)
 &rst
  ixpk= 5194, iat= 935, 980, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  166 LEU  MDX         171 LYS  HA          4.50    (#   5196:20   Unique)
 &rst
  ixpk= 5196, iat=  -1,2722, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  20-2:5197    81 LEU  HA          3.50    (#   5197:20   Single Ambig)
 &rst
  ixpk= 5197, iat=  -1,1315, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1322,1323,1324,1326,1327,1328,1322,1323,1324,1326,
      1327,1328,1341,1342,1343,1345,1346,1347,
 &end
#
#    0 AMB  20-2:5198     0 AMB  20-1:5198   6.00    (#   5198:20   Double Ambig)
 &rst
  ixpk= 5198, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1= 680, 877, 878,1296,
 igr2= 699, 866,1334,
 &end
#
#   54 TYR  HB+          88 ALA  HA          4.50    (#   5199:20   Unique)
 &rst
  ixpk= 5199, iat=  -1,1422, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 847, 848,
 &end
#
#   54 TYR  HB-          88 ALA  HA          4.50    (#   5200:20   Unique)
 &rst
  ixpk= 5200, iat=  -1,1422, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 847, 848,
 &end
#
#    0 AMB  20-2:5201    88 ALA  HA          3.50    (#   5201:20   Single Ambig)
 &rst
  ixpk= 5201, iat=  -1,1422, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 179, 180, 181, 183, 184, 185,1440,1441,
 &end
#
#   79 MET  HE           53 SER  HA          6.00    (#   5202:20   Unique)
 &rst
  ixpk= 5202, iat=  -1, 834, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1288,1289,1290,
 &end
#
#   54 TYR  HB+          53 SER  HA          6.00    (#   5203:20   Unique)
 &rst
  ixpk= 5203, iat=  -1, 834, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 847, 848,
 &end
#
#   88 ALA  MB           53 SER  HA          6.00    (#   5204:20   Unique)
 &rst
  ixpk= 5204, iat=  -1, 834, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1424,1425,1426,
 &end
#
#    0 AMB  20-2:5205    54 TYR  HA          6.00    (#   5205:20   Single Ambig)
 &rst
  ixpk= 5205, iat=  -1, 845, r1= 0.00, r2= 1.80, r3= 7.85, r4= 8.60,
 igr1= 869, 874, 875, 874, 875,
 &end
#
#    0 AMB  20-2:5206     0 AMB  20-1:5206   3.50    (#   5206:20   Double Ambig)
 &rst
  ixpk= 5206, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.98, r4= 7.73,
 igr1= 748, 749, 750,1659,1660,1661,1137,1138,1139,
 igr2= 736,1690,1691,1108,1109,1108,1109,
 &end
#
#   27 ILE  MG2           0 AMB  20-1:5207   3.50    (#   5207:20   Single Ambig)
 &rst
  ixpk= 5207, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 411, 412, 413,
 igr2= 193, 194, 193, 194,
 &end
#
#   69 PRO  HG+          36 LYS  HE-         4.50    (#   5209:20   Unique)
 &rst
  ixpk= 5209, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1111,1112,
 igr2= 576, 577,
 &end
#
#    0 AMB  20-2:5210   109 LYS  QE          3.50    (#   5210:20   Single Ambig)
 &rst
  ixpk= 5210, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1746,1747,1719,1720,1721,
 igr2=1752,1753,
 &end
#
#    0 AMB  20-2:5211     0 AMB  20-1:5211   2.70    (#   5211:20   Double Ambig)
 &rst
  ixpk= 5211, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.59, r4= 5.34,
 igr1=1031,1032,1037,1038, 570, 571,
 igr2=1040,1041, 576, 577,
 &end
#
#  109 LYS  HG+         109 LYS  QE          3.50    (#   5212:20   Unique)
 &rst
  ixpk= 5212, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1746,1747,
 igr2=1752,1753,
 &end
#
#    0 AMB  20-2:5213     0 AMB  20-1:5213   3.50    (#   5213:20   Double Ambig)
 &rst
  ixpk= 5213, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.85, r4= 7.60,
 igr1=2150,2151,2152,1982,1983,1984,2064,2065,2401,2402,
      2403,2405,2406,2407,
 igr2=2454,2455,2046,2047,
 &end
#
#  153 LYS  HB-         153 LYS  HE+         3.50    (#   5214:20   Unique)
 &rst
  ixpk= 5214, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2432,2433,
 igr2=2441,2442,
 &end
#
#    0 AMB  20-2:5215     0 AMB  20-1:5215   3.50    (#   5215:20   Double Ambig)
 &rst
  ixpk= 5215, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1= 871, 872,2804,2805,2806,2808,2809,2810,
 igr2= 877, 878,2612,2613,
 &end
#
#    0 AMB  20-2:5216     0 AMB  20-1:5216   3.50    (#   5216:20   Double Ambig)
 &rst
  ixpk= 5216, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2730,2731,2350,2351,2350,2351,2396,2765,2766,
 igr2=2722,2348,
 &end
#
#    0 AMB  20-2:5217     0 AMB  20-1:5217   3.50    (#   5217:20   Double Ambig)
 &rst
  ixpk= 5217, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2987,2724,2725,2350,2351,2396,
 igr2=2923,2722,2348,
 &end
#
#  165 ILE  MD1         142 PHE  HA          6.00    (#   5218:20   Unique)
 &rst
  ixpk= 5218, iat=  -1,2249, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=2634,2635,2636,
 &end
#
#    9 LEU  MDY          45 PHE  HA          6.00    (#   5219:20   Unique)
 &rst
  ixpk= 5219, iat=  -1, 716, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 124, 125, 126, 128, 129, 130,
 &end
#
#   54 TYR  HA           53 SER  HA          4.50    (#   5220:20   Unique)
 &rst
  ixpk= 5220, iat= 845, 834, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   52 THR  HA           53 SER  HA          6.00    (#   5221:20   Unique)
 &rst
  ixpk= 5221, iat= 820, 834, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   52 THR  HB           53 SER  HA          6.00    (#   5222:20   Unique)
 &rst
  ixpk= 5222, iat= 822, 834, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5223    53 SER  HA          6.00    (#   5223:20   Single Ambig)
 &rst
  ixpk= 5223, iat=  -1, 834, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1374,1375, 807,
 &end
#
#   97 PHE  HE            9 LEU  HA          6.00    (#   5224:20   Unique)
 &rst
  ixpk= 5224, iat=  -1, 117, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1565,1569,
 &end
#
#    0 AMB  20-2:5225   155 ALA  HA          6.00    (#   5225:20   Single Ambig)
 &rst
  ixpk= 5225, iat=  -1,2472, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2092,2116,
 &end
#
#    0 AMB  20-2:5226   107 ALA  HA          6.00    (#   5226:20   Single Ambig)
 &rst
  ixpk= 5226, iat=  -1,1717, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 103,  66,
 &end
#
#  137 GLY  HA-         116 ASP  HA          6.00    (#   5227:20   Unique)
 &rst
  ixpk= 5227, iat=  -1,1869, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2177,2178,
 &end
#
#    0 AMB  20-2:5228   155 ALA  HA          6.00    (#   5228:20   Single Ambig)
 &rst
  ixpk= 5228, iat=  -1,2472, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2094,2139,
 &end
#
#  186 ILE  HB          188 GLY  QA          6.00    (#   5230:20   Unique)
 &rst
  ixpk= 5230, iat=3003,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=3035,3036,
 &end
#
#  179 LEU  HN          179 LEU  HB+         3.50    (#   5231:20   Unique)
 &rst
  ixpk= 5231, iat=2863,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2867,2868,
 &end
#
#  179 LEU  HN            0 AMB  20-1:5232   3.50    (#   5232:20   Single Ambig)
 &rst
  ixpk= 5232, iat=2863,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr2=2867,2868,2867,2868,
 &end
#
#    0 AMB  20-2:5233     0 AMB  20-1:5233   3.50    (#   5233:20   Double Ambig)
 &rst
  ixpk= 5233, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=  82,  83,2054,
 igr2=1707,1708,2046,2047,
 &end
#
#    0 AMB  20-2:5234     0 AMB  20-1:5234   4.50    (#   5234:20   Double Ambig)
 &rst
  ixpk= 5234, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=  82,  83,2054,
 igr2=1707,1708,2046,2047,
 &end
#
#    0 AMB  20-2:5235     0 AMB  20-1:5235   3.50    (#   5235:20   Double Ambig)
 &rst
  ixpk= 5235, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1484,1500,1886,
 igr2=1488,1891,
 &end
#
#   19 LEU  MDX          15 GLY  HA-         3.50    (#   5236:20   Unique)
 &rst
  ixpk= 5236, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 278, 279, 280, 282, 283, 284,
 igr2= 223, 224,
 &end
#
#    0 AMB  20-2:5237     0 AMB  20-1:5237   2.70    (#   5237:20   Double Ambig)
 &rst
  ixpk= 5237, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.59, r4= 5.34,
 igr1= 411, 412, 413,1771,1772,1773, 278, 279, 280, 282,
       283, 284,
 igr2= 409,2077,
 &end
#
#    0 AMB  20-2:5238     0 AMB  20-1:5238   3.50    (#   5238:20   Double Ambig)
 &rst
  ixpk= 5238, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.24, r4= 6.99,
 igr1=1288,1289,1290,1279,2903,2904,2925,2926,
 igr2= 777, 778,2855,2856,
 &end
#
#    0 AMB  20-2:5239   183 ILE  HG1-        2.70    (#   5239:20   Single Ambig)
 &rst
  ixpk= 5239, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.03, r4= 5.78,
 igr1=2956,2957,2958, 616, 617, 618, 620, 621, 622, 616,
       617, 618, 620, 621, 622,2872,2873,2874,2876,2877,
      2878,
 igr2=2953,2954,
 &end
#
#    9 LEU  MDY         112 ILE  HG1-        3.50    (#   5240:20   Unique)
 &rst
  ixpk= 5240, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 124, 125, 126, 128, 129, 130,
 igr2=1806,1807,
 &end
#
#    0 AMB  20-2:5241     0 AMB  20-1:5241   2.70    (#   5241:20   Double Ambig)
 &rst
  ixpk= 5241, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.15, r4= 5.90,
 igr1=2079,2080,2081,1809,1810,1811,2086,2087,2088,1771,
      1772,1773,
 igr2=2083,2084,1806,1807,
 &end
#
#   82 LEU  MDX         120 THR  MG2         3.50    (#   5242:20   Unique)
 &rst
  ixpk= 5242, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1341,1342,1343,1345,1346,1347,
 igr2=1917,1918,1919,
 &end
#
#   82 LEU  MDY         120 THR  MG2         3.50    (#   5243:20   Unique)
 &rst
  ixpk= 5243, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1341,1342,1343,1345,1346,1347,
 igr2=1917,1918,1919,
 &end
#
#    0 AMB  20-2:5244    34 VAL  MG1         3.50    (#   5244:20   Single Ambig)
 &rst
  ixpk= 5244, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 532, 614,
 igr2= 534, 535, 536,
 &end
#
#  163 VAL  HB          163 VAL  MG1         2.70    (#   5245:20   Preassigned)
 &rst
  ixpk= 5245, iat=2587,  -1, r1= 0.00, r2= 1.80, r3= 3.24, r4= 3.99,
 igr2=2589,2590,2591,
 &end
#
#    0 AMB  20-2:5246    48 VAL  MGY         4.50    (#   5246:20   Single Ambig)
 &rst
  ixpk= 5246, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 847, 848,1543,
 igr2= 760, 761, 762, 764, 765, 766,
 &end
#
#    0 AMB  20-2:5247   151 LEU  MDY         4.50    (#   5247:20   Single Ambig)
 &rst
  ixpk= 5247, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.18, r4= 8.93,
 igr1=2177,2178,2353,2354,2353,2354,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#  115 THR  MG2         113 ILE  MG2         3.50    (#   5248:20   Unique)
 &rst
  ixpk= 5248, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1859,1860,1861,
 igr2=1821,1822,1823,
 &end
#
#  151 LEU  MDY         165 ILE  MD1         3.50    (#   5251:20   Unique)
 &rst
  ixpk= 5251, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2401,2402,2403,2405,2406,2407,
 igr2=2634,2635,2636,
 &end
#
#    0 AMB  20-2:5252   139 GLY  HA-         4.50    (#   5252:20   Single Ambig)
 &rst
  ixpk= 5252, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2184,2623,2177,2178,
 igr2=2203,2204,
 &end
#
#  101 LEU  MDY         101 LEU  HB3         3.50    (#   5253:20   Unique)
 &rst
  ixpk= 5253, iat=  -1,1634, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:5254     0 AMB  20-1:5254   3.50    (#   5254:20   Double Ambig)
 &rst
  ixpk= 5254, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=1031,1032, 504, 505, 570, 571, 501, 502,
 igr2=1040,1041,1040,1041, 507, 508,
 &end
#
#    0 AMB  20-2:5256   158 PRO  HB2         2.70    (#   5256:20   Single Ambig)
 &rst
  ixpk= 5256, iat=  -1,2520, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=2517,2518,2517,2518,
 &end
#
#    0 AMB  20-2:5258     0 AMB  20-1:5258   3.50    (#   5258:20   Double Ambig)
 &rst
  ixpk= 5258, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1=2370,2371,2855,2856,  77,  78,
 igr2=2305,2306,2928,2929,  51,  52,2606,2607,
 &end
#
#  163 VAL  MG2         155 ALA  MB          3.50    (#   5259:20   Unique)
 &rst
  ixpk= 5259, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2593,2594,2595,
 igr2=2474,2475,2476,
 &end
#
#  109 LYS  HN          109 LYS  QE          4.50    (#   5260:20   Unique)
 &rst
  ixpk= 5260, iat=1739,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1752,1753,
 &end
#
#    0 AMB  20-2:5261     0 AMB  20-1:5261   3.50    (#   5261:20   Double Ambig)
 &rst
  ixpk= 5261, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=  82,  83, 383,
 igr2=1707,1708, 447, 448, 447, 448,
 &end
#
#    0 AMB  20-2:5262   131 ILE  HB          4.50    (#   5262:20   Single Ambig)
 &rst
  ixpk= 5262, iat=  -1,2058, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2073,2042,
 &end
#
#  143 GLN  HN          143 GLN  HG+         4.50    (#   5264:20   Unique)
 &rst
  ixpk= 5264, iat=2267,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2274,2275,
 &end
#
#  143 GLN  HN          143 GLN  HG-         3.50    (#   5265:20   Unique)
 &rst
  ixpk= 5265, iat=2267,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2274,2275,
 &end
#
#    0 AMB  20-2:5266    35 MET  HG-         4.50    (#   5266:20   Single Ambig)
 &rst
  ixpk= 5266, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.99, r4= 7.74,
 igr1= 160, 164, 162, 724, 728, 726, 927,
 igr2= 551, 552,
 &end
#
#    0 AMB  20-2:5267    35 MET  HG-         4.50    (#   5267:20   Single Ambig)
 &rst
  ixpk= 5267, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 160, 164, 162, 726,
 igr2= 551, 552,
 &end
#
#  148 GLN  HE2+        148 GLN  HB+         4.50    (#   5268:20   Unique)
 &rst
  ixpk= 5268, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2358,2359,
 igr2=2350,2351,
 &end
#
#    0 AMB  20-2:5269   140 LYS  HD-         3.50    (#   5269:20   Single Ambig)
 &rst
  ixpk= 5269, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=2695,2699,2693,2701,2697,
 igr2=2218,2219,
 &end
#
#   91 TYR  HD           92 VAL  MG2         4.50    (#   5270:20   Unique)
 &rst
  ixpk= 5270, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1471,1480,
 igr2=1494,1495,1496,
 &end
#
#    0 AMB  20-2:5271   173 LYS  QG          3.50    (#   5271:20   Single Ambig)
 &rst
  ixpk= 5271, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2761,2783,
 igr2=2768,2769,
 &end
#
#    0 AMB  20-2:5273   112 ILE  MD1         6.00    (#   5273:20   Single Ambig)
 &rst
  ixpk= 5273, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.42, r4=10.17,
 igr1= 467, 158, 166, 465, 469,
 igr2=1809,1810,1811,
 &end
#
#    0 AMB  20-2:5274    62 ASP  HB2         4.50    (#   5274:20   Single Ambig)
 &rst
  ixpk= 5274, iat=  -1, 982, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1057, 915, 744,
 &end
#
#  134 TYR  HA          162 PHE  HB-         4.50    (#   5275:20   Unique)
 &rst
  ixpk= 5275, iat=2118,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2567,2568,
 &end
#
#   25 GLN  HE2-         28 LEU  HB-         4.50    (#   5276:20   Unique)
 &rst
  ixpk= 5276, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 378, 379,
 igr2= 428, 429,
 &end
#
#    0 AMB  20-2:5277    63 TYR  HB-         4.50    (#   5277:20   Single Ambig)
 &rst
  ixpk= 5277, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 951, 952, 719,1075,
 igr2= 994, 995,
 &end
#
#    0 AMB  20-2:5278    63 TYR  HB+         4.50    (#   5278:20   Single Ambig)
 &rst
  ixpk= 5278, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 951, 952, 951, 952, 719,
 igr2= 994, 995,
 &end
#
#    0 AMB  20-2:5279     0 AMB  20-1:5279   4.50    (#   5279:20   Double Ambig)
 &rst
  ixpk= 5279, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.14, r4= 8.89,
 igr1=2889,2890,1905,1906,1907,2765,2766,
 igr2=2966,2967,1397,2818,2819,
 &end
#
#   49 GLN  HN           57 GLU  HG+         4.50    (#   5280:20   Unique)
 &rst
  ixpk= 5280, iat= 770,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 907, 908,
 &end
#
#    0 AMB  20-2:5281    31 MET  HB-         6.00    (#   5281:20   Single Ambig)
 &rst
  ixpk= 5281, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1= 426, 496,
 igr2= 479, 480,
 &end
#
#    0 AMB  20-2:5282     0 AMB  20-1:5282   3.50    (#   5282:20   Double Ambig)
 &rst
  ixpk= 5282, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2279,2280,1678,
 igr2=2274,2275, 704, 705,
 &end
#
#  161 GLU  HN          158 PRO  HB2         3.50    (#   5283:20   Unique)
 &rst
  ixpk= 5283, iat=2548,2520, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:5284    25 GLN  HG-         4.50    (#   5284:20   Single Ambig)
 &rst
  ixpk= 5284, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 383, 405,
 igr2= 373, 374,
 &end
#
#    0 AMB  20-2:5286    31 MET  HG-         6.00    (#   5286:20   Single Ambig)
 &rst
  ixpk= 5286, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 494, 455, 528,
 igr2= 482, 483,
 &end
#
#  179 LEU  HN          178 GLU  QB          3.50    (#   5288:20   Unique)
 &rst
  ixpk= 5288, iat=2863,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2852,2853,
 &end
#
#    0 AMB  20-2:5290     0 AMB  20-1:5290   3.50    (#   5290:20   Double Ambig)
 &rst
  ixpk= 5290, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2350,2351,2350,2351,
 igr2=2305,2306,2305,2306,
 &end
#
#    0 AMB  20-2:5291     0 AMB  20-1:5291   3.50    (#   5291:20   Double Ambig)
 &rst
  ixpk= 5291, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.27, r4= 8.02,
 igr1=2218,2219,2925,2926,2925,2926,2603,2604,2212,2213,
      
 igr2=2215,2216,2928,2929,2928,2929,2606,2607,
 &end
#
#  135 ILE  HN          135 ILE  MG2         3.50    (#   5293:20   Unique)
 &rst
  ixpk= 5293, iat=2137,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2143,2144,2145,
 &end
#
#    0 AMB  20-2:5294    79 MET  HE          4.50    (#   5294:20   Single Ambig)
 &rst
  ixpk= 5294, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 787, 832,
 igr2=1288,1289,1290,
 &end
#
#   79 MET  HN           79 MET  HE          6.00    (#   5295:20   Unique)
 &rst
  ixpk= 5295, iat=1275,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1288,1289,1290,
 &end
#
#    0 AMB  20-2:5296   114 ILE  MD1         6.00    (#   5296:20   Single Ambig)
 &rst
  ixpk= 5296, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2156,1853,
 igr2=1847,1848,1849,
 &end
#
#  134 TYR  HD          112 ILE  MD1         3.50    (#   5300:20   Unique)
 &rst
  ixpk= 5300, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2124,2133,
 igr2=1809,1810,1811,
 &end
#
#  164 LYS  HA          165 ILE  MD1         6.00    (#   5301:20   Unique)
 &rst
  ixpk= 5301, iat=2601,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2634,2635,2636,
 &end
#
#    0 AMB  20-2:5302    13 PHE  HA          6.00    (#   5302:20   Single Ambig)
 &rst
  ixpk= 5302, iat=  -1, 191, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1= 797, 801, 799,
 &end
#
#    0 AMB  20-2:5304   116 ASP  HA          4.50    (#   5304:20   Single Ambig)
 &rst
  ixpk= 5304, iat=  -1,1869, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=2192,2193,2195,2196,2197,
 &end
#
#   48 VAL  HN           47 ALA  HA          3.50    (#   5306:20   Unique)
 &rst
  ixpk= 5306, iat= 754, 746, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   83 THR  HN            0 AMB  20-1:5308   4.50    (#   5308:20   Single Ambig)
 &rst
  ixpk= 5308, iat=1351,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1367,1903,
 &end
#
#  136 ILE  MG2         114 ILE  HA          4.50    (#   5309:20   Unique)
 &rst
  ixpk= 5309, iat=  -1,1836, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2162,2163,2164,
 &end
#
#  138 ILE  MD1         114 ILE  HA          6.00    (#   5310:20   Unique)
 &rst
  ixpk= 5310, iat=  -1,1836, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=2195,2196,2197,
 &end
#
#  124 ASN  HD2+        124 ASN  HA          4.50    (#   5314:20   Unique)
 &rst
  ixpk= 5314, iat=  -1,1957, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1964,1965,
 &end
#
#  120 THR  HN          121 ASP  HA          6.00    (#   5316:20   Unique)
 &rst
  ixpk= 5316, iat=1911,1927, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5317     0 AMB  20-1:5317   4.50    (#   5317:20   Double Ambig)
 &rst
  ixpk= 5317, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2201, 978, 967,
 igr2=2642, 937,
 &end
#
#  138 ILE  MG2         166 LEU  HA          6.00    (#   5318:20   Unique)
 &rst
  ixpk= 5318, iat=  -1,2642, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=2188,2189,2190,
 &end
#
#  140 LYS  QE          168 THR  HA          4.50    (#   5319:20   Unique)
 &rst
  ixpk= 5319, iat=  -1,2673, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2221,2222,
 &end
#
#    0 AMB  20-2:5324   168 THR  HA          4.50    (#   5324:20   Single Ambig)
 &rst
  ixpk= 5324, iat=  -1,2673, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2709,2710,2724,2725,
 &end
#
#   68 ASP  QB           66 TRP  HA          6.00    (#   5328:20   Unique)
 &rst
  ixpk= 5328, iat=  -1,1051, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1099,1100,
 &end
#
#   67 LYS  QB           66 TRP  HA          4.50    (#   5329:20   Unique)
 &rst
  ixpk= 5329, iat=  -1,1051, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1077,1078,
 &end
#
#    0 AMB  20-2:5330    66 TRP  HA          4.50    (#   5330:20   Single Ambig)
 &rst
  ixpk= 5330, iat=  -1,1051, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1031,1032,1083,1084,
 &end
#
#    0 AMB  20-2:5331    66 TRP  HA          4.50    (#   5331:20   Single Ambig)
 &rst
  ixpk= 5331, iat=  -1,1051, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=1031,1032,1150,1037,1038,
 &end
#
#    0 AMB  20-2:5332    66 TRP  HA          4.50    (#   5332:20   Single Ambig)
 &rst
  ixpk= 5332, iat=  -1,1051, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=1080,1081,1137,1138,1139,
 &end
#
#   65 LYS  HG+          66 TRP  HA          4.50    (#   5333:20   Unique)
 &rst
  ixpk= 5333, iat=  -1,1051, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1034,1035,
 &end
#
#   72 LEU  MDY          66 TRP  HA          4.50    (#   5334:20   Unique)
 &rst
  ixpk= 5334, iat=  -1,1051, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#   65 LYS  HG-          66 TRP  HA          4.50    (#   5335:20   Unique)
 &rst
  ixpk= 5335, iat=  -1,1051, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1034,1035,
 &end
#
#    0 AMB  20-2:5338    66 TRP  HA          6.00    (#   5338:20   Single Ambig)
 &rst
  ixpk= 5338, iat=  -1,1051, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1066,1064,
 &end
#
#    0 AMB  20-2:5339     0 AMB  20-1:5339   3.50    (#   5339:20   Double Ambig)
 &rst
  ixpk= 5339, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.72, r4= 7.47,
 igr1=1262,1224,1693,1694,1603,1604,1618,1619,1618,1619,
      
 igr2=1238,1164,1667,1577,1631,
 &end
#
#    0 AMB  20-2:5343   184 TYR  HA          4.50    (#   5343:20   Single Ambig)
 &rst
  ixpk= 5343, iat=  -1,2964, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2989,2990,2991,2993,2994,2995,2989,2990,2991,2993,
      2994,2995,
 &end
#
#    0 AMB  20-2:5345     0 AMB  20-1:5345   3.50    (#   5345:20   Double Ambig)
 &rst
  ixpk= 5345, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1669,1670, 611, 612, 614,1166,
 igr2=1667, 609,1164,
 &end
#
#    0 AMB  20-2:5347     0 AMB  20-1:5347   3.50    (#   5347:20   Double Ambig)
 &rst
  ixpk= 5347, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2795,2848, 383,
 igr2=2797, 321,
 &end
#
#  107 ALA  HN          105 PRO  HA          4.50    (#   5348:20   Unique)
 &rst
  ixpk= 5348, iat=1715,1699, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:5349   178 GLU  HA          2.70    (#   5349:20   Single Ambig)
 &rst
  ixpk= 5349, iat=  -1,2850, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=2852,2853,2855,2856,
 &end
#
#  186 ILE  HB          183 ILE  HA          4.50    (#   5350:20   Unique)
 &rst
  ixpk= 5350, iat=3003,2945, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:5351   183 ILE  HA          4.50    (#   5351:20   Single Ambig)
 &rst
  ixpk= 5351, iat=  -1,2945, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=3009,3010,2931,2932,
 &end
#
#    0 AMB  20-2:5352    78 HIS  HA          4.50    (#   5352:20   Single Ambig)
 &rst
  ixpk= 5352, iat=  -1,1260, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1294, 221,
 &end
#
#  108 THR  HN          107 ALA  HA          3.50    (#   5353:20   Unique)
 &rst
  ixpk= 5353, iat=1725,1717, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:5354     0 AMB  20-1:5354   4.50    (#   5354:20   Double Ambig)
 &rst
  ixpk= 5354, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2279,2280, 258,
 igr2=2269, 230,
 &end
#
#  187 GLU  HN          186 ILE  HA          3.50    (#   5355:20   Unique)
 &rst
  ixpk= 5355, iat=3018,3001, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:5356     0 AMB  20-1:5356   3.50    (#   5356:20   Double Ambig)
 &rst
  ixpk= 5356, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1313, 258, 300, 301, 269,
 igr2= 230, 260,
 &end
#
#    0 AMB  20-2:5358   155 ALA  HA          4.50    (#   5358:20   Single Ambig)
 &rst
  ixpk= 5358, iat=  -1,2472, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=2484,2485,2102,2103,2120,
 &end
#
#   65 LYS  HN           65 LYS  HA          3.50    (#   5361:20   Unique)
 &rst
  ixpk= 5361, iat=1027,1029, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   71 ALA  HN           72 LEU  HA          6.00    (#   5362:20   Unique)
 &rst
  ixpk= 5362, iat=1133,1145, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5363     0 AMB  20-1:5363   3.50    (#   5363:20   Double Ambig)
 &rst
  ixpk= 5363, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 265,2188,2189,2190,
 igr2= 262, 263,2687,
 &end
#
#    0 AMB  20-2:5364    53 SER  QB          6.00    (#   5364:20   Single Ambig)
 &rst
  ixpk= 5364, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 868, 847, 848,
 igr2= 836, 837,
 &end
#
#  170 GLU  QB          169 PHE  HB2         6.00    (#   5367:20   Unique)
 &rst
  ixpk= 5367, iat=  -1,2689, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2709,2710,
 &end
#
#   66 TRP  HB2          66 TRP  HB3         2.70    (#   5368:20   Unique)
 &rst
  ixpk= 5368, iat=1053,1054, r1= 0.00, r2= 1.80, r3= 2.70, r4= 3.45,  &end
#
#    0 AMB  20-2:5369   169 PHE  HB2         4.50    (#   5369:20   Single Ambig)
 &rst
  ixpk= 5369, iat=  -1,2689, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 393, 394, 390, 391,
 &end
#
#    0 AMB  20-2:5370     0 AMB  20-1:5370   3.50    (#   5370:20   Double Ambig)
 &rst
  ixpk= 5370, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2746,2747, 338, 339,
 igr2= 459, 460,2689,
 &end
#
#    0 AMB  20-2:5372     0 AMB  20-1:5372   3.50    (#   5372:20   Double Ambig)
 &rst
  ixpk= 5372, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2962, 947,1648,
 igr2=2966,2967, 951, 952, 951, 952,
 &end
#
#    0 AMB  20-2:5374     0 AMB  20-1:5374   3.50    (#   5374:20   Double Ambig)
 &rst
  ixpk= 5374, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 902, 917,
 igr2= 877, 878, 983,
 &end
#
#    0 AMB  20-2:5375     0 AMB  20-1:5375   4.50    (#   5375:20   Double Ambig)
 &rst
  ixpk= 5375, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.61, r4= 7.36,
 igr1= 390, 391, 276, 292, 293,
 igr2=2690, 351,
 &end
#
#   40 ASN  HD2+         40 ASN  QB          3.50    (#   5376:20   Unique)
 &rst
  ixpk= 5376, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 646, 647,
 igr2= 641, 642,
 &end
#
#    0 AMB  20-2:5377     0 AMB  20-1:5377   4.50    (#   5377:20   Double Ambig)
 &rst
  ixpk= 5377, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 415, 416, 278, 279, 280, 282, 283, 284, 431,
 igr2=2690, 351,
 &end
#
#    0 AMB  20-2:5378     0 AMB  20-1:5378   3.50    (#   5378:20   Double Ambig)
 &rst
  ixpk= 5378, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.54, r4= 8.29,
 igr1=2903,2904,2925,2926,1111,1112,1185,1186, 567, 568,
      
 igr2=2912,2913,2934,2935, 576, 577,1194,1195, 598, 599,
      
 &end
#
#    0 AMB  20-2:5379     0 AMB  20-1:5379   3.50    (#   5379:20   Double Ambig)
 &rst
  ixpk= 5379, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2925,2926, 504, 505,
 igr2=2934,2935, 576, 577,
 &end
#
#    0 AMB  20-2:5380   109 LYS  QE          3.50    (#   5380:20   Single Ambig)
 &rst
  ixpk= 5380, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1563,1571,1565,1569,
 igr2=1752,1753,
 &end
#
#   97 PHE  HD          109 LYS  QE          3.50    (#   5381:20   Unique)
 &rst
  ixpk= 5381, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1563,1571,
 igr2=1752,1753,
 &end
#
#    0 AMB  20-2:5382     0 AMB  20-1:5382   3.50    (#   5382:20   Double Ambig)
 &rst
  ixpk= 5382, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1=2279,2280, 199, 203,
 igr2=2274,2275, 907, 908,
 &end
#
#    0 AMB  20-2:5383     8 ASP  HB2         3.50    (#   5383:20   Single Ambig)
 &rst
  ixpk= 5383, iat=  -1, 107, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1565,1569,1563,1571,
 &end
#
#    0 AMB  20-2:5384     0 AMB  20-1:5384   4.50    (#   5384:20   Double Ambig)
 &rst
  ixpk= 5384, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1=1567, 463, 471, 544, 475,
 igr2= 107, 520, 521,
 &end
#
#  105 PRO  HA          105 PRO  HB3         3.50    (#   5385:20   Unique)
 &rst
  ixpk= 5385, iat=1699,1697, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:5386   118 GLU  HB3         3.50    (#   5386:20   Single Ambig)
 &rst
  ixpk= 5386, iat=  -1,1891, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1888,2382,
 &end
#
#  105 PRO  HA          105 PRO  HB3         3.50    (#   5387:20   Unique)
 &rst
  ixpk= 5387, iat=1699,1697, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:5388   112 ILE  HB          6.00    (#   5388:20   Single Ambig)
 &rst
  ixpk= 5388, iat=  -1,1800, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 170,1777,
 &end
#
#   95 GLU  QG           95 GLU  HB2         3.50    (#   5391:20   Unique)
 &rst
  ixpk= 5391, iat=  -1,1528, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1531,1532,
 &end
#
#    0 AMB  20-2:5392     0 AMB  20-1:5392   3.50    (#   5392:20   Double Ambig)
 &rst
  ixpk= 5392, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.72, r4= 7.47,
 igr1=2894,2895, 354, 362,2124,2133,2824,2828, 269,2826,
      
 igr2=2886,2887, 276,2166,2167,
 &end
#
#   99 GLU  HA          103 ALA  MB          3.50    (#   5394:20   Unique)
 &rst
  ixpk= 5394, iat=1601,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1659,1660,1661,
 &end
#
#   92 VAL  HA           92 VAL  MG2         3.50    (#   5395:20   Unique)
 &rst
  ixpk= 5395, iat=1486,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1494,1495,1496,
 &end
#
#    0 AMB  20-2:5397    56 THR  MG2         3.50    (#   5397:20   Single Ambig)
 &rst
  ixpk= 5397, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 935, 754,
 igr2= 892, 893, 894,
 &end
#
#   68 ASP  QB           71 ALA  MB          3.50    (#   5398:20   Unique)
 &rst
  ixpk= 5398, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1099,1100,
 igr2=1137,1138,1139,
 &end
#
#    0 AMB  20-2:5400     0 AMB  20-1:5400   3.50    (#   5400:20   Double Ambig)
 &rst
  ixpk= 5400, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.67, r4= 7.42,
 igr1= 174,1494,1495,1496,
 igr2=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,
 &end
#
#  129 LYS  HN          125 ILE  MD1         4.50    (#   5402:20   Unique)
 &rst
  ixpk= 5402, iat=2020,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1982,1983,1984,
 &end
#
#    0 AMB  20-2:5403     0 AMB  20-1:5403   3.50    (#   5403:20   Double Ambig)
 &rst
  ixpk= 5403, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1761, 832,
 igr2=1771,1772,1773,1322,1323,1324,1326,1327,1328,
 &end
#
#    0 AMB  20-2:5404     0 AMB  20-1:5404   3.50    (#   5404:20   Double Ambig)
 &rst
  ixpk= 5404, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2460,2464,2458,2466,2255,2263, 795, 803,2462,
 igr2=2401,2402,2403,2405,2406,2407,1424,1425,1426,
 &end
#
#    0 AMB  20-2:5405     0 AMB  20-1:5405   4.50    (#   5405:20   Double Ambig)
 &rst
  ixpk= 5405, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.75, r4= 9.50,
 igr1=2460,2464,2462,2424,1471,1480,
 igr2=2401,2402,2403,2405,2406,2407,1424,1425,1426,
 &end
#
#   27 ILE  HA           27 ILE  MG2         3.50    (#   5406:20   Preassigned)
 &rst
  ixpk= 5406, iat= 407,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 411, 412, 413,
 &end
#
#    0 AMB  20-2:5407     0 AMB  20-1:5407   3.50    (#   5407:20   Double Ambig)
 &rst
  ixpk= 5407, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=2724,2725, 428, 429,2947,
 igr2=2649,2650,2651,2653,2654,2655, 433, 434, 435, 437,
       438, 439, 616, 617, 618, 620, 621, 622,
 &end
#
#    0 AMB  20-2:5408   113 ILE  MD1         4.50    (#   5408:20   Single Ambig)
 &rst
  ixpk= 5408, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2137,1796,1834,
 igr2=1828,1829,1830,
 &end
#
#    0 AMB  20-2:5409   166 LEU  MDX         4.50    (#   5409:20   Single Ambig)
 &rst
  ixpk= 5409, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2158,2184,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  20-2:5411    28 LEU  MDX         3.50    (#   5411:20   Single Ambig)
 &rst
  ixpk= 5411, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 201, 356, 360, 197, 205, 358,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:5412    28 LEU  MDX         4.50    (#   5412:20   Single Ambig)
 &rst
  ixpk= 5412, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.39, r4= 9.14,
 igr1= 199, 203, 201, 197, 205, 354, 362,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:5413     7 VAL  MG2         4.50    (#   5413:20   Single Ambig)
 &rst
  ixpk= 5413, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=  73,1725,
 igr2=  97,  98,  99,
 &end
#
#   97 PHE  HZ           10 VAL  MG2         3.50    (#   5414:20   Unique)
 &rst
  ixpk= 5414, iat=1567,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  20-2:5415    10 VAL  MG2         3.50    (#   5415:20   Single Ambig)
 &rst
  ixpk= 5415, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1565,1569,1563,1571,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  20-2:5417    10 VAL  MG2         4.50    (#   5417:20   Single Ambig)
 &rst
  ixpk= 5417, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=1565,1569,1555,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  20-2:5418     0 AMB  20-1:5418   3.50    (#   5418:20   Double Ambig)
 &rst
  ixpk= 5418, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1= 959, 300, 301,
 igr2= 144, 145, 146,1303,1304,1305,1307,1308,1309,
 &end
#
#   45 PHE  HA           10 VAL  MG2         6.00    (#   5420:20   Unique)
 &rst
  ixpk= 5420, iat= 716,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  20-2:5421    10 VAL  MG2         3.50    (#   5421:20   Single Ambig)
 &rst
  ixpk= 5421, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 117,1779,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  20-2:5422    46 ALA  MB          4.50    (#   5422:20   Single Ambig)
 &rst
  ixpk= 5422, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1= 957, 961, 959, 923, 931,
 igr2= 738, 739, 740,
 &end
#
#   66 TRP  HA           72 LEU  MDX         6.00    (#   5424:20   Unique)
 &rst
  ixpk= 5424, iat=1051,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#   11 PHE  HD            9 LEU  MDY         3.50    (#   5425:20   Unique)
 &rst
  ixpk= 5425, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 158, 166,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#   45 PHE  HE            9 LEU  MDY         3.50    (#   5427:20   Unique)
 &rst
  ixpk= 5427, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 724, 728,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:5429    28 LEU  MDY         3.50    (#   5429:20   Single Ambig)
 &rst
  ixpk= 5429, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 409,1224,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:5430    28 LEU  MDY         3.50    (#   5430:20   Single Ambig)
 &rst
  ixpk= 5430, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 488, 489, 490, 479, 480,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:5431   151 LEU  MDX         3.50    (#   5431:20   Single Ambig)
 &rst
  ixpk= 5431, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2396,2350,2351,2350,2351,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#  137 GLY  HN          151 LEU  MDX         4.50    (#   5432:20   Unique)
 &rst
  ixpk= 5432, iat=2175,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#    0 AMB  20-2:5435   172 LEU  MDY         3.50    (#   5435:20   Single Ambig)
 &rst
  ixpk= 5435, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2693,2701, 463, 471,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#  139 GLY  HN          138 ILE  MG2         3.50    (#   5436:20   Unique)
 &rst
  ixpk= 5436, iat=2201,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2188,2189,2190,
 &end
#
#  115 THR  HN          115 THR  HA          6.00    (#   5438:20   Unique)
 &rst
  ixpk= 5438, iat=1853,1855, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5439     0 AMB  20-1:5439   3.50    (#   5439:20   Double Ambig)
 &rst
  ixpk= 5439, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1719,1720,1721,2143,2144,2145,
 igr2=1717,2472,
 &end
#
#    0 AMB  20-2:5440     0 AMB  20-1:5440   3.50    (#   5440:20   Double Ambig)
 &rst
  ixpk= 5440, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 300, 301,2279,2280,
 igr2= 295, 296,2274,2275,
 &end
#
#   86 PHE  HD          119 ALA  MB          3.50    (#   5441:20   Unique)
 &rst
  ixpk= 5441, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1401,1409,
 igr2=1905,1906,1907,
 &end
#
#    0 AMB  20-2:5444     0 AMB  20-1:5444   4.50    (#   5444:20   Double Ambig)
 &rst
  ixpk= 5444, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.75, r4= 9.50,
 igr1=2659,2640,2814,
 igr2=2649,2650,2651,2653,2654,2655,2872,2873,2874,2876,
      2877,2878,2872,2873,2874,2876,2877,2878,
 &end
#
#   50 PHE  HN           12 LEU  MDY         4.50    (#   5445:20   Unique)
 &rst
  ixpk= 5445, iat= 787,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#   97 PHE  HZ           10 VAL  MG1         6.00    (#   5446:20   Unique)
 &rst
  ixpk= 5446, iat=1567,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 140, 141, 142,
 &end
#
#    0 AMB  20-2:5447     0 AMB  20-1:5447   3.50    (#   5447:20   Double Ambig)
 &rst
  ixpk= 5447, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1= 726, 356, 360,2671, 358,
 igr2= 616, 617, 618, 620, 621, 622, 433, 434, 435, 437,
       438, 439,2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  20-2:5448     9 LEU  MDY         3.50    (#   5448:20   Single Ambig)
 &rst
  ixpk= 5448, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1806,1807, 120,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#  112 ILE  MD1           9 LEU  MDY         3.50    (#   5449:20   Unique)
 &rst
  ixpk= 5449, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1809,1810,1811,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#  163 VAL  HB          151 LEU  MDX         6.00    (#   5450:20   Unique)
 &rst
  ixpk= 5450, iat=2587,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#   25 GLN  HE2+         25 GLN  HA          4.50    (#   5451:20   Unique)
 &rst
  ixpk= 5451, iat=  -1, 368, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 378, 379,
 &end
#
#    0 AMB  20-2:5452    62 ASP  HA          4.50    (#   5452:20   Single Ambig)
 &rst
  ixpk= 5452, iat=  -1, 980, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1011, 967,
 &end
#
#   66 TRP  HN           62 ASP  HA          4.50    (#   5453:20   Unique)
 &rst
  ixpk= 5453, iat=1049, 980, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:5456    27 ILE  HA          6.00    (#   5456:20   Single Ambig)
 &rst
  ixpk= 5456, iat=  -1, 407, r1= 0.00, r2= 1.80, r3= 7.85, r4= 8.60,
 igr1= 463, 471,2693,2701, 475,
 &end
#
#    0 AMB  20-2:5457     0 AMB  20-1:5457   4.50    (#   5457:20   Double Ambig)
 &rst
  ixpk= 5457, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2943,2962, 494, 455,
 igr2=2884, 426,
 &end
#
#   36 LYS  HN           32 LYS  HA          6.00    (#   5458:20   Unique)
 &rst
  ixpk= 5458, iat= 563, 496, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   38 LEU  HN           34 VAL  HA          6.00    (#   5459:20   Unique)
 &rst
  ixpk= 5459, iat= 607, 530, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5461    86 PHE  HA          6.00    (#   5461:20   Single Ambig)
 &rst
  ixpk= 5461, iat=  -1,1395, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1458,1459,1937,
 &end
#
#   90 ASN  HN           86 PHE  HA          6.00    (#   5462:20   Unique)
 &rst
  ixpk= 5462, iat=1449,1395, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5463    89 ILE  HA          4.50    (#   5463:20   Single Ambig)
 &rst
  ixpk= 5463, iat=  -1,1432, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1484,1500,1463,
 &end
#
#    0 AMB  20-2:5464     0 AMB  20-1:5464   4.50    (#   5464:20   Double Ambig)
 &rst
  ixpk= 5464, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2548,2583,2346,2378,
 igr2=2539,2322,
 &end
#
#  111 LEU  HG          111 LEU  HB2         3.50    (#   5465:20   Unique)
 &rst
  ixpk= 5465, iat=1784,1781, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:5466   111 LEU  HB2         4.50    (#   5466:20   Single Ambig)
 &rst
  ixpk= 5466, iat=  -1,1781, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2058,1440,1441,1765,1806,1807,
 &end
#
#    0 AMB  20-2:5467   111 LEU  HB3         3.50    (#   5467:20   Single Ambig)
 &rst
  ixpk= 5467, iat=  -1,1782, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1784,2058,
 &end
#
#    0 AMB  20-2:5468   111 LEU  HB3         4.50    (#   5468:20   Single Ambig)
 &rst
  ixpk= 5468, iat=  -1,1782, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2058,1440,1441,2096,1806,1807,2083,2084,
 &end
#
#  162 PHE  HN          162 PHE  HA          4.50    (#   5469:20   Unique)
 &rst
  ixpk= 5469, iat=2563,2565, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:5470     0 AMB  20-1:5470   4.50    (#   5470:20   Double Ambig)
 &rst
  ixpk= 5470, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1=2983,1027,2378,
 igr2=2945, 971, 972,2339,2340,
 &end
#
#  144 THR  HN          143 GLN  HG+         6.00    (#   5471:20   Unique)
 &rst
  ixpk= 5471, iat=2284,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=2274,2275,
 &end
#
#  144 THR  HN          143 GLN  HG-         4.50    (#   5473:20   Unique)
 &rst
  ixpk= 5473, iat=2284,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2274,2275,
 &end
#
#    0 AMB  20-2:5474     0 AMB  20-1:5474   3.50    (#   5474:20   Double Ambig)
 &rst
  ixpk= 5474, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2335,2358,2359,3033,2999,
 igr2=2327,2328,2353,2354,3025,3026,
 &end
#
#    0 AMB  20-2:5475     0 AMB  20-1:5475   4.50    (#   5475:20   Double Ambig)
 &rst
  ixpk= 5475, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=2335,2358,2359,3033,
 igr2=2327,2328,2353,2354,3025,3026,
 &end
#
#    0 AMB  20-2:5476     0 AMB  20-1:5476   6.00    (#   5476:20   Double Ambig)
 &rst
  ixpk= 5476, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.49, r4= 9.24,
 igr1=1073, 443,
 igr2=1099,1100, 507, 508,
 &end
#
#  179 LEU  HN          182 LYS  QE          6.00    (#   5479:20   Unique)
 &rst
  ixpk= 5479, iat=2863,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=2934,2935,
 &end
#
#   37 LYS  HN           37 LYS  QE          4.50    (#   5480:20   Unique)
 &rst
  ixpk= 5480, iat= 585,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 598, 599,
 &end
#
#  123 GLY  HN          124 ASN  HB+         6.00    (#   5481:20   Unique)
 &rst
  ixpk= 5481, iat=1948,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1959,1960,
 &end
#
#    0 AMB  20-2:5485    66 TRP  HB3         4.50    (#   5485:20   Single Ambig)
 &rst
  ixpk= 5485, iat=  -1,1054, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1068,1143,
 &end
#
#   66 TRP  HD1          66 TRP  HB3         4.50    (#   5486:20   Unique)
 &rst
  ixpk= 5486, iat=1057,1054, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:5487    66 TRP  HB3         4.50    (#   5487:20   Single Ambig)
 &rst
  ixpk= 5487, iat=  -1,1054, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1068,1143,
 &end
#
#   66 TRP  HD1          66 TRP  HB2         6.00    (#   5488:20   Unique)
 &rst
  ixpk= 5488, iat=1057,1053, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5490   113 ILE  MG2         3.50    (#   5490:20   Single Ambig)
 &rst
  ixpk= 5490, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1825,1826,1819,
 igr2=1821,1822,1823,
 &end
#
#    0 AMB  20-2:5491   113 ILE  MG2         3.50    (#   5491:20   Single Ambig)
 &rst
  ixpk= 5491, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2147,2148, 177,
 igr2=1821,1822,1823,
 &end
#
#    0 AMB  20-2:5492   113 ILE  MG2         3.50    (#   5492:20   Single Ambig)
 &rst
  ixpk= 5492, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1825,1826,2141,
 igr2=1821,1822,1823,
 &end
#
#   76 VAL  MG1          76 VAL  HA          3.50    (#   5496:20   Preassigned)
 &rst
  ixpk= 5496, iat=  -1,1222, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1226,1227,1228,
 &end
#
#  161 GLU  HA          161 GLU  HB3         3.50    (#   5500:20   Unique)
 &rst
  ixpk= 5500, iat=2550,2553, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  161 GLU  HA          161 GLU  HB2         3.50    (#   5502:20   Unique)
 &rst
  ixpk= 5502, iat=2550,2552, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  169 PHE  HB2         168 THR  HB          6.00    (#   5505:20   Unique)
 &rst
  ixpk= 5505, iat=2689,2675, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  119 ALA  MB           83 THR  HB          6.00    (#   5509:20   Unique)
 &rst
  ixpk= 5509, iat=  -1,1355, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1905,1906,1907,
 &end
#
#    8 ASP  HN          108 THR  HB          6.00    (#   5511:20   Unique)
 &rst
  ixpk= 5511, iat= 103,1729, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5512    85 THR  HB          6.00    (#   5512:20   Single Ambig)
 &rst
  ixpk= 5512, iat=  -1,1383, r1= 0.00, r2= 1.80, r3= 8.30, r4= 9.05,
 igr1=2458,2466,2460,2464,2462, 795, 803,
 &end
#
#    0 AMB  20-2:5513    85 THR  HB          6.00    (#   5513:20   Single Ambig)
 &rst
  ixpk= 5513, iat=  -1,1383, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=2460,2464,2462,1948,
 &end
#
#   28 LEU  MDY          76 VAL  HA          6.00    (#   5514:20   Unique)
 &rst
  ixpk= 5514, iat=  -1,1222, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 433, 434, 435, 437, 438, 439,
 &end
#
#   64 VAL  HA           67 LYS  QE          3.50    (#   5515:20   Unique)
 &rst
  ixpk= 5515, iat=1013,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1086,1087,
 &end
#
#    0 AMB  20-2:5516     0 AMB  20-1:5516   4.50    (#   5516:20   Double Ambig)
 &rst
  ixpk= 5516, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 639, 902,
 igr2=1086,1087, 877, 878,
 &end
#
#    0 AMB  20-2:5517     0 AMB  20-1:5517   2.70    (#   5517:20   Double Ambig)
 &rst
  ixpk= 5517, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.43, r4= 6.18,
 igr1=2432,2433, 869,1083,1084,2438,2439, 874, 875,1246,
      1247,
 igr2=2441,2442, 877, 878,1086,1087,
 &end
#
#    0 AMB  20-2:5519     0 AMB  20-1:5519   3.50    (#   5519:20   Double Ambig)
 &rst
  ixpk= 5519, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 312, 370, 371, 370, 371,
 igr2= 323, 324, 447, 448, 447, 448,
 &end
#
#   34 VAL  MG2         176 PHE  HB+         4.50    (#   5522:20   Unique)
 &rst
  ixpk= 5522, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 538, 539, 540,
 igr2=2818,2819,
 &end
#
#   34 VAL  MG2         176 PHE  HB-         4.50    (#   5523:20   Unique)
 &rst
  ixpk= 5523, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 538, 539, 540,
 igr2=2818,2819,
 &end
#
#  161 GLU  HB2         161 GLU  QG          2.70    (#   5525:20   Unique)
 &rst
  ixpk= 5525, iat=2552,  -1, r1= 0.00, r2= 1.80, r3= 3.03, r4= 3.78,
 igr2=2555,2556,
 &end
#
#    0 AMB  20-2:5526    25 GLN  HG-         2.70    (#   5526:20   Single Ambig)
 &rst
  ixpk= 5526, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.82, r4= 4.57,
 igr1= 370, 371, 370, 371,
 igr2= 373, 374,
 &end
#
#    0 AMB  20-2:5529    25 GLN  HG+         2.70    (#   5529:20   Single Ambig)
 &rst
  ixpk= 5529, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.82, r4= 4.57,
 igr1= 370, 371, 370, 371,
 igr2= 373, 374,
 &end
#
#  118 GLU  HG+         118 GLU  HB2         3.50    (#   5531:20   Unique)
 &rst
  ixpk= 5531, iat=  -1,1890, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1893,1894,
 &end
#
#    0 AMB  20-2:5533     0 AMB  20-1:5533   3.50    (#   5533:20   Double Ambig)
 &rst
  ixpk= 5533, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 321, 315,
 igr2= 370, 371, 309, 310,
 &end
#
#    0 AMB  20-2:5534   186 ILE  HG1+        3.50    (#   5534:20   Single Ambig)
 &rst
  ixpk= 5534, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=3001,2923,
 igr2=3009,3010,
 &end
#
#  183 ILE  HA          186 ILE  HG1+        3.50    (#   5535:20   Unique)
 &rst
  ixpk= 5535, iat=2945,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=3009,3010,
 &end
#
#  172 LEU  HA          175 LEU  MDX         4.50    (#   5537:20   Unique)
 &rst
  ixpk= 5537, iat=2744,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#  172 LEU  HG          175 LEU  MDX         6.00    (#   5538:20   Unique)
 &rst
  ixpk= 5538, iat=2749,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#  128 ALA  MB          131 ILE  HG1-        4.50    (#   5539:20   Unique)
 &rst
  ixpk= 5539, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2014,2015,2016,
 igr2=2064,2065,
 &end
#
#    0 AMB  20-2:5540   175 LEU  MDX         6.00    (#   5540:20   Single Ambig)
 &rst
  ixpk= 5540, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.90, r4=11.65,
 igr1=2606,2607,2870,2644,2645,2647,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:5541   175 LEU  MDX         6.00    (#   5541:20   Single Ambig)
 &rst
  ixpk= 5541, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=11.19, r4=11.94,
 igr1=2606,2607,2606,2607,2644,2645,2647,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#  101 LEU  HG          101 LEU  MDX         3.50    (#   5542:20   Unique)
 &rst
  ixpk= 5542, iat=1636,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:5543     0 AMB  20-1:5543   3.50    (#   5543:20   Double Ambig)
 &rst
  ixpk= 5543, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.41, r4= 8.16,
 igr1=1825,1826, 138,1318,1782,
 igr2=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,1322,1323,1324,1326,1327,1328,
 &end
#
#    0 AMB  20-2:5544     0 AMB  20-1:5544   3.50    (#   5544:20   Double Ambig)
 &rst
  ixpk= 5544, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.98, r4= 8.73,
 igr1=1825,1826, 138,2160,1318,1782,1280,
 igr2=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,2166,2167,1322,1323,1324,1326,1327,1328,
      
 &end
#
#    0 AMB  20-2:5547     0 AMB  20-1:5547   3.50    (#   5547:20   Double Ambig)
 &rst
  ixpk= 5547, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.10, r4= 6.85,
 igr1=1504,1505,1506,2606,2607,1746,1747,
 igr2=2064,2065,2166,2167,
 &end
#
#    0 AMB  20-2:5551   172 LEU  MDX         3.50    (#   5551:20   Single Ambig)
 &rst
  ixpk= 5551, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2693,2701, 463, 471,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:5552   172 LEU  MDX         3.50    (#   5552:20   Single Ambig)
 &rst
  ixpk= 5552, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=2693,2701, 463, 471,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:5553   172 LEU  MDX         3.50    (#   5553:20   Single Ambig)
 &rst
  ixpk= 5553, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2742,2761,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:5554   172 LEU  MDX         3.50    (#   5554:20   Single Ambig)
 &rst
  ixpk= 5554, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 405,2761,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#   30 PHE  HN          172 LEU  MDX         4.50    (#   5555:20   Unique)
 &rst
  ixpk= 5555, iat= 455,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:5557    28 LEU  MDX         3.50    (#   5557:20   Single Ambig)
 &rst
  ixpk= 5557, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 431,1230,1231,1232,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#    0 AMB  20-2:5559    28 LEU  MDX         3.50    (#   5559:20   Single Ambig)
 &rst
  ixpk= 5559, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 431,1230,1231,1232,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#   12 LEU  HB3          12 LEU  MDY         3.50    (#   5560:20   Unique)
 &rst
  ixpk= 5560, iat= 175,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:5561   166 LEU  MDY         3.50    (#   5561:20   Single Ambig)
 &rst
  ixpk= 5561, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.53, r4= 7.28,
 igr1=2603,2604,2603,2604,2724,2725,2800,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  20-2:5562    47 ALA  MB          3.50    (#   5562:20   Single Ambig)
 &rst
  ixpk= 5562, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 905, 482, 483, 718,
 igr2= 748, 749, 750,
 &end
#
#   57 GLU  HG-          47 ALA  MB          3.50    (#   5563:20   Unique)
 &rst
  ixpk= 5563, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 907, 908,
 igr2= 748, 749, 750,
 &end
#
#  153 LYS  HE+         153 LYS  HG+         4.50    (#   5565:20   Unique)
 &rst
  ixpk= 5565, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2441,2442,
 igr2=2435,2436,
 &end
#
#  153 LYS  HE-         153 LYS  HG+         4.50    (#   5566:20   Unique)
 &rst
  ixpk= 5566, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2441,2442,
 igr2=2435,2436,
 &end
#
#    0 AMB  20-2:5567     0 AMB  20-1:5567   3.50    (#   5567:20   Double Ambig)
 &rst
  ixpk= 5567, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 758,1633,
 igr2= 760, 761, 762, 764, 765, 766,1638,1639,1640,1642,
      1643,1644,
 &end
#
#  100 GLU  QG          101 LEU  MDY         3.50    (#   5568:20   Unique)
 &rst
  ixpk= 5568, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1621,1622,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#  101 LEU  HB3         101 LEU  MDY         3.50    (#   5569:20   Unique)
 &rst
  ixpk= 5569, iat=1634,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#   59 ASP  HB-         101 LEU  MDY         3.50    (#   5571:20   Unique)
 &rst
  ixpk= 5571, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 939, 940,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:5575   101 LEU  MDY         3.50    (#   5575:20   Single Ambig)
 &rst
  ixpk= 5575, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1585,1586, 939, 940,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  20-2:5576    92 VAL  MG1         3.50    (#   5576:20   Single Ambig)
 &rst
  ixpk= 5576, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 138,1782,
 igr2=1490,1491,1492,
 &end
#
#   25 GLN  HA           28 LEU  MDX         3.50    (#   5577:20   Unique)
 &rst
  ixpk= 5577, iat= 368,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 433, 434, 435, 437, 438, 439,
 &end
#
#   12 LEU  HA           92 VAL  MG2         4.50    (#   5578:20   Unique)
 &rst
  ixpk= 5578, iat= 172,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1494,1495,1496,
 &end
#
#    0 AMB  20-2:5580   175 LEU  MDY         4.50    (#   5580:20   Single Ambig)
 &rst
  ixpk= 5580, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 465, 469, 467,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:5581   166 LEU  MDY         3.50    (#   5581:20   Single Ambig)
 &rst
  ixpk= 5581, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2671,2720,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  20-2:5582     9 LEU  MDY         3.50    (#   5582:20   Single Ambig)
 &rst
  ixpk= 5582, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 724, 728, 162, 160, 164,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:5586   175 LEU  MDY         2.70    (#   5586:20   Single Ambig)
 &rst
  ixpk= 5586, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.25, r4= 6.00,
 igr1=2649,2650,2651,2653,2654,2655,2162,2163,2164,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#   46 ALA  MB           47 ALA  MB          4.50    (#   5588:20   Unique)
 &rst
  ixpk= 5588, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1= 738, 739, 740,
 igr2= 748, 749, 750,
 &end
#
#  129 LYS  QE          129 LYS  QG          3.50    (#   5589:20   Preassigned)
 &rst
  ixpk= 5589, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2033,2034,
 igr2=2027,2028,
 &end
#
#  149 GLU  HG+         145 LYS  HG-         3.50    (#   5591:20   Unique)
 &rst
  ixpk= 5591, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2370,2371,
 igr2=2305,2306,
 &end
#
#    0 AMB  20-2:5592     0 AMB  20-1:5592   3.50    (#   5592:20   Double Ambig)
 &rst
  ixpk= 5592, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.27, r4= 8.02,
 igr1=  57,  58,2612,2613,2311,2312,1249,1250, 877, 878,
      
 igr2=  51,  52,2606,2607,2305,2306,1243,1244,
 &end
#
#   45 PHE  HD            9 LEU  MDY         4.50    (#   5594:20   Unique)
 &rst
  ixpk= 5594, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 722, 730,
 igr2= 124, 125, 126, 128, 129, 130,
 &end
#
#   68 ASP  HN           72 LEU  MDY         4.50    (#   5596:20   Unique)
 &rst
  ixpk= 5596, iat=1095,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2=1152,1153,1154,1156,1157,1158,
 &end
#
#  128 ALA  HA           93 ALA  MB          3.50    (#   5599:20   Unique)
 &rst
  ixpk= 5599, iat=2012,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1504,1505,1506,
 &end
#
#  128 ALA  HA           93 ALA  MB          3.50    (#   5600:20   Unique)
 &rst
  ixpk= 5600, iat=2012,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1504,1505,1506,
 &end
#
#  147 SER  HN          144 THR  HB          6.00    (#   5602:20   Unique)
 &rst
  ixpk= 5602, iat=2335,2288, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5604   108 THR  HA          4.50    (#   5604:20   Single Ambig)
 &rst
  ixpk= 5604, iat=  -1,1727, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1771,1772,1773,2086,2087,2088,1749,1750,
 &end
#
#    0 AMB  20-2:5605    61 SER  HB-         4.50    (#   5605:20   Single Ambig)
 &rst
  ixpk= 5605, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 951, 952, 951, 952, 939, 940,
 igr2= 971, 972,
 &end
#
#    0 AMB  20-2:5607    61 SER  HB-         6.00    (#   5607:20   Single Ambig)
 &rst
  ixpk= 5607, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.81, r4= 9.56,
 igr1=1021,1022,1023,1037,1038,
 igr2= 971, 972,
 &end
#
#   64 VAL  MG1          61 SER  HB-         4.50    (#   5608:20   Unique)
 &rst
  ixpk= 5608, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1017,1018,1019,
 igr2= 971, 972,
 &end
#
#    0 AMB  20-2:5609    51 SER  HB-         4.50    (#   5609:20   Single Ambig)
 &rst
  ixpk= 5609, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1279,1280,
 igr2= 811, 812,
 &end
#
#  133 ARG  HN            0 AMB  20-1:5610   6.00    (#   5610:20   Single Ambig)
 &rst
  ixpk= 5610, iat=2092,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2484,2485,2482,
 &end
#
#    0 AMB  20-2:5613    20 GLN  HA          3.50    (#   5613:20   Single Ambig)
 &rst
  ixpk= 5613, iat=  -1, 290, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 300, 301, 331,
 &end
#
#    0 AMB  20-2:5615    20 GLN  HA          3.50    (#   5615:20   Single Ambig)
 &rst
  ixpk= 5615, iat=  -1, 290, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 300, 301, 331,
 &end
#
#  106 ASP  HN          105 PRO  HD+         4.50    (#   5616:20   Unique)
 &rst
  ixpk= 5616, iat=1703,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1690,1691,
 &end
#
#    0 AMB  20-2:5618     0 AMB  20-1:5618   3.50    (#   5618:20   Double Ambig)
 &rst
  ixpk= 5618, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1463,3018,
 igr2=1415,1416,3035,3036,
 &end
#
#   66 TRP  HN           64 VAL  HA          6.00    (#   5619:20   Unique)
 &rst
  ixpk= 5619, iat=1049,1013, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  153 LYS  HG-         150 THR  HA          3.50    (#   5620:20   Unique)
 &rst
  ixpk= 5620, iat=  -1,2380, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2435,2436,
 &end
#
#  111 LEU  HN          131 ILE  HA          6.00    (#   5621:20   Unique)
 &rst
  ixpk= 5621, iat=1777,2056, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5624   164 LYS  HA          3.50    (#   5624:20   Single Ambig)
 &rst
  ixpk= 5624, iat=  -1,2601, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2606,2607,2606,2607,
 &end
#
#   47 ALA  HA           10 VAL  HA          4.50    (#   5625:20   Unique)
 &rst
  ixpk= 5625, iat= 746, 136, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   45 PHE  HA           10 VAL  HA          6.00    (#   5626:20   Unique)
 &rst
  ixpk= 5626, iat= 716, 136, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  162 PHE  HD          159 ALA  HA          6.00    (#   5631:20   Unique)
 &rst
  ixpk= 5631, iat=  -1,2529, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2571,2579,
 &end
#
#   52 THR  HN           53 SER  HA          6.00    (#   5635:20   Unique)
 &rst
  ixpk= 5635, iat= 818, 834, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   91 TYR  HA           88 ALA  HA          6.00    (#   5636:20   Unique)
 &rst
  ixpk= 5636, iat=1465,1422, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5637    88 ALA  HA          4.50    (#   5637:20   Single Ambig)
 &rst
  ixpk= 5637, iat=  -1,1422, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1415,1416,1451,
 &end
#
#   90 ASN  HN           88 ALA  HA          6.00    (#   5639:20   Unique)
 &rst
  ixpk= 5639, iat=1449,1422, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5642    88 ALA  HA          4.50    (#   5642:20   Single Ambig)
 &rst
  ixpk= 5642, iat=  -1,1422, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 843,1374,1375,
 &end
#
#    0 AMB  20-2:5648     0 AMB  20-1:5648   3.50    (#   5648:20   Double Ambig)
 &rst
  ixpk= 5648, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.47, r4= 7.22,
 igr1= 925, 929, 726,2894,2895, 356, 360, 201,1555, 358,
      
 igr2=1164, 609,1238,1577,
 &end
#
#    0 AMB  20-2:5649    49 GLN  HA          6.00    (#   5649:20   Single Ambig)
 &rst
  ixpk= 5649, iat=  -1, 772, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 221, 807,
 &end
#
#    0 AMB  20-2:5651   103 ALA  HA          6.00    (#   5651:20   Single Ambig)
 &rst
  ixpk= 5651, iat=  -1,1657, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1601,1650,1651,
 &end
#
#   72 LEU  MDX          68 ASP  HA          6.00    (#   5652:20   Unique)
 &rst
  ixpk= 5652, iat=  -1,1097, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#   84 ASN  HB2          87 GLY  HA+         6.00    (#   5656:20   Unique)
 &rst
  ixpk= 5656, iat=1369,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1415,1416,
 &end
#
#   90 ASN  HN           87 GLY  HA+         6.00    (#   5657:20   Unique)
 &rst
  ixpk= 5657, iat=1449,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1415,1416,
 &end
#
#   90 ASN  HD2-         87 GLY  HA+         6.00    (#   5659:20   Unique)
 &rst
  ixpk= 5659, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=1458,1459,
 igr2=1415,1416,
 &end
#
#    0 AMB  20-2:5662     0 AMB  20-1:5662   4.50    (#   5662:20   Double Ambig)
 &rst
  ixpk= 5662, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 191,1869,
 igr2= 213, 214, 213, 214,
 &end
#
#    0 AMB  20-2:5664    45 PHE  HB2         4.50    (#   5664:20   Single Ambig)
 &rst
  ixpk= 5664, iat=  -1, 718, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=1152,1153,1154,1156,1157,1158, 738, 739, 740,
 &end
#
#   46 ALA  MB           45 PHE  HB3         4.50    (#   5665:20   Unique)
 &rst
  ixpk= 5665, iat=  -1, 719, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 738, 739, 740,
 &end
#
#    9 LEU  MDY          45 PHE  HB3         4.50    (#   5666:20   Unique)
 &rst
  ixpk= 5666, iat=  -1, 719, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 124, 125, 126, 128, 129, 130,
 &end
#
#    0 AMB  20-2:5667    15 GLY  HA+         4.50    (#   5667:20   Single Ambig)
 &rst
  ixpk= 5667, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1260, 230,
 igr2= 223, 224,
 &end
#
#    0 AMB  20-2:5668    59 ASP  HB+         4.50    (#   5668:20   Single Ambig)
 &rst
  ixpk= 5668, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1545,1546,1547, 738, 739, 740,
 igr2= 939, 940,
 &end
#
#   60 PHE  HN           59 ASP  HB+         4.50    (#   5669:20   Unique)
 &rst
  ixpk= 5669, iat= 947,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 939, 940,
 &end
#
#  101 LEU  HB3          59 ASP  HB+         3.50    (#   5672:20   Unique)
 &rst
  ixpk= 5672, iat=1634,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 939, 940,
 &end
#
#    0 AMB  20-2:5675     0 AMB  20-1:5675   4.50    (#   5675:20   Double Ambig)
 &rst
  ixpk= 5675, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2550,2923,
 igr2=2934,2935,2912,2913,
 &end
#
#   65 LYS  HG+          65 LYS  HE-         3.50    (#   5677:20   Unique)
 &rst
  ixpk= 5677, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1034,1035,
 igr2=1040,1041,
 &end
#
#   32 LYS  HA            0 AMB  20-1:5678   4.50    (#   5678:20   Single Ambig)
 &rst
  ixpk= 5678, iat= 496,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr2= 576, 577, 576, 577,
 &end
#
#   71 ALA  HN           72 LEU  HB2         6.00    (#   5679:20   Unique)
 &rst
  ixpk= 5679, iat=1133,1147, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5680   162 PHE  HB+         6.00    (#   5680:20   Single Ambig)
 &rst
  ixpk= 5680, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=2583,2548,
 igr2=2567,2568,
 &end
#
#    0 AMB  20-2:5681    28 LEU  HB-         4.50    (#   5681:20   Single Ambig)
 &rst
  ixpk= 5681, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 378, 379, 494, 455,
 igr2= 428, 429,
 &end
#
#    0 AMB  20-2:5682   114 ILE  HB          6.00    (#   5682:20   Single Ambig)
 &rst
  ixpk= 5682, iat=  -1,1838, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1817, 152,
 &end
#
#   72 LEU  MDY          63 TYR  HB-         6.00    (#   5684:20   Unique)
 &rst
  ixpk= 5684, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1=1152,1153,1154,1156,1157,1158,
 igr2= 994, 995,
 &end
#
#   50 PHE  HA           54 TYR  HB+         6.00    (#   5686:20   Unique)
 &rst
  ixpk= 5686, iat= 789,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2= 847, 848,
 &end
#
#   50 PHE  HA           54 TYR  HB-         6.00    (#   5687:20   Unique)
 &rst
  ixpk= 5687, iat= 789,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2= 847, 848,
 &end
#
#    0 AMB  20-2:5689    54 TYR  HB-         6.00    (#   5689:20   Single Ambig)
 &rst
  ixpk= 5689, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 834, 836, 837,
 igr2= 847, 848,
 &end
#
#    0 AMB  20-2:5690   142 PHE  HB2         2.70    (#   5690:20   Single Ambig)
 &rst
  ixpk= 5690, iat=  -1,2251, r1= 0.00, r2= 1.80, r3= 3.64, r4= 4.39,
 igr1=2177,2178,2353,2354,2353,2354,
 &end
#
#    0 AMB  20-2:5693   142 PHE  HB2         3.50    (#   5693:20   Single Ambig)
 &rst
  ixpk= 5693, iat=  -1,2251, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2177,2178,2353,2354,2353,2354,
 &end
#
#    0 AMB  20-2:5694     0 AMB  20-1:5694   4.50    (#   5694:20   Double Ambig)
 &rst
  ixpk= 5694, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.53, r4= 8.28,
 igr1= 335, 336, 409,1262, 338, 339,2350,2351,2350,2351,
       312,
 igr2= 350,2251,
 &end
#
#    0 AMB  20-2:5695   112 ILE  HB          6.00    (#   5695:20   Single Ambig)
 &rst
  ixpk= 5695, iat=  -1,1800, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1815,2156,
 &end
#
#    0 AMB  20-2:5696     0 AMB  20-1:5696   4.50    (#   5696:20   Double Ambig)
 &rst
  ixpk= 5696, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.06, r4= 8.81,
 igr1= 847, 848,1582,1583,1582,1583,2064,2065,1504,1505,
      1506,
 igr2=1468,1559,1560,
 &end
#
#    0 AMB  20-2:5697     0 AMB  20-1:5697   4.50    (#   5697:20   Double Ambig)
 &rst
  ixpk= 5697, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=1494,1495,1496,1659,1660,1661,
 igr2=1468,1559,1560,
 &end
#
#    0 AMB  20-2:5698     0 AMB  20-1:5698   4.50    (#   5698:20   Double Ambig)
 &rst
  ixpk= 5698, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=2339,2340, 669, 670,1881,1882,
 igr2=1893,1894,  77,  78,
 &end
#
#  171 LYS  HN          170 GLU  HG+         4.50    (#   5699:20   Unique)
 &rst
  ixpk= 5699, iat=2720,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2712,2713,
 &end
#
#    0 AMB  20-2:5700     0 AMB  20-1:5700   6.00    (#   5700:20   Double Ambig)
 &rst
  ixpk= 5700, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.52, r4=10.27,
 igr1=2257,2261,2259,2720,
 igr2=1893,1894,2712,2713,
 &end
#
#    0 AMB  20-2:5701     0 AMB  20-1:5701   3.50    (#   5701:20   Double Ambig)
 &rst
  ixpk= 5701, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=1579,1580,2290,2291,2292,
 igr2=1621,1622,2327,2328,
 &end
#
#   11 PHE  HN           10 VAL  HB          6.00    (#   5704:20   Unique)
 &rst
  ixpk= 5704, iat= 150, 138, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5705   109 LYS  HB3         4.50    (#   5705:20   Single Ambig)
 &rst
  ixpk= 5705, iat=  -1,1744, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1752,1753,2046,2047,
 &end
#
#    0 AMB  20-2:5707     0 AMB  20-1:5707   4.50    (#   5707:20   Double Ambig)
 &rst
  ixpk= 5707, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2056,1729,
 igr2=1744,  91,
 &end
#
#    0 AMB  20-2:5709   158 PRO  HB3         3.50    (#   5709:20   Single Ambig)
 &rst
  ixpk= 5709, iat=  -1,2521, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2517,2518,2517,2518,
 &end
#
#   20 GLN  QB           20 GLN  HG-         3.50    (#   5710:20   Unique)
 &rst
  ixpk= 5710, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 292, 293,
 igr2= 295, 296,
 &end
#
#    0 AMB  20-2:5713    69 PRO  HB2         3.50    (#   5713:20   Single Ambig)
 &rst
  ixpk= 5713, iat=  -1,1114, r1= 0.00, r2= 1.80, r3= 5.22, r4= 5.97,
 igr1= 501, 502, 498, 499, 570, 571,1169, 504, 505, 504,
       505,
 &end
#
#    0 AMB  20-2:5714    69 PRO  HB2         2.70    (#   5714:20   Single Ambig)
 &rst
  ixpk= 5714, iat=  -1,1114, r1= 0.00, r2= 1.80, r3= 3.53, r4= 4.28,
 igr1=1111,1112, 498, 499, 548,
 &end
#
#  131 ILE  HA          109 LYS  HB2         3.50    (#   5716:20   Unique)
 &rst
  ixpk= 5716, iat=2056,1743, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:5718     0 AMB  20-1:5718   3.50    (#   5718:20   Double Ambig)
 &rst
  ixpk= 5718, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 482, 483, 501, 502,1171,1172,1173,1175,1176,1177,
      
 igr2= 479, 480,1115,
 &end
#
#   37 LYS  QG            0 AMB  20-1:5719   3.50    (#   5719:20   Single Ambig)
 &rst
  ixpk= 5719, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 592, 593,
 igr2= 589, 590, 589, 590,
 &end
#
#    0 AMB  20-2:5720     0 AMB  20-1:5720   3.50    (#   5720:20   Double Ambig)
 &rst
  ixpk= 5720, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2311,2312,2774,2775,2733,2734,
 igr2=2302,2303,2765,2766,2730,2731,
 &end
#
#    0 AMB  20-2:5721     0 AMB  20-1:5721   3.50    (#   5721:20   Double Ambig)
 &rst
  ixpk= 5721, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.00, r4= 7.75,
 igr1=2311,2312,2774,2775, 396, 397,2733,2734,
 igr2=2302,2303,2765,2766, 387, 388,2730,2731,
 &end
#
#   92 VAL  HA           96 VAL  HB          3.50    (#   5722:20   Unique)
 &rst
  ixpk= 5722, iat=1486,1543, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   28 LEU  MDX          25 GLN  HG+         4.50    (#   5725:20   Unique)
 &rst
  ixpk= 5725, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1= 433, 434, 435, 437, 438, 439,
 igr2= 373, 374,
 &end
#
#    0 AMB  20-2:5726     0 AMB  20-1:5726   3.50    (#   5726:20   Double Ambig)
 &rst
  ixpk= 5726, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1= 782, 783, 782, 783,2548,
 igr2= 774, 775,2552,
 &end
#
#  165 ILE  HN          163 VAL  HB          6.00    (#   5727:20   Unique)
 &rst
  ixpk= 5727, iat=2621,2587, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    4 LYS  HN            4 LYS  HB+         3.50    (#   5729:20   Unique)
 &rst
  ixpk= 5729, iat=  44,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=  48,  49,
 &end
#
#    0 AMB  20-2:5730     0 AMB  20-1:5730   3.50    (#   5730:20   Double Ambig)
 &rst
  ixpk= 5730, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.98, r4= 6.73,
 igr1=1705,2286,2601,2452,1667,
 igr2=1696,2302,2303,2587,2097,
 &end
#
#    0 AMB  20-2:5732     0 AMB  20-1:5732   3.50    (#   5732:20   Double Ambig)
 &rst
  ixpk= 5732, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1086,1087,2102,2103,
 igr2=1077,1078,2097,
 &end
#
#    0 AMB  20-2:5735   153 LYS  HB-         4.50    (#   5735:20   Single Ambig)
 &rst
  ixpk= 5735, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2450,1405,
 igr2=2432,2433,
 &end
#
#    0 AMB  20-2:5738    31 MET  HG-         4.50    (#   5738:20   Single Ambig)
 &rst
  ixpk= 5738, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 154, 155, 459, 460,
 igr2= 482, 483,
 &end
#
#    0 AMB  20-2:5741     0 AMB  20-1:5741   3.50    (#   5741:20   Double Ambig)
 &rst
  ixpk= 5741, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1143,1575,
 igr2=1150,1582,1583,
 &end
#
#  115 THR  HA           19 LEU  MDX         6.00    (#   5745:20   Unique)
 &rst
  ixpk= 5745, iat=1855,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2= 278, 279, 280, 282, 283, 284,
 &end
#
#  183 ILE  HA          186 ILE  HG1-        4.50    (#   5748:20   Unique)
 &rst
  ixpk= 5748, iat=2945,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=3009,3010,
 &end
#
#    0 AMB  20-2:5749     0 AMB  20-1:5749   3.50    (#   5749:20   Double Ambig)
 &rst
  ixpk= 5749, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1= 338, 339,1800, 175,
 igr2= 292, 293,1806,1807, 177,
 &end
#
#    0 AMB  20-2:5750     0 AMB  20-1:5750   3.50    (#   5750:20   Double Ambig)
 &rst
  ixpk= 5750, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1111,1112,2724,2725,2709,2710,
 igr2= 570, 571,2727,2728, 501, 502,
 &end
#
#    0 AMB  20-2:5752     0 AMB  20-1:5752   3.50    (#   5752:20   Double Ambig)
 &rst
  ixpk= 5752, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2724,2725,2396,2709,2710,
 igr2=2727,2728,2399,
 &end
#
#    0 AMB  20-2:5753     0 AMB  20-1:5753   3.50    (#   5753:20   Preassigned)
 &rst
  ixpk= 5753, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 396, 397,2733,2734,
 igr2= 390, 391,2727,2728,
 &end
#
#  107 ALA  HN          105 PRO  QG          6.00    (#   5754:20   Unique)
 &rst
  ixpk= 5754, iat=1715,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=1693,1694,
 &end
#
#  157 LYS  HN          157 LYS  HG+         3.50    (#   5757:20   Unique)
 &rst
  ixpk= 5757, iat=2491,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2498,2499,
 &end
#
#    0 AMB  20-2:5759   151 LEU  MDX         4.50    (#   5759:20   Single Ambig)
 &rst
  ixpk= 5759, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2599,2156,1853,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#    0 AMB  20-2:5761   151 LEU  MDX         4.50    (#   5761:20   Single Ambig)
 &rst
  ixpk= 5761, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2599,2156,1853,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#  174 ASP  HA          173 LYS  QG          6.00    (#   5762:20   Unique)
 &rst
  ixpk= 5762, iat=2785,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2=2768,2769,
 &end
#
#    0 AMB  20-2:5765     0 AMB  20-1:5765   6.00    (#   5765:20   Double Ambig)
 &rst
  ixpk= 5765, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.49, r4= 9.24,
 igr1=2010,2863,
 igr2=2027,2028,2928,2929,
 &end
#
#   54 TYR  HN           88 ALA  MB          4.50    (#   5766:20   Unique)
 &rst
  ixpk= 5766, iat= 843,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1424,1425,1426,
 &end
#
#    0 AMB  20-2:5767   151 LEU  MDY         3.50    (#   5767:20   Single Ambig)
 &rst
  ixpk= 5767, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2257,2261,2259,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#  184 TYR  HD          185 VAL  MGX         3.50    (#   5768:20   Unique)
 &rst
  ixpk= 5768, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2970,2979,
 igr2=2989,2990,2991,2993,2994,2995,
 &end
#
#    0 AMB  20-2:5769    34 VAL  MG2         6.00    (#   5769:20   Single Ambig)
 &rst
  ixpk= 5769, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2816, 518,
 igr2= 538, 539, 540,
 &end
#
#    0 AMB  20-2:5778    81 LEU  MDY         3.50    (#   5778:20   Single Ambig)
 &rst
  ixpk= 5778, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 811, 812,1277,
 igr2=1322,1323,1324,1326,1327,1328,
 &end
#
#  134 TYR  HB2         110 VAL  MG2         6.00    (#   5779:20   Unique)
 &rst
  ixpk= 5779, iat=2120,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1771,1772,1773,
 &end
#
#  134 TYR  HE          175 LEU  MDY         6.00    (#   5781:20   Unique)
 &rst
  ixpk= 5781, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1=2126,2131,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#   11 PHE  HA           47 ALA  MB          6.00    (#   5782:20   Unique)
 &rst
  ixpk= 5782, iat= 152,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 748, 749, 750,
 &end
#
#   34 VAL  HN           34 VAL  MG2         3.50    (#   5783:20   Unique)
 &rst
  ixpk= 5783, iat= 528,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 538, 539, 540,
 &end
#
#   45 PHE  HN           35 MET  HE          6.00    (#   5785:20   Unique)
 &rst
  ixpk= 5785, iat= 714,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 557, 558, 559,
 &end
#
#  138 ILE  HG1-        115 THR  MG2         6.00    (#   5786:20   Unique)
 &rst
  ixpk= 5786, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2192,2193,
 igr2=1859,1860,1861,
 &end
#
#    0 AMB  20-2:5787   135 ILE  MD1         4.50    (#   5787:20   Single Ambig)
 &rst
  ixpk= 5787, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2177,2178,2158,
 igr2=2150,2151,2152,
 &end
#
#  154 PHE  HE          135 ILE  MD1         4.50    (#   5791:20   Unique)
 &rst
  ixpk= 5791, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2460,2464,
 igr2=2150,2151,2152,
 &end
#
#  133 ARG  HE          125 ILE  MD1         3.50    (#   5793:20   Unique)
 &rst
  ixpk= 5793, iat=2105,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1982,1983,1984,
 &end
#
#  134 TYR  HD          136 ILE  MD1         4.50    (#   5794:20   Unique)
 &rst
  ixpk= 5794, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2124,2133,
 igr2=2169,2170,2171,
 &end
#
#    0 AMB  20-2:5796   131 ILE  MD1         4.50    (#   5796:20   Single Ambig)
 &rst
  ixpk= 5796, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2042,2073,
 igr2=2067,2068,2069,
 &end
#
#   52 THR  HG1          81 LEU  HA          6.00    (#   5798:20   Unique)
 &rst
  ixpk= 5798, iat= 828,1315, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5801    25 GLN  HG+         4.50    (#   5801:20   Single Ambig)
 &rst
  ixpk= 5801, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 383, 405,
 igr2= 373, 374,
 &end
#
#    0 AMB  20-2:5803     0 AMB  20-1:5803   3.50    (#   5803:20   Double Ambig)
 &rst
  ixpk= 5803, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=2491,1268,  82,  83,1678,
 igr2=2493, 290,1705,1667,
 &end
#
#    0 AMB  20-2:5805     0 AMB  20-1:5805   4.50    (#   5805:20   Double Ambig)
 &rst
  ixpk= 5805, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2571,2579,  82,  83, 686, 691,
 igr2=2493,1705, 609,
 &end
#
#    0 AMB  20-2:5807     0 AMB  20-1:5807   3.50    (#   5807:20   Double Ambig)
 &rst
  ixpk= 5807, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2571,2579,  82,  83, 686, 691,
 igr2=2493,1705, 609,
 &end
#
#  121 ASP  HA          122 SER  HA          6.00    (#   5809:20   Unique)
 &rst
  ixpk= 5809, iat=1927,1939, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5810     0 AMB  20-1:5810   2.70    (#   5810:20   Preassigned)
 &rst
  ixpk= 5810, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.52, r4= 8.27,
 igr1=2724,2725,1240,1241,2603,2604,2603,2604,1246,1247,
      2609,2610,2308,2309,2501,2502,2030,2031,2771,2772,
       874, 875, 393, 394,2727,2728,
 igr2=2733,2734,1249,1250,2612,2613, 877, 878,2311,2312,
      2504,2505,2033,2034,2774,2775, 396, 397,
 &end
#
#    0 AMB  20-2:5811     0 AMB  20-1:5811   2.70    (#   5811:20   Double Ambig)
 &rst
  ixpk= 5811, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.06, r4= 7.81,
 igr1=2498,2499, 390, 391, 869,2606,2607, 874, 875,2768,
      2769,2305,2306,2727,2728,1243,1244,2474,2475,2476,
      
 igr2=2504,2505, 396, 397, 877, 878,2612,2613,2774,2775,
      2311,2312,2733,2734,1249,1250,
 &end
#
#    0 AMB  20-2:5813     0 AMB  20-1:5813   3.50    (#   5813:20   Double Ambig)
 &rst
  ixpk= 5813, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1=2724,2725,2396,2709,2710,
 igr2=2727,2728,2399,
 &end
#
#   36 LYS  HG-          36 LYS  HE+         3.50    (#   5814:20   Unique)
 &rst
  ixpk= 5814, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 570, 571,
 igr2= 576, 577,
 &end
#
#    0 AMB  20-2:5815     0 AMB  20-1:5815   6.00    (#   5815:20   Double Ambig)
 &rst
  ixpk= 5815, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=11.44, r4=12.19,
 igr1=2712,2713,2046,2047, 323, 324, 907, 908,
 igr2= 396, 397,2033,2034, 877, 878,
 &end
#
#    0 AMB  20-2:5816     0 AMB  20-1:5816   4.50    (#   5816:20   Double Ambig)
 &rst
  ixpk= 5816, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.14, r4= 7.89,
 igr1=2712,2713,  77,  78,
 igr2= 396, 397,  57,  58,
 &end
#
#    0 AMB  20-2:5818    77 LYS  QB          4.50    (#   5818:20   Single Ambig)
 &rst
  ixpk= 5818, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1222,1277,
 igr2=1240,1241,
 &end
#
#    0 AMB  20-2:5819     0 AMB  20-1:5819   3.50    (#   5819:20   Double Ambig)
 &rst
  ixpk= 5819, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 494,2491,
 igr2= 479, 480,2496,
 &end
#
#    0 AMB  20-2:5820     0 AMB  20-1:5820   3.50    (#   5820:20   Double Ambig)
 &rst
  ixpk= 5820, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 276,2166,2167,
 igr2= 278, 279, 280, 282, 283, 284,1844,1845,
 &end
#
#    0 AMB  20-2:5821     0 AMB  20-1:5821   3.50    (#   5821:20   Double Ambig)
 &rst
  ixpk= 5821, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=1819,1185,1186,2903,2904,
 igr2=2147,2148,1191,1192,2909,2910,
 &end
#
#  164 LYS  HN          163 VAL  MG2         4.50    (#   5822:20   Unique)
 &rst
  ixpk= 5822, iat=2599,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2593,2594,2595,
 &end
#
#  169 PHE  HE           27 ILE  MD1         3.50    (#   5823:20   Unique)
 &rst
  ixpk= 5823, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2695,2699,
 igr2= 418, 419, 420,
 &end
#
#    0 AMB  20-2:5826   183 ILE  HA          4.50    (#   5826:20   Single Ambig)
 &rst
  ixpk= 5826, iat=  -1,2945, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=3012,3013,3014,3005,3006,3007,
 &end
#
#   68 ASP  HA           69 PRO  HA          6.00    (#   5828:20   Unique)
 &rst
  ixpk= 5828, iat=1097,1117, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  20-2:5829   133 ARG  HA          4.50    (#   5829:20   Single Ambig)
 &rst
  ixpk= 5829, iat=  -1,2094, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1781,1440,1441,1806,1807,2474,2475,2476,
 &end
#
#   86 PHE  HD           85 THR  HB          6.00    (#   5830:20   Unique)
 &rst
  ixpk= 5830, iat=  -1,1383, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1401,1409,
 &end
#
#    0 AMB  20-2:5831    61 SER  HB-         4.50    (#   5831:20   Single Ambig)
 &rst
  ixpk= 5831, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1015,1634,
 igr2= 971, 972,
 &end
#
#   19 LEU  HA           23 GLU  HB-         6.00    (#   5832:20   Unique)
 &rst
  ixpk= 5832, iat= 271,  -1, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr2= 335, 336,
 &end
#
#   30 PHE  HN          172 LEU  MDY         6.00    (#   5835:20   Unique)
 &rst
  ixpk= 5835, iat= 455,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:5836   175 LEU  MDX         3.50    (#   5836:20   Single Ambig)
 &rst
  ixpk= 5836, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2799,2160,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:5838   175 LEU  MDX         4.50    (#   5838:20   Single Ambig)
 &rst
  ixpk= 5838, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1= 465, 469, 467,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#   30 PHE  HE          175 LEU  HB2         6.00    (#   5839:20   Unique)
 &rst
  ixpk= 5839, iat=  -1,2799, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 465, 469,
 &end
#
#    0 AMB  20-2:5840   179 LEU  MDX         3.50    (#   5840:20   Single Ambig)
 &rst
  ixpk= 5840, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.53, r4= 7.28,
 igr1=2802,2925,2926,2925,2926,2603,2604,
 igr2=2872,2873,2874,2876,2877,2878,
 &end
#
#    0 AMB  20-2:5841   179 LEU  MDX         2.70    (#   5841:20   Single Ambig)
 &rst
  ixpk= 5841, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.43, r4= 6.18,
 igr1=2867,2868,2867,2868,2931,2932,2931,2932,2870,2606,
      2607,
 igr2=2872,2873,2874,2876,2877,2878,
 &end
#
#   92 VAL  HB           12 LEU  MDY         4.50    (#   5842:20   Unique)
 &rst
  ixpk= 5842, iat=1488,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#  178 GLU  HG+         179 LEU  MDX         3.50    (#   5843:20   Unique)
 &rst
  ixpk= 5843, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2855,2856,
 igr2=2872,2873,2874,2876,2877,2878,
 &end
#
#  182 LYS  QE          179 LEU  MDX         4.50    (#   5844:20   Unique)
 &rst
  ixpk= 5844, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2934,2935,
 igr2=2872,2873,2874,2876,2877,2878,
 &end
#
#   89 ILE  HA           12 LEU  MDY         3.50    (#   5845:20   Unique)
 &rst
  ixpk= 5845, iat=1432,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:5846    12 LEU  MDY         3.50    (#   5846:20   Single Ambig)
 &rst
  ixpk= 5846, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1494,1495,1496, 174,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#    0 AMB  20-2:5847    12 LEU  MDY         3.50    (#   5847:20   Single Ambig)
 &rst
  ixpk= 5847, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1422,1468,
 igr2= 179, 180, 181, 183, 184, 185,
 &end
#
#  172 LEU  MDY         166 LEU  MDY         3.50    (#   5848:20   Unique)
 &rst
  ixpk= 5848, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2751,2752,2753,2755,2756,2757,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  20-2:5849   183 ILE  MD1         6.00    (#   5849:20   Single Ambig)
 &rst
  ixpk= 5849, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1=2894,2895, 686, 691,
 igr2=2956,2957,2958,
 &end
#
#  131 ILE  HB          131 ILE  MD1         3.50    (#   5853:20   Preassigned)
 &rst
  ixpk= 5853, iat=2058,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2067,2068,2069,
 &end
#
#   50 PHE  HE          113 ILE  MG2         4.50    (#   5854:20   Unique)
 &rst
  ixpk= 5854, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 797, 801,
 igr2=1821,1822,1823,
 &end
#
#  128 ALA  HN          125 ILE  MD1         6.00    (#   5856:20   Unique)
 &rst
  ixpk= 5856, iat=2010,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1982,1983,1984,
 &end
#
#    0 AMB  20-2:5857   125 ILE  MD1         6.00    (#   5857:20   Single Ambig)
 &rst
  ixpk= 5857, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.65, r4= 9.40,
 igr1=1969,1988,2092,
 igr2=1982,1983,1984,
 &end
#
#  180 GLN  HE2+        183 ILE  MG2         3.50    (#   5859:20   Unique)
 &rst
  ixpk= 5859, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2894,2895,
 igr2=2949,2950,2951,
 &end
#
#    0 AMB  20-2:5860   183 ILE  MG2         3.50    (#   5860:20   Single Ambig)
 &rst
  ixpk= 5860, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 686, 691,2894,2895,
 igr2=2949,2950,2951,
 &end
#
#    0 AMB  20-2:5861     0 AMB  20-1:5861   3.50    (#   5861:20   Double Ambig)
 &rst
  ixpk= 5861, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1979,1980,1844,1845,
 igr2=1436,1437,1438,2162,2163,2164,
 &end
#
#    0 AMB  20-2:5862   159 ALA  MB          3.50    (#   5862:20   Single Ambig)
 &rst
  ixpk= 5862, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.81, r4= 6.56,
 igr1=2498,2499,2498,2499,2474,2475,2476,
 igr2=2531,2532,2533,
 &end
#
#  157 LYS  HA          159 ALA  MB          4.50    (#   5864:20   Unique)
 &rst
  ixpk= 5864, iat=2493,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2531,2532,2533,
 &end
#
#    0 AMB  20-2:5865   159 ALA  MB          6.00    (#   5865:20   Single Ambig)
 &rst
  ixpk= 5865, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2523,2585,
 igr2=2531,2532,2533,
 &end
#
#  183 ILE  HA          183 ILE  HG1-        3.50    (#   5866:20   Unique)
 &rst
  ixpk= 5866, iat=2945,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=2953,2954,
 &end
#
#  180 GLN  HA          183 ILE  HG1-        4.50    (#   5867:20   Unique)
 &rst
  ixpk= 5867, iat=2884,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=2953,2954,
 &end
#
#  180 GLN  HE2+        183 ILE  HG1+        4.50    (#   5868:20   Unique)
 &rst
  ixpk= 5868, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2894,2895,
 igr2=2953,2954,
 &end
#
#  183 ILE  MG2         184 TYR  HA          4.50    (#   5870:20   Unique)
 &rst
  ixpk= 5870, iat=  -1,2964, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2949,2950,2951,
 &end
#
#    0 AMB  20-2:5871    97 PHE  HA          3.50    (#   5871:20   Single Ambig)
 &rst
  ixpk= 5871, iat=  -1,1557, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1545,1546,1547, 144, 145, 146,
 &end
#
#  184 TYR  HD          185 VAL  MGX         3.50    (#   5873:20   Unique)
 &rst
  ixpk= 5873, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2970,2979,
 igr2=2989,2990,2991,2993,2994,2995,
 &end
#
#    0 AMB  20-2:5874   151 LEU  MDY         3.50    (#   5874:20   Single Ambig)
 &rst
  ixpk= 5874, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1=2396,2350,2351,2350,2351,
 igr2=2401,2402,2403,2405,2406,2407,
 &end
#
#    9 LEU  HG          110 VAL  MG1         3.50    (#   5875:20   Unique)
 &rst
  ixpk= 5875, iat= 122,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1767,1768,1769,
 &end
#
#  133 ARG  HA          132 ILE  MG2         4.50    (#   5876:20   Unique)
 &rst
  ixpk= 5876, iat=2094,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=2079,2080,2081,
 &end
#
#    0 AMB  20-2:5877   112 ILE  MG2         3.50    (#   5877:20   Single Ambig)
 &rst
  ixpk= 5877, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.50, r4= 6.25,
 igr1= 465, 469, 467, 158, 166,
 igr2=1802,1803,1804,
 &end
#
#   72 LEU  MDY          71 ALA  MB          3.50    (#   5878:20   Unique)
 &rst
  ixpk= 5878, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1152,1153,1154,1156,1157,1158,
 igr2=1137,1138,1139,
 &end
#
#  175 LEU  HG          176 PHE  HA          3.50    (#   5880:20   Unique)
 &rst
  ixpk= 5880, iat=2802,2816, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  134 TYR  HE          136 ILE  MD1         6.00    (#   5881:20   Unique)
 &rst
  ixpk= 5881, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=2126,2131,
 igr2=2169,2170,2171,
 &end
#
#   90 ASN  HN           89 ILE  MD1         4.50    (#   5882:20   Unique)
 &rst
  ixpk= 5882, iat=1449,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1443,1444,1445,
 &end
#
#  125 ILE  HB           89 ILE  MD1         4.50    (#   5883:20   Unique)
 &rst
  ixpk= 5883, iat=1973,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1443,1444,1445,
 &end
#
#    0 AMB  20-2:5884   138 ILE  MD1         3.50    (#   5884:20   Single Ambig)
 &rst
  ixpk= 5884, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1840,1841,1842,2186,
 igr2=2195,2196,2197,
 &end
#
#  118 GLU  HB2         118 GLU  HB3         3.50    (#   5887:20   Unique)
 &rst
  ixpk= 5887, iat=1890,1891, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  20-2:5888    17 MET  HG-         2.70    (#   5888:20   Single Ambig)
 &rst
  ixpk= 5888, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.96, r4= 4.71,
 igr1= 243, 244, 252, 253, 254,
 igr2= 246, 247,
 &end
#
#    0 AMB  20-2:5889   187 GLU  HB+         3.50    (#   5889:20   Single Ambig)
 &rst
  ixpk= 5889, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2949,2950,2951,3005,3006,3007,
 igr2=3022,3023,
 &end
#
#    0 AMB  20-2:5891   127 ALA  MB          4.50    (#   5891:20   Single Ambig)
 &rst
  ixpk= 5891, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1453,1454,1992,1993,
 igr2=2004,2005,2006,
 &end
#
#    0 AMB  20-2:5893     0 AMB  20-1:5893   4.50    (#   5893:20   Double Ambig)
 &rst
  ixpk= 5893, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=2399,2058,1434,
 igr2=1859,1860,1861,1504,1505,1506,
 &end
#
#   92 VAL  HB           93 ALA  MB          6.00    (#   5894:20   Unique)
 &rst
  ixpk= 5894, iat=1488,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1504,1505,1506,
 &end
#
#  125 ILE  HB          125 ILE  MG2         3.50    (#   5895:20   Preassigned)
 &rst
  ixpk= 5895, iat=1973,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1975,1976,1977,
 &end
#
#  184 TYR  HD            0 AMB  20-1:5896   4.50    (#   5896:20   Single Ambig)
 &rst
  ixpk= 5896, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.64, r4= 8.39,
 igr1=2970,2979,
 igr2=2989,2990,2991,2993,2994,2995,2989,2990,2991,2993,
      2994,2995,
 &end
#
#   42 SER  HN           41 THR  MG2         4.50    (#   5897:20   Unique)
 &rst
  ixpk= 5897, iat= 665,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2= 657, 658, 659,
 &end
#
#   95 GLU  HN           94 THR  MG2         4.50    (#   5898:20   Unique)
 &rst
  ixpk= 5898, iat=1524,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2=1516,1517,1518,
 &end
#
#  168 THR  HB          168 THR  MG2         3.50    (#   5899:20   Unique)
 &rst
  ixpk= 5899, iat=2675,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2677,2678,2679,
 &end
#
#  169 PHE  HA          168 THR  MG2         6.00    (#   5900:20   Unique)
 &rst
  ixpk= 5900, iat=2687,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2677,2678,2679,
 &end
#
#   34 VAL  HA           34 VAL  MG1         3.50    (#   5902:20   Preassigned)
 &rst
  ixpk= 5902, iat= 530,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 534, 535, 536,
 &end
#
#   43 TYR  HD            7 VAL  MG1         4.50    (#   5903:20   Unique)
 &rst
  ixpk= 5903, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 684, 693,
 igr2=  93,  94,  95,
 &end
#
#   43 TYR  HD            7 VAL  MG2         4.50    (#   5904:20   Unique)
 &rst
  ixpk= 5904, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 684, 693,
 igr2=  97,  98,  99,
 &end
#
#  152 HIS  HD2         163 VAL  MG1         3.50    (#   5905:20   Unique)
 &rst
  ixpk= 5905, iat=2424,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2589,2590,2591,
 &end
#
#   34 VAL  HN           34 VAL  MG1         4.50    (#   5909:20   Preassigned)
 &rst
  ixpk= 5909, iat= 528,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2= 534, 535, 536,
 &end
#
#    0 AMB  20-2:5910     0 AMB  20-1:5910   4.50    (#   5910:20   Double Ambig)
 &rst
  ixpk= 5910, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.79, r4= 8.54,
 igr1=1095,2470, 927,
 igr2=1152,1153,1154,1156,1157,1158,2593,2594,2595,
 &end
#
#    0 AMB  20-2:5911     0 AMB  20-1:5911   3.50    (#   5911:20   Double Ambig)
 &rst
  ixpk= 5911, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.06, r4= 6.81,
 igr1=2894,2895,1162,
 igr2= 534, 535, 536,1152,1153,1154,1156,1157,1158,
 &end
#
#    0 AMB  20-2:5912     0 AMB  20-1:5912   3.50    (#   5912:20   Double Ambig)
 &rst
  ixpk= 5912, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1057, 544,
 igr2=1152,1153,1154,1156,1157,1158, 534, 535, 536,
 &end
#
#    0 AMB  20-2:5913    76 VAL  MG1         4.50    (#   5913:20   Single Ambig)
 &rst
  ixpk= 5913, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1238,1164,
 igr2=1226,1227,1228,
 &end
#
#    0 AMB  20-2:5914   153 LYS  HG+         4.50    (#   5914:20   Single Ambig)
 &rst
  ixpk= 5914, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2382,2394,
 igr2=2435,2436,
 &end
#
#  153 LYS  HE-         153 LYS  HG+         3.50    (#   5915:20   Preassigned)
 &rst
  ixpk= 5915, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2441,2442,
 igr2=2435,2436,
 &end
#
#    0 AMB  20-2:5916    64 VAL  MG2         3.50    (#   5916:20   Single Ambig)
 &rst
  ixpk= 5916, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 994, 995, 971, 972,
 igr2=1021,1022,1023,
 &end
#
#   30 PHE  HA          172 LEU  MDY         6.00    (#   5917:20   Unique)
 &rst
  ixpk= 5917, iat= 457,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#   93 ALA  HA           92 VAL  MG1         3.50    (#   5918:20   Unique)
 &rst
  ixpk= 5918, iat=1502,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1490,1491,1492,
 &end
#
#   74 LYS  HB+          74 LYS  HG+         2.70    (#   5920:20   Unique)
 &rst
  ixpk= 5920, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=1185,1186,
 igr2=1188,1189,
 &end
#
#   92 VAL  HB           92 VAL  MG1         3.50    (#   5921:20   Unique)
 &rst
  ixpk= 5921, iat=1488,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1490,1491,1492,
 &end
#
#    0 AMB  20-2:5922   175 LEU  MDY         2.70    (#   5922:20   Single Ambig)
 &rst
  ixpk= 5922, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.03, r4= 5.78,
 igr1=2166,2167,2800,2609,2610,2603,2604,
 igr2=2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:5923     0 AMB  20-1:5923   2.70    (#   5923:20   Double Ambig)
 &rst
  ixpk= 5923, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.51, r4= 6.26,
 igr1=2606,2607,2606,2607,2644,2645,2647,1781,
 igr2=2804,2805,2806,2808,2809,2810,1490,1491,1492,
 &end
#
#   67 LYS  QE           67 LYS  HG-         3.50    (#   5926:20   Preassigned)
 &rst
  ixpk= 5926, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1086,1087,
 igr2=1080,1081,
 &end
#
#    0 AMB  20-2:5927     0 AMB  20-1:5927   3.50    (#   5927:20   Double Ambig)
 &rst
  ixpk= 5927, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.56, r4= 6.31,
 igr1= 877, 878,1086,1087,
 igr2= 871, 872,1080,1081,
 &end
#
#  171 LYS  HA          166 LEU  MDX         6.00    (#   5928:20   Unique)
 &rst
  ixpk= 5928, iat=2722,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr2=2649,2650,2651,2653,2654,2655,
 &end
#
#   38 LEU  HA           38 LEU  MDX         4.50    (#   5929:20   Unique)
 &rst
  ixpk= 5929, iat= 609,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr2= 616, 617, 618, 620, 621, 622,
 &end
#
#  186 ILE  HG1-        183 ILE  HA          3.50    (#   5930:20   Unique)
 &rst
  ixpk= 5930, iat=  -1,2945, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=3009,3010,
 &end
#
#    0 AMB  20-2:5931     0 AMB  20-1:5931   4.50    (#   5931:20   Double Ambig)
 &rst
  ixpk= 5931, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.90, r4= 9.65,
 igr1=2928,2929,1031,1032,2290,2291,2292,1021,1022,1023,
      1037,1038,
 igr2=2945, 971, 972,2339,2340,
 &end
#
#    0 AMB  20-2:5933     0 AMB  20-1:5933   6.00    (#   5933:20   Double Ambig)
 &rst
  ixpk= 5933, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.49, r4= 9.24,
 igr1= 709, 710,1471,1480,
 igr2= 699, 866,
 &end
#
#  160 SER  QB          158 PRO  HB2         4.50    (#   5935:20   Unique)
 &rst
  ixpk= 5935, iat=  -1,2520, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2541,2542,
 &end
#
#   97 PHE  HZ           10 VAL  MG2         4.50    (#   5938:20   Unique)
 &rst
  ixpk= 5938, iat=1567,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2= 144, 145, 146,
 &end
#
#  134 TYR  HE            0 AMB  20-1:5939   6.00    (#   5939:20   Single Ambig)
 &rst
  ixpk= 5939, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.19, r4=10.94,
 igr1=2126,2131,
 igr2=2872,2873,2874,2876,2877,2878,2872,2873,2874,2876,
      2877,2878,
 &end
#
#   37 LYS  HA           37 LYS  QG          3.50    (#   5943:20   Unique)
 &rst
  ixpk= 5943, iat= 587,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2= 592, 593,
 &end
#
#    0 AMB  20-2:5944     0 AMB  20-1:5944   6.00    (#   5944:20   Double Ambig)
 &rst
  ixpk= 5944, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.71, r4=10.46,
 igr1=2339,2340,2901,
 igr2=2290,2291,2292,2840,2841,2842,
 &end
#
#    0 AMB  20-2:5945   125 ILE  MG2         6.00    (#   5945:20   Single Ambig)
 &rst
  ixpk= 5945, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.08, r4= 9.83,
 igr1=1453,1454,1959,1960,
 igr2=1975,1976,1977,
 &end
#
#    0 AMB  20-2:5946   159 ALA  MB          4.50    (#   5946:20   Single Ambig)
 &rst
  ixpk= 5946, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2421,2411,
 igr2=2531,2532,2533,
 &end
#
#    0 AMB  20-2:5951     0 AMB  20-1:5951   4.50    (#   5951:20   Double Ambig)
 &rst
  ixpk= 5951, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.39, r4= 9.14,
 igr1=2192,2193,2606,2607,1504,1505,1506,
 igr2=2162,2163,2164,1436,1437,1438,
 &end
#
#    0 AMB  20-2:5953   107 ALA  MB          4.50    (#   5953:20   Single Ambig)
 &rst
  ixpk= 5953, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1= 107, 704, 705,
 igr2=1719,1720,1721,
 &end
#
#   76 VAL  MG1          78 HIS  HA          4.50    (#   5954:20   Unique)
 &rst
  ixpk= 5954, iat=  -1,1260, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1226,1227,1228,
 &end
#
#    0 AMB  20-2:5955     0 AMB  20-1:5955   3.50    (#   5955:20   Double Ambig)
 &rst
  ixpk= 5955, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=  48,  49,2800,2802,2609,2610,
 igr2=  46,2797,
 &end
#
#    0 AMB  20-2:5956     0 AMB  20-1:5956   3.50    (#   5956:20   Double Ambig)
 &rst
  ixpk= 5956, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=  57,  58,2612,2613,
 igr2=  46,2797,
 &end
#
#    0 AMB  20-2:5958   166 LEU  QB          3.50    (#   5958:20   Single Ambig)
 &rst
  ixpk= 5958, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2724,2725,2603,2604,2603,2604,
 igr2=2644,2645,
 &end
#
#    0 AMB  20-2:5959    57 GLU  HG-         4.50    (#   5959:20   Single Ambig)
 &rst
  ixpk= 5959, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 869, 874, 875,1167,
 igr2= 907, 908,
 &end
#
#    0 AMB  20-2:5960     0 AMB  20-1:5960   3.50    (#   5960:20   Double Ambig)
 &rst
  ixpk= 5960, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=2722,2923,2763,1699,
 igr2=2730,2731,2925,2926,2765,2766,2765,2766,1696,
 &end
#
#    0 AMB  20-2:5962     0 AMB  20-1:5962   4.50    (#   5962:20   Double Ambig)
 &rst
  ixpk= 5962, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2322,2539,2567,2568,
 igr2=2302,2303,2587,
 &end
#
#    0 AMB  20-2:5963     0 AMB  20-1:5963   4.50    (#   5963:20   Double Ambig)
 &rst
  ixpk= 5963, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.32, r4= 9.07,
 igr1=2232, 457,2203,2204, 321,
 igr2=2212,2213, 498, 499, 387, 388, 387, 388,
 &end
#
#    0 AMB  20-2:5965     0 AMB  20-1:5965   6.00    (#   5965:20   Double Ambig)
 &rst
  ixpk= 5965, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=11.74, r4=12.49,
 igr1=1565,1569, 465, 469,1563,1571, 467,
 igr2=2064,2065,2804,2805,2806,2808,2809,2810,
 &end
#
#    0 AMB  20-2:5966     0 AMB  20-1:5966   3.50    (#   5966:20   Double Ambig)
 &rst
  ixpk= 5966, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=2380,1260,
 igr2=2435,2436,1226,1227,1228,
 &end
#
#   52 THR  HB           52 THR  MG2         3.50    (#   5967:20   Unique)
 &rst
  ixpk= 5967, iat= 822,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2= 824, 825, 826,
 &end
#
#    0 AMB  20-2:5969   107 ALA  MB          6.00    (#   5969:20   Single Ambig)
 &rst
  ixpk= 5969, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1667,1705,
 igr2=1719,1720,1721,
 &end
#
#    0 AMB  20-2:5970   172 LEU  MDX         3.50    (#   5970:20   Single Ambig)
 &rst
  ixpk= 5970, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.17, r4= 6.92,
 igr1= 387, 388,2746,2747,2800,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:5971   172 LEU  MDX         3.50    (#   5971:20   Single Ambig)
 &rst
  ixpk= 5971, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1= 387, 388, 387, 388,
 igr2=2751,2752,2753,2755,2756,2757,
 &end
#
#    0 AMB  20-2:5972    83 THR  MG2         3.50    (#   5972:20   Single Ambig)
 &rst
  ixpk= 5972, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1857, 230,
 igr2=1357,1358,1359,
 &end
#
#  177 THR  HB          177 THR  MG2         3.50    (#   5973:20   Unique)
 &rst
  ixpk= 5973, iat=2838,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=2840,2841,2842,
 &end
#
#  176 PHE  HB-          34 VAL  MG2         4.50    (#   5974:20   Unique)
 &rst
  ixpk= 5974, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2818,2819,
 igr2= 538, 539, 540,
 &end
#
#  176 PHE  HA           34 VAL  MG2         6.00    (#   5975:20   Unique)
 &rst
  ixpk= 5975, iat=2816,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 538, 539, 540,
 &end
#
#  152 HIS  HB2         163 VAL  MG2         6.00    (#   5976:20   Unique)
 &rst
  ixpk= 5976, iat=2415,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=2593,2594,2595,
 &end
#
#  123 GLY  HN          125 ILE  MG2         6.00    (#   5977:20   Unique)
 &rst
  ixpk= 5977, iat=1948,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1975,1976,1977,
 &end
#
#    0 AMB  20-2:5979   132 ILE  MD1         3.50    (#   5979:20   Single Ambig)
 &rst
  ixpk= 5979, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2484,2485,1727,2482,
 igr2=2086,2087,2088,
 &end
#
#    0 AMB  20-2:5980     0 AMB  20-1:5980   3.50    (#   5980:20   Double Ambig)
 &rst
  ixpk= 5980, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=2501,2502,2496, 611, 612, 614,
 igr2=2493, 609,
 &end
#
#    0 AMB  20-2:5982    27 ILE  MG2         6.00    (#   5982:20   Single Ambig)
 &rst
  ixpk= 5982, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.42, r4=10.17,
 igr1= 459, 460, 154, 155, 211,
 igr2= 411, 412, 413,
 &end
#
#    0 AMB  20-2:5983     0 AMB  20-1:5983   4.50    (#   5983:20   Double Ambig)
 &rst
  ixpk= 5983, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.28, r4= 8.03,
 igr1=1879,1925, 221,
 igr2=1357,1358,1359,1917,1918,1919,
 &end
#
#    0 AMB  20-2:5984   122 SER  HA          4.50    (#   5984:20   Single Ambig)
 &rst
  ixpk= 5984, iat=  -1,1939, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=1397,1929,1930,1929,1930,
 &end
#
#   50 PHE  HE           50 PHE  HA          6.00    (#   5985:20   Unique)
 &rst
  ixpk= 5985, iat=  -1, 789, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 797, 801,
 &end
#
#   67 LYS  HD-          64 VAL  HA          6.00    (#   5986:20   Unique)
 &rst
  ixpk= 5986, iat=  -1,1013, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1083,1084,
 &end
#
#   27 ILE  HG1-         27 ILE  HA          4.50    (#   5987:20   Unique)
 &rst
  ixpk= 5987, iat=  -1, 407, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 415, 416,
 &end
#
#    0 AMB  20-2:5988    27 ILE  HA          4.50    (#   5988:20   Single Ambig)
 &rst
  ixpk= 5988, iat=  -1, 407, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1840,1841,1842, 431,
 &end
#
#   98 ARG  HD+         101 LEU  MDX         4.50    (#   5989:20   Unique)
 &rst
  ixpk= 5989, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1585,1586,
 igr2=1638,1639,1640,1642,1643,1644,
 &end
#
#   97 PHE  HD           97 PHE  HB+         3.50    (#   5992:20   Unique)
 &rst
  ixpk= 5992, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1563,1571,
 igr2=1559,1560,
 &end
#
#   14 ASP  HN           27 ILE  MG2         4.50    (#   5993:20   Unique)
 &rst
  ixpk= 5993, iat= 209,  -1, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr2= 411, 412, 413,
 &end
#
#    0 AMB  20-2:5995     0 AMB  20-1:5995   4.50    (#   5995:20   Double Ambig)
 &rst
  ixpk= 5995, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1=2470,2124,2133, 201,2450,
 igr2=2141, 428, 429,
 &end
#
#   82 LEU  MDX          82 LEU  HB+         3.50    (#   5996:20   Unique)
 &rst
  ixpk= 5996, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1341,1342,1343,1345,1346,1347,
 igr2=1336,1337,
 &end
#
#    0 AMB  20-2:5997     0 AMB  20-1:5997   3.50    (#   5997:20   Double Ambig)
 &rst
  ixpk= 5997, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.14, r4= 5.89,
 igr1=1840,1841,1842,1825,1826,
 igr2=2160,1819,
 &end
#
#   43 TYR  HN           41 THR  MG2         6.00    (#   5998:20   Unique)
 &rst
  ixpk= 5998, iat= 676,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2= 657, 658, 659,
 &end
#
#    0 AMB  20-2:5999     0 AMB  20-1:5999   6.00    (#   5999:20   Double Ambig)
 &rst
  ixpk= 5999, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 9.71, r4=10.46,
 igr1= 459, 460,1383,
 igr2=1840,1841,1842,1975,1976,1977,
 &end
#
#   90 ASN  HN          125 ILE  MG2         3.50    (#   6000:20   Unique)
 &rst
  ixpk= 6000, iat=1449,  -1, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr2=1975,1976,1977,
 &end
#
#    0 AMB  20-2:6001     0 AMB  20-1:6001   6.00    (#   6001:20   Double Ambig)
 &rst
  ixpk= 6001, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1222,2075,
 igr2= 877, 878,2120,
 &end
#
#    0 AMB  20-2:6002    88 ALA  MB          6.00    (#   6002:20   Single Ambig)
 &rst
  ixpk= 6002, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1=1484,1463,
 igr2=1424,1425,1426,
 &end
#
#   97 PHE  HD          103 ALA  MB          3.50    (#   6003:20   Unique)
 &rst
  ixpk= 6003, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1563,1571,
 igr2=1659,1660,1661,
 &end
#
#    0 AMB  20-2:6004   103 ALA  MB          3.50    (#   6004:20   Single Ambig)
 &rst
  ixpk= 6004, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1= 957, 961, 955, 963,
 igr2=1659,1660,1661,
 &end
#
#  102 GLY  HN          103 ALA  MB          6.00    (#   6005:20   Unique)
 &rst
  ixpk= 6005, iat=1648,  -1, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr2=1659,1660,1661,
 &end
#
#   59 ASP  HB+          58 PHE  HA          4.50    (#   6006:20   Unique)
 &rst
  ixpk= 6006, iat=  -1, 917, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 939, 940,
 &end
#
#   76 VAL  HB           57 GLU  HB3         6.00    (#   6008:20   Unique)
 &rst
  ixpk= 6008, iat=1224, 905, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  157 LYS  QE          153 LYS  HA          3.50    (#   6010:20   Unique)
 &rst
  ixpk= 6010, iat=  -1,2430, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2504,2505,
 &end
#
#    0 AMB  20-2:6011     0 AMB  20-1:6011   2.70    (#   6011:20   Double Ambig)
 &rst
  ixpk= 6011, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.64, r4= 4.39,
 igr1=1453,1454,2788,
 igr2=1451,2722,
 &end
#
#  174 ASP  HB2         171 LYS  HA          4.50    (#   6012:20   Unique)
 &rst
  ixpk= 6012, iat=2787,2722, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  20-2:6013     0 AMB  20-1:6013   4.50    (#   6013:20   Double Ambig)
 &rst
  ixpk= 6013, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.18, r4= 8.93,
 igr1=2949,2950,2951,2804,2805,2806,2808,2809,2810,
 igr2=3025,3026,2855,2856,
 &end
#
#    0 AMB  20-2:6014     0 AMB  20-1:6014   4.50    (#   6014:20   Double Ambig)
 &rst
  ixpk= 6014, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 8.18, r4= 8.93,
 igr1=2949,2950,2951,2804,2805,2806,2808,2809,2810,
 igr2=3025,3026,2855,2856,
 &end
#
#    0 AMB  20-2:6015     0 AMB  20-1:6015   6.00    (#   6015:20   Double Ambig)
 &rst
  ixpk= 6015, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=11.10, r4=11.85,
 igr1=2631,2632,1659,1660,1661,
 igr2=2353,2354,2353,2354,1606,1607,1606,1607,
 &end
#
#   64 VAL  HA           67 LYS  HD+         3.50    (#   6016:20   Unique)
 &rst
  ixpk= 6016, iat=1013,  -1, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr2=1083,1084,
 &end
#
#    0 AMB  20-2:6017     0 AMB  20-1:6017   4.50    (#   6017:20   Double Ambig)
 &rst
  ixpk= 6017, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=2300,  68,  69,
 igr2=2308,2309,  54,  55,
 &end
#
#   64 VAL  HA           67 LYS  HD-         4.50    (#   6019:20   Unique)
 &rst
  ixpk= 6019, iat=1013,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2=1083,1084,
 &end
#
#    0 AMB  20-2:6020     0 AMB  20-1:6020   3.50    (#   6020:20   Double Ambig)
 &rst
  ixpk= 6020, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=1432,2689,
 igr2= 179, 180, 181, 183, 184, 185,2751,2752,2753,2755,
      2756,2757,
 &end
#
#    0 AMB  20-2:6021    26 LYS  HA          4.50    (#   6021:20   Single Ambig)
 &rst
  ixpk= 6021, iat=  -1, 385, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 459, 460, 333,2689,
 &end
#
#   19 LEU  HA           19 LEU  HG          4.50    (#   6022:20   Unique)
 &rst
  ixpk= 6022, iat= 271, 276, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  154 PHE  HD          119 ALA  MB          3.50    (#   6023:20   Unique)
 &rst
  ixpk= 6023, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2458,2466,
 igr2=1905,1906,1907,
 &end
#
#  154 PHE  HD          119 ALA  MB          3.50    (#   6025:20   Unique)
 &rst
  ixpk= 6025, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2458,2466,
 igr2=1905,1906,1907,
 &end
#
#  154 PHE  HD          119 ALA  MB          3.50    (#   6026:20   Unique)
 &rst
  ixpk= 6026, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2458,2466,
 igr2=1905,1906,1907,
 &end
#
#   65 LYS  HB+          65 LYS  QD          3.50    (#   6027:20   Unique)
 &rst
  ixpk= 6027, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1031,1032,
 igr2=1037,1038,
 &end
#
#   73 LEU  MDX          69 PRO  HB2         3.50    (#   6028:20   Unique)
 &rst
  ixpk= 6028, iat=  -1,1114, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1171,1172,1173,1175,1176,1177,
 &end
#
#    0 AMB  20-2:6029   184 TYR  HA          4.50    (#   6029:20   Single Ambig)
 &rst
  ixpk= 6029, iat=  -1,2964, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=3025,3026,3022,3023,
 &end
#
#    0 AMB  20-2:6030   184 TYR  HA          4.50    (#   6030:20   Single Ambig)
 &rst
  ixpk= 6030, iat=  -1,2964, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=3025,3026,3025,3026,3022,3023,3022,3023,
 &end
#
#    0 AMB  20-2:6032     0 AMB  20-1:6032   3.50    (#   6032:20   Double Ambig)
 &rst
  ixpk= 6032, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.77, r4= 6.52,
 igr1=2430,2707,2482,2529,2413,
 igr2=2504,2505,2774,2775,
 &end
#
#  169 PHE  HA           26 LYS  QE          4.50    (#   6033:20   Unique)
 &rst
  ixpk= 6033, iat=2687,  -1, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr2= 396, 397,
 &end
#
#    0 AMB  20-2:6034     0 AMB  20-1:6034   3.50    (#   6034:20   Double Ambig)
 &rst
  ixpk= 6034, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 5.94, r4= 6.69,
 igr1=  68,  69,1222,2687,
 igr2=  57,  58, 877, 878, 396, 397,
 &end
#
#    0 AMB  20-2:6035    26 LYS  QE          2.70    (#   6035:20   Single Ambig)
 &rst
  ixpk= 6035, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3= 3.40, r4= 4.15,
 igr1=2689, 333,
 igr2= 396, 397,
 &end
#
#    0 AMB  20-2:6036     0 AMB  20-1:6036   6.00    (#   6036:20   Double Ambig)
 &rst
  ixpk= 6036, iat=  -1,  -1, r1= 0.00, r2= 1.80, r3=10.58, r4=11.33,
 igr1=1950,1951,2567,2568,1123, 518,
 igr2=1959,1960,2121, 576, 577,
 &end
#
#  111 LEU  HN          132 ILE  HN          4.50    (#      1:10   Unique)
 &rst
  ixpk= 1, iat=1777,2073, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25, 
      rk2=20.0, rk3=20.0, ir6=1,
 &end
#
#    0 AMB  10-2:2      132 ILE  HN          4.50    (#      2:10   Single Ambig)
 &rst
  ixpk= 2, iat=  -1,2073, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2092,1761,
 &end
#
#  137 GLY  HN          164 LYS  HN          4.50    (#      6:10   Unique)
 &rst
  ixpk= 6, iat=2175,2599, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   78 HIS  HN           79 MET  HN          6.00    (#      7:10   Unique)
 &rst
  ixpk= 7, iat=1258,1275, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  165 ILE  HN          164 LYS  HN          4.50    (#      8:10   Unique)
 &rst
  ixpk= 8, iat=2621,2599, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   80 LEU  HN           79 MET  HN          4.50    (#      9:10   Unique)
 &rst
  ixpk= 9, iat=1294,1275, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   78 HIS  HN           77 LYS  HN          4.50    (#     10:10   Unique)
 &rst
  ixpk= 10, iat=1258,1236, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:12     111 LEU  HN          4.50    (#     12:10   Single Ambig)
 &rst
  ixpk= 12, iat=  -1,1777, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2116,1796,
 &end
#
#    0 AMB  10-2:13     111 LEU  HN          4.50    (#     13:10   Single Ambig)
 &rst
  ixpk= 13, iat=  -1,1777, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1761,2092,
 &end
#
#  132 ILE  HN          111 LEU  HN          4.50    (#     14:10   Unique)
 &rst
  ixpk= 14, iat=2073,1777, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   95 GLU  HN           94 THR  HN          3.50    (#     15:10   Unique)
 &rst
  ixpk= 15, iat=1524,1510, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   93 ALA  HN           94 THR  HN          3.50    (#     16:10   Unique)
 &rst
  ixpk= 16, iat=1500,1510, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   61 SER  HN          102 GLY  HN          4.50    (#     21:10   Unique)
 &rst
  ixpk= 21, iat= 967,1648, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:23      12 LEU  HN          6.00    (#     23:10   Single Ambig)
 &rst
  ixpk= 23, iat=  -1, 170, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 189, 754,
 &end
#
#    0 AMB  10-2:24      12 LEU  HN          4.50    (#     24:10   Single Ambig)
 &rst
  ixpk= 24, iat=  -1, 170, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1796,1834,
 &end
#
#   11 PHE  HN           12 LEU  HN          6.00    (#     25:10   Unique)
 &rst
  ixpk= 25, iat= 150, 170, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   85 THR  HN           84 ASN  HN          4.50    (#     26:10   Unique)
 &rst
  ixpk= 26, iat=1379,1365, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:27      84 ASN  HN          4.50    (#     27:10   Single Ambig)
 &rst
  ixpk= 27, iat=  -1,1365, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 807,1374,1375,1925,
 &end
#
#    0 AMB  10-2:28      49 GLN  HN          4.50    (#     28:10   Single Ambig)
 &rst
  ixpk= 28, iat=  -1, 770, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 754, 189,
 &end
#
#   57 GLU  HN           49 GLN  HN          4.50    (#     29:10   Unique)
 &rst
  ixpk= 29, iat= 900, 770, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  110 VAL  HN          109 LYS  HN          4.50    (#     31:10   Unique)
 &rst
  ixpk= 31, iat=1761,1739, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    8 ASP  HN          109 LYS  HN          6.00    (#     33:10   Unique)
 &rst
  ixpk= 33, iat= 103,1739, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  132 ILE  HN          133 ARG  HN          6.00    (#     34:10   Unique)
 &rst
  ixpk= 34, iat=2073,2092, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  156 SER  HN          133 ARG  HN          4.50    (#     36:10   Unique)
 &rst
  ixpk= 36, iat=2480,2092, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:38     136 ILE  HN          4.50    (#     38:10   Single Ambig)
 &rst
  ixpk= 38, iat=  -1,2156, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2137,1834,
 &end
#
#  137 GLY  HN          136 ILE  HN          6.00    (#     39:10   Unique)
 &rst
  ixpk= 39, iat=2175,2156, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  116 ASP  HN           14 ASP  HN          6.00    (#     40:10   Unique)
 &rst
  ixpk= 40, iat=1867, 209, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   13 PHE  HN           14 ASP  HN          6.00    (#     41:10   Unique)
 &rst
  ixpk= 41, iat= 189, 209, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   12 LEU  HN          114 ILE  HN          4.50    (#     42:10   Unique)
 &rst
  ixpk= 42, iat= 170,1834, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  114 ILE  HN           14 ASP  HN          4.50    (#     44:10   Unique)
 &rst
  ixpk= 44, iat=1834, 209, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:45      14 ASP  HN          4.50    (#     45:10   Single Ambig)
 &rst
  ixpk= 45, iat=  -1, 209, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 221,1879,
 &end
#
#    0 AMB  10-2:47     166 LEU  HN          4.50    (#     47:10   Single Ambig)
 &rst
  ixpk= 47, iat=  -1,2640, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2621,2182,
 &end
#
#  139 GLY  HN          166 LEU  HN          4.50    (#     48:10   Unique)
 &rst
  ixpk= 48, iat=2201,2640, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   10 VAL  HN            9 LEU  HN          4.50    (#     49:10   Unique)
 &rst
  ixpk= 49, iat= 134, 115, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  110 VAL  HN            9 LEU  HN          6.00    (#     50:10   Unique)
 &rst
  ixpk= 50, iat=1761, 115, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   44 GLN  HN            9 LEU  HN          4.50    (#     51:10   Unique)
 &rst
  ixpk= 51, iat= 697, 115, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   55 LYS  HE-          56 THR  HN          6.00    (#     53:10   Unique)
 &rst
  ixpk= 53, iat=  -1, 886, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 877, 878,
 &end
#
#   55 LYS  HN           56 THR  HN          6.00    (#     55:10   Unique)
 &rst
  ixpk= 55, iat= 864, 886, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  115 THR  HN          116 ASP  HN          6.00    (#     56:10   Unique)
 &rst
  ixpk= 56, iat=1853,1867, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  117 GLY  HN          116 ASP  HN          3.50    (#     57:10   Unique)
 &rst
  ixpk= 57, iat=1879,1867, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   86 PHE  HN           88 ALA  HN          4.50    (#     59:10   Unique)
 &rst
  ixpk= 59, iat=1393,1420, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   87 GLY  HN           88 ALA  HN          3.50    (#     60:10   Unique)
 &rst
  ixpk= 60, iat=1413,1420, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:61      88 ALA  HN          6.00    (#     61:10   Single Ambig)
 &rst
  ixpk= 61, iat=  -1,1420, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1374,1375,1925,
 &end
#
#  164 LYS  HN          165 ILE  HN          4.50    (#     62:10   Unique)
 &rst
  ixpk= 62, iat=2599,2621, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  166 LEU  HN          165 ILE  HN          4.50    (#     63:10   Unique)
 &rst
  ixpk= 63, iat=2640,2621, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  131 ILE  HN          132 ILE  HN          6.00    (#     65:10   Unique)
 &rst
  ixpk= 65, iat=2054,2073, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  122 SER  HN          123 GLY  HN          4.50    (#     66:10   Unique)
 &rst
  ixpk= 66, iat=1937,1948, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   86 PHE  HD          123 GLY  HN          3.50    (#     67:10   Unique)
 &rst
  ixpk= 67, iat=  -1,1948, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1401,1409,
 &end
#
#   86 PHE  HZ          123 GLY  HN          6.00    (#     68:10   Unique)
 &rst
  ixpk= 68, iat=1405,1948, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   49 GLN  HE2+         79 MET  HN          6.00    (#     69:10   Unique)
 &rst
  ixpk= 69, iat=  -1,1275, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 782, 783,
 &end
#
#   49 GLN  HE2-         79 MET  HN          4.50    (#     70:10   Unique)
 &rst
  ixpk= 70, iat=  -1,1275, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 782, 783,
 &end
#
#  163 VAL  HN          164 LYS  HN          6.00    (#     71:10   Unique)
 &rst
  ixpk= 71, iat=2583,2599, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   24 PHE  HE           79 MET  HN          6.00    (#     72:10   Unique)
 &rst
  ixpk= 72, iat=  -1,1275, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 356, 360,
 &end
#
#    0 AMB  10-2:73      79 MET  HN          6.00    (#     73:10   Single Ambig)
 &rst
  ixpk= 73, iat=  -1,1275, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1313, 354, 362,
 &end
#
#   78 HIS  HD2          79 MET  HN          4.50    (#     74:10   Unique)
 &rst
  ixpk= 74, iat=1271,1275, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  134 TYR  HD          164 LYS  HN          6.00    (#     75:10   Unique)
 &rst
  ixpk= 75, iat=  -1,2599, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2124,2133,
 &end
#
#   49 GLN  HE2+         77 LYS  HN          4.50    (#     76:10   Unique)
 &rst
  ixpk= 76, iat=  -1,1236, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 782, 783,
 &end
#
#   49 GLN  HE2-         77 LYS  HN          4.50    (#     77:10   Unique)
 &rst
  ixpk= 77, iat=  -1,1236, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 782, 783,
 &end
#
#    0 AMB  10-2:78      77 LYS  HN          4.50    (#     78:10   Single Ambig)
 &rst
  ixpk= 78, iat=  -1,1236, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1220, 201,
 &end
#
#  111 LEU  HA          111 LEU  HN          4.50    (#     79:10   Unique)
 &rst
  ixpk= 79, iat=1779,1777, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:80     111 LEU  HN          4.50    (#     80:10   Single Ambig)
 &rst
  ixpk= 80, iat=  -1,1777, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2094,1798,
 &end
#
#    0 AMB  10-2:83      94 THR  HN          4.50    (#     83:10   Single Ambig)
 &rst
  ixpk= 83, iat=  -1,1510, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1539,1555,
 &end
#
#   66 TRP  HN           66 TRP  HE1         6.00    (#     84:10   Unique)
 &rst
  ixpk= 84, iat=1049,1059, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   66 TRP  HD1          66 TRP  HE1         2.70    (#     86:10   Unique)
 &rst
  ixpk= 86, iat=1057,1059, r1= 0.00, r2= 1.80, r3= 2.70, r4= 3.45,  &end
#
#   66 TRP  HH2          66 TRP  HE1         6.00    (#     87:10   Unique)
 &rst
  ixpk= 87, iat=1064,1059, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   24 PHE  HD           78 HIS  HN          6.00    (#     88:10   Unique)
 &rst
  ixpk= 88, iat=  -1,1258, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 354, 362,
 &end
#
#   98 ARG  HN          102 GLY  HN          6.00    (#     90:10   Unique)
 &rst
  ixpk= 90, iat=1575,1648, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  103 ALA  HN          102 GLY  HN          3.50    (#     91:10   Unique)
 &rst
  ixpk= 91, iat=1655,1648, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  101 LEU  HN          102 GLY  HN          3.50    (#     92:10   Unique)
 &rst
  ixpk= 92, iat=1629,1648, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   11 PHE  HD           12 LEU  HN          4.50    (#     94:10   Unique)
 &rst
  ixpk= 94, iat=  -1, 170, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 158, 166,
 &end
#
#   13 PHE  HD           12 LEU  HN          6.00    (#     95:10   Unique)
 &rst
  ixpk= 95, iat=  -1, 170, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 197, 205,
 &end
#
#  113 ILE  HA           12 LEU  HN          4.50    (#     96:10   Unique)
 &rst
  ixpk= 96, iat=1817, 170, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   11 PHE  HA           12 LEU  HN          3.50    (#     97:10   Unique)
 &rst
  ixpk= 97, iat= 152, 170, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   83 THR  HN           84 ASN  HN          4.50    (#     98:10   Unique)
 &rst
  ixpk= 98, iat=1351,1365, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   84 ASN  HD2-         84 ASN  HN          4.50    (#     99:10   Unique)
 &rst
  ixpk= 99, iat=  -1,1365, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1374,1375,
 &end
#
#   50 PHE  HD           84 ASN  HN          3.50    (#    100:10   Unique)
 &rst
  ixpk= 100, iat=  -1,1365, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 795, 803,
 &end
#
#    0 AMB  10-2:101     84 ASN  HN          6.00    (#    101:10   Single Ambig)
 &rst
  ixpk= 101, iat=  -1,1365, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1361, 814, 789,
 &end
#
#   84 ASN  HA           84 ASN  HN          3.50    (#    102:10   Unique)
 &rst
  ixpk= 102, iat=1367,1365, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   49 GLN  HE2+         49 GLN  HN          4.50    (#    103:10   Unique)
 &rst
  ixpk= 103, iat=  -1, 770, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 782, 783,
 &end
#
#    0 AMB  10-2:104     49 GLN  HN          4.50    (#    104:10   Single Ambig)
 &rst
  ixpk= 104, iat=  -1, 770, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 782, 783, 915,
 &end
#
#    0 AMB  10-2:107    113 ILE  HN          4.50    (#    107:10   Single Ambig)
 &rst
  ixpk= 107, iat=  -1,1815, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2116,1796,
 &end
#
#    0 AMB  10-2:108     49 GLN  HN          4.50    (#    108:10   Single Ambig)
 &rst
  ixpk= 108, iat=  -1, 770, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1= 199, 203, 197, 205, 201,
 &end
#
#  156 SER  HG          133 ARG  HN          4.50    (#    109:10   Unique)
 &rst
  ixpk= 109, iat=2487,2092, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:110     49 GLN  HN          6.00    (#    110:10   Single Ambig)
 &rst
  ixpk= 110, iat=  -1, 770, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 789, 746,
 &end
#
#  113 ILE  HA          113 ILE  HN          4.50    (#    111:10   Unique)
 &rst
  ixpk= 111, iat=1817,1815, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  133 ARG  HA          133 ARG  HN          4.50    (#    112:10   Unique)
 &rst
  ixpk= 112, iat=2094,2092, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  112 ILE  HA          113 ILE  HN          3.50    (#    113:10   Preassigned)
 &rst
  ixpk= 113, iat=1798,1815, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   54 TYR  HA           49 GLN  HN          6.00    (#    114:10   Unique)
 &rst
  ixpk= 114, iat= 845, 770, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  134 TYR  HD          136 ILE  HN          6.00    (#    115:10   Unique)
 &rst
  ixpk= 115, iat=  -1,2156, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2124,2133,
 &end
#
#    0 AMB  10-2:116    136 ILE  HN          3.50    (#    116:10   Single Ambig)
 &rst
  ixpk= 116, iat=  -1,2156, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2139,1836,
 &end
#
#   14 ASP  HN          114 ILE  HN          4.50    (#    117:10   Unique)
 &rst
  ixpk= 117, iat= 209,1834, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   50 PHE  HE           14 ASP  HN          4.50    (#    119:10   Unique)
 &rst
  ixpk= 119, iat=  -1, 209, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 797, 801,
 &end
#
#    0 AMB  10-2:120    114 ILE  HN          6.00    (#    120:10   Single Ambig)
 &rst
  ixpk= 120, iat=  -1,1834, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1= 799, 197, 205,
 &end
#
#    0 AMB  10-2:121     14 ASP  HN          4.50    (#    121:10   Single Ambig)
 &rst
  ixpk= 121, iat=  -1, 209, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 197, 205, 799,
 &end
#
#   13 PHE  HA          114 ILE  HN          4.50    (#    122:10   Unique)
 &rst
  ixpk= 122, iat= 191,1834, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   13 PHE  HA           14 ASP  HN          3.50    (#    123:10   Unique)
 &rst
  ixpk= 123, iat= 191, 209, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  115 THR  HA           14 ASP  HN          4.50    (#    124:10   Unique)
 &rst
  ixpk= 124, iat=1855, 209, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  113 ILE  HA          114 ILE  HN          3.50    (#    125:10   Unique)
 &rst
  ixpk= 125, iat=1817,1834, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  114 ILE  HA          114 ILE  HN          4.50    (#    126:10   Unique)
 &rst
  ixpk= 126, iat=1836,1834, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   97 PHE  HE            9 LEU  HN          6.00    (#    127:10   Unique)
 &rst
  ixpk= 127, iat=  -1, 115, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1565,1569,
 &end
#
#    0 AMB  10-2:128      9 LEU  HN          4.50    (#    128:10   Single Ambig)
 &rst
  ixpk= 128, iat=  -1, 115, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 957, 961, 709, 710, 684, 693,
 &end
#
#    0 AMB  10-2:129      9 LEU  HN          4.50    (#    129:10   Single Ambig)
 &rst
  ixpk= 129, iat=  -1, 115, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 684, 693, 959,
 &end
#
#   45 PHE  HD            9 LEU  HN          4.50    (#    131:10   Unique)
 &rst
  ixpk= 131, iat=  -1, 115, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 722, 730,
 &end
#
#   45 PHE  HA            9 LEU  HN          4.50    (#    132:10   Unique)
 &rst
  ixpk= 132, iat= 716, 115, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    9 LEU  HA            9 LEU  HN          4.50    (#    133:10   Unique)
 &rst
  ixpk= 133, iat= 117, 115, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:134    126 ASP  HN          6.00    (#    134:10   Single Ambig)
 &rst
  ixpk= 134, iat=  -1,1988, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=1964,1965,1458,1459,
 &end
#
#  124 ASN  HD2+        126 ASP  HN          6.00    (#    135:10   Unique)
 &rst
  ixpk= 135, iat=  -1,1988, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1964,1965,
 &end
#
#  128 ALA  HN          126 ASP  HN          4.50    (#    136:10   Unique)
 &rst
  ixpk= 136, iat=2010,1988, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  129 LYS  HN          126 ASP  HN          6.00    (#    137:10   Unique)
 &rst
  ixpk= 137, iat=2020,1988, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  124 ASN  HD2-        126 ASP  HN          6.00    (#    138:10   Unique)
 &rst
  ixpk= 138, iat=  -1,1988, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1964,1965,
 &end
#
#   14 ASP  HN          116 ASP  HN          6.00    (#    140:10   Unique)
 &rst
  ixpk= 140, iat= 209,1867, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  10-2:141    116 ASP  HN          4.50    (#    141:10   Single Ambig)
 &rst
  ixpk= 141, iat=  -1,1867, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2257,2261, 799,2259,
 &end
#
#  116 ASP  HA          116 ASP  HN          4.50    (#    143:10   Unique)
 &rst
  ixpk= 143, iat=1869,1867, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  115 THR  HA          116 ASP  HN          3.50    (#    144:10   Unique)
 &rst
  ixpk= 144, iat=1855,1867, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:145    104 ARG  HN          4.50    (#    145:10   Single Ambig)
 &rst
  ixpk= 145, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1678,1655,
 &end
#
#  107 ALA  HN          104 ARG  HN          6.00    (#    146:10   Unique)
 &rst
  ixpk= 146, iat=1715,1665, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   44 GLN  HE2+        104 ARG  HN          4.50    (#    147:10   Unique)
 &rst
  ixpk= 147, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 709, 710,
 &end
#
#   44 GLN  HE2-        104 ARG  HN          4.50    (#    148:10   Unique)
 &rst
  ixpk= 148, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 709, 710,
 &end
#
#    0 AMB  10-2:151     88 ALA  HN          6.00    (#    151:10   Single Ambig)
 &rst
  ixpk= 151, iat=  -1,1420, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=1374,1375,1401,1409,
 &end
#
#    0 AMB  10-2:152     88 ALA  HN          4.50    (#    152:10   Single Ambig)
 &rst
  ixpk= 152, iat=  -1,1420, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 853, 858, 795, 803,
 &end
#
#   54 TYR  HD           88 ALA  HN          4.50    (#    153:10   Unique)
 &rst
  ixpk= 153, iat=  -1,1420, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 851, 860,
 &end
#
#   86 PHE  HB3         123 GLY  HN          6.00    (#    154:10   Unique)
 &rst
  ixpk= 154, iat=1398,1948, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  10-2:155    123 GLY  HN          4.50    (#    155:10   Single Ambig)
 &rst
  ixpk= 155, iat=  -1,1948, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1927,1957,
 &end
#
#  122 SER  HA          123 GLY  HN          3.50    (#    158:10   Unique)
 &rst
  ixpk= 158, iat=1939,1948, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:159    132 ILE  HN          3.50    (#    159:10   Single Ambig)
 &rst
  ixpk= 159, iat=  -1,2073, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2056,2075,
 &end
#
#  123 GLY  HA-         123 GLY  HN          2.70    (#    160:10   Unique)
 &rst
  ixpk= 160, iat=  -1,1948, r1= 0.00, r2= 1.80, r3= 3.03, r4= 3.78,
 igr1=1950,1951,
 &end
#
#    0 AMB  10-2:161    123 GLY  HN          6.00    (#    161:10   Single Ambig)
 &rst
  ixpk= 161, iat=  -1,1948, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1397,1929,1930,
 &end
#
#  136 ILE  HA          164 LYS  HN          3.50    (#    162:10   Unique)
 &rst
  ixpk= 162, iat=2158,2599, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  164 LYS  HA          164 LYS  HN          4.50    (#    164:10   Unique)
 &rst
  ixpk= 164, iat=2601,2599, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   15 GLY  HA+          79 MET  HN          4.50    (#    165:10   Unique)
 &rst
  ixpk= 165, iat=  -1,1275, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 223, 224,
 &end
#
#   78 HIS  HA           79 MET  HN          3.50    (#    166:10   Preassigned)
 &rst
  ixpk= 166, iat=1260,1275, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   79 MET  HA           79 MET  HN          3.50    (#    167:10   Preassigned)
 &rst
  ixpk= 167, iat=1277,1275, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   80 LEU  HA           79 MET  HN          6.00    (#    168:10   Unique)
 &rst
  ixpk= 168, iat=1296,1275, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   79 MET  HG+          79 MET  HN          3.50    (#    169:10   Unique)
 &rst
  ixpk= 169, iat=  -1,1275, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1282,1283,
 &end
#
#   78 HIS  HB2          79 MET  HN          4.50    (#    170:10   Unique)
 &rst
  ixpk= 170, iat=1262,1275, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   77 LYS  HA           77 LYS  HN          3.50    (#    171:10   Unique)
 &rst
  ixpk= 171, iat=1238,1236, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   76 VAL  HA           77 LYS  HN          2.70    (#    172:10   Unique)
 &rst
  ixpk= 172, iat=1222,1236, r1= 0.00, r2= 1.80, r3= 2.70, r4= 3.45,  &end
#
#  110 VAL  HA          111 LEU  HN          3.50    (#    173:10   Unique)
 &rst
  ixpk= 173, iat=1763,1777, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  132 ILE  HG1-        111 LEU  HN          4.50    (#    174:10   Unique)
 &rst
  ixpk= 174, iat=  -1,1777, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2083,2084,
 &end
#
#    0 AMB  10-2:175    111 LEU  HN          4.50    (#    175:10   Single Ambig)
 &rst
  ixpk= 175, iat=  -1,1777, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2075,2056,
 &end
#
#   94 THR  HA           94 THR  HN          3.50    (#    177:10   Unique)
 &rst
  ixpk= 177, iat=1512,1510, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:178     94 THR  HN          3.50    (#    178:10   Single Ambig)
 &rst
  ixpk= 178, iat=  -1,1510, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1502,1514,
 &end
#
#   91 TYR  HA           94 THR  HN          4.50    (#    179:10   Unique)
 &rst
  ixpk= 179, iat=1465,1510, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:180     94 THR  HN          6.00    (#    180:10   Single Ambig)
 &rst
  ixpk= 180, iat=  -1,1510, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1486,1559,1560,
 &end
#
#   96 VAL  MG2          94 THR  HN          6.00    (#    181:10   Unique)
 &rst
  ixpk= 181, iat=  -1,1510, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1549,1550,1551,
 &end
#
#   92 VAL  HB           94 THR  HN          6.00    (#    182:10   Unique)
 &rst
  ixpk= 182, iat=1488,1510, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   95 GLU  QG           94 THR  HN          4.50    (#    183:10   Unique)
 &rst
  ixpk= 183, iat=  -1,1510, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1531,1532,
 &end
#
#   77 LYS  HA           78 HIS  HN          3.50    (#    185:10   Unique)
 &rst
  ixpk= 185, iat=1238,1258, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   62 ASP  HA           66 TRP  HE1         6.00    (#    186:10   Unique)
 &rst
  ixpk= 186, iat= 980,1059, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   78 HIS  HA           78 HIS  HN          4.50    (#    187:10   Unique)
 &rst
  ixpk= 187, iat=1260,1258, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   72 LEU  HA           66 TRP  HE1         6.00    (#    188:10   Unique)
 &rst
  ixpk= 188, iat=1145,1059, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  10-2:189     66 TRP  HE1         6.00    (#    189:10   Single Ambig)
 &rst
  ixpk= 189, iat=  -1,1059, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1= 982, 919, 920,
 &end
#
#   66 TRP  HB3          66 TRP  HE1         6.00    (#    190:10   Unique)
 &rst
  ixpk= 190, iat=1054,1059, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  10-2:191     66 TRP  HE1         4.50    (#    191:10   Single Ambig)
 &rst
  ixpk= 191, iat=  -1,1059, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 983,1053,
 &end
#
#   24 PHE  HE           78 HIS  HN          6.00    (#    192:10   Unique)
 &rst
  ixpk= 192, iat=  -1,1258, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 356, 360,
 &end
#
#    0 AMB  10-2:193     66 TRP  HE1         4.50    (#    193:10   Single Ambig)
 &rst
  ixpk= 193, iat=  -1,1059, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1040,1041,1040,1041,
 &end
#
#   78 HIS  HB3          78 HIS  HN          4.50    (#    194:10   Unique)
 &rst
  ixpk= 194, iat=1263,1258, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  101 LEU  HA          102 GLY  HN          3.50    (#    195:10   Unique)
 &rst
  ixpk= 195, iat=1631,1648, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:196     88 ALA  HN          6.00    (#    196:10   Single Ambig)
 &rst
  ixpk= 196, iat=  -1,1420, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1463,1484,
 &end
#
#  100 GLU  HA          102 GLY  HN          4.50    (#    197:10   Unique)
 &rst
  ixpk= 197, iat=1616,1648, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  100 GLU  QG          102 GLY  HN          4.50    (#    198:10   Unique)
 &rst
  ixpk= 198, iat=  -1,1648, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1621,1622,
 &end
#
#  102 GLY  HA-         102 GLY  HN          3.50    (#    199:10   Unique)
 &rst
  ixpk= 199, iat=  -1,1648, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1650,1651,
 &end
#
#    0 AMB  10-2:200    102 GLY  HN          4.50    (#    200:10   Single Ambig)
 &rst
  ixpk= 200, iat=  -1,1648, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 951, 952, 951, 952,
 &end
#
#    0 AMB  10-2:201    102 GLY  HN          4.50    (#    201:10   Single Ambig)
 &rst
  ixpk= 201, iat=  -1,1648, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1634,1606,1607,
 &end
#
#    0 AMB  10-2:202    102 GLY  HN          4.50    (#    202:10   Single Ambig)
 &rst
  ixpk= 202, iat=  -1,1648, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1618,1619,1618,1619,1603,1604,
 &end
#
#  103 ALA  HA          102 GLY  HN          6.00    (#    203:10   Unique)
 &rst
  ixpk= 203, iat=1657,1648, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   11 PHE  QB           12 LEU  HN          3.50    (#    204:10   Unique)
 &rst
  ixpk= 204, iat=  -1, 170, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 154, 155,
 &end
#
#   12 LEU  HB3          12 LEU  HN          3.50    (#    205:10   Unique)
 &rst
  ixpk= 205, iat= 175, 170, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:207     84 ASN  HN          3.50    (#    207:10   Single Ambig)
 &rst
  ixpk= 207, iat=  -1,1365, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1353, 820,
 &end
#
#   51 SER  HB-          84 ASN  HN          6.00    (#    208:10   Unique)
 &rst
  ixpk= 208, iat=  -1,1365, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 811, 812,
 &end
#
#   84 ASN  HB2          84 ASN  HN          3.50    (#    209:10   Unique)
 &rst
  ixpk= 209, iat=1369,1365, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   84 ASN  HB3          84 ASN  HN          3.50    (#    210:10   Unique)
 &rst
  ixpk= 210, iat=1370,1365, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   48 VAL  HA           49 GLN  HN          3.50    (#    211:10   Unique)
 &rst
  ixpk= 211, iat= 756, 770, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   55 LYS  HA           49 GLN  HN          6.00    (#    214:10   Unique)
 &rst
  ixpk= 214, iat= 866, 770, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   56 THR  HA           49 GLN  HN          4.50    (#    215:10   Unique)
 &rst
  ixpk= 215, iat= 888, 770, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  155 ALA  HA          133 ARG  HN          6.00    (#    216:10   Unique)
 &rst
  ixpk= 216, iat=2472,2092, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  10-2:217    133 ARG  HN          4.50    (#    217:10   Single Ambig)
 &rst
  ixpk= 217, iat=  -1,2092, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2484,2485,2482,
 &end
#
#   49 GLN  HA           49 GLN  HN          4.50    (#    218:10   Unique)
 &rst
  ixpk= 218, iat= 772, 770, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:219    109 LYS  HN          4.50    (#    219:10   Single Ambig)
 &rst
  ixpk= 219, iat=  -1,1739, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1729,2056,
 &end
#
#  132 ILE  HA          133 ARG  HN          3.50    (#    220:10   Unique)
 &rst
  ixpk= 220, iat=2075,2092, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  134 TYR  HB2         113 ILE  HN          6.00    (#    221:10   Unique)
 &rst
  ixpk= 221, iat=2120,1815, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  10-2:222    133 ARG  HN          4.50    (#    222:10   Single Ambig)
 &rst
  ixpk= 222, iat=  -1,2092, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2102,2103,2484,2485,
 &end
#
#  134 TYR  HB3         113 ILE  HN          4.50    (#    223:10   Unique)
 &rst
  ixpk= 223, iat=2121,1815, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   57 GLU  HG+          49 GLN  HN          4.50    (#    224:10   Unique)
 &rst
  ixpk= 224, iat=  -1, 770, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 907, 908,
 &end
#
#  108 THR  HA          109 LYS  HN          2.70    (#    225:10   Unique)
 &rst
  ixpk= 225, iat=1727,1739, r1= 0.00, r2= 1.80, r3= 2.70, r4= 3.45,  &end
#
#    0 AMB  10-2:226     49 GLN  HN          4.50    (#    226:10   Single Ambig)
 &rst
  ixpk= 226, iat=  -1, 770, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 777, 778, 905,
 &end
#
#    7 VAL  HA          109 LYS  HN          6.00    (#    227:10   Unique)
 &rst
  ixpk= 227, iat=  89,1739, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   57 GLU  HG-          49 GLN  HN          4.50    (#    228:10   Unique)
 &rst
  ixpk= 228, iat=  -1, 770, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 907, 908,
 &end
#
#    0 AMB  10-2:229    113 ILE  HN          4.50    (#    229:10   Single Ambig)
 &rst
  ixpk= 229, iat=  -1,1815, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 175,1800,
 &end
#
#  136 ILE  HA          136 ILE  HN          4.50    (#    230:10   Unique)
 &rst
  ixpk= 230, iat=2158,2156, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  115 THR  HB           14 ASP  HN          4.50    (#    231:10   Unique)
 &rst
  ixpk= 231, iat=1857, 209, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   14 ASP  HA           14 ASP  HN          4.50    (#    232:10   Unique)
 &rst
  ixpk= 232, iat= 211, 209, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:233    114 ILE  HN          4.50    (#    233:10   Single Ambig)
 &rst
  ixpk= 233, iat=  -1,1834, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 193, 194, 193, 194, 213, 214,
 &end
#
#    0 AMB  10-2:234     14 ASP  HN          3.50    (#    234:10   Single Ambig)
 &rst
  ixpk= 234, iat=  -1, 209, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 213, 214, 213, 214, 193, 194,
 &end
#
#    0 AMB  10-2:235    166 LEU  HN          3.50    (#    235:10   Single Ambig)
 &rst
  ixpk= 235, iat=  -1,2640, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2623,2184,
 &end
#
#  166 LEU  HA          166 LEU  HN          3.50    (#    236:10   Unique)
 &rst
  ixpk= 236, iat=2642,2640, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  137 GLY  HA-         166 LEU  HN          6.00    (#    237:10   Unique)
 &rst
  ixpk= 237, iat=  -1,2640, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2177,2178,
 &end
#
#    0 AMB  10-2:240      9 LEU  HN          4.50    (#    240:10   Single Ambig)
 &rst
  ixpk= 240, iat=  -1, 115, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 704, 705, 107,
 &end
#
#    0 AMB  10-2:241      9 LEU  HN          4.50    (#    241:10   Single Ambig)
 &rst
  ixpk= 241, iat=  -1, 115, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1= 701, 702, 108, 704, 705,
 &end
#
#    0 AMB  10-2:242      9 LEU  HN          4.50    (#    242:10   Single Ambig)
 &rst
  ixpk= 242, iat=  -1, 115, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 701, 702, 681,
 &end
#
#  125 ILE  HA          126 ASP  HN          3.50    (#    243:10   Unique)
 &rst
  ixpk= 243, iat=1971,1988, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  126 ASP  HA          126 ASP  HN          3.50    (#    245:10   Unique)
 &rst
  ixpk= 245, iat=1990,1988, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  127 ALA  HA          126 ASP  HN          6.00    (#    246:10   Unique)
 &rst
  ixpk= 246, iat=2002,1988, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  124 ASN  HB+         126 ASP  HN          3.50    (#    247:10   Unique)
 &rst
  ixpk= 247, iat=  -1,1988, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1959,1960,
 &end
#
#  126 ASP  QB          126 ASP  HN          2.70    (#    248:10   Unique)
 &rst
  ixpk= 248, iat=  -1,1988, r1= 0.00, r2= 1.80, r3= 3.03, r4= 3.78,
 igr1=1992,1993,
 &end
#
#  128 ALA  MB          126 ASP  HN          6.00    (#    249:10   Unique)
 &rst
  ixpk= 249, iat=  -1,1988, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=2014,2015,2016,
 &end
#
#    0 AMB  10-2:250     56 THR  HN          6.00    (#    250:10   Single Ambig)
 &rst
  ixpk= 250, iat=  -1, 886, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 756, 902,
 &end
#
#   55 LYS  HA           56 THR  HN          3.50    (#    252:10   Unique)
 &rst
  ixpk= 252, iat= 866, 886, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   56 THR  HB           56 THR  HN          3.50    (#    253:10   Unique)
 &rst
  ixpk= 253, iat= 890, 886, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:255    116 ASP  HN          4.50    (#    255:10   Single Ambig)
 &rst
  ixpk= 255, iat=  -1,1867, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1857, 262, 263,
 &end
#
#    0 AMB  10-2:256    116 ASP  HN          6.00    (#    256:10   Single Ambig)
 &rst
  ixpk= 256, iat=  -1,1867, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=1881,1882, 232, 233,
 &end
#
#  116 ASP  HB3         116 ASP  HN          4.50    (#    257:10   Unique)
 &rst
  ixpk= 257, iat=1872,1867, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:258    116 ASP  HN          3.50    (#    258:10   Single Ambig)
 &rst
  ixpk= 258, iat=  -1,1867, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1= 213, 214, 213, 214,
 &end
#
#  116 ASP  HB2         116 ASP  HN          4.50    (#    259:10   Unique)
 &rst
  ixpk= 259, iat=1871,1867, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  104 ARG  HA          104 ARG  HN          4.50    (#    261:10   Unique)
 &rst
  ixpk= 261, iat=1667,1665, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  107 ALA  MB          104 ARG  HN          4.50    (#    262:10   Unique)
 &rst
  ixpk= 262, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1719,1720,1721,
 &end
#
#  105 PRO  HD-         104 ARG  HN          4.50    (#    263:10   Unique)
 &rst
  ixpk= 263, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1690,1691,
 &end
#
#  103 ALA  HA          104 ARG  HN          3.50    (#    264:10   Unique)
 &rst
  ixpk= 264, iat=1657,1665, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   60 PHE  HB+         104 ARG  HN          6.00    (#    265:10   Unique)
 &rst
  ixpk= 265, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 951, 952,
 &end
#
#    0 AMB  10-2:266    104 ARG  HN          4.50    (#    266:10   Single Ambig)
 &rst
  ixpk= 266, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1= 704, 705, 701, 702, 108,
 &end
#
#    0 AMB  10-2:267     88 ALA  HN          6.00    (#    267:10   Single Ambig)
 &rst
  ixpk= 267, iat=  -1,1420, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1369,1383,
 &end
#
#   88 ALA  HA           88 ALA  HN          3.50    (#    268:10   Unique)
 &rst
  ixpk= 268, iat=1422,1420, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   87 GLY  HA+          88 ALA  HN          3.50    (#    269:10   Unique)
 &rst
  ixpk= 269, iat=  -1,1420, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1415,1416,
 &end
#
#   87 GLY  HA-          88 ALA  HN          3.50    (#    270:10   Unique)
 &rst
  ixpk= 270, iat=  -1,1420, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1415,1416,
 &end
#
#    0 AMB  10-2:271     88 ALA  HN          4.50    (#    271:10   Single Ambig)
 &rst
  ixpk= 271, iat=  -1,1420, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1370,1397,1929,1930,
 &end
#
#    0 AMB  10-2:272     88 ALA  HN          3.50    (#    272:10   Single Ambig)
 &rst
  ixpk= 272, iat=  -1,1420, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1381, 791,
 &end
#
#   86 PHE  HB3          88 ALA  HN          6.00    (#    273:10   Unique)
 &rst
  ixpk= 273, iat=1398,1420, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  165 ILE  HA          165 ILE  HN          4.50    (#    274:10   Unique)
 &rst
  ixpk= 274, iat=2623,2621, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  164 LYS  HA          165 ILE  HN          3.50    (#    276:10   Unique)
 &rst
  ixpk= 276, iat=2601,2621, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  132 ILE  HB          132 ILE  HN          3.50    (#    278:10   Unique)
 &rst
  ixpk= 278, iat=2077,2073, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  111 LEU  HB3         132 ILE  HN          4.50    (#    279:10   Unique)
 &rst
  ixpk= 279, iat=1782,2073, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  132 ILE  HG1+        132 ILE  HN          3.50    (#    280:10   Unique)
 &rst
  ixpk= 280, iat=  -1,2073, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2083,2084,
 &end
#
#    0 AMB  10-2:281    132 ILE  HN          4.50    (#    281:10   Single Ambig)
 &rst
  ixpk= 281, iat=  -1,2073, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1743,2064,2065,
 &end
#
#  132 ILE  HG1-        132 ILE  HN          3.50    (#    282:10   Unique)
 &rst
  ixpk= 282, iat=  -1,2073, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2083,2084,
 &end
#
#    0 AMB  10-2:283    132 ILE  HN          3.50    (#    283:10   Single Ambig)
 &rst
  ixpk= 283, iat=  -1,2073, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=2086,2087,2088,2064,2065,2067,2068,2069,
 &end
#
#    0 AMB  10-2:284    132 ILE  HN          3.50    (#    284:10   Single Ambig)
 &rst
  ixpk= 284, iat=  -1,2073, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2060,2061,2062,1744,
 &end
#
#    0 AMB  10-2:286    164 LYS  HN          4.50    (#    286:10   Single Ambig)
 &rst
  ixpk= 286, iat=  -1,2599, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2587,2160,
 &end
#
#    0 AMB  10-2:287     79 MET  HN          3.50    (#    287:10   Single Ambig)
 &rst
  ixpk= 287, iat=  -1,1275, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1280,1288,1289,1290,
 &end
#
#    0 AMB  10-2:288    164 LYS  HN          3.50    (#    288:10   Single Ambig)
 &rst
  ixpk= 288, iat=  -1,2599, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2603,2604,2603,2604,2609,2610,
 &end
#
#  164 LYS  HG-         164 LYS  HN          4.50    (#    289:10   Unique)
 &rst
  ixpk= 289, iat=  -1,2599, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2606,2607,
 &end
#
#  135 ILE  MG2         164 LYS  HN          3.50    (#    290:10   Unique)
 &rst
  ixpk= 290, iat=  -1,2599, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2143,2144,2145,
 &end
#
#  136 ILE  HG1-        164 LYS  HN          4.50    (#    291:10   Unique)
 &rst
  ixpk= 291, iat=  -1,2599, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2166,2167,
 &end
#
#  163 VAL  MG1         164 LYS  HN          3.50    (#    292:10   Unique)
 &rst
  ixpk= 292, iat=  -1,2599, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2589,2590,2591,
 &end
#
#   77 LYS  HG-          77 LYS  HN          4.50    (#    293:10   Unique)
 &rst
  ixpk= 293, iat=  -1,1236, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1243,1244,
 &end
#
#    0 AMB  10-2:294     77 LYS  HN          3.50    (#    294:10   Single Ambig)
 &rst
  ixpk= 294, iat=  -1,1236, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=1240,1241,1246,1247,
 &end
#
#   76 VAL  MG1          77 LYS  HN          3.50    (#    295:10   Unique)
 &rst
  ixpk= 295, iat=  -1,1236, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1226,1227,1228,
 &end
#
#   76 VAL  MG2          77 LYS  HN          4.50    (#    296:10   Unique)
 &rst
  ixpk= 296, iat=  -1,1236, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1230,1231,1232,
 &end
#
#  132 ILE  HB          111 LEU  HN          4.50    (#    297:10   Unique)
 &rst
  ixpk= 297, iat=2077,1777, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  111 LEU  HB3         111 LEU  HN          3.50    (#    298:10   Unique)
 &rst
  ixpk= 298, iat=1782,1777, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:299    111 LEU  HN          4.50    (#    299:10   Single Ambig)
 &rst
  ixpk= 299, iat=  -1,1777, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1765,2083,2084,2058,
 &end
#
#  111 LEU  HB2         111 LEU  HN          3.50    (#    300:10   Unique)
 &rst
  ixpk= 300, iat=1781,1777, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:301    111 LEU  HN          3.50    (#    301:10   Single Ambig)
 &rst
  ixpk= 301, iat=  -1,1777, r1= 0.00, r2= 1.80, r3= 5.30, r4= 6.05,
 igr1=1767,1768,1769,2079,2080,2081,1786,1787,1788,1790,
      1791,1792,
 &end
#
#  131 ILE  MG2         111 LEU  HN          3.50    (#    302:10   Unique)
 &rst
  ixpk= 302, iat=  -1,1777, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2060,2061,2062,
 &end
#
#   94 THR  MG2          94 THR  HN          3.50    (#    304:10   Unique)
 &rst
  ixpk= 304, iat=  -1,1510, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1516,1517,1518,
 &end
#
#   92 VAL  MG1          94 THR  HN          6.00    (#    305:10   Unique)
 &rst
  ixpk= 305, iat=  -1,1510, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=1490,1491,1492,
 &end
#
#    0 AMB  10-2:306     94 THR  HN          6.00    (#    306:10   Single Ambig)
 &rst
  ixpk= 306, iat=  -1,1510, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=1528,2067,2068,2069,
 &end
#
#    0 AMB  10-2:307     78 HIS  HN          4.50    (#    307:10   Single Ambig)
 &rst
  ixpk= 307, iat=  -1,1258, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=1240,1241,1246,1247,
 &end
#
#   65 LYS  HB+          66 TRP  HE1         4.50    (#    308:10   Unique)
 &rst
  ixpk= 308, iat=  -1,1059, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1031,1032,
 &end
#
#   77 LYS  HG+          78 HIS  HN          6.00    (#    309:10   Unique)
 &rst
  ixpk= 309, iat=  -1,1258, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1243,1244,
 &end
#
#   65 LYS  QD           66 TRP  HE1         3.50    (#    310:10   Unique)
 &rst
  ixpk= 310, iat=  -1,1059, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1037,1038,
 &end
#
#   65 LYS  HG+          66 TRP  HE1         6.00    (#    312:10   Unique)
 &rst
  ixpk= 312, iat=  -1,1059, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1034,1035,
 &end
#
#   72 LEU  MDY          66 TRP  HE1         4.50    (#    313:10   Unique)
 &rst
  ixpk= 313, iat=  -1,1059, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1152,1153,1154,1156,1157,1158,
 &end
#
#   65 LYS  HG-          66 TRP  HE1         4.50    (#    314:10   Unique)
 &rst
  ixpk= 314, iat=  -1,1059, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1034,1035,
 &end
#
#  101 LEU  HB2         102 GLY  HN          4.50    (#    315:10   Unique)
 &rst
  ixpk= 315, iat=1633,1648, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:316     12 LEU  HN          4.50    (#    316:10   Single Ambig)
 &rst
  ixpk= 316, iat=  -1, 170, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=1844,1845,1825,1826, 138,
 &end
#
#  101 LEU  HG          102 GLY  HN          4.50    (#    317:10   Unique)
 &rst
  ixpk= 317, iat=1636,1648, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   98 ARG  HB-         102 GLY  HN          6.00    (#    318:10   Unique)
 &rst
  ixpk= 318, iat=  -1,1648, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1579,1580,
 &end
#
#    0 AMB  10-2:319    102 GLY  HN          4.50    (#    319:10   Single Ambig)
 &rst
  ixpk= 319, iat=  -1,1648, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=1659,1660,1661,1638,1639,1640,1642,1643,1644,
 &end
#
#  101 LEU  MDY         102 GLY  HN          4.50    (#    320:10   Unique)
 &rst
  ixpk= 320, iat=  -1,1648, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1638,1639,1640,1642,1643,1644,
 &end
#
#    0 AMB  10-2:321     12 LEU  HN          4.50    (#    321:10   Single Ambig)
 &rst
  ixpk= 321, iat=  -1, 170, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 177,1806,1807,
 &end
#
#    0 AMB  10-2:322     12 LEU  HN          3.50    (#    322:10   Single Ambig)
 &rst
  ixpk= 322, iat=  -1, 170, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1= 174,1844,1845,
 &end
#
#    0 AMB  10-2:323     12 LEU  HN          4.50    (#    323:10   Single Ambig)
 &rst
  ixpk= 323, iat=  -1, 170, r1= 0.00, r2= 1.80, r3= 6.81, r4= 7.56,
 igr1=1786,1787,1788,1790,1791,1792,1786,1787,1788,1790,
      1791,1792,
 &end
#
#    0 AMB  10-2:324     12 LEU  HN          4.50    (#    324:10   Single Ambig)
 &rst
  ixpk= 324, iat=  -1, 170, r1= 0.00, r2= 1.80, r3= 7.07, r4= 7.82,
 igr1= 179, 180, 181, 183, 184, 185,1821,1822,1823, 124,
       125, 126, 128, 129, 130,
 &end
#
#   10 VAL  MG1          12 LEU  HN          4.50    (#    325:10   Unique)
 &rst
  ixpk= 325, iat=  -1, 170, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 140, 141, 142,
 &end
#
#   12 LEU  MDX          12 LEU  HN          4.50    (#    326:10   Unique)
 &rst
  ixpk= 326, iat=  -1, 170, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 179, 180, 181, 183, 184, 185,
 &end
#
#   82 LEU  HB+          84 ASN  HN          4.50    (#    328:10   Unique)
 &rst
  ixpk= 328, iat=  -1,1365, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1336,1337,
 &end
#
#    0 AMB  10-2:329     84 ASN  HN          4.50    (#    329:10   Single Ambig)
 &rst
  ixpk= 329, iat=  -1,1365, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1357,1358,1359,1917,1918,1919,
 &end
#
#   52 THR  MG2          84 ASN  HN          6.00    (#    330:10   Unique)
 &rst
  ixpk= 330, iat=  -1,1365, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1= 824, 825, 826,
 &end
#
#   88 ALA  MB           84 ASN  HN          4.50    (#    332:10   Unique)
 &rst
  ixpk= 332, iat=  -1,1365, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1424,1425,1426,
 &end
#
#  132 ILE  HB          133 ARG  HN          4.50    (#    333:10   Unique)
 &rst
  ixpk= 333, iat=2077,2092, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:334    113 ILE  HN          3.50    (#    334:10   Single Ambig)
 &rst
  ixpk= 334, iat=  -1,1815, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1825,1826,1819,
 &end
#
#    0 AMB  10-2:335    133 ARG  HN          3.50    (#    335:10   Single Ambig)
 &rst
  ixpk= 335, iat=  -1,2092, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2097,1782,
 &end
#
#   49 GLN  QB           49 GLN  HN          3.50    (#    336:10   Unique)
 &rst
  ixpk= 336, iat=  -1, 770, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 774, 775,
 &end
#
#    0 AMB  10-2:337    113 ILE  HN          4.50    (#    337:10   Single Ambig)
 &rst
  ixpk= 337, iat=  -1,1815, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1784,2166,2167,
 &end
#
#  133 ARG  HB2         133 ARG  HN          3.50    (#    338:10   Unique)
 &rst
  ixpk= 338, iat=2096,2092, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  132 ILE  HG1+        109 LYS  HN          4.50    (#    339:10   Unique)
 &rst
  ixpk= 339, iat=  -1,1739, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2083,2084,
 &end
#
#    0 AMB  10-2:340    113 ILE  HN          4.50    (#    340:10   Single Ambig)
 &rst
  ixpk= 340, iat=  -1,1815, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=2147,2148,1806,1807, 177,
 &end
#
#    0 AMB  10-2:341     49 GLN  HN          6.00    (#    341:10   Single Ambig)
 &rst
  ixpk= 341, iat=  -1, 770, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1= 868, 847, 848,
 &end
#
#  109 LYS  HB2         109 LYS  HN          3.50    (#    342:10   Unique)
 &rst
  ixpk= 342, iat=1743,1739, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:343    113 ILE  HN          4.50    (#    343:10   Single Ambig)
 &rst
  ixpk= 343, iat=  -1,1815, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1=2147,2148,1806,1807,
 &end
#
#  109 LYS  HG+         109 LYS  HN          3.50    (#    345:10   Unique)
 &rst
  ixpk= 345, iat=  -1,1739, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1746,1747,
 &end
#
#    0 AMB  10-2:346     49 GLN  HN          4.50    (#    346:10   Single Ambig)
 &rst
  ixpk= 346, iat=  -1, 770, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1= 871, 872, 748, 749, 750,
 &end
#
#  132 ILE  HG1-        133 ARG  HN          6.00    (#    347:10   Unique)
 &rst
  ixpk= 347, iat=  -1,2092, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2083,2084,
 &end
#
#    0 AMB  10-2:348    113 ILE  HN          3.50    (#    348:10   Single Ambig)
 &rst
  ixpk= 348, iat=  -1,1815, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1802,1803,1804,1844,1845,
 &end
#
#    0 AMB  10-2:349    109 LYS  HN          3.50    (#    349:10   Single Ambig)
 &rst
  ixpk= 349, iat=  -1,1739, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=1746,1747,1731,1732,1733,
 &end
#
#    0 AMB  10-2:350     49 GLN  HN          3.50    (#    350:10   Single Ambig)
 &rst
  ixpk= 350, iat=  -1, 770, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1= 760, 761, 762, 764, 765, 766, 871, 872,
 &end
#
#  113 ILE  HG1-        113 ILE  HN          3.50    (#    351:10   Unique)
 &rst
  ixpk= 351, iat=  -1,1815, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1825,1826,
 &end
#
#    0 AMB  10-2:352    133 ARG  HN          3.50    (#    352:10   Single Ambig)
 &rst
  ixpk= 352, iat=  -1,2092, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2079,2080,2081,2086,2087,2088,
 &end
#
#    0 AMB  10-2:353    113 ILE  HN          4.50    (#    353:10   Single Ambig)
 &rst
  ixpk= 353, iat=  -1,1815, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=2169,2170,2171,1821,1822,1823,
 &end
#
#    0 AMB  10-2:354    109 LYS  HN          4.50    (#    354:10   Single Ambig)
 &rst
  ixpk= 354, iat=  -1,1739, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1=1771,1772,1773,1749,1750,2086,2087,2088,
 &end
#
#   48 VAL  MGY          49 GLN  HN          3.50    (#    355:10   Unique)
 &rst
  ixpk= 355, iat=  -1, 770, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1= 760, 761, 762, 764, 765, 766,
 &end
#
#  113 ILE  MD1         113 ILE  HN          4.50    (#    356:10   Unique)
 &rst
  ixpk= 356, iat=  -1,1815, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1828,1829,1830,
 &end
#
#  131 ILE  MG2         133 ARG  HN          6.00    (#    357:10   Unique)
 &rst
  ixpk= 357, iat=  -1,2092, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=2060,2061,2062,
 &end
#
#  109 LYS  HB3         109 LYS  HN          3.50    (#    358:10   Unique)
 &rst
  ixpk= 358, iat=1744,1739, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    7 VAL  MG1         109 LYS  HN          6.00    (#    359:10   Unique)
 &rst
  ixpk= 359, iat=  -1,1739, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=  93,  94,  95,
 &end
#
#   89 ILE  HG1-        113 ILE  HN          6.00    (#    360:10   Unique)
 &rst
  ixpk= 360, iat=  -1,1815, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1440,1441,
 &end
#
#    0 AMB  10-2:362    136 ILE  HN          3.50    (#    362:10   Single Ambig)
 &rst
  ixpk= 362, iat=  -1,2156, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2160,1819,
 &end
#
#    0 AMB  10-2:363    136 ILE  HN          4.50    (#    363:10   Single Ambig)
 &rst
  ixpk= 363, iat=  -1,2156, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=2141,2603,2604,2603,2604,
 &end
#
#  135 ILE  HG1+        136 ILE  HN          3.50    (#    364:10   Unique)
 &rst
  ixpk= 364, iat=  -1,2156, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2147,2148,
 &end
#
#  135 ILE  HG1-        136 ILE  HN          4.50    (#    365:10   Unique)
 &rst
  ixpk= 365, iat=  -1,2156, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2147,2148,
 &end
#
#    0 AMB  10-2:366    136 ILE  HN          3.50    (#    366:10   Single Ambig)
 &rst
  ixpk= 366, iat=  -1,2156, r1= 0.00, r2= 1.80, r3= 4.95, r4= 5.70,
 igr1=1844,1845,1840,1841,1842,2143,2144,2145,
 &end
#
#    0 AMB  10-2:367    136 ILE  HN          3.50    (#    367:10   Single Ambig)
 &rst
  ixpk= 367, iat=  -1,2156, r1= 0.00, r2= 1.80, r3= 4.58, r4= 5.33,
 igr1=2166,2167,2150,2151,2152,
 &end
#
#  136 ILE  MD1         136 ILE  HN          3.50    (#    368:10   Unique)
 &rst
  ixpk= 368, iat=  -1,2156, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2169,2170,2171,
 &end
#
#  136 ILE  MG2         136 ILE  HN          4.50    (#    369:10   Unique)
 &rst
  ixpk= 369, iat=  -1,2156, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2162,2163,2164,
 &end
#
#    0 AMB  10-2:370    114 ILE  HN          3.50    (#    370:10   Single Ambig)
 &rst
  ixpk= 370, iat=  -1,1834, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1844,1845,1838,
 &end
#
#  114 ILE  HB           14 ASP  HN          4.50    (#    371:10   Unique)
 &rst
  ixpk= 371, iat=1838, 209, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  135 ILE  HG1+        114 ILE  HN          6.00    (#    372:10   Unique)
 &rst
  ixpk= 372, iat=  -1,1834, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2147,2148,
 &end
#
#  135 ILE  HG1-        114 ILE  HN          6.00    (#    373:10   Unique)
 &rst
  ixpk= 373, iat=  -1,1834, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2147,2148,
 &end
#
#  114 ILE  HG1-        114 ILE  HN          3.50    (#    374:10   Unique)
 &rst
  ixpk= 374, iat=  -1,1834, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1844,1845,
 &end
#
#    0 AMB  10-2:375     14 ASP  HN          4.50    (#    375:10   Single Ambig)
 &rst
  ixpk= 375, iat=  -1, 209, r1= 0.00, r2= 1.80, r3= 6.90, r4= 7.65,
 igr1= 278, 279, 280, 282, 283, 284,1844,1845, 415, 416,
      1847,1848,1849,
 &end
#
#    0 AMB  10-2:376    114 ILE  HN          4.50    (#    376:10   Single Ambig)
 &rst
  ixpk= 376, iat=  -1,1834, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=1825,1826,1840,1841,1842,
 &end
#
#  114 ILE  MG2          14 ASP  HN          4.50    (#    377:10   Unique)
 &rst
  ixpk= 377, iat=  -1, 209, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1840,1841,1842,
 &end
#
#    0 AMB  10-2:378    114 ILE  HN          3.50    (#    378:10   Single Ambig)
 &rst
  ixpk= 378, iat=  -1,1834, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=1821,1822,1823,2169,2170,2171,
 &end
#
#   27 ILE  MG2          14 ASP  HN          4.50    (#    379:10   Unique)
 &rst
  ixpk= 379, iat=  -1, 209, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 411, 412, 413,
 &end
#
#   12 LEU  HB3         114 ILE  HN          4.50    (#    381:10   Unique)
 &rst
  ixpk= 381, iat= 175,1834, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:382    166 LEU  HN          4.50    (#    382:10   Single Ambig)
 &rst
  ixpk= 382, iat=  -1,2640, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2625,2160,
 &end
#
#    0 AMB  10-2:383    166 LEU  HN          6.00    (#    383:10   Single Ambig)
 &rst
  ixpk= 383, iat=  -1,2640, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1=2603,2604,2609,2610,
 &end
#
#    0 AMB  10-2:384    166 LEU  HN          3.50    (#    384:10   Single Ambig)
 &rst
  ixpk= 384, iat=  -1,2640, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=2644,2645,2647,
 &end
#
#  165 ILE  HG1-        166 LEU  HN          6.00    (#    385:10   Unique)
 &rst
  ixpk= 385, iat=  -1,2640, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2631,2632,
 &end
#
#    0 AMB  10-2:387    166 LEU  HN          3.50    (#    387:10   Single Ambig)
 &rst
  ixpk= 387, iat=  -1,2640, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2627,2628,2629,2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  10-2:388    166 LEU  HN          4.50    (#    388:10   Single Ambig)
 &rst
  ixpk= 388, iat=  -1,2640, r1= 0.00, r2= 1.80, r3= 6.49, r4= 7.24,
 igr1=2162,2163,2164,2649,2650,2651,2653,2654,2655,
 &end
#
#    0 AMB  10-2:389    166 LEU  HN          4.50    (#    389:10   Single Ambig)
 &rst
  ixpk= 389, iat=  -1,2640, r1= 0.00, r2= 1.80, r3= 5.88, r4= 6.63,
 igr1=2192,2193,2634,2635,2636,
 &end
#
#  138 ILE  MG2         166 LEU  HN          6.00    (#    390:10   Unique)
 &rst
  ixpk= 390, iat=  -1,2640, r1= 0.00, r2= 1.80, r3= 7.21, r4= 7.96,
 igr1=2188,2189,2190,
 &end
#
#    9 LEU  HB3           9 LEU  HN          3.50    (#    391:10   Unique)
 &rst
  ixpk= 391, iat= 120, 115, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    9 LEU  HG            9 LEU  HN          4.50    (#    392:10   Unique)
 &rst
  ixpk= 392, iat= 122, 115, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    9 LEU  HB2           9 LEU  HN          3.50    (#    393:10   Unique)
 &rst
  ixpk= 393, iat= 119, 115, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:395      9 LEU  HN          4.50    (#    395:10   Single Ambig)
 &rst
  ixpk= 395, iat=  -1, 115, r1= 0.00, r2= 1.80, r3= 6.22, r4= 6.97,
 igr1=  91, 124, 125, 126, 128, 129, 130,
 &end
#
#    7 VAL  MG1           9 LEU  HN          4.50    (#    396:10   Unique)
 &rst
  ixpk= 396, iat=  -1, 115, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=  93,  94,  95,
 &end
#
#    0 AMB  10-2:397      9 LEU  HN          4.50    (#    397:10   Single Ambig)
 &rst
  ixpk= 397, iat=  -1, 115, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 144, 145, 146, 738, 739, 740,
 &end
#
#    9 LEU  MDY           9 LEU  HN          4.50    (#    398:10   Unique)
 &rst
  ixpk= 398, iat=  -1, 115, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 124, 125, 126, 128, 129, 130,
 &end
#
#  127 ALA  MB          126 ASP  HN          4.50    (#    399:10   Unique)
 &rst
  ixpk= 399, iat=  -1,1988, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2004,2005,2006,
 &end
#
#    0 AMB  10-2:400    126 ASP  HN          4.50    (#    400:10   Single Ambig)
 &rst
  ixpk= 400, iat=  -1,1988, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1975,1976,1977,1982,1983,1984,
 &end
#
#    0 AMB  10-2:402     56 THR  HN          4.50    (#    402:10   Single Ambig)
 &rst
  ixpk= 402, iat=  -1, 886, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1= 869, 874, 875,
 &end
#
#   55 LYS  HG+          56 THR  HN          4.50    (#    403:10   Unique)
 &rst
  ixpk= 403, iat=  -1, 886, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 871, 872,
 &end
#
#   55 LYS  HG-          56 THR  HN          4.50    (#    404:10   Unique)
 &rst
  ixpk= 404, iat=  -1, 886, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 871, 872,
 &end
#
#   48 VAL  MGY          56 THR  HN          6.00    (#    405:10   Unique)
 &rst
  ixpk= 405, iat=  -1, 886, r1= 0.00, r2= 1.80, r3= 8.09, r4= 8.84,
 igr1= 760, 761, 762, 764, 765, 766,
 &end
#
#    0 AMB  10-2:406    116 ASP  HN          4.50    (#    406:10   Single Ambig)
 &rst
  ixpk= 406, iat=  -1,1867, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1=1859,1860,1861,1357,1358,1359,
 &end
#
#  104 ARG  QB          104 ARG  HN          3.50    (#    407:10   Unique)
 &rst
  ixpk= 407, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1669,1670,
 &end
#
#  103 ALA  MB          104 ARG  HN          3.50    (#    409:10   Unique)
 &rst
  ixpk= 409, iat=  -1,1665, r1= 0.00, r2= 1.80, r3= 4.20, r4= 4.95,
 igr1=1659,1660,1661,
 &end
#
#    0 AMB  10-2:410     88 ALA  HN          4.50    (#    410:10   Single Ambig)
 &rst
  ixpk= 410, iat=  -1,1420, r1= 0.00, r2= 1.80, r3= 6.36, r4= 7.11,
 igr1= 179, 180, 181, 183, 184, 185,1440,1441,
 &end
#
#   89 ILE  HB           88 ALA  HN          4.50    (#    411:10   Unique)
 &rst
  ixpk= 411, iat=1434,1420, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:412     88 ALA  HN          4.50    (#    412:10   Single Ambig)
 &rst
  ixpk= 412, iat=  -1,1420, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1440,1441, 177,
 &end
#
#   54 TYR  HB-          88 ALA  HN          6.00    (#    413:10   Unique)
 &rst
  ixpk= 413, iat=  -1,1420, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 847, 848,
 &end
#
#  165 ILE  HB          165 ILE  HN          3.50    (#    414:10   Unique)
 &rst
  ixpk= 414, iat=2625,2621, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:415    165 ILE  HN          3.50    (#    415:10   Single Ambig)
 &rst
  ixpk= 415, iat=  -1,2621, r1= 0.00, r2= 1.80, r3= 4.41, r4= 5.16,
 igr1=2609,2610,2603,2604,
 &end
#
#  165 ILE  HG1+        165 ILE  HN          3.50    (#    416:10   Unique)
 &rst
  ixpk= 416, iat=  -1,2621, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2631,2632,
 &end
#
#  165 ILE  HG1-        165 ILE  HN          3.50    (#    417:10   Unique)
 &rst
  ixpk= 417, iat=  -1,2621, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2631,2632,
 &end
#
#    0 AMB  10-2:418    165 ILE  HN          3.50    (#    418:10   Single Ambig)
 &rst
  ixpk= 418, iat=  -1,2621, r1= 0.00, r2= 1.80, r3= 4.72, r4= 5.47,
 igr1=2589,2590,2591,2627,2628,2629,
 &end
#
#  165 ILE  MD1         165 ILE  HN          4.50    (#    419:10   Unique)
 &rst
  ixpk= 419, iat=  -1,2621, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=2634,2635,2636,
 &end
#
#  113 ILE  MD1         134 TYR  HN          4.50    (#    420:10   Unique)
 &rst
  ixpk= 420, iat=  -1,2116, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=1828,1829,1830,
 &end
#
#  111 LEU  HN          134 TYR  HN          4.50    (#    421:10   Unique)
 &rst
  ixpk= 421, iat=1777,2116, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  113 ILE  HN          134 TYR  HN          4.50    (#    422:10   Unique)
 &rst
  ixpk= 422, iat=1815,2116, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  111 LEU  HN          112 ILE  HN          4.50    (#    424:10   Preassigned)
 &rst
  ixpk= 424, iat=1777,1796, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   12 LEU  HN           11 PHE  HN          4.50    (#    425:10   Unique)
 &rst
  ixpk= 425, iat= 170, 150, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   48 VAL  HN           11 PHE  HN          4.50    (#    426:10   Unique)
 &rst
  ixpk= 426, iat= 754, 150, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   18 SER  HG           19 LEU  HN          4.50    (#    428:10   Unique)
 &rst
  ixpk= 428, iat= 265, 269, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  104 ARG  HN          103 ALA  HN          4.50    (#    429:10   Unique)
 &rst
  ixpk= 429, iat=1665,1655, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  111 LEU  HN          110 VAL  HN          4.50    (#    430:10   Unique)
 &rst
  ixpk= 430, iat=1777,1761, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   10 VAL  HN          110 VAL  HN          4.50    (#    432:10   Unique)
 &rst
  ixpk= 432, iat= 134,1761, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   20 GLN  HN           19 LEU  HN          4.50    (#    433:10   Unique)
 &rst
  ixpk= 433, iat= 288, 269, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    8 ASP  HN          110 VAL  HN          6.00    (#    434:10   Unique)
 &rst
  ixpk= 434, iat= 103,1761, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   16 SER  HG           19 LEU  HN          6.00    (#    435:10   Unique)
 &rst
  ixpk= 435, iat= 235, 269, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  10-2:436    110 VAL  HN          6.00    (#    436:10   Single Ambig)
 &rst
  ixpk= 436, iat=  -1,1761, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1739,2073,
 &end
#
#   59 ASP  HN           62 ASP  HN          4.50    (#    437:10   Unique)
 &rst
  ixpk= 437, iat= 935, 978, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  146 GLU  HN          148 GLN  HN          6.00    (#    438:10   Unique)
 &rst
  ixpk= 438, iat=2320,2346, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   42 SER  HN           43 TYR  HN          3.50    (#    439:10   Unique)
 &rst
  ixpk= 439, iat= 665, 676, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   63 TYR  HN           62 ASP  HN          3.50    (#    440:10   Unique)
 &rst
  ixpk= 440, iat= 990, 978, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   44 GLN  HN           43 TYR  HN          4.50    (#    443:10   Unique)
 &rst
  ixpk= 443, iat= 697, 676, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   49 GLN  HN           48 VAL  HN          6.00    (#    446:10   Unique)
 &rst
  ixpk= 446, iat= 770, 754, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   11 PHE  HN           48 VAL  HN          4.50    (#    447:10   Unique)
 &rst
  ixpk= 447, iat= 150, 754, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   51 SER  HN           55 LYS  HN          6.00    (#    448:10   Unique)
 &rst
  ixpk= 448, iat= 807, 864, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  10-2:449     55 LYS  HN          4.50    (#    449:10   Single Ambig)
 &rst
  ixpk= 449, iat=  -1, 864, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 886, 900,
 &end
#
#  110 VAL  HN           10 VAL  HN          4.50    (#    451:10   Unique)
 &rst
  ixpk= 451, iat=1761, 134, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:453     10 VAL  HN          4.50    (#    453:10   Single Ambig)
 &rst
  ixpk= 453, iat=  -1, 134, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 115, 103,
 &end
#
#   13 PHE  HN           50 PHE  HN          4.50    (#    454:10   Unique)
 &rst
  ixpk= 454, iat= 189, 787, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   15 GLY  HN           50 PHE  HN          4.50    (#    457:10   Unique)
 &rst
  ixpk= 457, iat= 221, 787, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   86 PHE  HN          121 ASP  HN          6.00    (#    458:10   Unique)
 &rst
  ixpk= 458, iat=1393,1925, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  120 THR  HN          121 ASP  HN          3.50    (#    459:10   Unique)
 &rst
  ixpk= 459, iat=1911,1925, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   53 SER  HN           52 THR  HN          3.50    (#    460:10   Unique)
 &rst
  ixpk= 460, iat= 832, 818, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   85 THR  HN          121 ASP  HN          4.50    (#    461:10   Unique)
 &rst
  ixpk= 461, iat=1379,1925, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:463     52 THR  HN          4.50    (#    463:10   Single Ambig)
 &rst
  ixpk= 463, iat=  -1, 818, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 807,1294,
 &end
#
#   83 THR  HN          121 ASP  HN          6.00    (#    464:10   Unique)
 &rst
  ixpk= 464, iat=1351,1925, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  10-2:467     13 PHE  HN          4.50    (#    467:10   Single Ambig)
 &rst
  ixpk= 467, iat=  -1, 189, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 787, 770,
 &end
#
#  120 THR  HN          119 ALA  HN          4.50    (#    468:10   Unique)
 &rst
  ixpk= 468, iat=1911,1901, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   63 TYR  HN           59 ASP  HN          6.00    (#    469:10   Unique)
 &rst
  ixpk= 469, iat= 990, 935, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   62 ASP  HN           59 ASP  HN          4.50    (#    471:10   Unique)
 &rst
  ixpk= 471, iat= 978, 935, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  118 GLU  HN          119 ALA  HN          4.50    (#    472:10   Unique)
 &rst
  ixpk= 472, iat=1886,1901, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  115 THR  HN          138 ILE  HN          4.50    (#    474:10   Unique)
 &rst
  ixpk= 474, iat=1853,2182, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:475    138 ILE  HN          4.50    (#    475:10   Single Ambig)
 &rst
  ixpk= 475, iat=  -1,2182, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2175,2208,
 &end
#
#    0 AMB  10-2:476     91 TYR  HN          4.50    (#    476:10   Single Ambig)
 &rst
  ixpk= 476, iat=  -1,1463, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 853, 858,1471,1480,
 &end
#
#   87 GLY  HN           86 PHE  HN          3.50    (#    477:10   Unique)
 &rst
  ixpk= 477, iat=1413,1393, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  121 ASP  HN           86 PHE  HN          6.00    (#    478:10   Unique)
 &rst
  ixpk= 478, iat=1925,1393, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   29 ASP  HN           30 PHE  HN          3.50    (#    479:10   Unique)
 &rst
  ixpk= 479, iat= 443, 455, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   77 LYS  HN           76 VAL  HN          4.50    (#    480:10   Unique)
 &rst
  ixpk= 480, iat=1236,1220, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  104 ARG  HN          107 ALA  HN          6.00    (#    481:10   Unique)
 &rst
  ixpk= 481, iat=1665,1715, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   20 GLN  HN           23 GLU  HN          4.50    (#    482:10   Unique)
 &rst
  ixpk= 482, iat= 288, 331, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:483    107 ALA  HN          4.50    (#    483:10   Single Ambig)
 &rst
  ixpk= 483, iat=  -1,1715, r1= 0.00, r2= 1.80, r3= 5.40, r4= 6.15,
 igr1=  82,  83,1678,
 &end
#
#   22 ASP  HN           23 GLU  HN          3.50    (#    484:10   Preassigned)
 &rst
  ixpk= 484, iat= 319, 331, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   29 ASP  HN           27 ILE  HN          4.50    (#    485:10   Unique)
 &rst
  ixpk= 485, iat= 443, 405, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   75 HIS  HN           76 VAL  HN          4.50    (#    486:10   Unique)
 &rst
  ixpk= 486, iat=1203,1220, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    8 ASP  HN          107 ALA  HN          6.00    (#    487:10   Unique)
 &rst
  ixpk= 487, iat= 103,1715, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  106 ASP  HN          107 ALA  HN          3.50    (#    488:10   Unique)
 &rst
  ixpk= 488, iat=1703,1715, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  187 GLU  HN          186 ILE  HN          3.50    (#    489:10   Unique)
 &rst
  ixpk= 489, iat=3018,2999, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  130 ASP  HN          131 ILE  HN          3.50    (#    490:10   Unique)
 &rst
  ixpk= 490, iat=2042,2054, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  156 SER  HN          155 ALA  HN          4.50    (#    491:10   Unique)
 &rst
  ixpk= 491, iat=2480,2470, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   16 SER  HN           81 LEU  HN          6.00    (#    492:10   Unique)
 &rst
  ixpk= 492, iat= 228,1313, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   17 MET  HN           81 LEU  HN          4.50    (#    494:10   Unique)
 &rst
  ixpk= 494, iat= 239,1313, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   80 LEU  HN           81 LEU  HN          3.50    (#    496:10   Unique)
 &rst
  ixpk= 496, iat=1294,1313, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  176 PHE  HN          175 LEU  HN          3.50    (#    497:10   Unique)
 &rst
  ixpk= 497, iat=2814,2795, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   59 ASP  HN           63 TYR  HN          6.00    (#    498:10   Unique)
 &rst
  ixpk= 498, iat= 935, 990, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   64 VAL  HN           63 TYR  HN          3.50    (#    500:10   Unique)
 &rst
  ixpk= 500, iat=1011, 990, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   62 ASP  HN           63 TYR  HN          3.50    (#    501:10   Unique)
 &rst
  ixpk= 501, iat= 978, 990, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  180 GLN  HN          178 GLU  HN          4.50    (#    502:10   Unique)
 &rst
  ixpk= 502, iat=2882,2848, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   75 HIS  HN           74 LYS  HN          4.50    (#    503:10   Unique)
 &rst
  ixpk= 503, iat=1203,1181, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  180 GLN  HN          179 LEU  HN          3.50    (#    504:10   Unique)
 &rst
  ixpk= 504, iat=2882,2863, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  114 ILE  HN          115 THR  HN          6.00    (#    508:10   Unique)
 &rst
  ixpk= 508, iat=1834,1853, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  137 GLY  HN          115 THR  HN          6.00    (#    509:10   Unique)
 &rst
  ixpk= 509, iat=2175,1853, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  116 ASP  HN          115 THR  HN          6.00    (#    510:10   Unique)
 &rst
  ixpk= 510, iat=1867,1853, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  138 ILE  HN          115 THR  HN          4.50    (#    511:10   Unique)
 &rst
  ixpk= 511, iat=2182,1853, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   87 GLY  HN           85 THR  HN          6.00    (#    512:10   Unique)
 &rst
  ixpk= 512, iat=1413,1379, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  126 ASP  HN          127 ALA  HN          3.50    (#    513:10   Unique)
 &rst
  ixpk= 513, iat=1988,2000, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   86 PHE  HN           85 THR  HN          4.50    (#    514:10   Preassigned)
 &rst
  ixpk= 514, iat=1393,1379, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    8 ASP  HN          108 THR  HN          3.50    (#    515:10   Unique)
 &rst
  ixpk= 515, iat= 103,1725, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   95 GLU  HN           92 VAL  HN          6.00    (#    516:10   Unique)
 &rst
  ixpk= 516, iat=1524,1484, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  121 ASP  HN           85 THR  HN          4.50    (#    517:10   Unique)
 &rst
  ixpk= 517, iat=1925,1379, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:519    124 ASN  HN          4.50    (#    519:10   Single Ambig)
 &rst
  ixpk= 519, iat=  -1,1955, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=1969,1988,
 &end
#
#   29 ASP  HN           28 LEU  HN          3.50    (#    521:10   Unique)
 &rst
  ixpk= 521, iat= 443, 424, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    5 GLY  HN            6 ASN  HN          4.50    (#    522:10   Unique)
 &rst
  ixpk= 522, iat=  66,  73, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   36 LYS  HN           37 LYS  HN          3.50    (#    524:10   Unique)
 &rst
  ixpk= 524, iat= 563, 585, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   38 LEU  HN           37 LYS  HN          3.50    (#    525:10   Unique)
 &rst
  ixpk= 525, iat= 607, 585, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  160 SER  HN          161 GLU  HN          3.50    (#    526:10   Unique)
 &rst
  ixpk= 526, iat=2537,2548, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   87 GLY  HN           89 ILE  HN          6.00    (#    527:10   Unique)
 &rst
  ixpk= 527, iat=1413,1430, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  140 LYS  HN          141 HIS  HN          4.50    (#    531:10   Unique)
 &rst
  ixpk= 531, iat=2208,2230, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  141 HIS  HN          140 LYS  HN          4.50    (#    532:10   Unique)
 &rst
  ixpk= 532, iat=2230,2208, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  133 ARG  HN          156 SER  HN          4.50    (#    533:10   Unique)
 &rst
  ixpk= 533, iat=2092,2480, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   53 SER  HN           54 TYR  HN          4.50    (#    534:10   Unique)
 &rst
  ixpk= 534, iat= 832, 843, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   55 LYS  HN           54 TYR  HN          4.50    (#    537:10   Unique)
 &rst
  ixpk= 537, iat= 864, 843, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   51 SER  HN           54 TYR  HN          6.00    (#    538:10   Unique)
 &rst
  ixpk= 538, iat= 807, 843, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  139 GLY  HN          140 LYS  HN          4.50    (#    539:10   Unique)
 &rst
  ixpk= 539, iat=2201,2208, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   36 LYS  HN           38 LEU  HN          4.50    (#    541:10   Unique)
 &rst
  ixpk= 541, iat= 563, 607, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  134 TYR  HD          134 TYR  HN          4.50    (#    542:10   Unique)
 &rst
  ixpk= 542, iat=  -1,2116, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2124,2133,
 &end
#
#  162 PHE  HD          134 TYR  HN          6.00    (#    543:10   Unique)
 &rst
  ixpk= 543, iat=  -1,2116, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2571,2579,
 &end
#
#  134 TYR  HA          134 TYR  HN          3.50    (#    544:10   Preassigned)
 &rst
  ixpk= 544, iat=2118,2116, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:545    134 TYR  HN          3.50    (#    545:10   Single Ambig)
 &rst
  ixpk= 545, iat=  -1,2116, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2094,1798,
 &end
#
#   46 ALA  HN           11 PHE  HN          4.50    (#    546:10   Unique)
 &rst
  ixpk= 546, iat= 734, 150, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   11 PHE  HD          112 ILE  HN          4.50    (#    547:10   Unique)
 &rst
  ixpk= 547, iat=  -1,1796, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 158, 166,
 &end
#
#   11 PHE  HD           11 PHE  HN          3.50    (#    548:10   Unique)
 &rst
  ixpk= 548, iat=  -1, 150, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 158, 166,
 &end
#
#    0 AMB  10-2:549     11 PHE  HN          4.50    (#    549:10   Single Ambig)
 &rst
  ixpk= 549, iat=  -1, 150, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 160, 164, 927, 162,
 &end
#
#   47 ALA  HA           11 PHE  HN          3.50    (#    550:10   Unique)
 &rst
  ixpk= 550, iat= 746, 150, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:551    112 ILE  HN          3.50    (#    551:10   Single Ambig)
 &rst
  ixpk= 551, iat=  -1,1796, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1779, 152,
 &end
#
#   11 PHE  HA           11 PHE  HN          3.50    (#    552:10   Unique)
 &rst
  ixpk= 552, iat= 152, 150, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  112 ILE  HA          112 ILE  HN          4.50    (#    553:10   Unique)
 &rst
  ixpk= 553, iat=1798,1796, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  102 GLY  HN          103 ALA  HN          3.50    (#    555:10   Unique)
 &rst
  ixpk= 555, iat=1648,1655, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   97 PHE  HZ          110 VAL  HN          4.50    (#    558:10   Unique)
 &rst
  ixpk= 558, iat=1567,1761, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#  134 TYR  HD          135 ILE  HN          4.50    (#    559:10   Unique)
 &rst
  ixpk= 559, iat=  -1,2137, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2124,2133,
 &end
#
#  101 LEU  HN          103 ALA  HN          3.50    (#    560:10   Unique)
 &rst
  ixpk= 560, iat=1629,1655, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  162 PHE  HD          135 ILE  HN          6.00    (#    562:10   Unique)
 &rst
  ixpk= 562, iat=  -1,2137, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=2571,2579,
 &end
#
#  134 TYR  HA          135 ILE  HN          3.50    (#    563:10   Unique)
 &rst
  ixpk= 563, iat=2118,2137, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    9 LEU  HA          110 VAL  HN          3.50    (#    564:10   Unique)
 &rst
  ixpk= 564, iat= 117,1761, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#  135 ILE  HA          135 ILE  HN          4.50    (#    565:10   Unique)
 &rst
  ixpk= 565, iat=2139,2137, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:566    110 VAL  HN          6.00    (#    566:10   Single Ambig)
 &rst
  ixpk= 566, iat=  -1,1761, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1=1729,2056,
 &end
#
#    0 AMB  10-2:567    148 GLN  HN          3.50    (#    567:10   Single Ambig)
 &rst
  ixpk= 567, iat=  -1,2346, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2335,2363,
 &end
#
#   45 PHE  HZ           43 TYR  HN          6.00    (#    569:10   Unique)
 &rst
  ixpk= 569, iat= 726, 676, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  10-2:570     43 TYR  HN          6.00    (#    570:10   Single Ambig)
 &rst
  ixpk= 570, iat=  -1, 676, r1= 0.00, r2= 1.80, r3= 7.56, r4= 8.31,
 igr1= 686, 691, 709, 710,
 &end
#
#    0 AMB  10-2:571    148 GLN  HN          4.50    (#    571:10   Single Ambig)
 &rst
  ixpk= 571, iat=  -1,2346, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2342,2249,
 &end
#
#   43 TYR  HA           43 TYR  HN          3.50    (#    572:10   Unique)
 &rst
  ixpk= 572, iat= 678, 676, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#    0 AMB  10-2:573     48 VAL  HN          4.50    (#    573:10   Single Ambig)
 &rst
  ixpk= 573, iat=  -1, 754, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 744, 915,
 &end
#
#   11 PHE  HD           48 VAL  HN          6.00    (#    574:10   Unique)
 &rst
  ixpk= 574, iat=  -1, 754, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 158, 166,
 &end
#
#    0 AMB  10-2:575     48 VAL  HN          4.50    (#    575:10   Single Ambig)
 &rst
  ixpk= 575, iat=  -1, 754, r1= 0.00, r2= 1.80, r3= 5.67, r4= 6.42,
 igr1= 197, 205, 199, 203,
 &end
#
#  142 PHE  HD          148 GLN  HN          4.50    (#    576:10   Unique)
 &rst
  ixpk= 576, iat=  -1,2346, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1=2255,2263,
 &end
#
#   54 TYR  HD           55 LYS  HN          4.50    (#    577:10   Unique)
 &rst
  ixpk= 577, iat=  -1, 864, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 851, 860,
 &end
#
#   12 LEU  HA           48 VAL  HN          3.50    (#    578:10   Unique)
 &rst
  ixpk= 578, iat= 172, 754, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   47 ALA  HA           48 VAL  HN          3.50    (#    579:10   Unique)
 &rst
  ixpk= 579, iat= 746, 754, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   97 PHE  HZ           10 VAL  HN          4.50    (#    580:10   Unique)
 &rst
  ixpk= 580, iat=1567, 134, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   54 TYR  HN           55 LYS  HN          4.50    (#    581:10   Unique)
 &rst
  ixpk= 581, iat= 843, 864, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   50 PHE  HA           55 LYS  HN          4.50    (#    582:10   Unique)
 &rst
  ixpk= 582, iat= 789, 864, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:583     10 VAL  HN          3.50    (#    583:10   Single Ambig)
 &rst
  ixpk= 583, iat=  -1, 134, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 117,1779,
 &end
#
#   54 TYR  HA           55 LYS  HN          3.50    (#    584:10   Unique)
 &rst
  ixpk= 584, iat= 845, 864, r1= 0.00, r2= 1.80, r3= 3.50, r4= 4.25,  &end
#
#   49 GLN  HE2+         50 PHE  HN          6.00    (#    585:10   Unique)
 &rst
  ixpk= 585, iat=  -1, 787, r1= 0.00, r2= 1.80, r3= 6.73, r4= 7.48,
 igr1= 782, 783,
 &end
#
#    0 AMB  10-2:586     50 PHE  HN          4.50    (#    586:10   Single Ambig)
 &rst
  ixpk= 586, iat=  -1, 787, r1= 0.00, r2= 1.80, r3= 6.07, r4= 6.82,
 igr1= 197, 205, 199, 203, 201, 799,
 &end
#
#   50 PHE  HD           50 PHE  HN          3.50    (#    588:10   Unique)
 &rst
  ixpk= 588, iat=  -1, 787, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1= 795, 803,
 &end
#
#   12 LEU  HA           50 PHE  HN          6.00    (#    590:10   Unique)
 &rst
  ixpk= 590, iat= 172, 787, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  10-2:591     50 PHE  HN          4.50    (#    591:10   Single Ambig)
 &rst
  ixpk= 591, iat=  -1, 787, r1= 0.00, r2= 1.80, r3= 5.05, r4= 5.80,
 igr1= 789, 814,
 &end
#
#   54 TYR  HA           50 PHE  HN          6.00    (#    592:10   Unique)
 &rst
  ixpk= 592, iat= 845, 787, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#  122 SER  HN          121 ASP  HN          4.50    (#    594:10   Unique)
 &rst
  ixpk= 594, iat=1937,1925, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#   82 LEU  HN           52 THR  HN          4.50    (#    595:10   Unique)
 &rst
  ixpk= 595, iat=1332, 818, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:596    187 GLU  HN          3.50    (#    596:10   Single Ambig)
 &rst
  ixpk= 596, iat=  -1,3018, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=2999,3033,
 &end
#
#  123 GLY  HN          121 ASP  HN          6.00    (#    597:10   Unique)
 &rst
  ixpk= 597, iat=1948,1925, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   51 SER  HG           52 THR  HN          4.50    (#    598:10   Unique)
 &rst
  ixpk= 598, iat= 814, 818, r1= 0.00, r2= 1.80, r3= 4.50, r4= 5.25,  &end
#
#    0 AMB  10-2:599    121 ASP  HN          3.50    (#    599:10   Single Ambig)
 &rst
  ixpk= 599, iat=  -1,1925, r1= 0.00, r2= 1.80, r3= 3.93, r4= 4.68,
 igr1=1367,1903,
 &end
#
#   81 LEU  HN           52 THR  HN          6.00    (#    600:10   Unique)
 &rst
  ixpk= 600, iat=1313, 818, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#   14 ASP  HN           13 PHE  HN          6.00    (#    601:10   Unique)
 &rst
  ixpk= 601, iat= 209, 189, r1= 0.00, r2= 1.80, r3= 6.00, r4= 6.75,  &end
#
#    0 AMB  10-2:602     20 GLN  HN          6.00    (#    602:10   Single Ambig)
 &rst
  ixpk= 602, iat=  -1, 288, r1= 0.00, r2= 1.80, r