NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
476082 |
2rop   |
11041 | cing | 1-original | 1 | AMBER | distance | NOE | simple |
#
# 10 GLU HN 10 GLU HB2 3.72 (#peak 355)
&rst
ixpk= 355, nxpk= 0, iat= 129, 133, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
rk2=32.0, rk3=32.0, ir6=1, ialtd=0,
&end
#
# 10 GLU HN 10 GLU HB3 3.72 (#peak 356)
&rst
ixpk= 356, nxpk= 0, iat= 129, 134, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 10 GLU HN 10 GLU QG 5.85 (#peak 193)
&rst
ixpk= 193, nxpk= 0, iat= 129, -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr2= 136, 137,
&end
#
# 10 GLU HN 11 THR HN 3.90 (#peak 1118)
&rst
ixpk= 1118, nxpk= 0, iat= 129, 144, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 10 GLU HB2 11 THR HN 4.89 (#peak 1119)
&rst
ixpk= 1119, nxpk= 0, iat= 133, 144, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 10 GLU HB3 11 THR HN 4.13 (#peak 1120)
&rst
ixpk= 1120, nxpk= 0, iat= 134, 144, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 10 GLU QG 11 THR HA 5.03 (#peak 2454)
&rst
ixpk= 2454, nxpk= 0, iat= -1, 146, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1= 136, 137,
&end
#
# 11 THR HN 11 THR QG2 3.79 (#peak 1363)
&rst
ixpk= 1363, nxpk= 0, iat= 144, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2= 150, 151, 152,
&end
#
# 11 THR HA 11 THR QG2 3.56 (#peak 2367)
&rst
ixpk= 2367, nxpk= 0, iat= 146, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2= 150, 151, 152,
&end
#
# 11 THR HB 12 LEU QD1 5.61 (#peak 1534)
&rst
ixpk= 1534, nxpk= 0, iat= 148, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr2= 167, 168, 169,
&end
#
# 11 THR QG2 12 LEU HN 3.94 (#peak 261)
&rst
ixpk= 261, nxpk= 0, iat= -1, 158, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1= 150, 151, 152,
&end
#
# 11 THR QG2 12 LEU HG 3.14 (#peak 1361)
&rst
ixpk= 1361, nxpk= 0, iat= -1, 165, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr1= 150, 151, 152,
&end
#
# 11 THR QG2 12 LEU QD1 2.40 (#peak 1632)
&rst
ixpk= 1632, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
igr1= 150, 151, 152,
igr2= 167, 168, 169,
&end
#
# 11 THR QG2 13 GLY HN 6.03 (#peak 1394)
&rst
ixpk= 1394, nxpk= 0, iat= -1, 177, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr1= 150, 151, 152,
&end
#
# 12 LEU HN 12 LEU HG 2.74 (#peak 260)
&rst
ixpk= 260, nxpk= 0, iat= 158, 165, r1= 1.30, r2= 1.80, r3= 2.74, r4= 3.24, &end
#
# 12 LEU HN 12 LEU QB 3.98 (#peak 1808)
&rst
ixpk= 1808, nxpk= 0, iat= 158, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2= 162, 163,
&end
#
# 12 LEU HN 12 LEU QD2 3.75 (#peak 265)
&rst
ixpk= 265, nxpk= 0, iat= 158, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 171, 172, 173,
&end
#
# 12 LEU HN 13 GLY HN 3.67 (#peak 1390)
&rst
ixpk= 1390, nxpk= 0, iat= 158, 177, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 12 LEU HA 12 LEU HG 3.63 (#peak 820)
&rst
ixpk= 820, nxpk= 0, iat= 160, 165, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 12 LEU HA 12 LEU QD2 4.59 (#peak 1203)
&rst
ixpk= 1203, nxpk= 0, iat= 160, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2= 171, 172, 173,
&end
#
# 12 LEU HG 13 GLY HN 3.60 (#peak 1712)
&rst
ixpk= 1712, nxpk= 0, iat= 165, 177, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 12 LEU QB 12 LEU QD2 3.07 (#peak 1574)
&rst
ixpk= 1574, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr1= 162, 163,
igr2= 171, 172, 173,
&end
#
# 12 LEU QB 13 GLY HN 3.85 (#peak 1715)
&rst
ixpk= 1715, nxpk= 0, iat= -1, 177, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr1= 162, 163,
&end
#
# 12 LEU QD2 13 GLY HN 4.43 (#peak 1393)
&rst
ixpk= 1393, nxpk= 0, iat= -1, 177, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 171, 172, 173,
&end
#
# 13 GLY HN 13 GLY HA3 2.79 (#peak 1392)
&rst
ixpk= 1392, nxpk= 0, iat= 177, 180, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29, &end
#
# 18 HIS HB2 19 VAL HN 4.36 (#peak 1505)
&rst
ixpk= 1505, nxpk= 0, iat= 240, 253, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 18 HIS HB3 19 VAL HN 4.33 (#peak 1506)
&rst
ixpk= 1506, nxpk= 0, iat= 241, 253, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 18 HIS HD2 19 VAL HN 5.14 (#peak 1706)
&rst
ixpk= 1706, nxpk= 0, iat= 249, 253, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 19 VAL HN 19 VAL HB 3.78 (#peak 1152)
&rst
ixpk= 1152, nxpk= 0, iat= 253, 257, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 19 VAL HN 19 VAL QG1 3.86 (#peak 1686)
&rst
ixpk= 1686, nxpk= 0, iat= 253, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2= 259, 260, 261,
&end
#
# 19 VAL HN 19 VAL QG2 3.80 (#peak 1709)
&rst
ixpk= 1709, nxpk= 0, iat= 253, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2= 263, 264, 265,
&end
#
# 19 VAL HN 20 VAL HN 4.53 (#peak 856)
&rst
ixpk= 856, nxpk= 0, iat= 253, 269, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 19 VAL HN 65 ASP HA 6.25 (#peak 857)
&rst
ixpk= 857, nxpk= 0, iat= 253, 984, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 19 VAL HA 19 VAL QG1 3.33 (#peak 1688)
&rst
ixpk= 1688, nxpk= 0, iat= 255, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2= 259, 260, 261,
&end
#
# 19 VAL HA 19 VAL QG2 3.71 (#peak 1556)
&rst
ixpk= 1556, nxpk= 0, iat= 255, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 263, 264, 265,
&end
#
# 19 VAL HA 65 ASP HA 4.69 (#peak 274)
&rst
ixpk= 274, nxpk= 0, iat= 255, 984, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 19 VAL HB 20 VAL HN 4.11 (#peak 1151)
&rst
ixpk= 1151, nxpk= 0, iat= 257, 269, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 19 VAL HB 64 TYR HN 5.27 (#peak 367)
&rst
ixpk= 367, nxpk= 0, iat= 257, 961, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 19 VAL HB 65 ASP HA 6.25 (#peak 2960)
&rst
ixpk= 2960, nxpk= 0, iat= 257, 984, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 19 VAL QG1 20 VAL HN 3.70 (#peak 1685)
&rst
ixpk= 1685, nxpk= 0, iat= -1, 269, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1= 259, 260, 261,
&end
#
# 19 VAL QG1 49 GLN HE21 4.86 (#peak 2043)
&rst
ixpk= 2043, nxpk= 0, iat= -1, 733, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 259, 260, 261,
&end
#
# 19 VAL QG1 49 GLN HE22 4.48 (#peak 1298)
&rst
ixpk= 1298, nxpk= 0, iat= -1, 734, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1= 259, 260, 261,
&end
#
# 19 VAL QG1 63 LYS HA 3.73 (#peak 1958)
&rst
ixpk= 1958, nxpk= 0, iat= -1, 941, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 259, 260, 261,
&end
#
# 19 VAL QG1 63 LYS HB3 4.43 (#peak 2967)
&rst
ixpk= 2967, nxpk= 0, iat= -1, 944, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 259, 260, 261,
&end
#
# 19 VAL QG1 63 LYS QG 5.09 (#peak 993)
&rst
ixpk= 993, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr1= 259, 260, 261,
igr2= 946, 947,
&end
#
# 19 VAL QG1 64 TYR HN 4.27 (#peak 1412)
&rst
ixpk= 1412, nxpk= 0, iat= -1, 961, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 259, 260, 261,
&end
#
# 19 VAL QG1 65 ASP HA 4.35 (#peak 1687)
&rst
ixpk= 1687, nxpk= 0, iat= -1, 984, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 259, 260, 261,
&end
#
# 19 VAL QG1 65 ASP QB 6.25 (#peak 1753)
&rst
ixpk= 1753, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.43, r4= 8.93,
igr1= 259, 260, 261,
igr2= 986, 987,
&end
#
# 19 VAL QG2 20 VAL HN 4.22 (#peak 1552)
&rst
ixpk= 1552, nxpk= 0, iat= -1, 269, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 263, 264, 265,
&end
#
# 19 VAL QG2 63 LYS HA 5.02 (#peak 1554)
&rst
ixpk= 1554, nxpk= 0, iat= -1, 941, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1= 263, 264, 265,
&end
#
# 19 VAL QG2 63 LYS HB3 4.08 (#peak 1164)
&rst
ixpk= 1164, nxpk= 0, iat= -1, 944, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1= 263, 264, 265,
&end
#
# 19 VAL QG2 64 TYR HN 4.97 (#peak 1551)
&rst
ixpk= 1551, nxpk= 0, iat= -1, 961, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 263, 264, 265,
&end
#
# 19 VAL QG2 65 ASP HA 5.40 (#peak 1555)
&rst
ixpk= 1555, nxpk= 0, iat= -1, 984, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1= 263, 264, 265,
&end
#
# 20 VAL HN 20 VAL HB 4.21 (#peak 1128)
&rst
ixpk= 1128, nxpk= 0, iat= 269, 273, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 20 VAL HN 20 VAL QG1 4.39 (#peak 1380)
&rst
ixpk= 1380, nxpk= 0, iat= 269, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2= 275, 276, 277,
&end
#
# 20 VAL HN 20 VAL QG2 3.66 (#peak 1713)
&rst
ixpk= 1713, nxpk= 0, iat= 269, -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr2= 279, 280, 281,
&end
#
# 20 VAL HN 63 LYS HA 5.94 (#peak 221)
&rst
ixpk= 221, nxpk= 0, iat= 269, 941, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 20 VAL HN 64 TYR HN 5.32 (#peak 232)
&rst
ixpk= 232, nxpk= 0, iat= 269, 961, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 20 VAL HN 64 TYR QD 5.09 (#peak 1503)
&rst
ixpk= 1503, nxpk= 0, iat= 269, -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
igr2= 969, 978,
&end
#
# 20 VAL HN 65 ASP HA 4.83 (#peak 209)
&rst
ixpk= 209, nxpk= 0, iat= 269, 984, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 20 VAL HN 66 PRO QD 5.24 (#peak 220)
&rst
ixpk= 220, nxpk= 0, iat= 269, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2= 995, 996,
&end
#
# 20 VAL HA 20 VAL QG1 3.73 (#peak 1349)
&rst
ixpk= 1349, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2= 275, 276, 277,
&end
#
# 20 VAL HA 20 VAL QG2 3.41 (#peak 1569)
&rst
ixpk= 1569, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2= 279, 280, 281,
&end
#
# 20 VAL HA 21 THR HN 2.93 (#peak 743)
&rst
ixpk= 743, nxpk= 0, iat= 271, 285, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43, &end
#
# 20 VAL HA 21 THR HA 6.10 (#peak 2576)
&rst
ixpk= 2576, nxpk= 0, iat= 271, 287, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60, &end
#
# 20 VAL HA 21 THR QG2 5.15 (#peak 1635)
&rst
ixpk= 1635, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr2= 291, 292, 293,
&end
#
# 20 VAL HB 21 THR HN 4.45 (#peak 1124)
&rst
ixpk= 1124, nxpk= 0, iat= 273, 285, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 20 VAL HB 64 TYR HN 5.51 (#peak 1123)
&rst
ixpk= 1123, nxpk= 0, iat= 273, 961, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 20 VAL HB 64 TYR QD 5.57 (#peak 2820)
&rst
ixpk= 2820, nxpk= 0, iat= 273, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr2= 969, 978,
&end
#
# 20 VAL HB 66 PRO QG 5.27 (#peak 3101)
&rst
ixpk= 3101, nxpk= 0, iat= 273, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2= 998, 999,
&end
#
# 20 VAL QG1 21 THR HN 3.47 (#peak 1656)
&rst
ixpk= 1656, nxpk= 0, iat= -1, 285, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr1= 275, 276, 277,
&end
#
# 20 VAL QG1 21 THR HA 5.63 (#peak 1348)
&rst
ixpk= 1348, nxpk= 0, iat= -1, 287, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1= 275, 276, 277,
&end
#
# 20 VAL QG1 64 TYR QD 5.36 (#peak 1347)
&rst
ixpk= 1347, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr1= 275, 276, 277,
igr2= 969, 978,
&end
#
# 20 VAL QG1 66 PRO HA 6.25 (#peak 3099)
&rst
ixpk= 3099, nxpk= 0, iat= -1,1004, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1= 275, 276, 277,
&end
#
# 20 VAL QG2 21 THR HN 4.26 (#peak 1563)
&rst
ixpk= 1563, nxpk= 0, iat= -1, 285, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1= 279, 280, 281,
&end
#
# 20 VAL QG2 22 LEU HA 5.38 (#peak 1568)
&rst
ixpk= 1568, nxpk= 0, iat= -1, 301, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1= 279, 280, 281,
&end
#
# 20 VAL QG2 63 LYS HA 5.84 (#peak 1566)
&rst
ixpk= 1566, nxpk= 0, iat= -1, 941, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1= 279, 280, 281,
&end
#
# 20 VAL QG2 64 TYR HN 5.48 (#peak 1561)
&rst
ixpk= 1561, nxpk= 0, iat= -1, 961, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 279, 280, 281,
&end
#
# 20 VAL QG2 64 TYR QD 4.14 (#peak 1565)
&rst
ixpk= 1565, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 279, 280, 281,
igr2= 969, 978,
&end
#
# 20 VAL QG2 65 ASP HA 4.48 (#peak 1567)
&rst
ixpk= 1567, nxpk= 0, iat= -1, 984, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1= 279, 280, 281,
&end
#
# 20 VAL QG2 66 PRO HA 5.21 (#peak 3100)
&rst
ixpk= 3100, nxpk= 0, iat= -1,1004, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1= 279, 280, 281,
&end
#
# 20 VAL QG2 66 PRO QB 4.02 (#peak 1719)
&rst
ixpk= 1719, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 279, 280, 281,
igr2=1001,1002,
&end
#
# 20 VAL QG2 66 PRO QD 3.93 (#peak 1570)
&rst
ixpk= 1570, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 279, 280, 281,
igr2= 995, 996,
&end
#
# 20 VAL QG2 66 PRO QG 3.07 (#peak 1573)
&rst
ixpk= 1573, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr1= 279, 280, 281,
igr2= 998, 999,
&end
#
# 21 THR HN 21 THR HB 3.54 (#peak 41)
&rst
ixpk= 41, nxpk= 0, iat= 285, 289, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 21 THR HN 21 THR QG2 4.10 (#peak 1647)
&rst
ixpk= 1647, nxpk= 0, iat= 285, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr2= 291, 292, 293,
&end
#
# 21 THR HN 22 LEU HN 6.17 (#peak 49)
&rst
ixpk= 49, nxpk= 0, iat= 285, 299, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67, &end
#
# 21 THR HN 64 TYR QD 6.02 (#peak 1502)
&rst
ixpk= 1502, nxpk= 0, iat= 285, -1, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr2= 969, 978,
&end
#
# 21 THR HA 21 THR QG2 3.31 (#peak 1649)
&rst
ixpk= 1649, nxpk= 0, iat= 287, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2= 291, 292, 293,
&end
#
# 21 THR HA 22 LEU HN 3.46 (#peak 217)
&rst
ixpk= 217, nxpk= 0, iat= 287, 299, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 21 THR HA 22 LEU HA 5.75 (#peak 2394)
&rst
ixpk= 2394, nxpk= 0, iat= 287, 301, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 21 THR HA 22 LEU HB2 5.54 (#peak 679)
&rst
ixpk= 679, nxpk= 0, iat= 287, 303, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 21 THR HA 22 LEU HB3 6.15 (#peak 1218)
&rst
ixpk= 1218, nxpk= 0, iat= 287, 304, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 21 THR HA 63 LYS HA 4.35 (#peak 493)
&rst
ixpk= 493, nxpk= 0, iat= 287, 941, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 21 THR HA 64 TYR QD 6.25 (#peak 2391)
&rst
ixpk= 2391, nxpk= 0, iat= 287, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2= 969, 978,
&end
#
# 21 THR HB 22 LEU HN 4.99 (#peak 39)
&rst
ixpk= 39, nxpk= 0, iat= 289, 299, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 21 THR HB 22 LEU HA 4.44 (#peak 43)
&rst
ixpk= 43, nxpk= 0, iat= 289, 301, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 21 THR HB 61 GLN HE22 6.25 (#peak 1280)
&rst
ixpk= 1280, nxpk= 0, iat= 289, 919, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 21 THR QG2 22 LEU HN 3.60 (#peak 1646)
&rst
ixpk= 1646, nxpk= 0, iat= -1, 299, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr1= 291, 292, 293,
&end
#
# 21 THR QG2 61 GLN HA 5.11 (#peak 360)
&rst
ixpk= 360, nxpk= 0, iat= -1, 908, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1= 291, 292, 293,
&end
#
# 21 THR QG2 61 GLN HE21 4.25 (#peak 1291)
&rst
ixpk= 1291, nxpk= 0, iat= -1, 918, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 291, 292, 293,
&end
#
# 21 THR QG2 61 GLN HE22 4.17 (#peak 1650)
&rst
ixpk= 1650, nxpk= 0, iat= -1, 919, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1= 291, 292, 293,
&end
#
# 21 THR QG2 61 GLN HG2 3.79 (#peak 2807)
&rst
ixpk= 2807, nxpk= 0, iat= -1, 913, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1= 291, 292, 293,
&end
#
# 21 THR QG2 61 GLN HG3 3.95 (#peak 2815)
&rst
ixpk= 2815, nxpk= 0, iat= -1, 914, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1= 291, 292, 293,
&end
#
# 21 THR QG2 61 GLN QB 5.44 (#peak 348)
&rst
ixpk= 348, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 291, 292, 293,
igr2= 910, 911,
&end
#
# 22 LEU HN 22 LEU HG 5.31 (#peak 1509)
&rst
ixpk= 1509, nxpk= 0, iat= 299, 306, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 22 LEU HN 22 LEU QD1 4.93 (#peak 884)
&rst
ixpk= 884, nxpk= 0, iat= 299, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2= 308, 309, 310,
&end
#
# 22 LEU HN 22 LEU QD2 5.39 (#peak 1191)
&rst
ixpk= 1191, nxpk= 0, iat= 299, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2= 312, 313, 314,
&end
#
# 22 LEU HN 23 GLN HN 6.07 (#peak 1512)
&rst
ixpk= 1512, nxpk= 0, iat= 299, 318, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57, &end
#
# 22 LEU HN 62 VAL HN 5.09 (#peak 1513)
&rst
ixpk= 1513, nxpk= 0, iat= 299, 923, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 22 LEU HN 63 LYS HA 5.30 (#peak 51)
&rst
ixpk= 51, nxpk= 0, iat= 299, 941, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 22 LEU HN 64 TYR QD 5.29 (#peak 50)
&rst
ixpk= 50, nxpk= 0, iat= 299, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2= 969, 978,
&end
#
# 22 LEU HA 22 LEU QD1 4.45 (#peak 888)
&rst
ixpk= 888, nxpk= 0, iat= 301, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2= 308, 309, 310,
&end
#
# 22 LEU HA 22 LEU QD2 3.99 (#peak 1194)
&rst
ixpk= 1194, nxpk= 0, iat= 301, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2= 312, 313, 314,
&end
#
# 22 LEU HA 23 GLN HN 3.06 (#peak 586)
&rst
ixpk= 586, nxpk= 0, iat= 301, 318, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, &end
#
# 22 LEU HA 23 GLN HA 5.09 (#peak 570)
&rst
ixpk= 570, nxpk= 0, iat= 301, 320, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 22 LEU HA 23 GLN HB3 5.78 (#peak 435)
&rst
ixpk= 435, nxpk= 0, iat= 301, 323, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 22 LEU HA 23 GLN HE21 5.60 (#peak 1527)
&rst
ixpk= 1527, nxpk= 0, iat= 301, 330, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 22 LEU HB2 22 LEU QD1 3.88 (#peak 890)
&rst
ixpk= 890, nxpk= 0, iat= 303, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 308, 309, 310,
&end
#
# 22 LEU HB2 23 GLN HN 5.04 (#peak 670)
&rst
ixpk= 670, nxpk= 0, iat= 303, 318, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 22 LEU HB2 62 VAL QG1 4.91 (#peak 1163)
&rst
ixpk= 1163, nxpk= 0, iat= 303, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 929, 930, 931,
&end
#
# 22 LEU HB2 64 TYR QD 4.86 (#peak 1212)
&rst
ixpk= 1212, nxpk= 0, iat= 303, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2= 969, 978,
&end
#
# 22 LEU HB2 64 TYR QE 4.49 (#peak 672)
&rst
ixpk= 672, nxpk= 0, iat= 303, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 971, 976,
&end
#
# 22 LEU HB3 22 LEU QD1 4.20 (#peak 685)
&rst
ixpk= 685, nxpk= 0, iat= 304, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 308, 309, 310,
&end
#
# 22 LEU HB3 22 LEU QD2 4.18 (#peak 683)
&rst
ixpk= 683, nxpk= 0, iat= 304, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2= 312, 313, 314,
&end
#
# 22 LEU HB3 23 GLN HN 4.94 (#peak 686)
&rst
ixpk= 686, nxpk= 0, iat= 304, 318, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 22 LEU HB3 62 VAL HN 5.81 (#peak 1671)
&rst
ixpk= 1671, nxpk= 0, iat= 304, 923, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 22 LEU HB3 62 VAL QG1 5.13 (#peak 1221)
&rst
ixpk= 1221, nxpk= 0, iat= 304, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2= 929, 930, 931,
&end
#
# 22 LEU HB3 64 TYR QD 4.79 (#peak 1217)
&rst
ixpk= 1217, nxpk= 0, iat= 304, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2= 969, 978,
&end
#
# 22 LEU HB3 64 TYR QE 4.46 (#peak 684)
&rst
ixpk= 684, nxpk= 0, iat= 304, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2= 971, 976,
&end
#
# 22 LEU HG 23 GLN HN 4.63 (#peak 181)
&rst
ixpk= 181, nxpk= 0, iat= 306, 318, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 22 LEU HG 62 VAL HN 5.84 (#peak 1672)
&rst
ixpk= 1672, nxpk= 0, iat= 306, 923, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 22 LEU HG 62 VAL QG1 4.20 (#peak 807)
&rst
ixpk= 807, nxpk= 0, iat= 306, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 929, 930, 931,
&end
#
# 22 LEU HG 64 TYR QD 5.70 (#peak 806)
&rst
ixpk= 806, nxpk= 0, iat= 306, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2= 969, 978,
&end
#
# 22 LEU QD1 23 GLN HN 5.61 (#peak 885)
&rst
ixpk= 885, nxpk= 0, iat= -1, 318, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 308, 309, 310,
&end
#
# 22 LEU QD1 62 VAL HB 4.53 (#peak 2723)
&rst
ixpk= 2723, nxpk= 0, iat= -1, 927, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1= 308, 309, 310,
&end
#
# 22 LEU QD1 62 VAL QG1 3.57 (#peak 892)
&rst
ixpk= 892, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr1= 308, 309, 310,
igr2= 929, 930, 931,
&end
#
# 22 LEU QD1 64 TYR QD 4.21 (#peak 886)
&rst
ixpk= 886, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1= 308, 309, 310,
igr2= 969, 978,
&end
#
# 22 LEU QD2 23 GLN HN 3.50 (#peak 1584)
&rst
ixpk= 1584, nxpk= 0, iat= -1, 318, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1= 312, 313, 314,
&end
#
# 22 LEU QD2 23 GLN HA 5.44 (#peak 419)
&rst
ixpk= 419, nxpk= 0, iat= -1, 320, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 312, 313, 314,
&end
#
# 22 LEU QD2 23 GLN HB3 6.25 (#peak 436)
&rst
ixpk= 436, nxpk= 0, iat= -1, 323, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1= 312, 313, 314,
&end
#
# 22 LEU QD2 75 GLN HA 5.63 (#peak 1916)
&rst
ixpk= 1916, nxpk= 0, iat= -1,1116, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1= 312, 313, 314,
&end
#
# 22 LEU QD2 94 ALA HN 5.90 (#peak 1948)
&rst
ixpk= 1948, nxpk= 0, iat= -1,1398, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr1= 312, 313, 314,
&end
#
# 23 GLN HN 23 GLN HB2 3.84 (#peak 175)
&rst
ixpk= 175, nxpk= 0, iat= 318, 322, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 23 GLN HN 23 GLN HB3 4.00 (#peak 1287)
&rst
ixpk= 1287, nxpk= 0, iat= 318, 323, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 23 GLN HN 23 GLN HG2 4.72 (#peak 180)
&rst
ixpk= 180, nxpk= 0, iat= 318, 325, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 23 GLN HN 24 LEU HN 5.10 (#peak 391)
&rst
ixpk= 391, nxpk= 0, iat= 318, 335, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 23 GLN HA 23 GLN HE21 5.53 (#peak 1528)
&rst
ixpk= 1528, nxpk= 0, iat= 320, 330, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 23 GLN HA 24 LEU HN 3.34 (#peak 563)
&rst
ixpk= 563, nxpk= 0, iat= 320, 335, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 23 GLN HA 24 LEU HB2 6.25 (#peak 1479)
&rst
ixpk= 1479, nxpk= 0, iat= 320, 339, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 23 GLN HA 61 GLN HA 5.06 (#peak 3044)
&rst
ixpk= 3044, nxpk= 0, iat= 320, 908, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 23 GLN HA 61 GLN HE21 5.63 (#peak 1689)
&rst
ixpk= 1689, nxpk= 0, iat= 320, 918, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 23 GLN HA 61 GLN HE22 5.52 (#peak 1690)
&rst
ixpk= 1690, nxpk= 0, iat= 320, 919, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 23 GLN HA 62 VAL HN 5.11 (#peak 105)
&rst
ixpk= 105, nxpk= 0, iat= 320, 923, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 23 GLN HB2 23 GLN HE22 5.46 (#peak 1272)
&rst
ixpk= 1272, nxpk= 0, iat= 322, 331, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 23 GLN HB2 24 LEU HN 4.32 (#peak 431)
&rst
ixpk= 431, nxpk= 0, iat= 322, 335, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 23 GLN HB3 23 GLN HE22 5.49 (#peak 1308)
&rst
ixpk= 1308, nxpk= 0, iat= 323, 331, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 23 GLN HB3 24 LEU HN 4.89 (#peak 433)
&rst
ixpk= 433, nxpk= 0, iat= 323, 335, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 23 GLN HE21 59 THR QG2 5.21 (#peak 1289)
&rst
ixpk= 1289, nxpk= 0, iat= 330, -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr2= 888, 889, 890,
&end
#
# 23 GLN HE21 61 GLN HA 5.07 (#peak 1682)
&rst
ixpk= 1682, nxpk= 0, iat= 330, 908, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 23 GLN HE22 59 THR QG2 4.74 (#peak 1274)
&rst
ixpk= 1274, nxpk= 0, iat= 331, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2= 888, 889, 890,
&end
#
# 23 GLN HG2 23 GLN HE21 3.96 (#peak 1288)
&rst
ixpk= 1288, nxpk= 0, iat= 325, 330, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 23 GLN HG2 23 GLN HE22 3.99 (#peak 1525)
&rst
ixpk= 1525, nxpk= 0, iat= 325, 331, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 23 GLN HG2 24 LEU HN 4.68 (#peak 418)
&rst
ixpk= 418, nxpk= 0, iat= 325, 335, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 23 GLN HG2 59 THR QG2 5.03 (#peak 2839)
&rst
ixpk= 2839, nxpk= 0, iat= 325, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2= 888, 889, 890,
&end
#
# 23 GLN HG3 24 LEU HN 5.47 (#peak 2844)
&rst
ixpk= 2844, nxpk= 0, iat= 326, 335, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 24 LEU HN 24 LEU HB2 4.06 (#peak 785)
&rst
ixpk= 785, nxpk= 0, iat= 335, 339, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 24 LEU HN 24 LEU QD1 4.47 (#peak 947)
&rst
ixpk= 947, nxpk= 0, iat= 335, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2= 344, 345, 346,
&end
#
# 24 LEU HN 25 ARG HN 6.14 (#peak 1540)
&rst
ixpk= 1540, nxpk= 0, iat= 335, 354, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64, &end
#
# 24 LEU HN 60 ALA QB 4.87 (#peak 1532)
&rst
ixpk= 1532, nxpk= 0, iat= 335, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2= 900, 901, 902,
&end
#
# 24 LEU HN 61 GLN HA 5.02 (#peak 1529)
&rst
ixpk= 1529, nxpk= 0, iat= 335, 908, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 24 LEU HN 62 VAL HN 6.14 (#peak 403)
&rst
ixpk= 403, nxpk= 0, iat= 335, 923, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64, &end
#
# 24 LEU HA 24 LEU QD1 4.33 (#peak 1466)
&rst
ixpk= 1466, nxpk= 0, iat= 337, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2= 344, 345, 346,
&end
#
# 24 LEU HA 25 ARG HN 2.87 (#peak 645)
&rst
ixpk= 645, nxpk= 0, iat= 337, 354, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37, &end
#
# 24 LEU HA 59 THR HA 6.25 (#peak 2688)
&rst
ixpk= 2688, nxpk= 0, iat= 337, 884, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 24 LEU HA 59 THR HB 5.85 (#peak 9)
&rst
ixpk= 9, nxpk= 0, iat= 337, 886, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 24 LEU HA 59 THR QG2 3.81 (#peak 1449)
&rst
ixpk= 1449, nxpk= 0, iat= 337, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2= 888, 889, 890,
&end
#
# 24 LEU HA 90 LEU QQD 5.41 (#peak 1026)
&rst
ixpk= 1026, nxpk= 0, iat= 337, -1, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr2=1359,1360,1361,1355,1356,1357,
&end
#
# 24 LEU HB2 25 ARG HN 4.82 (#peak 720)
&rst
ixpk= 720, nxpk= 0, iat= 339, 354, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 24 LEU HB3 25 ARG HN 4.22 (#peak 772)
&rst
ixpk= 772, nxpk= 0, iat= 340, 354, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 24 LEU HB3 25 ARG HA 5.79 (#peak 722)
&rst
ixpk= 722, nxpk= 0, iat= 340, 356, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 24 LEU HB3 89 SER HN 5.44 (#peak 400)
&rst
ixpk= 400, nxpk= 0, iat= 340,1335, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 24 LEU QD1 25 ARG HN 5.31 (#peak 1531)
&rst
ixpk= 1531, nxpk= 0, iat= -1, 354, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1= 344, 345, 346,
&end
#
# 24 LEU QD1 60 ALA HN 5.68 (#peak 1535)
&rst
ixpk= 1535, nxpk= 0, iat= -1, 896, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1= 344, 345, 346,
&end
#
# 24 LEU QD1 61 GLN HA 5.53 (#peak 359)
&rst
ixpk= 359, nxpk= 0, iat= -1, 908, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1= 344, 345, 346,
&end
#
# 24 LEU QD1 62 VAL HN 5.43 (#peak 1670)
&rst
ixpk= 1670, nxpk= 0, iat= -1, 923, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 344, 345, 346,
&end
#
# 24 LEU QD1 89 SER HN 5.26 (#peak 402)
&rst
ixpk= 402, nxpk= 0, iat= -1,1335, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1= 344, 345, 346,
&end
#
# 24 LEU QD2 25 ARG HN 4.87 (#peak 1534)
&rst
ixpk= 1534, nxpk= 0, iat= -1, 354, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1= 348, 349, 350,
&end
#
# 24 LEU QD2 60 ALA HN 5.02 (#peak 1757)
&rst
ixpk= 1757, nxpk= 0, iat= -1, 896, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1= 348, 349, 350,
&end
#
# 25 ARG HN 25 ARG HD3 6.25 (#peak 1631)
&rst
ixpk= 1631, nxpk= 0, iat= 354, 365, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 25 ARG HN 25 ARG QG 4.77 (#peak 383)
&rst
ixpk= 383, nxpk= 0, iat= 354, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr2= 361, 362,
&end
#
# 25 ARG HN 59 THR HA 6.25 (#peak 406)
&rst
ixpk= 406, nxpk= 0, iat= 354, 884, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 25 ARG HN 89 SER HN 5.21 (#peak 393)
&rst
ixpk= 393, nxpk= 0, iat= 354,1335, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 25 ARG HN 89 SER HB2 5.10 (#peak 1546)
&rst
ixpk= 1546, nxpk= 0, iat= 354,1339, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 25 ARG HN 89 SER HB3 5.07 (#peak 1545)
&rst
ixpk= 1545, nxpk= 0, iat= 354,1340, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 25 ARG HN 90 LEU HA 5.28 (#peak 1645)
&rst
ixpk= 1645, nxpk= 0, iat= 354,1348, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 25 ARG HN 90 LEU QQD 5.68 (#peak 3104)
&rst
ixpk= 3104, nxpk= 0, iat= 354, -1, r1= 1.30, r2= 1.80, r3= 7.66, r4= 8.16,
igr2=1359,1360,1361,1355,1356,1357,
&end
#
# 25 ARG HA 25 ARG HD2 4.62 (#peak 805)
&rst
ixpk= 805, nxpk= 0, iat= 356, 364, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 25 ARG HA 26 ILE HN 3.42 (#peak 501)
&rst
ixpk= 501, nxpk= 0, iat= 356, 378, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 25 ARG HA 26 ILE HB 6.01 (#peak 2095)
&rst
ixpk= 2095, nxpk= 0, iat= 356, 382, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 25 ARG HA 26 ILE HG12 6.22 (#peak 826)
&rst
ixpk= 826, nxpk= 0, iat= 356, 388, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72, &end
#
# 25 ARG HA 26 ILE HG13 5.39 (#peak 1431)
&rst
ixpk= 1431, nxpk= 0, iat= 356, 389, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 25 ARG HA 26 ILE QD1 5.53 (#peak 2293)
&rst
ixpk= 2293, nxpk= 0, iat= 356, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2= 391, 392, 393,
&end
#
# 25 ARG HA 59 THR HA 4.11 (#peak 320)
&rst
ixpk= 320, nxpk= 0, iat= 356, 884, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 25 ARG HA 59 THR HB 5.31 (#peak 1015)
&rst
ixpk= 1015, nxpk= 0, iat= 356, 886, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 25 ARG HA 59 THR QG2 4.67 (#peak 283)
&rst
ixpk= 283, nxpk= 0, iat= 356, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 888, 889, 890,
&end
#
# 25 ARG HA 60 ALA HN 4.96 (#peak 500)
&rst
ixpk= 500, nxpk= 0, iat= 356, 896, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 25 ARG HA 60 ALA QB 4.44 (#peak 504)
&rst
ixpk= 504, nxpk= 0, iat= 356, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2= 900, 901, 902,
&end
#
# 25 ARG HB2 26 ILE HN 4.84 (#peak 279)
&rst
ixpk= 279, nxpk= 0, iat= 358, 378, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 25 ARG HB2 89 SER HN 4.97 (#peak 1668)
&rst
ixpk= 1668, nxpk= 0, iat= 358,1335, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 25 ARG HB3 25 ARG HD2 3.65 (#peak 1673)
&rst
ixpk= 1673, nxpk= 0, iat= 359, 364, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 25 ARG HB3 26 ILE HN 4.55 (#peak 280)
&rst
ixpk= 280, nxpk= 0, iat= 359, 378, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 25 ARG HB3 59 THR QG2 4.67 (#peak 235)
&rst
ixpk= 235, nxpk= 0, iat= 359, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 888, 889, 890,
&end
#
# 25 ARG HB3 89 SER HN 4.52 (#peak 399)
&rst
ixpk= 399, nxpk= 0, iat= 359,1335, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 25 ARG HD2 26 ILE HN 5.49 (#peak 804)
&rst
ixpk= 804, nxpk= 0, iat= 364, 378, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 25 ARG HD2 60 ALA QB 5.86 (#peak 819)
&rst
ixpk= 819, nxpk= 0, iat= 364, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2= 900, 901, 902,
&end
#
# 25 ARG HD2 89 SER HN 6.25 (#peak 1666)
&rst
ixpk= 1666, nxpk= 0, iat= 364,1335, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 25 ARG HD3 26 ILE HN 4.79 (#peak 1630)
&rst
ixpk= 1630, nxpk= 0, iat= 365, 378, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 25 ARG HD3 29 MET QE 4.82 (#peak 3082)
&rst
ixpk= 3082, nxpk= 0, iat= 365, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2= 427, 428, 429,
&end
#
# 25 ARG QG 26 ILE HN 4.69 (#peak 303)
&rst
ixpk= 303, nxpk= 0, iat= -1, 378, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 361, 362,
&end
#
# 25 ARG QG 89 SER HN 5.48 (#peak 1669)
&rst
ixpk= 1669, nxpk= 0, iat= -1,1335, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1= 361, 362,
&end
#
# 26 ILE HN 26 ILE HG12 6.16 (#peak 829)
&rst
ixpk= 829, nxpk= 0, iat= 378, 388, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66, &end
#
# 26 ILE HN 26 ILE HG13 5.85 (#peak 304)
&rst
ixpk= 304, nxpk= 0, iat= 378, 389, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 26 ILE HN 26 ILE QD1 4.49 (#peak 1861)
&rst
ixpk= 1861, nxpk= 0, iat= 378, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 391, 392, 393,
&end
#
# 26 ILE HN 26 ILE QG2 4.66 (#peak 305)
&rst
ixpk= 305, nxpk= 0, iat= 378, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2= 384, 385, 386,
&end
#
# 26 ILE HN 29 MET QE 4.99 (#peak 3086)
&rst
ixpk= 3086, nxpk= 0, iat= 378, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 427, 428, 429,
&end
#
# 26 ILE HN 59 THR HA 4.14 (#peak 274)
&rst
ixpk= 274, nxpk= 0, iat= 378, 884, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 26 ILE HN 60 ALA HN 5.49 (#peak 578)
&rst
ixpk= 578, nxpk= 0, iat= 378, 896, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 26 ILE HN 60 ALA QB 4.99 (#peak 281)
&rst
ixpk= 281, nxpk= 0, iat= 378, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 900, 901, 902,
&end
#
# 26 ILE HN 90 LEU QQD 6.25 (#peak 1024)
&rst
ixpk= 1024, nxpk= 0, iat= 378, -1, r1= 1.30, r2= 1.80, r3= 8.43, r4= 8.93,
igr2=1359,1360,1361,1355,1356,1357,
&end
#
# 26 ILE HA 26 ILE QD1 4.63 (#peak 1855)
&rst
ixpk= 1855, nxpk= 0, iat= 380, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2= 391, 392, 393,
&end
#
# 26 ILE HA 26 ILE QG2 3.31 (#peak 1802)
&rst
ixpk= 1802, nxpk= 0, iat= 380, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2= 384, 385, 386,
&end
#
# 26 ILE HA 27 ASP HB3 5.27 (#peak 796)
&rst
ixpk= 796, nxpk= 0, iat= 380, 402, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 26 ILE HA 88 VAL HA 4.14 (#peak 2568)
&rst
ixpk= 2568, nxpk= 0, iat= 380,1321, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 26 ILE HA 89 SER HN 4.92 (#peak 396)
&rst
ixpk= 396, nxpk= 0, iat= 380,1335, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 26 ILE HB 27 ASP HN 5.37 (#peak 1548)
&rst
ixpk= 1548, nxpk= 0, iat= 382, 397, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 26 ILE HB 27 ASP HA 6.11 (#peak 472)
&rst
ixpk= 472, nxpk= 0, iat= 382, 399, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61, &end
#
# 26 ILE HG12 27 ASP HN 6.25 (#peak 825)
&rst
ixpk= 825, nxpk= 0, iat= 388, 397, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 26 ILE HG12 60 ALA HN 5.97 (#peak 828)
&rst
ixpk= 828, nxpk= 0, iat= 388, 896, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 26 ILE HG13 27 ASP HN 5.24 (#peak 1547)
&rst
ixpk= 1547, nxpk= 0, iat= 389, 397, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 26 ILE HG13 29 MET QE 2.57 (#peak 3060)
&rst
ixpk= 3060, nxpk= 0, iat= 389, -1, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,
igr2= 427, 428, 429,
&end
#
# 26 ILE QD1 27 ASP HN 5.47 (#peak 1550)
&rst
ixpk= 1550, nxpk= 0, iat= -1, 397, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr1= 391, 392, 393,
&end
#
# 26 ILE QD1 38 ILE QD1 3.95 (#peak 2295)
&rst
ixpk= 2295, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 391, 392, 393,
igr2= 567, 568, 569,
&end
#
# 26 ILE QD1 60 ALA HN 5.44 (#peak 2291)
&rst
ixpk= 2291, nxpk= 0, iat= -1, 896, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 391, 392, 393,
&end
#
# 26 ILE QD1 86 PHE QD 6.21 (#peak 2296)
&rst
ixpk= 2296, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.37, r4= 8.87,
igr1= 391, 392, 393,
igr2=1285,1293,
&end
#
# 26 ILE QD1 88 VAL QG1 4.44 (#peak 3273)
&rst
ixpk= 3273, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1= 391, 392, 393,
igr2=1325,1326,1327,
&end
#
# 26 ILE QG2 26 ILE HG13 3.34 (#peak 1786)
&rst
ixpk= 1786, nxpk= 0, iat= -1, 389, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr1= 384, 385, 386,
&end
#
# 26 ILE QG2 27 ASP HN 4.39 (#peak 1984)
&rst
ixpk= 1984, nxpk= 0, iat= -1, 397, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr1= 384, 385, 386,
&end
#
# 26 ILE QG2 27 ASP HA 5.45 (#peak 465)
&rst
ixpk= 465, nxpk= 0, iat= -1, 399, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr1= 384, 385, 386,
&end
#
# 26 ILE QG2 27 ASP HB2 6.19 (#peak 1612)
&rst
ixpk= 1612, nxpk= 0, iat= -1, 401, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
igr1= 384, 385, 386,
&end
#
# 26 ILE QG2 27 ASP HB3 5.94 (#peak 1619)
&rst
ixpk= 1619, nxpk= 0, iat= -1, 402, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1= 384, 385, 386,
&end
#
# 26 ILE QG2 28 GLY HN 6.11 (#peak 1425)
&rst
ixpk= 1425, nxpk= 0, iat= -1, 409, r1= 1.30, r2= 1.80, r3= 7.34, r4= 7.84,
igr1= 384, 385, 386,
&end
#
# 26 ILE QG2 29 MET QE 3.35 (#peak 3059)
&rst
ixpk= 3059, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 384, 385, 386,
igr2= 427, 428, 429,
&end
#
# 26 ILE QG2 38 ILE QD1 4.06 (#peak 1993)
&rst
ixpk= 1993, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 384, 385, 386,
igr2= 567, 568, 569,
&end
#
# 26 ILE QG2 79 GLU HA 5.18 (#peak 2662)
&rst
ixpk= 2662, nxpk= 0, iat= -1,1186, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1= 384, 385, 386,
&end
#
# 26 ILE QG2 86 PHE HN 5.68 (#peak 561)
&rst
ixpk= 561, nxpk= 0, iat= -1,1277, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1= 384, 385, 386,
&end
#
# 26 ILE QG2 86 PHE HA 4.50 (#peak 3097)
&rst
ixpk= 3097, nxpk= 0, iat= -1,1279, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 384, 385, 386,
&end
#
# 26 ILE QG2 86 PHE HB2 4.64 (#peak 2380)
&rst
ixpk= 2380, nxpk= 0, iat= -1,1281, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 384, 385, 386,
&end
#
# 26 ILE QG2 86 PHE HB3 5.29 (#peak 1988)
&rst
ixpk= 1988, nxpk= 0, iat= -1,1282, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 384, 385, 386,
&end
#
# 26 ILE QG2 86 PHE QD 3.97 (#peak 1801)
&rst
ixpk= 1801, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1= 384, 385, 386,
igr2=1285,1293,
&end
#
# 26 ILE QG2 87 LYS HN 4.31 (#peak 422)
&rst
ixpk= 422, nxpk= 0, iat= -1,1297, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 384, 385, 386,
&end
#
# 26 ILE QG2 88 VAL HA 4.70 (#peak 2521)
&rst
ixpk= 2521, nxpk= 0, iat= -1,1321, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1= 384, 385, 386,
&end
#
# 27 ASP HN 27 ASP HB3 4.02 (#peak 791)
&rst
ixpk= 791, nxpk= 0, iat= 397, 402, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 27 ASP HN 86 PHE QD 6.25 (#peak 1552)
&rst
ixpk= 1552, nxpk= 0, iat= 397, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=1285,1293,
&end
#
# 27 ASP HN 87 LYS HN 5.28 (#peak 152)
&rst
ixpk= 152, nxpk= 0, iat= 397,1297, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 27 ASP HN 87 LYS HA 6.25 (#peak 140)
&rst
ixpk= 140, nxpk= 0, iat= 397,1299, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 27 ASP HN 87 LYS HB2 5.19 (#peak 1559)
&rst
ixpk= 1559, nxpk= 0, iat= 397,1301, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 27 ASP HN 87 LYS HB3 5.21 (#peak 1080)
&rst
ixpk= 1080, nxpk= 0, iat= 397,1302, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 27 ASP HN 87 LYS HG3 6.25 (#peak 1110)
&rst
ixpk= 1110, nxpk= 0, iat= 397,1305, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 27 ASP HN 88 VAL HA 4.89 (#peak 1554)
&rst
ixpk= 1554, nxpk= 0, iat= 397,1321, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 27 ASP HN 89 SER HN 5.89 (#peak 1553)
&rst
ixpk= 1553, nxpk= 0, iat= 397,1335, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 27 ASP HA 28 GLY HA2 4.77 (#peak 464)
&rst
ixpk= 464, nxpk= 0, iat= 399, 411, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 27 ASP HA 28 GLY HA3 6.06 (#peak 469)
&rst
ixpk= 469, nxpk= 0, iat= 399, 412, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56, &end
#
# 27 ASP HB2 28 GLY HN 4.62 (#peak 1422)
&rst
ixpk= 1422, nxpk= 0, iat= 401, 409, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 27 ASP HB2 28 GLY HA2 6.07 (#peak 1608)
&rst
ixpk= 1608, nxpk= 0, iat= 401, 411, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57, &end
#
# 27 ASP HB2 28 GLY HA3 6.25 (#peak 1609)
&rst
ixpk= 1609, nxpk= 0, iat= 401, 412, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 27 ASP HB2 87 LYS HN 4.47 (#peak 1665)
&rst
ixpk= 1665, nxpk= 0, iat= 401,1297, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 27 ASP HB2 87 LYS HB2 5.56 (#peak 3183)
&rst
ixpk= 3183, nxpk= 0, iat= 401,1301, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06, &end
#
# 27 ASP HB2 87 LYS HB3 4.40 (#peak 1611)
&rst
ixpk= 1611, nxpk= 0, iat= 401,1302, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 27 ASP HB2 87 LYS HG3 5.29 (#peak 1604)
&rst
ixpk= 1604, nxpk= 0, iat= 401,1305, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 27 ASP HB3 28 GLY HN 4.67 (#peak 792)
&rst
ixpk= 792, nxpk= 0, iat= 402, 409, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 27 ASP HB3 87 LYS HN 4.85 (#peak 1666)
&rst
ixpk= 1666, nxpk= 0, iat= 402,1297, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 27 ASP HB3 87 LYS HB2 5.23 (#peak 3182)
&rst
ixpk= 3182, nxpk= 0, iat= 402,1301, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 27 ASP HB3 87 LYS HB3 4.04 (#peak 795)
&rst
ixpk= 795, nxpk= 0, iat= 402,1302, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 27 ASP HB3 87 LYS HG2 5.10 (#peak 1109)
&rst
ixpk= 1109, nxpk= 0, iat= 402,1304, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 27 ASP HB3 87 LYS HG3 5.20 (#peak 1620)
&rst
ixpk= 1620, nxpk= 0, iat= 402,1305, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 27 ASP HB3 87 LYS QD 4.90 (#peak 1402)
&rst
ixpk= 1402, nxpk= 0, iat= 402, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=1307,1308,
&end
#
# 28 GLY HN 29 MET HN 4.27 (#peak 692)
&rst
ixpk= 692, nxpk= 0, iat= 409, 416, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 28 GLY HN 29 MET HB2 6.25 (#peak 1424)
&rst
ixpk= 1424, nxpk= 0, iat= 409, 420, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 28 GLY HN 86 PHE QD 5.39 (#peak 1560)
&rst
ixpk= 1560, nxpk= 0, iat= 409, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=1285,1293,
&end
#
# 28 GLY HA2 86 PHE HA 6.01 (#peak 107)
&rst
ixpk= 107, nxpk= 0, iat= 411,1279, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 28 GLY HA3 86 PHE QD 5.65 (#peak 1438)
&rst
ixpk= 1438, nxpk= 0, iat= 412, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2=1285,1293,
&end
#
# 28 GLY HA3 87 LYS HN 6.25 (#peak 1663)
&rst
ixpk= 1663, nxpk= 0, iat= 412,1297, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 29 MET HN 29 MET QE 4.57 (#peak 3054)
&rst
ixpk= 3054, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 427, 428, 429,
&end
#
# 29 MET HN 29 MET QG 5.24 (#peak 695)
&rst
ixpk= 695, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2= 423, 424,
&end
#
# 29 MET HN 86 PHE QD 4.77 (#peak 693)
&rst
ixpk= 693, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr2=1285,1293,
&end
#
# 29 MET HB2 29 MET QE 3.25 (#peak 3056)
&rst
ixpk= 3056, nxpk= 0, iat= 420, -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
igr2= 427, 428, 429,
&end
#
# 29 MET HB3 29 MET QE 2.77 (#peak 3058)
&rst
ixpk= 3058, nxpk= 0, iat= 421, -1, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
igr2= 427, 428, 429,
&end
#
# 29 MET HB3 34 CYS HN 5.87 (#peak 1759)
&rst
ixpk= 1759, nxpk= 0, iat= 421, 494, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 29 MET QE 35 VAL QG1 4.82 (#peak 3061)
&rst
ixpk= 3061, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr1= 427, 428, 429,
igr2= 511, 512, 513,
&end
#
# 29 MET QE 38 ILE QD1 4.25 (#peak 3055)
&rst
ixpk= 3055, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1= 427, 428, 429,
igr2= 567, 568, 569,
&end
#
# 29 MET QE 55 LEU HN 5.46 (#peak 3091)
&rst
ixpk= 3091, nxpk= 0, iat= -1, 812, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1= 427, 428, 429,
&end
#
# 29 MET QE 55 LEU HA 4.53 (#peak 3148)
&rst
ixpk= 3148, nxpk= 0, iat= -1, 814, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1= 427, 428, 429,
&end
#
# 29 MET QE 58 LYS HN 5.14 (#peak 3093)
&rst
ixpk= 3093, nxpk= 0, iat= -1, 860, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 427, 428, 429,
&end
#
# 29 MET QE 58 LYS HA 4.23 (#peak 3123)
&rst
ixpk= 3123, nxpk= 0, iat= -1, 862, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 427, 428, 429,
&end
#
# 29 MET QE 59 THR HN 4.69 (#peak 3116)
&rst
ixpk= 3116, nxpk= 0, iat= -1, 882, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 427, 428, 429,
&end
#
# 29 MET QE 60 ALA QB 4.24 (#peak 3277)
&rst
ixpk= 3277, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 427, 428, 429,
igr2= 900, 901, 902,
&end
#
# 29 MET QG 29 MET QE 2.91 (#peak 3057)
&rst
ixpk= 3057, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr1= 423, 424,
igr2= 427, 428, 429,
&end
#
# 31 CYS HN 33 SER HN 6.25 (#peak 2070)
&rst
ixpk= 2070, nxpk= 0, iat= 450, 483, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 31 CYS HN 34 CYS HN 5.38 (#peak 1683)
&rst
ixpk= 1683, nxpk= 0, iat= 450, 494, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 31 CYS HN 55 LEU QQD 6.24 (#peak 2066)
&rst
ixpk= 2066, nxpk= 0, iat= 450, -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
igr2= 825, 826, 827, 821, 822, 823,
&end
#
# 31 CYS HN 86 PHE QD 6.25 (#peak 2068)
&rst
ixpk= 2068, nxpk= 0, iat= 450, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=1285,1293,
&end
#
# 32 LYS HA 33 SER HN 3.57 (#peak 1908)
&rst
ixpk= 1908, nxpk= 0, iat= 463, 483, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 32 LYS HA 35 VAL HB 5.23 (#peak 190)
&rst
ixpk= 190, nxpk= 0, iat= 463, 509, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 32 LYS HD2 33 SER HN 5.36 (#peak 1569)
&rst
ixpk= 1569, nxpk= 0, iat= 471, 483, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 32 LYS HD2 35 VAL HN 5.70 (#peak 1764)
&rst
ixpk= 1764, nxpk= 0, iat= 471, 505, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 32 LYS QB 33 SER HN 5.00 (#peak 1567)
&rst
ixpk= 1567, nxpk= 0, iat= -1, 483, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 465, 466,
&end
#
# 32 LYS QB 34 CYS HN 5.80 (#peak 1761)
&rst
ixpk= 1761, nxpk= 0, iat= -1, 494, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1= 465, 466,
&end
#
# 32 LYS QB 35 VAL HN 5.34 (#peak 1763)
&rst
ixpk= 1763, nxpk= 0, iat= -1, 505, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 465, 466,
&end
#
# 32 LYS QG 33 SER HN 5.29 (#peak 1568)
&rst
ixpk= 1568, nxpk= 0, iat= -1, 483, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1= 468, 469,
&end
#
# 32 LYS QG 34 CYS HN 5.96 (#peak 1760)
&rst
ixpk= 1760, nxpk= 0, iat= -1, 494, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1= 468, 469,
&end
#
# 33 SER HN 34 CYS HN 5.26 (#peak 1053)
&rst
ixpk= 1053, nxpk= 0, iat= 483, 494, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 33 SER HN 34 CYS HB2 5.47 (#peak 1565)
&rst
ixpk= 1565, nxpk= 0, iat= 483, 498, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 33 SER HN 34 CYS HB3 6.25 (#peak 1564)
&rst
ixpk= 1564, nxpk= 0, iat= 483, 499, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 33 SER HN 35 VAL HN 6.25 (#peak 890)
&rst
ixpk= 890, nxpk= 0, iat= 483, 505, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 33 SER QB 34 CYS HN 4.50 (#peak 240)
&rst
ixpk= 240, nxpk= 0, iat= -1, 494, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1= 487, 488,
&end
#
# 33 SER QB 35 VAL HN 5.25 (#peak 875)
&rst
ixpk= 875, nxpk= 0, iat= -1, 505, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr1= 487, 488,
&end
#
# 33 SER QB 36 LEU HB2 4.99 (#peak 1886)
&rst
ixpk= 1886, nxpk= 0, iat= -1, 525, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 487, 488,
&end
#
# 34 CYS HN 35 VAL HN 4.64 (#peak 238)
&rst
ixpk= 238, nxpk= 0, iat= 494, 505, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 34 CYS HN 35 VAL HA 5.46 (#peak 1731)
&rst
ixpk= 1731, nxpk= 0, iat= 494, 507, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 34 CYS HN 35 VAL HB 5.26 (#peak 243)
&rst
ixpk= 243, nxpk= 0, iat= 494, 509, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 34 CYS HN 35 VAL QG1 5.02 (#peak 245)
&rst
ixpk= 245, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2= 511, 512, 513,
&end
#
# 34 CYS HN 35 VAL QG2 6.14 (#peak 1587)
&rst
ixpk= 1587, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr2= 515, 516, 517,
&end
#
# 34 CYS HN 86 PHE QD 6.25 (#peak 1608)
&rst
ixpk= 1608, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=1285,1293,
&end
#
# 34 CYS HA 36 LEU HN 4.65 (#peak 866)
&rst
ixpk= 866, nxpk= 0, iat= 496, 521, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 34 CYS HA 37 ASN HN 4.58 (#peak 940)
&rst
ixpk= 940, nxpk= 0, iat= 496, 540, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 34 CYS HA 37 ASN HD21 5.55 (#peak 1402)
&rst
ixpk= 1402, nxpk= 0, iat= 496, 549, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 34 CYS HA 37 ASN HD22 5.22 (#peak 1412)
&rst
ixpk= 1412, nxpk= 0, iat= 496, 550, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 34 CYS HA 38 ILE HG12 6.25 (#peak 2164)
&rst
ixpk= 2164, nxpk= 0, iat= 496, 564, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 34 CYS HA 38 ILE QD1 6.23 (#peak 2165)
&rst
ixpk= 2165, nxpk= 0, iat= 496, -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
igr2= 567, 568, 569,
&end
#
# 34 CYS HA 86 PHE QD 4.88 (#peak 2162)
&rst
ixpk= 2162, nxpk= 0, iat= 496, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2=1285,1293,
&end
#
# 34 CYS HB2 38 ILE QD1 6.25 (#peak 555)
&rst
ixpk= 555, nxpk= 0, iat= 498, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr2= 567, 568, 569,
&end
#
# 34 CYS HB3 35 VAL HN 5.05 (#peak 876)
&rst
ixpk= 876, nxpk= 0, iat= 499, 505, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 34 CYS HB3 38 ILE QD1 6.18 (#peak 600)
&rst
ixpk= 600, nxpk= 0, iat= 499, -1, r1= 1.30, r2= 1.80, r3= 7.42, r4= 7.92,
igr2= 567, 568, 569,
&end
#
# 34 CYS HB3 86 PHE QD 5.84 (#peak 3276)
&rst
ixpk= 3276, nxpk= 0, iat= 499, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr2=1285,1293,
&end
#
# 35 VAL HN 35 VAL QG1 3.71 (#peak 1569)
&rst
ixpk= 1569, nxpk= 0, iat= 505, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 511, 512, 513,
&end
#
# 35 VAL HN 35 VAL QG2 4.33 (#peak 1499)
&rst
ixpk= 1499, nxpk= 0, iat= 505, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2= 515, 516, 517,
&end
#
# 35 VAL HN 36 LEU HN 4.36 (#peak 874)
&rst
ixpk= 874, nxpk= 0, iat= 505, 521, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 35 VAL HN 36 LEU HB2 5.47 (#peak 879)
&rst
ixpk= 879, nxpk= 0, iat= 505, 525, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 35 VAL HN 37 ASN HN 6.25 (#peak 1591)
&rst
ixpk= 1591, nxpk= 0, iat= 505, 540, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 35 VAL HN 38 ILE QD1 6.25 (#peak 903)
&rst
ixpk= 903, nxpk= 0, iat= 505, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr2= 567, 568, 569,
&end
#
# 35 VAL HN 86 PHE QD 6.25 (#peak 891)
&rst
ixpk= 891, nxpk= 0, iat= 505, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=1285,1293,
&end
#
# 35 VAL HA 35 VAL QG1 3.39 (#peak 1570)
&rst
ixpk= 1570, nxpk= 0, iat= 507, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2= 511, 512, 513,
&end
#
# 35 VAL HA 35 VAL QG2 3.17 (#peak 1697)
&rst
ixpk= 1697, nxpk= 0, iat= 507, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2= 515, 516, 517,
&end
#
# 35 VAL HA 37 ASN HD21 5.34 (#peak 60)
&rst
ixpk= 60, nxpk= 0, iat= 507, 549, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, &end
#
# 35 VAL HA 38 ILE HN 4.56 (#peak 59)
&rst
ixpk= 59, nxpk= 0, iat= 507, 554, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 35 VAL HA 38 ILE HA 5.65 (#peak 61)
&rst
ixpk= 61, nxpk= 0, iat= 507, 556, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 35 VAL HA 38 ILE HB 4.51 (#peak 63)
&rst
ixpk= 63, nxpk= 0, iat= 507, 558, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 35 VAL HA 38 ILE HG12 5.47 (#peak 1733)
&rst
ixpk= 1733, nxpk= 0, iat= 507, 564, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 35 VAL HA 38 ILE QD1 4.23 (#peak 1886)
&rst
ixpk= 1886, nxpk= 0, iat= 507, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2= 567, 568, 569,
&end
#
# 35 VAL HA 38 ILE QG2 5.27 (#peak 1821)
&rst
ixpk= 1821, nxpk= 0, iat= 507, -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr2= 560, 561, 562,
&end
#
# 35 VAL HA 39 GLU HN 5.23 (#peak 1574)
&rst
ixpk= 1574, nxpk= 0, iat= 507, 573, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 35 VAL HA 39 GLU HB2 5.53 (#peak 561)
&rst
ixpk= 561, nxpk= 0, iat= 507, 577, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 35 VAL HB 36 LEU HN 4.63 (#peak 869)
&rst
ixpk= 869, nxpk= 0, iat= 509, 521, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 35 VAL QG1 36 LEU HN 4.84 (#peak 1613)
&rst
ixpk= 1613, nxpk= 0, iat= -1, 521, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 511, 512, 513,
&end
#
# 35 VAL QG1 38 ILE HN 5.21 (#peak 808)
&rst
ixpk= 808, nxpk= 0, iat= -1, 554, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1= 511, 512, 513,
&end
#
# 35 VAL QG1 38 ILE QD1 5.19 (#peak 1141)
&rst
ixpk= 1141, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
igr1= 511, 512, 513,
igr2= 567, 568, 569,
&end
#
# 35 VAL QG2 39 GLU HN 4.70 (#peak 853)
&rst
ixpk= 853, nxpk= 0, iat= -1, 573, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1= 515, 516, 517,
&end
#
# 35 VAL QG2 39 GLU HA 4.82 (#peak 2563)
&rst
ixpk= 2563, nxpk= 0, iat= -1, 575, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1= 515, 516, 517,
&end
#
# 35 VAL QG2 39 GLU HB2 4.52 (#peak 543)
&rst
ixpk= 543, nxpk= 0, iat= -1, 577, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 515, 516, 517,
&end
#
# 36 LEU HN 36 LEU HB2 3.80 (#peak 870)
&rst
ixpk= 870, nxpk= 0, iat= 521, 525, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 36 LEU HN 36 LEU QQD 3.86 (#peak 1201)
&rst
ixpk= 1201, nxpk= 0, iat= 521, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2= 534, 535, 536, 530, 531, 532,
&end
#
# 36 LEU HN 37 ASN HN 4.87 (#peak 1588)
&rst
ixpk= 1588, nxpk= 0, iat= 521, 540, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 36 LEU HN 37 ASN HA 6.25 (#peak 865)
&rst
ixpk= 865, nxpk= 0, iat= 521, 542, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 36 LEU HN 39 GLU HB3 6.12 (#peak 873)
&rst
ixpk= 873, nxpk= 0, iat= 521, 578, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62, &end
#
# 36 LEU HA 36 LEU QQD 3.78 (#peak 2975)
&rst
ixpk= 2975, nxpk= 0, iat= 523, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2= 534, 535, 536, 530, 531, 532,
&end
#
# 36 LEU HA 37 ASN HD21 6.25 (#peak 1571)
&rst
ixpk= 1571, nxpk= 0, iat= 523, 549, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 36 LEU HA 37 ASN HD22 6.25 (#peak 1572)
&rst
ixpk= 1572, nxpk= 0, iat= 523, 550, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 36 LEU HA 38 ILE HN 6.25 (#peak 805)
&rst
ixpk= 805, nxpk= 0, iat= 523, 554, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 36 LEU HA 39 GLU HN 3.86 (#peak 3073)
&rst
ixpk= 3073, nxpk= 0, iat= 523, 573, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 36 LEU HA 39 GLU HB2 4.04 (#peak 3064)
&rst
ixpk= 3064, nxpk= 0, iat= 523, 577, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 36 LEU HA 39 GLU HB3 4.45 (#peak 3062)
&rst
ixpk= 3062, nxpk= 0, iat= 523, 578, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 36 LEU HB2 36 LEU QQD 2.95 (#peak 922)
&rst
ixpk= 922, nxpk= 0, iat= 525, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2= 534, 535, 536, 530, 531, 532,
&end
#
# 36 LEU HB2 37 ASN HN 4.46 (#peak 920)
&rst
ixpk= 920, nxpk= 0, iat= 525, 540, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 36 LEU HB3 36 LEU QQD 2.87 (#peak 923)
&rst
ixpk= 923, nxpk= 0, iat= 526, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2= 534, 535, 536, 530, 531, 532,
&end
#
# 36 LEU HB3 37 ASN HN 5.08 (#peak 1956)
&rst
ixpk= 1956, nxpk= 0, iat= 526, 540, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 36 LEU QQD 37 ASN HN 4.14 (#peak 3074)
&rst
ixpk= 3074, nxpk= 0, iat= -1, 540, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 534, 535, 536, 530, 531, 532,
&end
#
# 36 LEU QQD 37 ASN HB2 6.02 (#peak 2231)
&rst
ixpk= 2231, nxpk= 0, iat= -1, 544, r1= 1.30, r2= 1.80, r3= 8.11, r4= 8.61,
igr1= 534, 535, 536, 530, 531, 532,
&end
#
# 36 LEU QQD 37 ASN HD21 5.17 (#peak 1415)
&rst
ixpk= 1415, nxpk= 0, iat= -1, 549, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1= 534, 535, 536, 530, 531, 532,
&end
#
# 36 LEU QQD 37 ASN HD22 5.44 (#peak 1399)
&rst
ixpk= 1399, nxpk= 0, iat= -1, 550, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 534, 535, 536, 530, 531, 532,
&end
#
# 36 LEU QQD 38 ILE HN 5.23 (#peak 1614)
&rst
ixpk= 1614, nxpk= 0, iat= -1, 554, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1= 534, 535, 536, 530, 531, 532,
&end
#
# 36 LEU QQD 39 GLU HN 4.43 (#peak 3076)
&rst
ixpk= 3076, nxpk= 0, iat= -1, 573, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 534, 535, 536, 530, 531, 532,
&end
#
# 36 LEU QQD 40 GLU HN 4.45 (#peak 3077)
&rst
ixpk= 3077, nxpk= 0, iat= -1, 588, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 534, 535, 536, 530, 531, 532,
&end
#
# 36 LEU QQD 40 GLU HB2 5.51 (#peak 538)
&rst
ixpk= 538, nxpk= 0, iat= -1, 592, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
igr1= 534, 535, 536, 530, 531, 532,
&end
#
# 36 LEU QQD 40 GLU HG3 4.60 (#peak 2612)
&rst
ixpk= 2612, nxpk= 0, iat= -1, 596, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1= 534, 535, 536, 530, 531, 532,
&end
#
# 36 LEU QQD 41 ASN HN 5.78 (#peak 1767)
&rst
ixpk= 1767, nxpk= 0, iat= -1, 603, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
igr1= 534, 535, 536, 530, 531, 532,
&end
#
# 36 LEU QQD 41 ASN HD22 5.72 (#peak 3075)
&rst
ixpk= 3075, nxpk= 0, iat= -1, 613, r1= 1.30, r2= 1.80, r3= 7.71, r4= 8.21,
igr1= 534, 535, 536, 530, 531, 532,
&end
#
# 37 ASN HN 37 ASN HB3 3.99 (#peak 902)
&rst
ixpk= 902, nxpk= 0, iat= 540, 545, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 37 ASN HN 38 ILE QD1 6.21 (#peak 889)
&rst
ixpk= 889, nxpk= 0, iat= 540, -1, r1= 1.30, r2= 1.80, r3= 7.46, r4= 7.96,
igr2= 567, 568, 569,
&end
#
# 37 ASN HN 86 PHE QD 6.25 (#peak 1593)
&rst
ixpk= 1593, nxpk= 0, iat= 540, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=1285,1293,
&end
#
# 37 ASN HA 37 ASN HD21 5.10 (#peak 1401)
&rst
ixpk= 1401, nxpk= 0, iat= 542, 549, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 37 ASN HA 37 ASN HD22 4.86 (#peak 170)
&rst
ixpk= 170, nxpk= 0, iat= 542, 550, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 37 ASN HA 40 GLU HN 5.15 (#peak 837)
&rst
ixpk= 837, nxpk= 0, iat= 542, 588, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 37 ASN HA 40 GLU HB2 5.05 (#peak 535)
&rst
ixpk= 535, nxpk= 0, iat= 542, 592, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 37 ASN HA 41 ASN HD21 4.56 (#peak 787)
&rst
ixpk= 787, nxpk= 0, iat= 542, 612, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 37 ASN HA 41 ASN HD22 5.39 (#peak 739)
&rst
ixpk= 739, nxpk= 0, iat= 542, 613, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 37 ASN HB2 37 ASN HD22 4.05 (#peak 973)
&rst
ixpk= 973, nxpk= 0, iat= 544, 550, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 37 ASN HB2 41 ASN HD21 6.25 (#peak 2262)
&rst
ixpk= 2262, nxpk= 0, iat= 544, 612, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 37 ASN HB3 37 ASN HD22 3.99 (#peak 2268)
&rst
ixpk= 2268, nxpk= 0, iat= 545, 550, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 37 ASN HB3 38 ILE HN 4.72 (#peak 806)
&rst
ixpk= 806, nxpk= 0, iat= 545, 554, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 37 ASN HB3 40 GLU HN 5.62 (#peak 1622)
&rst
ixpk= 1622, nxpk= 0, iat= 545, 588, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 37 ASN HD21 38 ILE HG12 5.76 (#peak 1414)
&rst
ixpk= 1414, nxpk= 0, iat= 549, 564, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 37 ASN HD21 86 PHE QD 4.19 (#peak 1582)
&rst
ixpk= 1582, nxpk= 0, iat= 549, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2=1285,1293,
&end
#
# 37 ASN HD22 38 ILE HG12 6.25 (#peak 1398)
&rst
ixpk= 1398, nxpk= 0, iat= 550, 564, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 37 ASN HD22 86 PHE QD 5.34 (#peak 1609)
&rst
ixpk= 1609, nxpk= 0, iat= 550, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1285,1293,
&end
#
# 38 ILE HN 38 ILE HG12 5.82 (#peak 399)
&rst
ixpk= 399, nxpk= 0, iat= 554, 564, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 38 ILE HN 38 ILE HG13 4.80 (#peak 1279)
&rst
ixpk= 1279, nxpk= 0, iat= 554, 565, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 38 ILE HN 38 ILE QD1 4.69 (#peak 2480)
&rst
ixpk= 2480, nxpk= 0, iat= 554, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2= 567, 568, 569,
&end
#
# 38 ILE HN 38 ILE QG2 4.38 (#peak 1820)
&rst
ixpk= 1820, nxpk= 0, iat= 554, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 560, 561, 562,
&end
#
# 38 ILE HN 39 GLU HN 5.20 (#peak 847)
&rst
ixpk= 847, nxpk= 0, iat= 554, 573, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 38 ILE HN 39 GLU HB3 6.11 (#peak 786)
&rst
ixpk= 786, nxpk= 0, iat= 554, 578, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61, &end
#
# 38 ILE HN 40 GLU HN 5.84 (#peak 835)
&rst
ixpk= 835, nxpk= 0, iat= 554, 588, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 38 ILE HN 81 LEU QD1 4.39 (#peak 3072)
&rst
ixpk= 3072, nxpk= 0, iat= 554, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2=1218,1219,1220,
&end
#
# 38 ILE HN 86 PHE QD 5.10 (#peak 1592)
&rst
ixpk= 1592, nxpk= 0, iat= 554, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2=1285,1293,
&end
#
# 38 ILE HA 38 ILE HG13 4.04 (#peak 98)
&rst
ixpk= 98, nxpk= 0, iat= 556, 565, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 38 ILE HA 38 ILE QD1 4.43 (#peak 1885)
&rst
ixpk= 1885, nxpk= 0, iat= 556, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2= 567, 568, 569,
&end
#
# 38 ILE HA 38 ILE QG2 3.58 (#peak 1804)
&rst
ixpk= 1804, nxpk= 0, iat= 556, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2= 560, 561, 562,
&end
#
# 38 ILE HA 40 GLU HN 6.25 (#peak 1621)
&rst
ixpk= 1621, nxpk= 0, iat= 556, 588, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 38 ILE HA 41 ASN HN 4.87 (#peak 1624)
&rst
ixpk= 1624, nxpk= 0, iat= 556, 603, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 38 ILE HA 41 ASN HB2 4.87 (#peak 3070)
&rst
ixpk= 3070, nxpk= 0, iat= 556, 607, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 38 ILE HA 41 ASN HB3 4.94 (#peak 3069)
&rst
ixpk= 3069, nxpk= 0, iat= 556, 608, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 38 ILE HA 42 ILE HN 5.43 (#peak 1829)
&rst
ixpk= 1829, nxpk= 0, iat= 556, 617, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 38 ILE HA 81 LEU QD1 3.67 (#peak 96)
&rst
ixpk= 96, nxpk= 0, iat= 556, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2=1218,1219,1220,
&end
#
# 38 ILE HA 86 PHE QD 6.02 (#peak 1836)
&rst
ixpk= 1836, nxpk= 0, iat= 556, -1, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr2=1285,1293,
&end
#
# 38 ILE HB 38 ILE QD1 3.93 (#peak 2481)
&rst
ixpk= 2481, nxpk= 0, iat= 558, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2= 567, 568, 569,
&end
#
# 38 ILE HB 39 GLU HN 4.92 (#peak 852)
&rst
ixpk= 852, nxpk= 0, iat= 558, 573, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 38 ILE HG12 86 PHE QD 6.02 (#peak 402)
&rst
ixpk= 402, nxpk= 0, iat= 564, -1, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr2=1285,1293,
&end
#
# 38 ILE HG13 81 LEU QD1 4.87 (#peak 1283)
&rst
ixpk= 1283, nxpk= 0, iat= 565, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=1218,1219,1220,
&end
#
# 38 ILE HG13 86 PHE QD 5.50 (#peak 1258)
&rst
ixpk= 1258, nxpk= 0, iat= 565, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1285,1293,
&end
#
# 38 ILE QD1 39 GLU HN 5.12 (#peak 2477)
&rst
ixpk= 2477, nxpk= 0, iat= -1, 573, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1= 567, 568, 569,
&end
#
# 38 ILE QD1 60 ALA QB 5.36 (#peak 1175)
&rst
ixpk= 1175, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.73, r4= 8.23,
igr1= 567, 568, 569,
igr2= 900, 901, 902,
&end
#
# 38 ILE QD1 81 LEU QD1 4.58 (#peak 1430)
&rst
ixpk= 1430, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 567, 568, 569,
igr2=1218,1219,1220,
&end
#
# 38 ILE QD1 86 PHE QD 4.07 (#peak 1891)
&rst
ixpk= 1891, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 567, 568, 569,
igr2=1285,1293,
&end
#
# 38 ILE QG2 38 ILE QD1 3.42 (#peak 1823)
&rst
ixpk= 1823, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1= 560, 561, 562,
igr2= 567, 568, 569,
&end
#
# 38 ILE QG2 39 GLU HN 4.18 (#peak 1819)
&rst
ixpk= 1819, nxpk= 0, iat= -1, 573, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1= 560, 561, 562,
&end
#
# 38 ILE QG2 39 GLU HA 4.44 (#peak 1803)
&rst
ixpk= 1803, nxpk= 0, iat= -1, 575, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 560, 561, 562,
&end
#
# 38 ILE QG2 42 ILE HB 4.07 (#peak 1805)
&rst
ixpk= 1805, nxpk= 0, iat= -1, 621, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1= 560, 561, 562,
&end
#
# 38 ILE QG2 42 ILE HG12 3.57 (#peak 1806)
&rst
ixpk= 1806, nxpk= 0, iat= -1, 627, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1= 560, 561, 562,
&end
#
# 38 ILE QG2 42 ILE QG2 3.58 (#peak 1808)
&rst
ixpk= 1808, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1= 560, 561, 562,
igr2= 623, 624, 625,
&end
#
# 38 ILE QG2 81 LEU QD1 3.94 (#peak 1910)
&rst
ixpk= 1910, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1= 560, 561, 562,
igr2=1218,1219,1220,
&end
#
# 38 ILE QG2 86 PHE QD 5.56 (#peak 1906)
&rst
ixpk= 1906, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
igr1= 560, 561, 562,
igr2=1285,1293,
&end
#
# 39 GLU HN 39 GLU QG 5.15 (#peak 850)
&rst
ixpk= 850, nxpk= 0, iat= 573, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2= 580, 581,
&end
#
# 39 GLU HN 40 GLU HN 4.61 (#peak 1595)
&rst
ixpk= 1595, nxpk= 0, iat= 573, 588, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 39 GLU HN 41 ASN HN 6.25 (#peak 848)
&rst
ixpk= 848, nxpk= 0, iat= 573, 603, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 39 GLU HN 51 ILE HG13 5.70 (#peak 1619)
&rst
ixpk= 1619, nxpk= 0, iat= 573, 760, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 39 GLU HA 41 ASN HN 5.16 (#peak 1625)
&rst
ixpk= 1625, nxpk= 0, iat= 575, 603, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 39 GLU HA 42 ILE HB 4.21 (#peak 3071)
&rst
ixpk= 3071, nxpk= 0, iat= 575, 621, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 39 GLU HA 51 ILE QG2 4.12 (#peak 3251)
&rst
ixpk= 3251, nxpk= 0, iat= 575, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 755, 756, 757,
&end
#
# 39 GLU QG 40 GLU HN 5.31 (#peak 840)
&rst
ixpk= 840, nxpk= 0, iat= -1, 588, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 580, 581,
&end
#
# 40 GLU HN 40 GLU HB2 3.75 (#peak 1304)
&rst
ixpk= 1304, nxpk= 0, iat= 588, 592, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 40 GLU HN 40 GLU HB3 3.88 (#peak 842)
&rst
ixpk= 842, nxpk= 0, iat= 588, 593, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 40 GLU HN 40 GLU HG3 4.77 (#peak 1048)
&rst
ixpk= 1048, nxpk= 0, iat= 588, 596, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 40 GLU HN 41 ASN HN 4.57 (#peak 1133)
&rst
ixpk= 1133, nxpk= 0, iat= 588, 603, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 40 GLU HN 41 ASN HB3 6.25 (#peak 833)
&rst
ixpk= 833, nxpk= 0, iat= 588, 608, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 40 GLU HN 41 ASN HD21 6.25 (#peak 1594)
&rst
ixpk= 1594, nxpk= 0, iat= 588, 612, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 40 GLU HN 42 ILE HN 5.45 (#peak 1596)
&rst
ixpk= 1596, nxpk= 0, iat= 588, 617, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 40 GLU HA 40 GLU HG3 3.61 (#peak 344)
&rst
ixpk= 344, nxpk= 0, iat= 590, 596, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 40 GLU HA 41 ASN HD21 6.25 (#peak 747)
&rst
ixpk= 747, nxpk= 0, iat= 590, 612, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 40 GLU HB2 41 ASN HN 4.58 (#peak 1139)
&rst
ixpk= 1139, nxpk= 0, iat= 592, 603, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 40 GLU HB2 41 ASN HD21 5.45 (#peak 788)
&rst
ixpk= 788, nxpk= 0, iat= 592, 612, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 40 GLU HB3 41 ASN HN 4.57 (#peak 1140)
&rst
ixpk= 1140, nxpk= 0, iat= 593, 603, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 40 GLU HB3 41 ASN HD21 5.73 (#peak 789)
&rst
ixpk= 789, nxpk= 0, iat= 593, 612, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 40 GLU HG2 41 ASN HD22 5.11 (#peak 2545)
&rst
ixpk= 2545, nxpk= 0, iat= 595, 613, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 41 ASN HN 41 ASN HB3 3.95 (#peak 958)
&rst
ixpk= 958, nxpk= 0, iat= 603, 608, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 41 ASN HN 41 ASN HD21 5.63 (#peak 769)
&rst
ixpk= 769, nxpk= 0, iat= 603, 612, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 41 ASN HN 41 ASN HD22 4.17 (#peak 738)
&rst
ixpk= 738, nxpk= 0, iat= 603, 613, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 41 ASN HN 42 ILE HN 4.65 (#peak 701)
&rst
ixpk= 701, nxpk= 0, iat= 603, 617, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 41 ASN HN 42 ILE QD1 5.45 (#peak 1141)
&rst
ixpk= 1141, nxpk= 0, iat= 603, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr2= 630, 631, 632,
&end
#
# 41 ASN HA 43 GLY HN 5.64 (#peak 1492)
&rst
ixpk= 1492, nxpk= 0, iat= 605, 636, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 41 ASN HA 44 GLN HE21 4.29 (#peak 1241)
&rst
ixpk= 1241, nxpk= 0, iat= 605, 655, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 41 ASN HA 44 GLN HE22 4.04 (#peak 1238)
&rst
ixpk= 1238, nxpk= 0, iat= 605, 656, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 41 ASN HB2 42 ILE HN 4.95 (#peak 948)
&rst
ixpk= 948, nxpk= 0, iat= 607, 617, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 41 ASN HB2 42 ILE QD1 5.19 (#peak 2065)
&rst
ixpk= 2065, nxpk= 0, iat= 607, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2= 630, 631, 632,
&end
#
# 41 ASN HB2 81 LEU QD2 4.30 (#peak 2064)
&rst
ixpk= 2064, nxpk= 0, iat= 607, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2=1222,1223,1224,
&end
#
# 41 ASN HB3 42 ILE HN 6.25 (#peak 712)
&rst
ixpk= 712, nxpk= 0, iat= 608, 617, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 41 ASN HB3 42 ILE HG12 5.61 (#peak 1364)
&rst
ixpk= 1364, nxpk= 0, iat= 608, 627, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 41 ASN HB3 42 ILE QD1 5.32 (#peak 947)
&rst
ixpk= 947, nxpk= 0, iat= 608, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr2= 630, 631, 632,
&end
#
# 41 ASN HB3 81 LEU QD2 3.99 (#peak 957)
&rst
ixpk= 957, nxpk= 0, iat= 608, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=1222,1223,1224,
&end
#
# 41 ASN HD21 81 LEU QD1 4.26 (#peak 1929)
&rst
ixpk= 1929, nxpk= 0, iat= 612, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=1218,1219,1220,
&end
#
# 41 ASN HD21 81 LEU QD2 4.75 (#peak 1250)
&rst
ixpk= 1250, nxpk= 0, iat= 612, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1222,1223,1224,
&end
#
# 41 ASN HD22 81 LEU QD1 3.54 (#peak 1928)
&rst
ixpk= 1928, nxpk= 0, iat= 613, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr2=1218,1219,1220,
&end
#
# 41 ASN HD22 81 LEU QD2 5.18 (#peak 1228)
&rst
ixpk= 1228, nxpk= 0, iat= 613, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr2=1222,1223,1224,
&end
#
# 42 ILE HN 42 ILE HG12 4.99 (#peak 1603)
&rst
ixpk= 1603, nxpk= 0, iat= 617, 627, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 42 ILE HN 42 ILE HG13 4.92 (#peak 1601)
&rst
ixpk= 1601, nxpk= 0, iat= 617, 628, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 42 ILE HN 42 ILE QD1 4.11 (#peak 1903)
&rst
ixpk= 1903, nxpk= 0, iat= 617, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2= 630, 631, 632,
&end
#
# 42 ILE HN 42 ILE QG2 4.41 (#peak 1708)
&rst
ixpk= 1708, nxpk= 0, iat= 617, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 623, 624, 625,
&end
#
# 42 ILE HN 43 GLY HN 4.75 (#peak 1491)
&rst
ixpk= 1491, nxpk= 0, iat= 617, 636, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 42 ILE HN 43 GLY HA2 6.25 (#peak 1312)
&rst
ixpk= 1312, nxpk= 0, iat= 617, 638, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 42 ILE HN 44 GLN HN 5.79 (#peak 1161)
&rst
ixpk= 1161, nxpk= 0, iat= 617, 643, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 42 ILE HN 45 LEU QD1 5.50 (#peak 1056)
&rst
ixpk= 1056, nxpk= 0, iat= 617, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 669, 670, 671,
&end
#
# 42 ILE HN 81 LEU QD1 4.14 (#peak 1927)
&rst
ixpk= 1927, nxpk= 0, iat= 617, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2=1218,1219,1220,
&end
#
# 42 ILE HN 81 LEU QD2 5.53 (#peak 1226)
&rst
ixpk= 1226, nxpk= 0, iat= 617, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2=1222,1223,1224,
&end
#
# 42 ILE HA 42 ILE QD1 3.24 (#peak 1905)
&rst
ixpk= 1905, nxpk= 0, iat= 619, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr2= 630, 631, 632,
&end
#
# 42 ILE HA 42 ILE QG2 3.32 (#peak 298)
&rst
ixpk= 298, nxpk= 0, iat= 619, -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr2= 623, 624, 625,
&end
#
# 42 ILE HA 44 GLN HN 4.49 (#peak 1725)
&rst
ixpk= 1725, nxpk= 0, iat= 619, 643, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 42 ILE HA 45 LEU HN 4.22 (#peak 1730)
&rst
ixpk= 1730, nxpk= 0, iat= 619, 660, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 42 ILE HA 45 LEU QD1 4.09 (#peak 1060)
&rst
ixpk= 1060, nxpk= 0, iat= 619, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2= 669, 670, 671,
&end
#
# 42 ILE HA 81 LEU QD1 4.95 (#peak 3156)
&rst
ixpk= 3156, nxpk= 0, iat= 619, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2=1218,1219,1220,
&end
#
# 42 ILE HB 43 GLY HN 4.64 (#peak 1141)
&rst
ixpk= 1141, nxpk= 0, iat= 621, 636, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 42 ILE HB 43 GLY HA3 5.25 (#peak 699)
&rst
ixpk= 699, nxpk= 0, iat= 621, 639, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 42 ILE HG12 43 GLY HN 5.48 (#peak 1490)
&rst
ixpk= 1490, nxpk= 0, iat= 627, 636, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 42 ILE HG12 78 ILE QG2 3.94 (#peak 636)
&rst
ixpk= 636, nxpk= 0, iat= 627, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=1171,1172,1173,
&end
#
# 42 ILE HG12 81 LEU QD1 3.26 (#peak 1448)
&rst
ixpk= 1448, nxpk= 0, iat= 627, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=1218,1219,1220,
&end
#
# 42 ILE HG13 78 ILE HB 5.57 (#peak 3166)
&rst
ixpk= 3166, nxpk= 0, iat= 628,1169, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 42 ILE QD1 43 GLY HN 4.74 (#peak 1498)
&rst
ixpk= 1498, nxpk= 0, iat= -1, 636, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 630, 631, 632,
&end
#
# 42 ILE QD1 44 GLN HN 5.80 (#peak 1168)
&rst
ixpk= 1168, nxpk= 0, iat= -1, 643, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1= 630, 631, 632,
&end
#
# 42 ILE QD1 45 LEU HN 5.02 (#peak 336)
&rst
ixpk= 336, nxpk= 0, iat= -1, 660, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1= 630, 631, 632,
&end
#
# 42 ILE QD1 45 LEU HG 3.85 (#peak 1438)
&rst
ixpk= 1438, nxpk= 0, iat= -1, 667, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1= 630, 631, 632,
&end
#
# 42 ILE QD1 45 LEU QD1 2.92 (#peak 1077)
&rst
ixpk= 1077, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr1= 630, 631, 632,
igr2= 669, 670, 671,
&end
#
# 42 ILE QD1 48 VAL HN 6.25 (#peak 465)
&rst
ixpk= 465, nxpk= 0, iat= -1, 705, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1= 630, 631, 632,
&end
#
# 42 ILE QD1 77 ALA QB 3.58 (#peak 1741)
&rst
ixpk= 1741, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1= 630, 631, 632,
igr2=1159,1160,1161,
&end
#
# 42 ILE QD1 78 ILE HN 4.28 (#peak 1904)
&rst
ixpk= 1904, nxpk= 0, iat= -1,1165, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1= 630, 631, 632,
&end
#
# 42 ILE QD1 78 ILE HA 3.90 (#peak 1906)
&rst
ixpk= 1906, nxpk= 0, iat= -1,1167, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 630, 631, 632,
&end
#
# 42 ILE QD1 78 ILE QG2 2.73 (#peak 1909)
&rst
ixpk= 1909, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr1= 630, 631, 632,
igr2=1171,1172,1173,
&end
#
# 42 ILE QD1 81 LEU HN 5.96 (#peak 81)
&rst
ixpk= 81, nxpk= 0, iat= -1,1209, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr1= 630, 631, 632,
&end
#
# 42 ILE QD1 81 LEU HG 5.15 (#peak 959)
&rst
ixpk= 959, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr1= 630, 631, 632,
&end
#
# 42 ILE QD1 81 LEU QD1 3.59 (#peak 1450)
&rst
ixpk= 1450, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 630, 631, 632,
igr2=1218,1219,1220,
&end
#
# 42 ILE QD1 81 LEU QD2 3.49 (#peak 1256)
&rst
ixpk= 1256, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1= 630, 631, 632,
igr2=1222,1223,1224,
&end
#
# 42 ILE QG2 43 GLY HN 4.38 (#peak 1497)
&rst
ixpk= 1497, nxpk= 0, iat= -1, 636, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 623, 624, 625,
&end
#
# 42 ILE QG2 43 GLY HA2 4.54 (#peak 696)
&rst
ixpk= 696, nxpk= 0, iat= -1, 638, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1= 623, 624, 625,
&end
#
# 42 ILE QG2 43 GLY HA3 4.72 (#peak 700)
&rst
ixpk= 700, nxpk= 0, iat= -1, 639, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1= 623, 624, 625,
&end
#
# 42 ILE QG2 44 GLN HN 4.83 (#peak 1167)
&rst
ixpk= 1167, nxpk= 0, iat= -1, 643, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 623, 624, 625,
&end
#
# 42 ILE QG2 45 LEU HG 5.29 (#peak 3162)
&rst
ixpk= 3162, nxpk= 0, iat= -1, 667, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 623, 624, 625,
&end
#
# 42 ILE QG2 48 VAL HB 3.51 (#peak 1233)
&rst
ixpk= 1233, nxpk= 0, iat= -1, 709, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr1= 623, 624, 625,
&end
#
# 42 ILE QG2 48 VAL QQG 2.81 (#peak 1707)
&rst
ixpk= 1707, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1= 623, 624, 625,
igr2= 711, 712, 713, 715, 716, 717,
&end
#
# 42 ILE QG2 51 ILE HB 5.20 (#peak 3161)
&rst
ixpk= 3161, nxpk= 0, iat= -1, 753, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1= 623, 624, 625,
&end
#
# 42 ILE QG2 51 ILE HG12 5.14 (#peak 3164)
&rst
ixpk= 3164, nxpk= 0, iat= -1, 759, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 623, 624, 625,
&end
#
# 42 ILE QG2 78 ILE HN 5.96 (#peak 1709)
&rst
ixpk= 1709, nxpk= 0, iat= -1,1165, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr1= 623, 624, 625,
&end
#
# 42 ILE QG2 78 ILE HB 3.96 (#peak 1017)
&rst
ixpk= 1017, nxpk= 0, iat= -1,1169, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 623, 624, 625,
&end
#
# 42 ILE QG2 78 ILE QD1 3.25 (#peak 2462)
&rst
ixpk= 2462, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1= 623, 624, 625,
igr2=1178,1179,1180,
&end
#
# 43 GLY HN 44 GLN HN 4.90 (#peak 1488)
&rst
ixpk= 1488, nxpk= 0, iat= 636, 643, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 43 GLY HN 44 GLN HG3 5.64 (#peak 1489)
&rst
ixpk= 1489, nxpk= 0, iat= 636, 651, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 43 GLY HN 45 LEU QD1 4.42 (#peak 1496)
&rst
ixpk= 1496, nxpk= 0, iat= 636, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2= 669, 670, 671,
&end
#
# 43 GLY HA2 45 LEU QD1 5.40 (#peak 1292)
&rst
ixpk= 1292, nxpk= 0, iat= 638, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr2= 669, 670, 671,
&end
#
# 43 GLY HA2 48 VAL QQG 4.00 (#peak 3137)
&rst
ixpk= 3137, nxpk= 0, iat= 638, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 711, 712, 713, 715, 716, 717,
&end
#
# 43 GLY HA3 45 LEU HN 4.92 (#peak 1729)
&rst
ixpk= 1729, nxpk= 0, iat= 639, 660, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 43 GLY HA3 45 LEU QD1 5.35 (#peak 3139)
&rst
ixpk= 3139, nxpk= 0, iat= 639, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2= 669, 670, 671,
&end
#
# 43 GLY HA3 48 VAL QQG 4.27 (#peak 3138)
&rst
ixpk= 3138, nxpk= 0, iat= 639, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2= 711, 712, 713, 715, 716, 717,
&end
#
# 43 GLY HA3 51 ILE QG2 3.90 (#peak 1948)
&rst
ixpk= 1948, nxpk= 0, iat= 639, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 755, 756, 757,
&end
#
# 44 GLN HN 44 GLN HB2 4.05 (#peak 1165)
&rst
ixpk= 1165, nxpk= 0, iat= 643, 647, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 44 GLN HN 44 GLN HB3 4.08 (#peak 1310)
&rst
ixpk= 1310, nxpk= 0, iat= 643, 648, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 44 GLN HN 44 GLN HG2 4.22 (#peak 2931)
&rst
ixpk= 2931, nxpk= 0, iat= 643, 650, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 44 GLN HN 44 GLN HG3 3.99 (#peak 1164)
&rst
ixpk= 1164, nxpk= 0, iat= 643, 651, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 44 GLN HN 45 LEU HN 3.94 (#peak 1156)
&rst
ixpk= 1156, nxpk= 0, iat= 643, 660, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 44 GLN HN 45 LEU HA 5.24 (#peak 1727)
&rst
ixpk= 1727, nxpk= 0, iat= 643, 662, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 44 GLN HN 45 LEU HB2 5.28 (#peak 1737)
&rst
ixpk= 1737, nxpk= 0, iat= 643, 664, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 44 GLN HN 45 LEU HB3 5.58 (#peak 1736)
&rst
ixpk= 1736, nxpk= 0, iat= 643, 665, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 44 GLN HN 45 LEU HG 6.02 (#peak 1738)
&rst
ixpk= 1738, nxpk= 0, iat= 643, 667, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 44 GLN HA 44 GLN HG2 4.03 (#peak 1133)
&rst
ixpk= 1133, nxpk= 0, iat= 645, 650, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 44 GLN HA 44 GLN HG3 4.11 (#peak 289)
&rst
ixpk= 289, nxpk= 0, iat= 645, 651, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 44 GLN HB2 45 LEU HN 4.77 (#peak 502)
&rst
ixpk= 502, nxpk= 0, iat= 647, 660, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 44 GLN HB3 44 GLN HE22 4.83 (#peak 1235)
&rst
ixpk= 1235, nxpk= 0, iat= 648, 656, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 44 GLN HG3 44 GLN HE21 4.05 (#peak 1239)
&rst
ixpk= 1239, nxpk= 0, iat= 651, 655, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 44 GLN HG3 44 GLN HE22 3.47 (#peak 1234)
&rst
ixpk= 1234, nxpk= 0, iat= 651, 656, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 45 LEU HN 45 LEU HB2 3.76 (#peak 856)
&rst
ixpk= 856, nxpk= 0, iat= 660, 664, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 45 LEU HN 45 LEU HB3 4.05 (#peak 861)
&rst
ixpk= 861, nxpk= 0, iat= 660, 665, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 45 LEU HN 45 LEU HG 4.17 (#peak 1456)
&rst
ixpk= 1456, nxpk= 0, iat= 660, 667, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 45 LEU HN 45 LEU QD1 4.20 (#peak 1059)
&rst
ixpk= 1059, nxpk= 0, iat= 660, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 669, 670, 671,
&end
#
# 45 LEU HN 45 LEU QD2 3.76 (#peak 335)
&rst
ixpk= 335, nxpk= 0, iat= 660, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 673, 674, 675,
&end
#
# 45 LEU HN 46 LEU HN 6.25 (#peak 2045)
&rst
ixpk= 2045, nxpk= 0, iat= 660, 679, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 45 LEU HN 48 VAL HN 5.44 (#peak 1732)
&rst
ixpk= 1732, nxpk= 0, iat= 660, 705, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 45 LEU HA 46 LEU HN 3.26 (#peak 507)
&rst
ixpk= 507, nxpk= 0, iat= 662, 679, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 45 LEU HB2 48 VAL HB 5.01 (#peak 842)
&rst
ixpk= 842, nxpk= 0, iat= 664, 709, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 45 LEU HB3 46 LEU HN 3.52 (#peak 162)
&rst
ixpk= 162, nxpk= 0, iat= 665, 679, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 45 LEU HB3 47 GLY HN 4.40 (#peak 1256)
&rst
ixpk= 1256, nxpk= 0, iat= 665, 698, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 45 LEU HB3 48 VAL HN 5.50 (#peak 463)
&rst
ixpk= 463, nxpk= 0, iat= 665, 705, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 45 LEU HG 46 LEU HN 6.09 (#peak 882)
&rst
ixpk= 882, nxpk= 0, iat= 667, 679, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59, &end
#
# 45 LEU QD1 46 LEU HN 4.65 (#peak 1057)
&rst
ixpk= 1057, nxpk= 0, iat= -1, 679, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 669, 670, 671,
&end
#
# 45 LEU QD1 48 VAL HN 4.42 (#peak 1734)
&rst
ixpk= 1734, nxpk= 0, iat= -1, 705, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 669, 670, 671,
&end
#
# 45 LEU QD1 78 ILE HA 6.08 (#peak 1535)
&rst
ixpk= 1535, nxpk= 0, iat= -1,1167, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr1= 669, 670, 671,
&end
#
# 46 LEU HN 46 LEU QB 3.61 (#peak 897)
&rst
ixpk= 897, nxpk= 0, iat= 679, -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr2= 683, 684,
&end
#
# 46 LEU HN 46 LEU QD1 4.22 (#peak 1050)
&rst
ixpk= 1050, nxpk= 0, iat= 679, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2= 688, 689, 690,
&end
#
# 46 LEU HN 46 LEU QD2 4.27 (#peak 1123)
&rst
ixpk= 1123, nxpk= 0, iat= 679, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2= 692, 693, 694,
&end
#
# 46 LEU HN 47 GLY HN 5.50 (#peak 164)
&rst
ixpk= 164, nxpk= 0, iat= 679, 698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 46 LEU HN 48 VAL HB 6.25 (#peak 165)
&rst
ixpk= 165, nxpk= 0, iat= 679, 709, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 46 LEU HA 46 LEU QD1 4.03 (#peak 1503)
&rst
ixpk= 1503, nxpk= 0, iat= 681, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2= 688, 689, 690,
&end
#
# 46 LEU HA 46 LEU QD2 3.82 (#peak 3244)
&rst
ixpk= 3244, nxpk= 0, iat= 681, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2= 692, 693, 694,
&end
#
# 46 LEU HA 48 VAL HN 5.00 (#peak 436)
&rst
ixpk= 436, nxpk= 0, iat= 681, 705, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 46 LEU QB 46 LEU QD1 2.86 (#peak 1054)
&rst
ixpk= 1054, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr1= 683, 684,
igr2= 688, 689, 690,
&end
#
# 46 LEU QB 46 LEU QD2 3.01 (#peak 1125)
&rst
ixpk= 1125, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr1= 683, 684,
igr2= 692, 693, 694,
&end
#
# 46 LEU QB 68 CYS HB2 5.22 (#peak 208)
&rst
ixpk= 208, nxpk= 0, iat= -1,1023, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 683, 684,
&end
#
# 46 LEU QD1 47 GLY HN 4.10 (#peak 1257)
&rst
ixpk= 1257, nxpk= 0, iat= -1, 698, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 688, 689, 690,
&end
#
# 46 LEU QD1 47 GLY HA2 4.97 (#peak 1502)
&rst
ixpk= 1502, nxpk= 0, iat= -1, 700, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 688, 689, 690,
&end
#
# 46 LEU QD1 68 CYS HA 4.52 (#peak 1501)
&rst
ixpk= 1501, nxpk= 0, iat= -1,1021, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 688, 689, 690,
&end
#
# 46 LEU QD1 68 CYS HB2 3.57 (#peak 1524)
&rst
ixpk= 1524, nxpk= 0, iat= -1,1023, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1= 688, 689, 690,
&end
#
# 46 LEU QD1 68 CYS HB3 4.15 (#peak 1232)
&rst
ixpk= 1232, nxpk= 0, iat= -1,1024, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1= 688, 689, 690,
&end
#
# 46 LEU QD2 47 GLY HN 3.73 (#peak 1122)
&rst
ixpk= 1122, nxpk= 0, iat= -1, 698, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 692, 693, 694,
&end
#
# 46 LEU QD2 47 GLY HA3 4.93 (#peak 1120)
&rst
ixpk= 1120, nxpk= 0, iat= -1, 701, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 692, 693, 694,
&end
#
# 46 LEU QD2 68 CYS HB3 4.73 (#peak 1121)
&rst
ixpk= 1121, nxpk= 0, iat= -1,1024, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1= 692, 693, 694,
&end
#
# 47 GLY HN 48 VAL HN 4.29 (#peak 457)
&rst
ixpk= 457, nxpk= 0, iat= 698, 705, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 47 GLY HN 48 VAL HB 6.25 (#peak 299)
&rst
ixpk= 299, nxpk= 0, iat= 698, 709, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 47 GLY HN 68 CYS HB2 4.64 (#peak 1225)
&rst
ixpk= 1225, nxpk= 0, iat= 698,1023, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 47 GLY HN 68 CYS HB3 4.78 (#peak 1243)
&rst
ixpk= 1243, nxpk= 0, iat= 698,1024, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 47 GLY HN 69 THR QG2 4.82 (#peak 1738)
&rst
ixpk= 1738, nxpk= 0, iat= 698, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=1036,1037,1038,
&end
#
# 47 GLY HA2 65 ASP QB 5.12 (#peak 849)
&rst
ixpk= 849, nxpk= 0, iat= 700, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr2= 986, 987,
&end
#
# 47 GLY HA2 68 CYS HB2 4.14 (#peak 1227)
&rst
ixpk= 1227, nxpk= 0, iat= 700,1023, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 47 GLY HA2 68 CYS HB3 5.06 (#peak 1459)
&rst
ixpk= 1459, nxpk= 0, iat= 700,1024, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 47 GLY HA2 69 THR HN 5.40 (#peak 1769)
&rst
ixpk= 1769, nxpk= 0, iat= 700,1030, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 47 GLY HA3 64 TYR HA 5.50 (#peak 525)
&rst
ixpk= 525, nxpk= 0, iat= 701, 963, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 47 GLY HA3 65 ASP QB 4.98 (#peak 834)
&rst
ixpk= 834, nxpk= 0, iat= 701, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr2= 986, 987,
&end
#
# 47 GLY HA3 67 SER HN 5.51 (#peak 1745)
&rst
ixpk= 1745, nxpk= 0, iat= 701,1008, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 47 GLY HA3 68 CYS HN 5.75 (#peak 913)
&rst
ixpk= 913, nxpk= 0, iat= 701,1019, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 47 GLY HA3 68 CYS HB2 4.25 (#peak 1213)
&rst
ixpk= 1213, nxpk= 0, iat= 701,1023, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 47 GLY HA3 68 CYS HB3 4.41 (#peak 1214)
&rst
ixpk= 1214, nxpk= 0, iat= 701,1024, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 47 GLY HA3 69 THR HN 4.63 (#peak 1771)
&rst
ixpk= 1771, nxpk= 0, iat= 701,1030, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 47 GLY HA3 69 THR QG2 5.02 (#peak 1661)
&rst
ixpk= 1661, nxpk= 0, iat= 701, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=1036,1037,1038,
&end
#
# 48 VAL HN 48 VAL HB 3.85 (#peak 462)
&rst
ixpk= 462, nxpk= 0, iat= 705, 709, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 48 VAL HN 48 VAL QQG 3.61 (#peak 464)
&rst
ixpk= 464, nxpk= 0, iat= 705, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr2= 711, 712, 713, 715, 716, 717,
&end
#
# 48 VAL HN 49 GLN HN 6.23 (#peak 456)
&rst
ixpk= 456, nxpk= 0, iat= 705, 721, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73, &end
#
# 48 VAL HN 50 SER HN 6.25 (#peak 1374)
&rst
ixpk= 1374, nxpk= 0, iat= 705, 738, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 48 VAL HN 64 TYR HA 5.53 (#peak 459)
&rst
ixpk= 459, nxpk= 0, iat= 705, 963, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 48 VAL HA 48 VAL QQG 3.23 (#peak 1659)
&rst
ixpk= 1659, nxpk= 0, iat= 707, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr2= 711, 712, 713, 715, 716, 717,
&end
#
# 48 VAL HA 50 SER HN 4.64 (#peak 1380)
&rst
ixpk= 1380, nxpk= 0, iat= 707, 738, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 48 VAL HA 64 TYR HN 6.10 (#peak 366)
&rst
ixpk= 366, nxpk= 0, iat= 707, 961, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60, &end
#
# 48 VAL HA 64 TYR HA 3.92 (#peak 520)
&rst
ixpk= 520, nxpk= 0, iat= 707, 963, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 48 VAL HA 64 TYR HB3 4.88 (#peak 886)
&rst
ixpk= 886, nxpk= 0, iat= 707, 966, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 48 VAL HB 49 GLN HN 6.25 (#peak 261)
&rst
ixpk= 261, nxpk= 0, iat= 709, 721, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 48 VAL QQG 49 GLN HN 3.85 (#peak 1682)
&rst
ixpk= 1682, nxpk= 0, iat= -1, 721, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 711, 712, 713, 715, 716, 717,
&end
#
# 48 VAL QQG 49 GLN HA 5.33 (#peak 3011)
&rst
ixpk= 3011, nxpk= 0, iat= -1, 723, r1= 1.30, r2= 1.80, r3= 7.18, r4= 7.68,
igr1= 711, 712, 713, 715, 716, 717,
&end
#
# 48 VAL QQG 50 SER HN 3.65 (#peak 1658)
&rst
ixpk= 1658, nxpk= 0, iat= -1, 738, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 711, 712, 713, 715, 716, 717,
&end
#
# 48 VAL QQG 64 TYR HA 5.20 (#peak 313)
&rst
ixpk= 313, nxpk= 0, iat= -1, 963, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1= 711, 712, 713, 715, 716, 717,
&end
#
# 48 VAL QQG 74 LEU QD2 3.31 (#peak 1681)
&rst
ixpk= 1681, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr1= 711, 712, 713, 715, 716, 717,
igr2=1108,1109,1110,
&end
#
# 49 GLN HN 49 GLN HB3 4.07 (#peak 1314)
&rst
ixpk= 1314, nxpk= 0, iat= 721, 726, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 49 GLN HN 49 GLN HG2 5.74 (#peak 2871)
&rst
ixpk= 2871, nxpk= 0, iat= 721, 728, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 49 GLN HN 49 GLN HG3 6.12 (#peak 96)
&rst
ixpk= 96, nxpk= 0, iat= 721, 729, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62, &end
#
# 49 GLN HN 50 SER HN 4.54 (#peak 1375)
&rst
ixpk= 1375, nxpk= 0, iat= 721, 738, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 49 GLN HN 64 TYR HA 4.48 (#peak 518)
&rst
ixpk= 518, nxpk= 0, iat= 721, 963, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 49 GLN HB2 49 GLN HE21 5.57 (#peak 2035)
&rst
ixpk= 2035, nxpk= 0, iat= 725, 733, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 49 GLN HB2 49 GLN HE22 5.24 (#peak 2039)
&rst
ixpk= 2039, nxpk= 0, iat= 725, 734, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 49 GLN HB2 50 SER HN 4.39 (#peak 1384)
&rst
ixpk= 1384, nxpk= 0, iat= 725, 738, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 49 GLN HB3 49 GLN HE21 5.68 (#peak 2036)
&rst
ixpk= 2036, nxpk= 0, iat= 726, 733, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 49 GLN HB3 49 GLN HE22 5.82 (#peak 2038)
&rst
ixpk= 2038, nxpk= 0, iat= 726, 734, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 49 GLN HB3 50 SER HN 4.67 (#peak 511)
&rst
ixpk= 511, nxpk= 0, iat= 726, 738, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 49 GLN HE21 50 SER QB 6.12 (#peak 2027)
&rst
ixpk= 2027, nxpk= 0, iat= 733, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr2= 742, 743,
&end
#
# 49 GLN HG2 50 SER HN 5.51 (#peak 1383)
&rst
ixpk= 1383, nxpk= 0, iat= 728, 738, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 49 GLN HG3 50 SER HN 5.23 (#peak 1382)
&rst
ixpk= 1382, nxpk= 0, iat= 729, 738, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 49 GLN HG3 50 SER QB 4.97 (#peak 1106)
&rst
ixpk= 1106, nxpk= 0, iat= 729, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2= 742, 743,
&end
#
# 50 SER HN 51 ILE HA 6.25 (#peak 1708)
&rst
ixpk= 1708, nxpk= 0, iat= 738, 751, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 50 SER HN 62 VAL HA 6.25 (#peak 1707)
&rst
ixpk= 1707, nxpk= 0, iat= 738, 925, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 50 SER HN 63 LYS HN 5.24 (#peak 1376)
&rst
ixpk= 1376, nxpk= 0, iat= 738, 939, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 50 SER HN 63 LYS HB2 4.14 (#peak 1954)
&rst
ixpk= 1954, nxpk= 0, iat= 738, 943, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 50 SER HN 63 LYS HB3 4.92 (#peak 1157)
&rst
ixpk= 1157, nxpk= 0, iat= 738, 944, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 50 SER HN 63 LYS QD 5.71 (#peak 569)
&rst
ixpk= 569, nxpk= 0, iat= 738, -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr2= 949, 950,
&end
#
# 50 SER HN 64 TYR HA 4.93 (#peak 1377)
&rst
ixpk= 1377, nxpk= 0, iat= 738, 963, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 50 SER HA 51 ILE HN 3.38 (#peak 656)
&rst
ixpk= 656, nxpk= 0, iat= 740, 749, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 50 SER HA 51 ILE QG2 5.43 (#peak 3249)
&rst
ixpk= 3249, nxpk= 0, iat= 740, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2= 755, 756, 757,
&end
#
# 50 SER QB 51 ILE HN 3.67 (#peak 658)
&rst
ixpk= 658, nxpk= 0, iat= -1, 749, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1= 742, 743,
&end
#
# 50 SER QB 63 LYS HN 5.66 (#peak 147)
&rst
ixpk= 147, nxpk= 0, iat= -1, 939, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 742, 743,
&end
#
# 50 SER QB 63 LYS HB3 5.23 (#peak 1122)
&rst
ixpk= 1122, nxpk= 0, iat= -1, 944, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1= 742, 743,
&end
#
# 51 ILE HN 51 ILE HG13 5.93 (#peak 663)
&rst
ixpk= 663, nxpk= 0, iat= 749, 760, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 51 ILE HN 51 ILE QG2 4.11 (#peak 662)
&rst
ixpk= 662, nxpk= 0, iat= 749, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2= 755, 756, 757,
&end
#
# 51 ILE HA 51 ILE HG13 3.71 (#peak 338)
&rst
ixpk= 338, nxpk= 0, iat= 751, 760, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 51 ILE HA 51 ILE QD1 4.10 (#peak 1868)
&rst
ixpk= 1868, nxpk= 0, iat= 751, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr2= 762, 763, 764,
&end
#
# 51 ILE HA 51 ILE QG2 3.88 (#peak 1850)
&rst
ixpk= 1850, nxpk= 0, iat= 751, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 755, 756, 757,
&end
#
# 51 ILE HA 52 GLN HN 3.53 (#peak 336)
&rst
ixpk= 336, nxpk= 0, iat= 751, 768, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 51 ILE HA 63 LYS HN 5.17 (#peak 145)
&rst
ixpk= 145, nxpk= 0, iat= 751, 939, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 51 ILE HB 52 GLN HN 5.45 (#peak 229)
&rst
ixpk= 229, nxpk= 0, iat= 753, 768, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 51 ILE HB 62 VAL HA 4.75 (#peak 3245)
&rst
ixpk= 3245, nxpk= 0, iat= 753, 925, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 51 ILE HG12 52 GLN HN 4.71 (#peak 1370)
&rst
ixpk= 1370, nxpk= 0, iat= 759, 768, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 51 ILE HG13 52 GLN HN 4.58 (#peak 1353)
&rst
ixpk= 1353, nxpk= 0, iat= 760, 768, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 51 ILE QD1 52 GLN HN 5.05 (#peak 2387)
&rst
ixpk= 2387, nxpk= 0, iat= -1, 768, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1= 762, 763, 764,
&end
#
# 51 ILE QD1 62 VAL HB 4.76 (#peak 3252)
&rst
ixpk= 3252, nxpk= 0, iat= -1, 927, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 762, 763, 764,
&end
#
# 51 ILE QD1 62 VAL QG1 3.96 (#peak 3253)
&rst
ixpk= 3253, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
igr1= 762, 763, 764,
igr2= 929, 930, 931,
&end
#
# 51 ILE QD1 62 VAL QG2 4.08 (#peak 3254)
&rst
ixpk= 3254, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 762, 763, 764,
igr2= 933, 934, 935,
&end
#
# 51 ILE QG2 51 ILE QD1 3.28 (#peak 1860)
&rst
ixpk= 1860, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1= 755, 756, 757,
igr2= 762, 763, 764,
&end
#
# 51 ILE QG2 52 GLN HN 5.54 (#peak 214)
&rst
ixpk= 214, nxpk= 0, iat= -1, 768, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr1= 755, 756, 757,
&end
#
# 51 ILE QG2 52 GLN HA 4.69 (#peak 2244)
&rst
ixpk= 2244, nxpk= 0, iat= -1, 770, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 755, 756, 757,
&end
#
# 52 GLN HN 52 GLN HB3 3.97 (#peak 1223)
&rst
ixpk= 1223, nxpk= 0, iat= 768, 773, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 52 GLN HN 52 GLN HG2 4.86 (#peak 1109)
&rst
ixpk= 1109, nxpk= 0, iat= 768, 775, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 52 GLN HN 53 VAL HN 6.25 (#peak 201)
&rst
ixpk= 201, nxpk= 0, iat= 768, 785, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 52 GLN HN 62 VAL QG2 5.28 (#peak 1505)
&rst
ixpk= 1505, nxpk= 0, iat= 768, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2= 933, 934, 935,
&end
#
# 52 GLN HN 63 LYS HN 6.25 (#peak 158)
&rst
ixpk= 158, nxpk= 0, iat= 768, 939, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 52 GLN HA 53 VAL HN 3.37 (#peak 566)
&rst
ixpk= 566, nxpk= 0, iat= 770, 785, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 52 GLN HA 53 VAL QQG 5.57 (#peak 1283)
&rst
ixpk= 1283, nxpk= 0, iat= 770, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr2= 791, 792, 793, 795, 796, 797,
&end
#
# 52 GLN HA 63 LYS QD 4.26 (#peak 448)
&rst
ixpk= 448, nxpk= 0, iat= 770, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2= 949, 950,
&end
#
# 52 GLN HB2 52 GLN HE22 5.98 (#peak 155)
&rst
ixpk= 155, nxpk= 0, iat= 772, 781, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 52 GLN HB2 53 VAL HN 4.54 (#peak 1198)
&rst
ixpk= 1198, nxpk= 0, iat= 772, 785, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 52 GLN HB3 52 GLN HG2 2.83 (#peak 166)
&rst
ixpk= 166, nxpk= 0, iat= 773, 775, r1= 1.30, r2= 1.80, r3= 2.83, r4= 3.33, &end
#
# 52 GLN HB3 53 VAL HN 4.97 (#peak 1199)
&rst
ixpk= 1199, nxpk= 0, iat= 773, 785, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 52 GLN HG2 53 VAL HN 4.87 (#peak 1140)
&rst
ixpk= 1140, nxpk= 0, iat= 775, 785, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 52 GLN HG2 53 VAL HA 5.74 (#peak 2438)
&rst
ixpk= 2438, nxpk= 0, iat= 775, 787, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 52 GLN HG2 61 GLN HG3 4.18 (#peak 1957)
&rst
ixpk= 1957, nxpk= 0, iat= 775, 914, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 52 GLN HG2 62 VAL HN 6.25 (#peak 2805)
&rst
ixpk= 2805, nxpk= 0, iat= 775, 923, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 52 GLN HG2 62 VAL HA 6.25 (#peak 2566)
&rst
ixpk= 2566, nxpk= 0, iat= 775, 925, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 52 GLN HG3 53 VAL HN 4.93 (#peak 1144)
&rst
ixpk= 1144, nxpk= 0, iat= 776, 785, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 53 VAL HN 53 VAL QQG 3.51 (#peak 1613)
&rst
ixpk= 1613, nxpk= 0, iat= 785, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2= 791, 792, 793, 795, 796, 797,
&end
#
# 53 VAL HN 54 SER HN 6.25 (#peak 83)
&rst
ixpk= 83, nxpk= 0, iat= 785, 801, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 53 VAL HN 54 SER HA 5.04 (#peak 81)
&rst
ixpk= 81, nxpk= 0, iat= 785, 803, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 53 VAL HN 60 ALA HA 6.25 (#peak 2021)
&rst
ixpk= 2021, nxpk= 0, iat= 785, 898, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 53 VAL HN 60 ALA QB 6.25 (#peak 1184)
&rst
ixpk= 1184, nxpk= 0, iat= 785, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr2= 900, 901, 902,
&end
#
# 53 VAL HA 53 VAL QQG 3.49 (#peak 1615)
&rst
ixpk= 1615, nxpk= 0, iat= 787, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2= 791, 792, 793, 795, 796, 797,
&end
#
# 53 VAL HA 54 SER HN 3.40 (#peak 228)
&rst
ixpk= 228, nxpk= 0, iat= 787, 801, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 53 VAL HA 60 ALA HA 4.69 (#peak 926)
&rst
ixpk= 926, nxpk= 0, iat= 787, 898, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 53 VAL HA 60 ALA QB 3.95 (#peak 1567)
&rst
ixpk= 1567, nxpk= 0, iat= 787, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 900, 901, 902,
&end
#
# 53 VAL HA 61 GLN HN 4.74 (#peak 539)
&rst
ixpk= 539, nxpk= 0, iat= 787, 906, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 53 VAL HB 54 SER HA 5.33 (#peak 3029)
&rst
ixpk= 3029, nxpk= 0, iat= 789, 803, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 53 VAL QQG 54 SER HN 3.41 (#peak 1614)
&rst
ixpk= 1614, nxpk= 0, iat= -1, 801, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 791, 792, 793, 795, 796, 797,
&end
#
# 53 VAL QQG 60 ALA HA 4.69 (#peak 1282)
&rst
ixpk= 1282, nxpk= 0, iat= -1, 898, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1= 791, 792, 793, 795, 796, 797,
&end
#
# 53 VAL QQG 61 GLN HN 5.64 (#peak 541)
&rst
ixpk= 541, nxpk= 0, iat= -1, 906, r1= 1.30, r2= 1.80, r3= 7.60, r4= 8.10,
igr1= 791, 792, 793, 795, 796, 797,
&end
#
# 54 SER HN 54 SER HB2 3.88 (#peak 201)
&rst
ixpk= 201, nxpk= 0, iat= 801, 805, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 54 SER HN 54 SER HB3 3.84 (#peak 203)
&rst
ixpk= 203, nxpk= 0, iat= 801, 806, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 54 SER HN 60 ALA HA 4.41 (#peak 515)
&rst
ixpk= 515, nxpk= 0, iat= 801, 898, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 54 SER HN 60 ALA QB 4.20 (#peak 505)
&rst
ixpk= 505, nxpk= 0, iat= 801, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 900, 901, 902,
&end
#
# 54 SER HN 61 GLN HN 5.63 (#peak 535)
&rst
ixpk= 535, nxpk= 0, iat= 801, 906, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 54 SER HA 56 GLU HN 4.55 (#peak 923)
&rst
ixpk= 923, nxpk= 0, iat= 803, 831, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 54 SER HB2 61 GLN HE22 6.25 (#peak 2171)
&rst
ixpk= 2171, nxpk= 0, iat= 805, 919, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 54 SER HB2 61 GLN HG2 5.56 (#peak 2184)
&rst
ixpk= 2184, nxpk= 0, iat= 805, 913, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06, &end
#
# 54 SER HB2 61 GLN QB 6.00 (#peak 2215)
&rst
ixpk= 2215, nxpk= 0, iat= 805, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 910, 911,
&end
#
# 54 SER HB3 61 GLN HG2 5.64 (#peak 2872)
&rst
ixpk= 2872, nxpk= 0, iat= 806, 913, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 54 SER HB3 61 GLN QB 5.21 (#peak 308)
&rst
ixpk= 308, nxpk= 0, iat= 806, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2= 910, 911,
&end
#
# 55 LEU HN 55 LEU QQD 3.95 (#peak 1002)
&rst
ixpk= 1002, nxpk= 0, iat= 812, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2= 825, 826, 827, 821, 822, 823,
&end
#
# 55 LEU HN 57 ASN HN 5.94 (#peak 31)
&rst
ixpk= 31, nxpk= 0, iat= 812, 846, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 55 LEU HA 55 LEU QQD 4.41 (#peak 3145)
&rst
ixpk= 3145, nxpk= 0, iat= 814, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2= 825, 826, 827, 821, 822, 823,
&end
#
# 55 LEU HA 58 LYS HN 4.60 (#peak 943)
&rst
ixpk= 943, nxpk= 0, iat= 814, 860, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 55 LEU HB2 55 LEU QQD 3.37 (#peak 1031)
&rst
ixpk= 1031, nxpk= 0, iat= 816, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr2= 825, 826, 827, 821, 822, 823,
&end
#
# 55 LEU HB3 56 GLU HN 4.02 (#peak 927)
&rst
ixpk= 927, nxpk= 0, iat= 817, 831, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 55 LEU HB3 56 GLU HA 4.86 (#peak 2652)
&rst
ixpk= 2652, nxpk= 0, iat= 817, 833, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 55 LEU HB3 57 ASN HN 5.89 (#peak 1192)
&rst
ixpk= 1192, nxpk= 0, iat= 817, 846, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 55 LEU QQD 56 GLU HN 4.23 (#peak 929)
&rst
ixpk= 929, nxpk= 0, iat= -1, 831, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 825, 826, 827, 821, 822, 823,
&end
#
# 55 LEU QQD 56 GLU HA 5.43 (#peak 2657)
&rst
ixpk= 2657, nxpk= 0, iat= -1, 833, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1= 825, 826, 827, 821, 822, 823,
&end
#
# 55 LEU QQD 58 LYS HA 4.38 (#peak 3146)
&rst
ixpk= 3146, nxpk= 0, iat= -1, 862, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 825, 826, 827, 821, 822, 823,
&end
#
# 55 LEU QQD 60 ALA HA 4.13 (#peak 930)
&rst
ixpk= 930, nxpk= 0, iat= -1, 898, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 825, 826, 827, 821, 822, 823,
&end
#
# 56 GLU HN 56 GLU HB2 3.91 (#peak 1344)
&rst
ixpk= 1344, nxpk= 0, iat= 831, 835, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 56 GLU HN 56 GLU HB3 3.60 (#peak 926)
&rst
ixpk= 926, nxpk= 0, iat= 831, 836, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 56 GLU HN 56 GLU HG2 4.73 (#peak 2581)
&rst
ixpk= 2581, nxpk= 0, iat= 831, 838, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 56 GLU HN 56 GLU HG3 4.42 (#peak 925)
&rst
ixpk= 925, nxpk= 0, iat= 831, 839, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 56 GLU HN 57 ASN HN 4.33 (#peak 922)
&rst
ixpk= 922, nxpk= 0, iat= 831, 846, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 56 GLU HN 57 ASN HB2 6.03 (#peak 946)
&rst
ixpk= 946, nxpk= 0, iat= 831, 850, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 56 GLU HN 58 LYS HN 5.21 (#peak 957)
&rst
ixpk= 957, nxpk= 0, iat= 831, 860, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 56 GLU HA 56 GLU HG3 3.98 (#peak 306)
&rst
ixpk= 306, nxpk= 0, iat= 833, 839, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 56 GLU HB2 57 ASN HN 4.59 (#peak 637)
&rst
ixpk= 637, nxpk= 0, iat= 835, 846, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 56 GLU HB3 57 ASN HN 4.37 (#peak 1347)
&rst
ixpk= 1347, nxpk= 0, iat= 836, 846, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 56 GLU HG2 57 ASN HN 4.73 (#peak 1050)
&rst
ixpk= 1050, nxpk= 0, iat= 838, 846, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 56 GLU HG2 57 ASN HB3 5.38 (#peak 2314)
&rst
ixpk= 2314, nxpk= 0, iat= 838, 851, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 56 GLU HG3 57 ASN HB2 5.40 (#peak 2302)
&rst
ixpk= 2302, nxpk= 0, iat= 839, 850, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 57 ASN HN 57 ASN HB2 4.00 (#peak 2275)
&rst
ixpk= 2275, nxpk= 0, iat= 846, 850, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 57 ASN HN 57 ASN HB3 4.10 (#peak 995)
&rst
ixpk= 995, nxpk= 0, iat= 846, 851, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 57 ASN HN 58 LYS HA 5.12 (#peak 1186)
&rst
ixpk= 1186, nxpk= 0, iat= 846, 862, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 57 ASN HA 58 LYS QD 5.15 (#peak 1020)
&rst
ixpk= 1020, nxpk= 0, iat= 848, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2= 870, 871,
&end
#
# 57 ASN HA 58 LYS QG 5.94 (#peak 1045)
&rst
ixpk= 1045, nxpk= 0, iat= 848, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr2= 867, 868,
&end
#
# 57 ASN HA 59 THR HN 5.12 (#peak 1450)
&rst
ixpk= 1450, nxpk= 0, iat= 848, 882, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 57 ASN HB2 58 LYS HN 5.96 (#peak 944)
&rst
ixpk= 944, nxpk= 0, iat= 850, 860, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 57 ASN HB2 59 THR HN 5.29 (#peak 1451)
&rst
ixpk= 1451, nxpk= 0, iat= 850, 882, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 57 ASN HB3 58 LYS HN 5.87 (#peak 945)
&rst
ixpk= 945, nxpk= 0, iat= 851, 860, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 57 ASN HB3 59 THR HN 5.13 (#peak 1439)
&rst
ixpk= 1439, nxpk= 0, iat= 851, 882, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 57 ASN HB3 59 THR QG2 5.24 (#peak 2239)
&rst
ixpk= 2239, nxpk= 0, iat= 851, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2= 888, 889, 890,
&end
#
# 58 LYS HN 58 LYS QD 5.37 (#peak 1048)
&rst
ixpk= 1048, nxpk= 0, iat= 860, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2= 870, 871,
&end
#
# 58 LYS HN 58 LYS QG 4.67 (#peak 962)
&rst
ixpk= 962, nxpk= 0, iat= 860, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2= 867, 868,
&end
#
# 58 LYS HN 59 THR HN 4.09 (#peak 958)
&rst
ixpk= 958, nxpk= 0, iat= 860, 882, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 58 LYS HN 59 THR HA 6.25 (#peak 941)
&rst
ixpk= 941, nxpk= 0, iat= 860, 884, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 58 LYS HA 58 LYS QD 4.48 (#peak 1515)
&rst
ixpk= 1515, nxpk= 0, iat= 862, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2= 870, 871,
&end
#
# 58 LYS HB2 58 LYS QD 3.68 (#peak 1516)
&rst
ixpk= 1516, nxpk= 0, iat= 864, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2= 870, 871,
&end
#
# 58 LYS HB2 59 THR HN 4.92 (#peak 1440)
&rst
ixpk= 1440, nxpk= 0, iat= 864, 882, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 58 LYS HB3 59 THR HN 4.53 (#peak 1345)
&rst
ixpk= 1345, nxpk= 0, iat= 865, 882, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 58 LYS QG 59 THR HN 5.42 (#peak 1442)
&rst
ixpk= 1442, nxpk= 0, iat= -1, 882, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 867, 868,
&end
#
# 59 THR HN 59 THR QG2 4.15 (#peak 1494)
&rst
ixpk= 1494, nxpk= 0, iat= 882, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2= 888, 889, 890,
&end
#
# 59 THR HN 60 ALA HN 5.90 (#peak 525)
&rst
ixpk= 525, nxpk= 0, iat= 882, 896, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40, &end
#
# 59 THR HA 59 THR QG2 3.51 (#peak 332)
&rst
ixpk= 332, nxpk= 0, iat= 884, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 888, 889, 890,
&end
#
# 59 THR HA 60 ALA HN 3.43 (#peak 319)
&rst
ixpk= 319, nxpk= 0, iat= 884, 896, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 59 THR HA 60 ALA HA 4.63 (#peak 661)
&rst
ixpk= 661, nxpk= 0, iat= 884, 898, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 59 THR HB 60 ALA HN 3.68 (#peak 6)
&rst
ixpk= 6, nxpk= 0, iat= 886, 896, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 59 THR HB 60 ALA HA 5.30 (#peak 15)
&rst
ixpk= 15, nxpk= 0, iat= 886, 898, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 59 THR HB 61 GLN HE21 5.24 (#peak 1268)
&rst
ixpk= 1268, nxpk= 0, iat= 886, 918, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 59 THR QG2 60 ALA HN 4.16 (#peak 1441)
&rst
ixpk= 1441, nxpk= 0, iat= -1, 896, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1= 888, 889, 890,
&end
#
# 60 ALA HN 60 ALA QB 3.82 (#peak 1176)
&rst
ixpk= 1176, nxpk= 0, iat= 896, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2= 900, 901, 902,
&end
#
# 60 ALA HA 61 GLN HN 3.36 (#peak 656)
&rst
ixpk= 656, nxpk= 0, iat= 898, 906, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, &end
#
# 60 ALA HA 61 GLN QB 5.00 (#peak 927)
&rst
ixpk= 927, nxpk= 0, iat= 898, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 910, 911,
&end
#
# 60 ALA QB 61 GLN HN 3.69 (#peak 1582)
&rst
ixpk= 1582, nxpk= 0, iat= -1, 906, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1= 900, 901, 902,
&end
#
# 60 ALA QB 61 GLN HE22 5.74 (#peak 3102)
&rst
ixpk= 3102, nxpk= 0, iat= -1, 919, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr1= 900, 901, 902,
&end
#
# 61 GLN HN 61 GLN HE21 5.60 (#peak 1290)
&rst
ixpk= 1290, nxpk= 0, iat= 906, 918, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 61 GLN HN 61 GLN HG3 4.97 (#peak 2782)
&rst
ixpk= 2782, nxpk= 0, iat= 906, 914, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 61 GLN HN 61 GLN QB 4.09 (#peak 536)
&rst
ixpk= 536, nxpk= 0, iat= 906, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2= 910, 911,
&end
#
# 61 GLN HN 62 VAL HN 5.85 (#peak 534)
&rst
ixpk= 534, nxpk= 0, iat= 906, 923, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 61 GLN HA 61 GLN HE21 5.28 (#peak 1277)
&rst
ixpk= 1277, nxpk= 0, iat= 908, 918, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 61 GLN HA 61 GLN HE22 5.12 (#peak 1282)
&rst
ixpk= 1282, nxpk= 0, iat= 908, 919, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 61 GLN HA 61 GLN HG2 4.13 (#peak 1085)
&rst
ixpk= 1085, nxpk= 0, iat= 908, 913, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 61 GLN HA 62 VAL HN 3.32 (#peak 556)
&rst
ixpk= 556, nxpk= 0, iat= 908, 923, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 61 GLN HA 62 VAL HB 5.42 (#peak 2731)
&rst
ixpk= 2731, nxpk= 0, iat= 908, 927, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 61 GLN HG2 62 VAL HN 4.85 (#peak 2780)
&rst
ixpk= 2780, nxpk= 0, iat= 913, 923, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 61 GLN HG3 62 VAL HN 5.64 (#peak 1520)
&rst
ixpk= 1520, nxpk= 0, iat= 914, 923, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 61 GLN QB 61 GLN HE21 6.13 (#peak 349)
&rst
ixpk= 349, nxpk= 0, iat= -1, 918, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr1= 910, 911,
&end
#
# 61 GLN QB 62 VAL HN 4.93 (#peak 347)
&rst
ixpk= 347, nxpk= 0, iat= -1, 923, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr1= 910, 911,
&end
#
# 61 GLN QB 62 VAL HA 5.82 (#peak 225)
&rst
ixpk= 225, nxpk= 0, iat= -1, 925, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 910, 911,
&end
#
# 62 VAL HN 62 VAL QG1 4.62 (#peak 1327)
&rst
ixpk= 1327, nxpk= 0, iat= 923, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2= 929, 930, 931,
&end
#
# 62 VAL HN 62 VAL QG2 4.06 (#peak 1502)
&rst
ixpk= 1502, nxpk= 0, iat= 923, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2= 933, 934, 935,
&end
#
# 62 VAL HN 63 LYS HN 6.25 (#peak 142)
&rst
ixpk= 142, nxpk= 0, iat= 923, 939, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 62 VAL HN 64 TYR QD 6.25 (#peak 102)
&rst
ixpk= 102, nxpk= 0, iat= 923, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2= 969, 978,
&end
#
# 62 VAL HA 62 VAL QG1 3.62 (#peak 278)
&rst
ixpk= 278, nxpk= 0, iat= 925, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr2= 929, 930, 931,
&end
#
# 62 VAL HA 62 VAL QG2 3.67 (#peak 276)
&rst
ixpk= 276, nxpk= 0, iat= 925, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 933, 934, 935,
&end
#
# 62 VAL HA 63 LYS HN 3.54 (#peak 294)
&rst
ixpk= 294, nxpk= 0, iat= 925, 939, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 62 VAL HA 63 LYS HB2 5.44 (#peak 1955)
&rst
ixpk= 1955, nxpk= 0, iat= 925, 943, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 62 VAL HA 63 LYS QD 5.07 (#peak 269)
&rst
ixpk= 269, nxpk= 0, iat= 925, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2= 949, 950,
&end
#
# 62 VAL HB 63 LYS HN 5.42 (#peak 141)
&rst
ixpk= 141, nxpk= 0, iat= 927, 939, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 62 VAL HB 64 TYR QD 5.28 (#peak 2730)
&rst
ixpk= 2730, nxpk= 0, iat= 927, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2= 969, 978,
&end
#
# 62 VAL HB 74 LEU QD1 6.24 (#peak 2736)
&rst
ixpk= 2736, nxpk= 0, iat= 927, -1, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
igr2=1104,1105,1106,
&end
#
# 62 VAL QG1 63 LYS HN 3.95 (#peak 1625)
&rst
ixpk= 1625, nxpk= 0, iat= -1, 939, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1= 929, 930, 931,
&end
#
# 62 VAL QG1 63 LYS HA 5.10 (#peak 277)
&rst
ixpk= 277, nxpk= 0, iat= -1, 941, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 929, 930, 931,
&end
#
# 62 VAL QG1 64 TYR QD 3.38 (#peak 1626)
&rst
ixpk= 1626, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1= 929, 930, 931,
igr2= 969, 978,
&end
#
# 62 VAL QG1 74 LEU QD1 3.10 (#peak 1610)
&rst
ixpk= 1610, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1= 929, 930, 931,
igr2=1104,1105,1106,
&end
#
# 62 VAL QG2 63 LYS HN 4.93 (#peak 1503)
&rst
ixpk= 1503, nxpk= 0, iat= -1, 939, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 933, 934, 935,
&end
#
# 62 VAL QG2 64 TYR HA 4.21 (#peak 523)
&rst
ixpk= 523, nxpk= 0, iat= -1, 963, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1= 933, 934, 935,
&end
#
# 62 VAL QG2 64 TYR HB3 4.30 (#peak 887)
&rst
ixpk= 887, nxpk= 0, iat= -1, 966, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1= 933, 934, 935,
&end
#
# 62 VAL QG2 64 TYR QD 5.00 (#peak 1455)
&rst
ixpk= 1455, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 933, 934, 935,
igr2= 969, 978,
&end
#
# 62 VAL QG2 74 LEU QD1 3.01 (#peak 1497)
&rst
ixpk= 1497, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1= 933, 934, 935,
igr2=1104,1105,1106,
&end
#
# 63 LYS HN 63 LYS QD 4.83 (#peak 1329)
&rst
ixpk= 1329, nxpk= 0, iat= 939, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2= 949, 950,
&end
#
# 63 LYS HN 63 LYS QG 6.02 (#peak 992)
&rst
ixpk= 992, nxpk= 0, iat= 939, -1, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr2= 946, 947,
&end
#
# 63 LYS HN 64 TYR QD 6.25 (#peak 159)
&rst
ixpk= 159, nxpk= 0, iat= 939, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2= 969, 978,
&end
#
# 63 LYS HA 63 LYS QD 4.49 (#peak 1330)
&rst
ixpk= 1330, nxpk= 0, iat= 941, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 949, 950,
&end
#
# 63 LYS HA 64 TYR QD 4.65 (#peak 526)
&rst
ixpk= 526, nxpk= 0, iat= 941, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 969, 978,
&end
#
# 63 LYS HB2 63 LYS QD 3.78 (#peak 1163)
&rst
ixpk= 1163, nxpk= 0, iat= 943, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2= 949, 950,
&end
#
# 63 LYS HB2 64 TYR HN 5.28 (#peak 1147)
&rst
ixpk= 1147, nxpk= 0, iat= 943, 961, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 63 LYS HB2 64 TYR HA 6.25 (#peak 316)
&rst
ixpk= 316, nxpk= 0, iat= 943, 963, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 63 LYS HB3 64 TYR HN 5.70 (#peak 388)
&rst
ixpk= 388, nxpk= 0, iat= 944, 961, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 63 LYS QG 64 TYR HN 6.25 (#peak 995)
&rst
ixpk= 995, nxpk= 0, iat= -1, 961, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1= 946, 947,
&end
#
# 64 TYR HN 64 TYR QD 4.51 (#peak 363)
&rst
ixpk= 363, nxpk= 0, iat= 961, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 969, 978,
&end
#
# 64 TYR HA 64 TYR QD 4.47 (#peak 524)
&rst
ixpk= 524, nxpk= 0, iat= 963, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2= 969, 978,
&end
#
# 64 TYR HA 65 ASP HA 6.25 (#peak 317)
&rst
ixpk= 317, nxpk= 0, iat= 963, 984, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 64 TYR HA 69 THR QG2 4.97 (#peak 1659)
&rst
ixpk= 1659, nxpk= 0, iat= 963, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=1036,1037,1038,
&end
#
# 64 TYR HA 74 LEU QD1 5.85 (#peak 978)
&rst
ixpk= 978, nxpk= 0, iat= 963, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr2=1104,1105,1106,
&end
#
# 64 TYR HB2 65 ASP HN 5.63 (#peak 1876)
&rst
ixpk= 1876, nxpk= 0, iat= 965, 982, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 64 TYR HB2 69 THR HB 6.23 (#peak 1592)
&rst
ixpk= 1592, nxpk= 0, iat= 965,1034, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73, &end
#
# 64 TYR HB2 74 LEU QD1 5.07 (#peak 874)
&rst
ixpk= 874, nxpk= 0, iat= 965, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr2=1104,1105,1106,
&end
#
# 64 TYR HB3 65 ASP HN 4.73 (#peak 884)
&rst
ixpk= 884, nxpk= 0, iat= 966, 982, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 64 TYR HB3 69 THR QG2 4.14 (#peak 1752)
&rst
ixpk= 1752, nxpk= 0, iat= 966, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2=1036,1037,1038,
&end
#
# 64 TYR HB3 74 LEU QD1 5.94 (#peak 1881)
&rst
ixpk= 1881, nxpk= 0, iat= 966, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr2=1104,1105,1106,
&end
#
# 64 TYR QD 65 ASP HN 5.07 (#peak 579)
&rst
ixpk= 579, nxpk= 0, iat= -1, 982, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 969, 978,
&end
#
# 64 TYR QD 65 ASP QB 6.25 (#peak 1751)
&rst
ixpk= 1751, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr1= 969, 978,
igr2= 986, 987,
&end
#
# 64 TYR QD 66 PRO HA 3.64 (#peak 187)
&rst
ixpk= 187, nxpk= 0, iat= -1,1004, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
igr1= 969, 978,
&end
#
# 64 TYR QD 67 SER HN 6.09 (#peak 1062)
&rst
ixpk= 1062, nxpk= 0, iat= -1,1008, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
igr1= 969, 978,
&end
#
# 64 TYR QD 68 CYS HN 5.35 (#peak 916)
&rst
ixpk= 916, nxpk= 0, iat= -1,1019, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1= 969, 978,
&end
#
# 64 TYR QD 69 THR HN 4.57 (#peak 1093)
&rst
ixpk= 1093, nxpk= 0, iat= -1,1030, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 969, 978,
&end
#
# 64 TYR QD 69 THR QG2 3.28 (#peak 1751)
&rst
ixpk= 1751, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr1= 969, 978,
igr2=1036,1037,1038,
&end
#
# 64 TYR QD 70 SER HN 5.23 (#peak 1142)
&rst
ixpk= 1142, nxpk= 0, iat= -1,1044, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1= 969, 978,
&end
#
# 64 TYR QD 70 SER HA 4.17 (#peak 475)
&rst
ixpk= 475, nxpk= 0, iat= -1,1046, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 969, 978,
&end
#
# 64 TYR QD 71 PRO HD3 6.25 (#peak 861)
&rst
ixpk= 861, nxpk= 0, iat= -1,1057, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1= 969, 978,
&end
#
# 64 TYR QD 74 LEU QD1 4.17 (#peak 1495)
&rst
ixpk= 1495, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 969, 978,
igr2=1104,1105,1106,
&end
#
# 64 TYR QD 74 LEU QD2 5.13 (#peak 1153)
&rst
ixpk= 1153, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
igr1= 969, 978,
igr2=1108,1109,1110,
&end
#
# 65 ASP HN 65 ASP QB 4.11 (#peak 832)
&rst
ixpk= 832, nxpk= 0, iat= 982, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2= 986, 987,
&end
#
# 65 ASP HN 69 THR QG2 4.66 (#peak 1655)
&rst
ixpk= 1655, nxpk= 0, iat= 982, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2=1036,1037,1038,
&end
#
# 65 ASP HA 66 PRO QD 3.37 (#peak 608)
&rst
ixpk= 608, nxpk= 0, iat= 984, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2= 995, 996,
&end
#
# 65 ASP QB 67 SER HB3 4.45 (#peak 178)
&rst
ixpk= 178, nxpk= 0, iat= -1,1013, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr1= 986, 987,
&end
#
# 65 ASP QB 68 CYS HN 6.25 (#peak 1757)
&rst
ixpk= 1757, nxpk= 0, iat= -1,1019, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1= 986, 987,
&end
#
# 65 ASP QB 69 THR HN 6.25 (#peak 1804)
&rst
ixpk= 1804, nxpk= 0, iat= -1,1030, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1= 986, 987,
&end
#
# 66 PRO HA 68 CYS HN 5.21 (#peak 917)
&rst
ixpk= 917, nxpk= 0, iat=1004,1019, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 66 PRO HA 69 THR HN 4.52 (#peak 169)
&rst
ixpk= 169, nxpk= 0, iat=1004,1030, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 66 PRO HA 69 THR QG2 4.72 (#peak 3140)
&rst
ixpk= 3140, nxpk= 0, iat=1004, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2=1036,1037,1038,
&end
#
# 66 PRO QB 67 SER HA 5.82 (#peak 2615)
&rst
ixpk= 2615, nxpk= 0, iat= -1,1010, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1=1001,1002,
&end
#
# 66 PRO QB 67 SER HB2 6.25 (#peak 2166)
&rst
ixpk= 2166, nxpk= 0, iat= -1,1012, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=1001,1002,
&end
#
# 66 PRO QB 68 CYS HN 6.25 (#peak 918)
&rst
ixpk= 918, nxpk= 0, iat= -1,1019, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=1001,1002,
&end
#
# 66 PRO QD 67 SER HN 4.09 (#peak 1064)
&rst
ixpk= 1064, nxpk= 0, iat= -1,1008, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1= 995, 996,
&end
#
# 66 PRO QD 68 CYS HN 5.76 (#peak 912)
&rst
ixpk= 912, nxpk= 0, iat= -1,1019, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr1= 995, 996,
&end
#
# 66 PRO QD 69 THR HN 6.25 (#peak 1111)
&rst
ixpk= 1111, nxpk= 0, iat= -1,1030, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1= 995, 996,
&end
#
# 66 PRO QG 67 SER HN 5.41 (#peak 1069)
&rst
ixpk= 1069, nxpk= 0, iat= -1,1008, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 998, 999,
&end
#
# 67 SER HN 67 SER HB2 4.02 (#peak 153)
&rst
ixpk= 153, nxpk= 0, iat=1008,1012, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 67 SER HN 68 CYS HN 3.98 (#peak 1061)
&rst
ixpk= 1061, nxpk= 0, iat=1008,1019, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 67 SER HN 69 THR HN 4.61 (#peak 1099)
&rst
ixpk= 1099, nxpk= 0, iat=1008,1030, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 67 SER HN 69 THR QG2 5.73 (#peak 1070)
&rst
ixpk= 1070, nxpk= 0, iat=1008, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr2=1036,1037,1038,
&end
#
# 67 SER HA 67 SER HB3 2.96 (#peak 158)
&rst
ixpk= 158, nxpk= 0, iat=1010,1013, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46, &end
#
# 68 CYS HN 68 CYS HB2 3.93 (#peak 1226)
&rst
ixpk= 1226, nxpk= 0, iat=1019,1023, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 68 CYS HN 68 CYS HB3 4.08 (#peak 1229)
&rst
ixpk= 1229, nxpk= 0, iat=1019,1024, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 68 CYS HN 69 THR QG2 4.93 (#peak 915)
&rst
ixpk= 915, nxpk= 0, iat=1019, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2=1036,1037,1038,
&end
#
# 68 CYS HB2 69 THR QG2 4.56 (#peak 209)
&rst
ixpk= 209, nxpk= 0, iat=1023, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2=1036,1037,1038,
&end
#
# 68 CYS HB3 69 THR HN 4.48 (#peak 1101)
&rst
ixpk= 1101, nxpk= 0, iat=1024,1030, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 68 CYS HB3 69 THR HB 5.10 (#peak 49)
&rst
ixpk= 49, nxpk= 0, iat=1024,1034, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 68 CYS HB3 69 THR QG2 4.36 (#peak 216)
&rst
ixpk= 216, nxpk= 0, iat=1024, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1036,1037,1038,
&end
#
# 69 THR HN 69 THR QG2 4.07 (#peak 1097)
&rst
ixpk= 1097, nxpk= 0, iat=1030, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1036,1037,1038,
&end
#
# 69 THR HA 73 ALA QB 4.48 (#peak 296)
&rst
ixpk= 296, nxpk= 0, iat=1032, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2=1089,1090,1091,
&end
#
# 69 THR HB 70 SER HN 5.61 (#peak 1603)
&rst
ixpk= 1603, nxpk= 0, iat=1034,1044, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 69 THR HB 73 ALA QB 6.25 (#peak 1591)
&rst
ixpk= 1591, nxpk= 0, iat=1034, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr2=1089,1090,1091,
&end
#
# 69 THR QG2 70 SER HN 4.24 (#peak 1126)
&rst
ixpk= 1126, nxpk= 0, iat= -1,1044, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr1=1036,1037,1038,
&end
#
# 69 THR QG2 70 SER QB 6.25 (#peak 2028)
&rst
ixpk= 2028, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.43, r4= 8.93,
igr1=1036,1037,1038,
igr2=1048,1049,
&end
#
# 69 THR QG2 74 LEU HG 4.24 (#peak 961)
&rst
ixpk= 961, nxpk= 0, iat= -1,1102, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr1=1036,1037,1038,
&end
#
# 69 THR QG2 74 LEU QD1 4.66 (#peak 1663)
&rst
ixpk= 1663, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.72, r4= 7.22,
igr1=1036,1037,1038,
igr2=1104,1105,1106,
&end
#
# 69 THR QG2 74 LEU QD2 3.03 (#peak 1740)
&rst
ixpk= 1740, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1=1036,1037,1038,
igr2=1108,1109,1110,
&end
#
# 70 SER HN 73 ALA HN 4.75 (#peak 1123)
&rst
ixpk= 1123, nxpk= 0, iat=1044,1085, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 70 SER HN 73 ALA QB 3.11 (#peak 1792)
&rst
ixpk= 1792, nxpk= 0, iat=1044, -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr2=1089,1090,1091,
&end
#
# 70 SER HN 74 LEU QD1 5.42 (#peak 1132)
&rst
ixpk= 1132, nxpk= 0, iat=1044, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr2=1104,1105,1106,
&end
#
# 70 SER HN 74 LEU QD2 5.47 (#peak 1131)
&rst
ixpk= 1131, nxpk= 0, iat=1044, -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr2=1108,1109,1110,
&end
#
# 70 SER HA 72 VAL HN 6.05 (#peak 1102)
&rst
ixpk= 1102, nxpk= 0, iat=1046,1069, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 70 SER HA 73 ALA HN 6.25 (#peak 314)
&rst
ixpk= 314, nxpk= 0, iat=1046,1085, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 70 SER QB 71 PRO HD2 4.31 (#peak 858)
&rst
ixpk= 858, nxpk= 0, iat= -1,1056, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1=1048,1049,
&end
#
# 70 SER QB 72 VAL HN 6.25 (#peak 2029)
&rst
ixpk= 2029, nxpk= 0, iat= -1,1069, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=1048,1049,
&end
#
# 71 PRO HA 74 LEU HN 5.27 (#peak 74)
&rst
ixpk= 74, nxpk= 0, iat=1065,1095, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 71 PRO HA 74 LEU HB3 4.65 (#peak 1822)
&rst
ixpk= 1822, nxpk= 0, iat=1065,1100, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 71 PRO HA 74 LEU QD1 3.95 (#peak 980)
&rst
ixpk= 980, nxpk= 0, iat=1065, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1104,1105,1106,
&end
#
# 71 PRO HA 75 GLN HN 6.25 (#peak 1797)
&rst
ixpk= 1797, nxpk= 0, iat=1065,1114, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 71 PRO HD2 72 VAL HN 4.04 (#peak 1113)
&rst
ixpk= 1113, nxpk= 0, iat=1056,1069, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 72 VAL HN 72 VAL HB 3.63 (#peak 1240)
&rst
ixpk= 1240, nxpk= 0, iat=1069,1073, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 72 VAL HN 72 VAL QG1 3.29 (#peak 1606)
&rst
ixpk= 1606, nxpk= 0, iat=1069, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2=1075,1076,1077,
&end
#
# 72 VAL HN 72 VAL QG2 4.30 (#peak 1545)
&rst
ixpk= 1545, nxpk= 0, iat=1069, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2=1079,1080,1081,
&end
#
# 72 VAL HN 73 ALA HN 4.66 (#peak 289)
&rst
ixpk= 289, nxpk= 0, iat=1069,1085, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 72 VAL HN 73 ALA QB 4.91 (#peak 1103)
&rst
ixpk= 1103, nxpk= 0, iat=1069, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=1089,1090,1091,
&end
#
# 72 VAL HN 90 LEU QQD 4.81 (#peak 3103)
&rst
ixpk= 3103, nxpk= 0, iat=1069, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr2=1359,1360,1361,1355,1356,1357,
&end
#
# 72 VAL HA 72 VAL QG1 3.33 (#peak 1276)
&rst
ixpk= 1276, nxpk= 0, iat=1071, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2=1075,1076,1077,
&end
#
# 72 VAL HA 72 VAL QG2 3.22 (#peak 124)
&rst
ixpk= 124, nxpk= 0, iat=1071, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2=1079,1080,1081,
&end
#
# 72 VAL HA 73 ALA HA 5.40 (#peak 1913)
&rst
ixpk= 1913, nxpk= 0, iat=1071,1087, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 72 VAL HA 75 GLN HN 4.55 (#peak 99)
&rst
ixpk= 99, nxpk= 0, iat=1071,1114, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 72 VAL HA 75 GLN HB2 3.96 (#peak 125)
&rst
ixpk= 125, nxpk= 0, iat=1071,1118, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 72 VAL HA 75 GLN HB3 4.01 (#peak 1912)
&rst
ixpk= 1912, nxpk= 0, iat=1071,1119, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 72 VAL HB 73 ALA HN 3.93 (#peak 1944)
&rst
ixpk= 1944, nxpk= 0, iat=1073,1085, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 72 VAL QG1 73 ALA HN 4.47 (#peak 1942)
&rst
ixpk= 1942, nxpk= 0, iat= -1,1085, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1075,1076,1077,
&end
#
# 72 VAL QG2 73 ALA HN 3.89 (#peak 1945)
&rst
ixpk= 1945, nxpk= 0, iat= -1,1085, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1=1079,1080,1081,
&end
#
# 72 VAL QG2 73 ALA HA 4.44 (#peak 293)
&rst
ixpk= 293, nxpk= 0, iat= -1,1087, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1=1079,1080,1081,
&end
#
# 73 ALA HN 73 ALA QB 3.10 (#peak 1793)
&rst
ixpk= 1793, nxpk= 0, iat=1085, -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr2=1089,1090,1091,
&end
#
# 73 ALA HN 74 LEU HN 3.82 (#peak 288)
&rst
ixpk= 288, nxpk= 0, iat=1085,1095, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 73 ALA HN 74 LEU QD1 5.83 (#peak 308)
&rst
ixpk= 308, nxpk= 0, iat=1085, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr2=1104,1105,1106,
&end
#
# 73 ALA HN 74 LEU QD2 5.77 (#peak 1150)
&rst
ixpk= 1150, nxpk= 0, iat=1085, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr2=1108,1109,1110,
&end
#
# 73 ALA HN 75 GLN HN 4.60 (#peak 287)
&rst
ixpk= 287, nxpk= 0, iat=1085,1114, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 73 ALA HA 76 ARG HB2 3.41 (#peak 516)
&rst
ixpk= 516, nxpk= 0, iat=1087,1135, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 73 ALA QB 74 LEU QD2 4.89 (#peak 1157)
&rst
ixpk= 1157, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1=1089,1090,1091,
igr2=1108,1109,1110,
&end
#
# 74 LEU HN 74 LEU HG 4.44 (#peak 683)
&rst
ixpk= 683, nxpk= 0, iat=1095,1102, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 74 LEU HN 74 LEU QD1 4.29 (#peak 1479)
&rst
ixpk= 1479, nxpk= 0, iat=1095, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=1104,1105,1106,
&end
#
# 74 LEU HN 74 LEU QD2 3.86 (#peak 1577)
&rst
ixpk= 1577, nxpk= 0, iat=1095, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1108,1109,1110,
&end
#
# 74 LEU HN 75 GLN HN 4.72 (#peak 716)
&rst
ixpk= 716, nxpk= 0, iat=1095,1114, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 74 LEU HN 75 GLN HB2 6.25 (#peak 654)
&rst
ixpk= 654, nxpk= 0, iat=1095,1118, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 74 LEU HA 74 LEU QD1 3.84 (#peak 1914)
&rst
ixpk= 1914, nxpk= 0, iat=1097, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2=1104,1105,1106,
&end
#
# 74 LEU HA 74 LEU QD2 3.91 (#peak 1578)
&rst
ixpk= 1578, nxpk= 0, iat=1097, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2=1108,1109,1110,
&end
#
# 74 LEU HA 77 ALA HN 4.92 (#peak 544)
&rst
ixpk= 544, nxpk= 0, iat=1097,1155, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 74 LEU HA 77 ALA QB 3.56 (#peak 1761)
&rst
ixpk= 1761, nxpk= 0, iat=1097, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1159,1160,1161,
&end
#
# 74 LEU HB2 74 LEU QD1 4.05 (#peak 894)
&rst
ixpk= 894, nxpk= 0, iat=1099, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2=1104,1105,1106,
&end
#
# 74 LEU HB2 74 LEU QD2 4.21 (#peak 855)
&rst
ixpk= 855, nxpk= 0, iat=1099, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=1108,1109,1110,
&end
#
# 74 LEU HB2 75 GLN HN 4.32 (#peak 718)
&rst
ixpk= 718, nxpk= 0, iat=1099,1114, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 74 LEU HB3 74 LEU QD1 3.86 (#peak 868)
&rst
ixpk= 868, nxpk= 0, iat=1100, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1104,1105,1106,
&end
#
# 74 LEU HB3 74 LEU QD2 3.63 (#peak 867)
&rst
ixpk= 867, nxpk= 0, iat=1100, -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr2=1108,1109,1110,
&end
#
# 74 LEU HB3 75 GLN HN 4.28 (#peak 706)
&rst
ixpk= 706, nxpk= 0, iat=1100,1114, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 74 LEU HB3 75 GLN HB2 5.35 (#peak 670)
&rst
ixpk= 670, nxpk= 0, iat=1100,1118, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 74 LEU HG 75 GLN HN 5.82 (#peak 943)
&rst
ixpk= 943, nxpk= 0, iat=1102,1114, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 74 LEU QD1 75 GLN HN 4.87 (#peak 975)
&rst
ixpk= 975, nxpk= 0, iat= -1,1114, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=1104,1105,1106,
&end
#
# 74 LEU QD2 75 GLN HN 4.76 (#peak 1576)
&rst
ixpk= 1576, nxpk= 0, iat= -1,1114, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1108,1109,1110,
&end
#
# 75 GLN HN 75 GLN HB2 3.92 (#peak 1374)
&rst
ixpk= 1374, nxpk= 0, iat=1114,1118, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 75 GLN HN 75 GLN HB3 3.87 (#peak 1377)
&rst
ixpk= 1377, nxpk= 0, iat=1114,1119, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 75 GLN HA 75 GLN QG 3.88 (#peak 310)
&rst
ixpk= 310, nxpk= 0, iat=1116, -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr2=1121,1122,
&end
#
# 75 GLN HA 77 ALA HN 4.60 (#peak 308)
&rst
ixpk= 308, nxpk= 0, iat=1116,1155, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 75 GLN HA 78 ILE HG13 3.99 (#peak 1918)
&rst
ixpk= 1918, nxpk= 0, iat=1116,1176, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 75 GLN HA 88 VAL HB 5.76 (#peak 2874)
&rst
ixpk= 2874, nxpk= 0, iat=1116,1323, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 75 GLN HA 88 VAL QG1 4.20 (#peak 1195)
&rst
ixpk= 1195, nxpk= 0, iat=1116, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1325,1326,1327,
&end
#
# 75 GLN HA 88 VAL QG2 3.98 (#peak 1917)
&rst
ixpk= 1917, nxpk= 0, iat=1116, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1329,1330,1331,
&end
#
# 75 GLN HB2 90 LEU QQD 5.17 (#peak 3115)
&rst
ixpk= 3115, nxpk= 0, iat=1118, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr2=1359,1360,1361,1355,1356,1357,
&end
#
# 75 GLN HE21 88 VAL QG1 5.73 (#peak 1912)
&rst
ixpk= 1912, nxpk= 0, iat=1126, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr2=1325,1326,1327,
&end
#
# 75 GLN HE21 88 VAL QG2 4.79 (#peak 1913)
&rst
ixpk= 1913, nxpk= 0, iat=1126, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr2=1329,1330,1331,
&end
#
# 75 GLN HE21 90 LEU HN 4.09 (#peak 1905)
&rst
ixpk= 1905, nxpk= 0, iat=1126,1346, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 75 GLN HE21 90 LEU QQD 4.82 (#peak 3106)
&rst
ixpk= 3106, nxpk= 0, iat=1126, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2=1359,1360,1361,1355,1356,1357,
&end
#
# 75 GLN HE22 88 VAL QG1 5.67 (#peak 1911)
&rst
ixpk= 1911, nxpk= 0, iat=1127, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr2=1325,1326,1327,
&end
#
# 75 GLN HE22 88 VAL QG2 4.94 (#peak 1910)
&rst
ixpk= 1910, nxpk= 0, iat=1127, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=1329,1330,1331,
&end
#
# 75 GLN HE22 90 LEU HN 3.70 (#peak 1904)
&rst
ixpk= 1904, nxpk= 0, iat=1127,1346, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 75 GLN HE22 90 LEU QQD 5.00 (#peak 1909)
&rst
ixpk= 1909, nxpk= 0, iat=1127, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr2=1359,1360,1361,1355,1356,1357,
&end
#
# 75 GLN QG 79 GLU HG2 5.70 (#peak 2406)
&rst
ixpk= 2406, nxpk= 0, iat= -1,1191, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=1121,1122,
&end
#
# 75 GLN QG 88 VAL QG2 3.66 (#peak 3037)
&rst
ixpk= 3037, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=1121,1122,
igr2=1329,1330,1331,
&end
#
# 76 ARG HB2 77 ALA HN 3.85 (#peak 570)
&rst
ixpk= 570, nxpk= 0, iat=1135,1155, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 76 ARG HB2 77 ALA QB 4.46 (#peak 1739)
&rst
ixpk= 1739, nxpk= 0, iat=1135, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2=1159,1160,1161,
&end
#
# 77 ALA HN 77 ALA QB 3.29 (#peak 1736)
&rst
ixpk= 1736, nxpk= 0, iat=1155, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2=1159,1160,1161,
&end
#
# 77 ALA HN 78 ILE QG2 4.67 (#peak 546)
&rst
ixpk= 546, nxpk= 0, iat=1155, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=1171,1172,1173,
&end
#
# 77 ALA HA 80 ALA HN 4.75 (#peak 548)
&rst
ixpk= 548, nxpk= 0, iat=1157,1199, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 77 ALA QB 78 ILE HN 2.87 (#peak 1777)
&rst
ixpk= 1777, nxpk= 0, iat= -1,1165, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,
igr1=1159,1160,1161,
&end
#
# 77 ALA QB 78 ILE QG2 3.25 (#peak 1740)
&rst
ixpk= 1740, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1=1159,1160,1161,
igr2=1171,1172,1173,
&end
#
# 78 ILE HN 78 ILE HB 3.82 (#peak 1020)
&rst
ixpk= 1020, nxpk= 0, iat=1165,1169, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 78 ILE HN 78 ILE HG12 3.75 (#peak 1257)
&rst
ixpk= 1257, nxpk= 0, iat=1165,1175, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 78 ILE HN 78 ILE HG13 4.04 (#peak 901)
&rst
ixpk= 901, nxpk= 0, iat=1165,1176, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 78 ILE HN 78 ILE QD1 3.88 (#peak 1893)
&rst
ixpk= 1893, nxpk= 0, iat=1165, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2=1178,1179,1180,
&end
#
# 78 ILE HN 78 ILE QG2 5.01 (#peak 910)
&rst
ixpk= 910, nxpk= 0, iat=1165, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2=1171,1172,1173,
&end
#
# 78 ILE HN 80 ALA HN 5.87 (#peak 2063)
&rst
ixpk= 2063, nxpk= 0, iat=1165,1199, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 78 ILE HN 81 LEU QD1 5.51 (#peak 3152)
&rst
ixpk= 3152, nxpk= 0, iat=1165, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr2=1218,1219,1220,
&end
#
# 78 ILE HA 78 ILE HG13 3.63 (#peak 115)
&rst
ixpk= 115, nxpk= 0, iat=1167,1176, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 78 ILE HA 78 ILE QD1 4.34 (#peak 1894)
&rst
ixpk= 1894, nxpk= 0, iat=1167, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2=1178,1179,1180,
&end
#
# 78 ILE HA 78 ILE QG2 3.56 (#peak 113)
&rst
ixpk= 113, nxpk= 0, iat=1167, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1171,1172,1173,
&end
#
# 78 ILE HA 80 ALA HN 5.80 (#peak 762)
&rst
ixpk= 762, nxpk= 0, iat=1167,1199, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 78 ILE HA 81 LEU HN 4.91 (#peak 1648)
&rst
ixpk= 1648, nxpk= 0, iat=1167,1209, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 78 ILE HA 81 LEU HG 4.51 (#peak 127)
&rst
ixpk= 127, nxpk= 0, iat=1167,1216, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 78 ILE HA 81 LEU QD1 3.85 (#peak 128)
&rst
ixpk= 128, nxpk= 0, iat=1167, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1218,1219,1220,
&end
#
# 78 ILE HB 79 GLU HN 4.76 (#peak 1630)
&rst
ixpk= 1630, nxpk= 0, iat=1169,1184, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 78 ILE HG13 79 GLU HN 4.31 (#peak 1627)
&rst
ixpk= 1627, nxpk= 0, iat=1176,1184, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 78 ILE HG13 79 GLU HA 4.80 (#peak 324)
&rst
ixpk= 324, nxpk= 0, iat=1176,1186, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 78 ILE HG13 79 GLU HG2 6.12 (#peak 2407)
&rst
ixpk= 2407, nxpk= 0, iat=1176,1191, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62, &end
#
# 78 ILE HG13 80 ALA HN 5.41 (#peak 726)
&rst
ixpk= 726, nxpk= 0, iat=1176,1199, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 78 ILE HG13 81 LEU HN 5.47 (#peak 476)
&rst
ixpk= 476, nxpk= 0, iat=1176,1209, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 78 ILE HG13 88 VAL HN 5.84 (#peak 1655)
&rst
ixpk= 1655, nxpk= 0, iat=1176,1319, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 78 ILE QD1 88 VAL QG1 3.44 (#peak 1884)
&rst
ixpk= 1884, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1=1178,1179,1180,
igr2=1325,1326,1327,
&end
#
# 78 ILE QG2 78 ILE QD1 2.99 (#peak 1705)
&rst
ixpk= 1705, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1=1171,1172,1173,
igr2=1178,1179,1180,
&end
#
# 78 ILE QG2 79 GLU HN 5.39 (#peak 1628)
&rst
ixpk= 1628, nxpk= 0, iat= -1,1184, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr1=1171,1172,1173,
&end
#
# 79 GLU HN 79 GLU HB2 4.14 (#peak 1047)
&rst
ixpk= 1047, nxpk= 0, iat=1184,1188, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 79 GLU HN 79 GLU HB3 4.13 (#peak 1631)
&rst
ixpk= 1631, nxpk= 0, iat=1184,1189, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 79 GLU HN 79 GLU HG2 4.63 (#peak 1024)
&rst
ixpk= 1024, nxpk= 0, iat=1184,1191, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 79 GLU HN 79 GLU HG3 5.04 (#peak 1046)
&rst
ixpk= 1046, nxpk= 0, iat=1184,1192, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 79 GLU HN 80 ALA HN 4.42 (#peak 744)
&rst
ixpk= 744, nxpk= 0, iat=1184,1199, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 79 GLU HN 81 LEU HN 6.25 (#peak 425)
&rst
ixpk= 425, nxpk= 0, iat=1184,1209, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 79 GLU HA 81 LEU HN 5.00 (#peak 471)
&rst
ixpk= 471, nxpk= 0, iat=1186,1209, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 79 GLU HA 87 LYS HA 5.94 (#peak 2666)
&rst
ixpk= 2666, nxpk= 0, iat=1186,1299, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 79 GLU HA 88 VAL HN 5.15 (#peak 3157)
&rst
ixpk= 3157, nxpk= 0, iat=1186,1319, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 79 GLU HA 88 VAL QG1 5.45 (#peak 2669)
&rst
ixpk= 2669, nxpk= 0, iat=1186, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr2=1325,1326,1327,
&end
#
# 79 GLU HB2 80 ALA HN 5.39 (#peak 1341)
&rst
ixpk= 1341, nxpk= 0, iat=1188,1199, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 79 GLU HB3 80 ALA HN 5.23 (#peak 765)
&rst
ixpk= 765, nxpk= 0, iat=1189,1199, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 79 GLU HB3 81 LEU HN 5.04 (#peak 1652)
&rst
ixpk= 1652, nxpk= 0, iat=1189,1209, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 79 GLU HG2 80 ALA HN 6.25 (#peak 763)
&rst
ixpk= 763, nxpk= 0, iat=1191,1199, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 79 GLU HG2 87 LYS HA 5.96 (#peak 2403)
&rst
ixpk= 2403, nxpk= 0, iat=1191,1299, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 79 GLU HG2 88 VAL HN 5.29 (#peak 1025)
&rst
ixpk= 1025, nxpk= 0, iat=1191,1319, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 79 GLU HG3 80 ALA HN 5.26 (#peak 1635)
&rst
ixpk= 1635, nxpk= 0, iat=1192,1199, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 79 GLU HG3 87 LYS HA 5.14 (#peak 2412)
&rst
ixpk= 2412, nxpk= 0, iat=1192,1299, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 79 GLU HG3 88 VAL HN 4.95 (#peak 1028)
&rst
ixpk= 1028, nxpk= 0, iat=1192,1319, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 80 ALA HN 80 ALA QB 3.22 (#peak 1679)
&rst
ixpk= 1679, nxpk= 0, iat=1199, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2=1203,1204,1205,
&end
#
# 80 ALA HN 81 LEU QD2 6.25 (#peak 1687)
&rst
ixpk= 1687, nxpk= 0, iat=1199, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr2=1222,1223,1224,
&end
#
# 80 ALA QB 81 LEU HN 4.14 (#peak 474)
&rst
ixpk= 474, nxpk= 0, iat= -1,1209, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1=1203,1204,1205,
&end
#
# 80 ALA QB 84 GLY HN 4.99 (#peak 1175)
&rst
ixpk= 1175, nxpk= 0, iat= -1,1256, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1203,1204,1205,
&end
#
# 80 ALA QB 85 ASN HN 6.25 (#peak 1662)
&rst
ixpk= 1662, nxpk= 0, iat= -1,1263, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1=1203,1204,1205,
&end
#
# 81 LEU HN 81 LEU HG 4.18 (#peak 1483)
&rst
ixpk= 1483, nxpk= 0, iat=1209,1216, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 81 LEU HN 81 LEU QD1 4.20 (#peak 1443)
&rst
ixpk= 1443, nxpk= 0, iat=1209, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1218,1219,1220,
&end
#
# 81 LEU HN 81 LEU QD2 4.29 (#peak 475)
&rst
ixpk= 475, nxpk= 0, iat=1209, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=1222,1223,1224,
&end
#
# 81 LEU HA 81 LEU QD1 4.75 (#peak 831)
&rst
ixpk= 831, nxpk= 0, iat=1211, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1218,1219,1220,
&end
#
# 81 LEU HA 81 LEU QD2 3.71 (#peak 577)
&rst
ixpk= 577, nxpk= 0, iat=1211, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2=1222,1223,1224,
&end
#
# 81 LEU HB2 81 LEU QD1 3.26 (#peak 1447)
&rst
ixpk= 1447, nxpk= 0, iat=1213, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=1218,1219,1220,
&end
#
# 81 LEU HB2 86 PHE QD 6.25 (#peak 2009)
&rst
ixpk= 2009, nxpk= 0, iat=1213, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=1285,1293,
&end
#
# 81 LEU HB3 81 LEU QD1 4.03 (#peak 838)
&rst
ixpk= 838, nxpk= 0, iat=1214, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=1218,1219,1220,
&end
#
# 81 LEU HB3 86 PHE QD 4.99 (#peak 946)
&rst
ixpk= 946, nxpk= 0, iat=1214, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2=1285,1293,
&end
#
# 81 LEU QD1 82 PRO HD2 4.67 (#peak 921)
&rst
ixpk= 921, nxpk= 0, iat= -1,1229, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=1218,1219,1220,
&end
#
# 81 LEU QD1 86 PHE HB2 6.05 (#peak 1010)
&rst
ixpk= 1010, nxpk= 0, iat= -1,1281, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1218,1219,1220,
&end
#
# 81 LEU QD1 86 PHE QD 5.37 (#peak 830)
&rst
ixpk= 830, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr1=1218,1219,1220,
igr2=1285,1293,
&end
#
# 82 PRO HB2 83 PRO QD 4.55 (#peak 659)
&rst
ixpk= 659, nxpk= 0, iat=1235, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2=1243,1244,
&end
#
# 82 PRO HB2 83 PRO QG 4.86 (#peak 1082)
&rst
ixpk= 1082, nxpk= 0, iat=1235, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2=1246,1247,
&end
#
# 82 PRO HB2 84 GLY HN 4.86 (#peak 1173)
&rst
ixpk= 1173, nxpk= 0, iat=1235,1256, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 82 PRO HB2 84 GLY HA2 6.25 (#peak 1206)
&rst
ixpk= 1206, nxpk= 0, iat=1235,1258, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 83 PRO HA 85 ASN HN 5.09 (#peak 982)
&rst
ixpk= 982, nxpk= 0, iat=1252,1263, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 83 PRO QB 84 GLY HN 4.26 (#peak 1181)
&rst
ixpk= 1181, nxpk= 0, iat= -1,1256, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1=1249,1250,
&end
#
# 83 PRO QB 85 ASN HN 5.55 (#peak 1639)
&rst
ixpk= 1639, nxpk= 0, iat= -1,1263, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1=1249,1250,
&end
#
# 83 PRO QB 85 ASN QD2 5.64 (#peak 1640)
&rst
ixpk= 1640, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr1=1249,1250,
igr2=1272,1273,
&end
#
# 83 PRO QD 84 GLY HN 5.30 (#peak 662)
&rst
ixpk= 662, nxpk= 0, iat= -1,1256, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr1=1243,1244,
&end
#
# 83 PRO QD 85 ASN HN 5.18 (#peak 985)
&rst
ixpk= 985, nxpk= 0, iat= -1,1263, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1=1243,1244,
&end
#
# 83 PRO QD 86 PHE QD 5.09 (#peak 3096)
&rst
ixpk= 3096, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr1=1243,1244,
igr2=1285,1293,
&end
#
# 83 PRO QG 84 GLY HN 4.72 (#peak 1174)
&rst
ixpk= 1174, nxpk= 0, iat= -1,1256, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1246,1247,
&end
#
# 83 PRO QG 85 ASN HN 5.05 (#peak 989)
&rst
ixpk= 989, nxpk= 0, iat= -1,1263, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1=1246,1247,
&end
#
# 83 PRO QG 85 ASN QD2 5.36 (#peak 1212)
&rst
ixpk= 1212, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr1=1246,1247,
igr2=1272,1273,
&end
#
# 84 GLY HN 85 ASN HN 4.47 (#peak 1638)
&rst
ixpk= 1638, nxpk= 0, iat=1256,1263, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 84 GLY HN 85 ASN HA 5.47 (#peak 1169)
&rst
ixpk= 1169, nxpk= 0, iat=1256,1265, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 84 GLY HN 85 ASN HB3 5.95 (#peak 1637)
&rst
ixpk= 1637, nxpk= 0, iat=1256,1268, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 84 GLY HA3 86 PHE HN 6.25 (#peak 582)
&rst
ixpk= 582, nxpk= 0, iat=1259,1277, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 85 ASN HN 85 ASN HB2 4.07 (#peak 988)
&rst
ixpk= 988, nxpk= 0, iat=1263,1267, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 85 ASN HN 85 ASN HB3 4.18 (#peak 987)
&rst
ixpk= 987, nxpk= 0, iat=1263,1268, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 85 ASN HN 85 ASN QD2 5.63 (#peak 979)
&rst
ixpk= 979, nxpk= 0, iat=1263, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2=1272,1273,
&end
#
# 85 ASN HN 86 PHE HN 3.93 (#peak 977)
&rst
ixpk= 977, nxpk= 0, iat=1263,1277, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 85 ASN HN 86 PHE HA 5.64 (#peak 980)
&rst
ixpk= 980, nxpk= 0, iat=1263,1279, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 85 ASN HN 86 PHE HB3 5.99 (#peak 986)
&rst
ixpk= 986, nxpk= 0, iat=1263,1282, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49, &end
#
# 85 ASN HN 86 PHE QD 5.54 (#peak 978)
&rst
ixpk= 978, nxpk= 0, iat=1263, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr2=1285,1293,
&end
#
# 85 ASN HB2 86 PHE HN 5.20 (#peak 560)
&rst
ixpk= 560, nxpk= 0, iat=1267,1277, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 85 ASN HB2 86 PHE HA 6.25 (#peak 2108)
&rst
ixpk= 2108, nxpk= 0, iat=1267,1279, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 85 ASN HB3 86 PHE HN 5.75 (#peak 2135)
&rst
ixpk= 2135, nxpk= 0, iat=1268,1277, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 86 PHE HN 86 PHE QD 4.08 (#peak 554)
&rst
ixpk= 554, nxpk= 0, iat=1277, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2=1285,1293,
&end
#
# 86 PHE HN 87 LYS HN 4.54 (#peak 581)
&rst
ixpk= 581, nxpk= 0, iat=1277,1297, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 86 PHE HA 86 PHE QD 3.76 (#peak 445)
&rst
ixpk= 445, nxpk= 0, iat=1279, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=1285,1293,
&end
#
# 86 PHE HA 87 LYS HB3 6.25 (#peak 103)
&rst
ixpk= 103, nxpk= 0, iat=1279,1302, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 86 PHE QD 87 LYS HN 4.56 (#peak 451)
&rst
ixpk= 451, nxpk= 0, iat= -1,1297, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1=1285,1293,
&end
#
# 87 LYS HN 87 LYS HE3 6.16 (#peak 1750)
&rst
ixpk= 1750, nxpk= 0, iat=1297,1311, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66, &end
#
# 87 LYS HN 87 LYS HG2 5.27 (#peak 1108)
&rst
ixpk= 1108, nxpk= 0, iat=1297,1304, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 87 LYS HN 87 LYS HG3 5.02 (#peak 1114)
&rst
ixpk= 1114, nxpk= 0, iat=1297,1305, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 87 LYS HA 87 LYS QD 3.95 (#peak 1403)
&rst
ixpk= 1403, nxpk= 0, iat=1299, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2=1307,1308,
&end
#
# 87 LYS HA 88 VAL QG2 5.48 (#peak 1259)
&rst
ixpk= 1259, nxpk= 0, iat=1299, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2=1329,1330,1331,
&end
#
# 87 LYS HB2 88 VAL HN 4.66 (#peak 1078)
&rst
ixpk= 1078, nxpk= 0, iat=1301,1319, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 87 LYS HB3 88 VAL HN 5.20 (#peak 1659)
&rst
ixpk= 1659, nxpk= 0, iat=1302,1319, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 87 LYS HE2 88 VAL HN 6.25 (#peak 1742)
&rst
ixpk= 1742, nxpk= 0, iat=1310,1319, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 87 LYS HG2 87 LYS HE2 3.85 (#peak 848)
&rst
ixpk= 848, nxpk= 0, iat=1304,1310, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 87 LYS HG2 88 VAL HN 5.19 (#peak 1107)
&rst
ixpk= 1107, nxpk= 0, iat=1304,1319, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 87 LYS HG2 88 VAL HA 6.25 (#peak 2519)
&rst
ixpk= 2519, nxpk= 0, iat=1304,1321, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 87 LYS HG3 87 LYS HE2 3.97 (#peak 1746)
&rst
ixpk= 1746, nxpk= 0, iat=1305,1310, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 87 LYS HG3 87 LYS HE3 3.92 (#peak 1749)
&rst
ixpk= 1749, nxpk= 0, iat=1305,1311, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 87 LYS HG3 88 VAL HN 6.13 (#peak 1661)
&rst
ixpk= 1661, nxpk= 0, iat=1305,1319, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63, &end
#
# 87 LYS QD 88 VAL HN 4.84 (#peak 1400)
&rst
ixpk= 1400, nxpk= 0, iat= -1,1319, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1=1307,1308,
&end
#
# 88 VAL HN 88 VAL HB 4.17 (#peak 1115)
&rst
ixpk= 1115, nxpk= 0, iat=1319,1323, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 88 VAL HN 88 VAL QG1 4.35 (#peak 1138)
&rst
ixpk= 1138, nxpk= 0, iat=1319, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=1325,1326,1327,
&end
#
# 88 VAL HN 88 VAL QG2 4.95 (#peak 1257)
&rst
ixpk= 1257, nxpk= 0, iat=1319, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2=1329,1330,1331,
&end
#
# 88 VAL HN 89 SER HN 6.25 (#peak 392)
&rst
ixpk= 392, nxpk= 0, iat=1319,1335, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 88 VAL HA 88 VAL QG1 3.58 (#peak 1583)
&rst
ixpk= 1583, nxpk= 0, iat=1321, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2=1325,1326,1327,
&end
#
# 88 VAL HA 88 VAL QG2 3.93 (#peak 263)
&rst
ixpk= 263, nxpk= 0, iat=1321, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=1329,1330,1331,
&end
#
# 88 VAL HA 89 SER HN 3.50 (#peak 261)
&rst
ixpk= 261, nxpk= 0, iat=1321,1335, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 88 VAL HA 90 LEU HN 6.21 (#peak 195)
&rst
ixpk= 195, nxpk= 0, iat=1321,1346, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71, &end
#
# 88 VAL HB 89 SER HN 5.10 (#peak 398)
&rst
ixpk= 398, nxpk= 0, iat=1323,1335, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 88 VAL HB 90 LEU QQD 4.92 (#peak 2875)
&rst
ixpk= 2875, nxpk= 0, iat=1323, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2=1359,1360,1361,1355,1356,1357,
&end
#
# 88 VAL QG1 89 SER HN 4.10 (#peak 1568)
&rst
ixpk= 1568, nxpk= 0, iat= -1,1335, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=1325,1326,1327,
&end
#
# 88 VAL QG2 89 SER HN 4.09 (#peak 1251)
&rst
ixpk= 1251, nxpk= 0, iat= -1,1335, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1=1329,1330,1331,
&end
#
# 89 SER HN 90 LEU HN 5.84 (#peak 193)
&rst
ixpk= 193, nxpk= 0, iat=1335,1346, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 89 SER HA 90 LEU HN 3.19 (#peak 424)
&rst
ixpk= 424, nxpk= 0, iat=1337,1346, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69, &end
#
# 89 SER HA 90 LEU QQD 5.31 (#peak 1488)
&rst
ixpk= 1488, nxpk= 0, iat=1337, -1, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr2=1359,1360,1361,1355,1356,1357,
&end
#
# 89 SER HB2 90 LEU HN 4.14 (#peak 130)
&rst
ixpk= 130, nxpk= 0, iat=1339,1346, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 89 SER HB2 90 LEU QQD 5.16 (#peak 2004)
&rst
ixpk= 2004, nxpk= 0, iat=1339, -1, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr2=1359,1360,1361,1355,1356,1357,
&end
#
# 89 SER HB3 90 LEU HN 4.39 (#peak 198)
&rst
ixpk= 198, nxpk= 0, iat=1340,1346, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 90 LEU HN 90 LEU HB2 3.94 (#peak 935)
&rst
ixpk= 935, nxpk= 0, iat=1346,1350, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 90 LEU HN 90 LEU HG 4.57 (#peak 199)
&rst
ixpk= 199, nxpk= 0, iat=1346,1353, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 90 LEU HN 90 LEU QQD 3.92 (#peak 1508)
&rst
ixpk= 1508, nxpk= 0, iat=1346, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=1359,1360,1361,1355,1356,1357,
&end
#
# 90 LEU HN 91 PRO HD3 6.25 (#peak 920)
&rst
ixpk= 920, nxpk= 0, iat=1346,1367, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 90 LEU HA 91 PRO HD2 3.99 (#peak 651)
&rst
ixpk= 651, nxpk= 0, iat=1348,1366, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 90 LEU HA 91 PRO HD3 3.28 (#peak 903)
&rst
ixpk= 903, nxpk= 0, iat=1348,1367, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 90 LEU HB2 91 PRO HD3 6.25 (#peak 1976)
&rst
ixpk= 1976, nxpk= 0, iat=1350,1367, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 90 LEU HB3 90 LEU QQD 3.37 (#peak 1028)
&rst
ixpk= 1028, nxpk= 0, iat=1351, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr2=1359,1360,1361,1355,1356,1357,
&end
#
# 90 LEU QQD 91 PRO HD2 4.06 (#peak 3112)
&rst
ixpk= 3112, nxpk= 0, iat= -1,1366, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1=1359,1360,1361,1355,1356,1357,
&end
#
# 90 LEU QQD 91 PRO HD3 4.34 (#peak 3111)
&rst
ixpk= 3111, nxpk= 0, iat= -1,1367, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=1359,1360,1361,1355,1356,1357,
&end
#
# 90 LEU QQD 92 ASP HN 5.08 (#peak 1882)
&rst
ixpk= 1882, nxpk= 0, iat= -1,1379, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1=1359,1360,1361,1355,1356,1357,
&end
#
# 90 LEU QQD 93 GLY HN 5.50 (#peak 1883)
&rst
ixpk= 1883, nxpk= 0, iat= -1,1391, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1=1359,1360,1361,1355,1356,1357,
&end
#
# 90 LEU QQD 94 ALA HN 5.05 (#peak 1949)
&rst
ixpk= 1949, nxpk= 0, iat= -1,1398, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1=1359,1360,1361,1355,1356,1357,
&end
#
# 91 PRO HA 92 ASP HN 3.49 (#peak 2205)
&rst
ixpk= 2205, nxpk= 0, iat=1375,1379, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 91 PRO HA 92 ASP QB 4.76 (#peak 2226)
&rst
ixpk= 2226, nxpk= 0, iat=1375, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1383,1384,
&end
#
# 91 PRO HD3 92 ASP HN 5.33 (#peak 563)
&rst
ixpk= 563, nxpk= 0, iat=1367,1379, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 91 PRO HD3 94 ALA QB 4.23 (#peak 1652)
&rst
ixpk= 1652, nxpk= 0, iat=1367, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=1402,1403,1404,
&end
#
# 91 PRO QB 92 ASP HN 3.60 (#peak 565)
&rst
ixpk= 565, nxpk= 0, iat= -1,1379, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr1=1372,1373,
&end
#
# 91 PRO QB 92 ASP QB 4.52 (#peak 1998)
&rst
ixpk= 1998, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1=1372,1373,
igr2=1383,1384,
&end
#
# 91 PRO QG 92 ASP HN 3.57 (#peak 566)
&rst
ixpk= 566, nxpk= 0, iat= -1,1379, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr1=1369,1370,
&end
#
# 91 PRO QG 93 GLY HN 4.12 (#peak 1356)
&rst
ixpk= 1356, nxpk= 0, iat= -1,1391, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1=1369,1370,
&end
#
# 91 PRO QG 94 ALA HN 4.84 (#peak 313)
&rst
ixpk= 313, nxpk= 0, iat= -1,1398, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1=1369,1370,
&end
#
# 91 PRO QG 94 ALA QB 3.11 (#peak 1433)
&rst
ixpk= 1433, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr1=1369,1370,
igr2=1402,1403,1404,
&end
#
# 92 ASP HN 92 ASP QB 3.06 (#peak 564)
&rst
ixpk= 564, nxpk= 0, iat=1379, -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
igr2=1383,1384,
&end
#
# 92 ASP HN 94 ALA QB 5.17 (#peak 1947)
&rst
ixpk= 1947, nxpk= 0, iat=1379, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=1402,1403,1404,
&end
#
# 92 ASP HA 93 GLY HN 3.12 (#peak 1345)
&rst
ixpk= 1345, nxpk= 0, iat=1381,1391, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, &end
#
# 92 ASP HA 94 ALA HN 4.33 (#peak 317)
&rst
ixpk= 317, nxpk= 0, iat=1381,1398, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 92 ASP QB 93 GLY HN 3.97 (#peak 1334)
&rst
ixpk= 1334, nxpk= 0, iat= -1,1391, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1=1383,1384,
&end
#
# 92 ASP QB 93 GLY QA 5.48 (#peak 1997)
&rst
ixpk= 1997, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1383,1384,
igr2=1393,1394,
&end
#
# 92 ASP QB 94 ALA HN 5.14 (#peak 319)
&rst
ixpk= 319, nxpk= 0, iat= -1,1398, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1=1383,1384,
&end
#
# 93 GLY HN 93 GLY QA 2.73 (#peak 1346)
&rst
ixpk= 1346, nxpk= 0, iat=1391, -1, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56,
igr2=1393,1394,
&end
#
# 93 GLY HN 94 ALA HN 3.34 (#peak 312)
&rst
ixpk= 312, nxpk= 0, iat=1391,1398, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 93 GLY HN 94 ALA QB 4.77 (#peak 1347)
&rst
ixpk= 1347, nxpk= 0, iat=1391, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr2=1402,1403,1404,
&end
#
# 93 GLY HN 95 GLU QG 5.12 (#peak 1355)
&rst
ixpk= 1355, nxpk= 0, iat=1391, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr2=1415,1416,
&end
#
# 93 GLY QA 94 ALA HN 3.13 (#peak 318)
&rst
ixpk= 318, nxpk= 0, iat= -1,1398, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
igr1=1393,1394,
&end
#
# 93 GLY QA 95 GLU HN 4.45 (#peak 1952)
&rst
ixpk= 1952, nxpk= 0, iat= -1,1408, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr1=1393,1394,
&end
#
# 93 GLY QA 95 GLU QG 4.67 (#peak 743)
&rst
ixpk= 743, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1=1393,1394,
igr2=1415,1416,
&end
#
# 94 ALA HN 94 ALA QB 2.83 (#peak 321)
&rst
ixpk= 321, nxpk= 0, iat=1398, -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
igr2=1402,1403,1404,
&end
#
# 94 ALA HN 95 GLU HN 3.38 (#peak 655)
&rst
ixpk= 655, nxpk= 0, iat=1398,1408, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 94 ALA HN 95 GLU QG 4.59 (#peak 320)
&rst
ixpk= 320, nxpk= 0, iat=1398, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=1415,1416,
&end
#
# 94 ALA HA 95 GLU HN 3.49 (#peak 648)
&rst
ixpk= 648, nxpk= 0, iat=1400,1408, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 94 ALA HA 95 GLU QG 5.38 (#peak 651)
&rst
ixpk= 651, nxpk= 0, iat=1400, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2=1415,1416,
&end
#
# 94 ALA QB 95 GLU HN 3.58 (#peak 661)
&rst
ixpk= 661, nxpk= 0, iat= -1,1408, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1=1402,1403,1404,
&end
#
# 94 ALA QB 95 GLU QG 3.73 (#peak 1742)
&rst
ixpk= 1742, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=1402,1403,1404,
igr2=1415,1416,
&end
#
# 94 ALA QB 96 GLY HN 4.92 (#peak 1358)
&rst
ixpk= 1358, nxpk= 0, iat= -1,1423, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr1=1402,1403,1404,
&end
#
# 95 GLU HN 95 GLU QB 3.96 (#peak 660)
&rst
ixpk= 660, nxpk= 0, iat=1408, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=1412,1413,
&end
#
# 95 GLU HN 95 GLU QG 3.43 (#peak 659)
&rst
ixpk= 659, nxpk= 0, iat=1408, -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
igr2=1415,1416,
&end
#
# 95 GLU HN 96 GLY HN 3.26 (#peak 654)
&rst
ixpk= 654, nxpk= 0, iat=1408,1423, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 95 GLU HA 95 GLU QG 3.78 (#peak 433)
&rst
ixpk= 433, nxpk= 0, iat=1410, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2=1415,1416,
&end
#
# 95 GLU QB 96 GLY HN 3.40 (#peak 1353)
&rst
ixpk= 1353, nxpk= 0, iat= -1,1423, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr1=1412,1413,
&end
#
# 95 GLU QB 96 GLY QA 4.63 (#peak 542)
&rst
ixpk= 542, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1=1412,1413,
igr2=1425,1426,
&end
#
# 95 GLU QG 96 GLY HN 3.84 (#peak 1352)
&rst
ixpk= 1352, nxpk= 0, iat= -1,1423, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1=1415,1416,
&end
#
# 97 SER HN 98 GLY HN 4.43 (#peak 1299)
&rst
ixpk= 1299, nxpk= 0, iat=1430,1441, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 97 SER HN 99 THR HN 4.71 (#peak 1049)
&rst
ixpk= 1049, nxpk= 0, iat=1430,1448, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 97 SER HA 97 SER QB 2.75 (#peak 384)
&rst
ixpk= 384, nxpk= 0, iat=1432, -1, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,
igr2=1434,1435,
&end
#
# 97 SER HA 98 GLY HN 3.24 (#peak 1301)
&rst
ixpk= 1301, nxpk= 0, iat=1432,1441, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 97 SER QB 98 GLY HN 4.01 (#peak 1955)
&rst
ixpk= 1955, nxpk= 0, iat= -1,1441, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1=1434,1435,
&end
#
# 98 GLY HN 98 GLY QA 2.86 (#peak 1303)
&rst
ixpk= 1303, nxpk= 0, iat=1441, -1, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,
igr2=1443,1444,
&end
#
# 98 GLY HN 99 THR HN 3.70 (#peak 1177)
&rst
ixpk= 1177, nxpk= 0, iat=1441,1448, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 98 GLY HN 99 THR HA 4.90 (#peak 1302)
&rst
ixpk= 1302, nxpk= 0, iat=1441,1450, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 98 GLY HN 99 THR QG2 5.84 (#peak 1304)
&rst
ixpk= 1304, nxpk= 0, iat=1441, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr2=1454,1455,1456,
&end
#
# 98 GLY HN 100 ASP HN 4.51 (#peak 374)
&rst
ixpk= 374, nxpk= 0, iat=1441,1462, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 98 GLY QA 99 THR HN 2.87 (#peak 1181)
&rst
ixpk= 1181, nxpk= 0, iat= -1,1448, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,
igr1=1443,1444,
&end
#
# 98 GLY QA 100 ASP HN 3.46 (#peak 376)
&rst
ixpk= 376, nxpk= 0, iat= -1,1462, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr1=1443,1444,
&end
#
# 99 THR HN 99 THR QG2 4.45 (#peak 1394)
&rst
ixpk= 1394, nxpk= 0, iat=1448, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1454,1455,1456,
&end
#
# 99 THR HN 100 ASP HN 3.39 (#peak 1178)
&rst
ixpk= 1178, nxpk= 0, iat=1448,1462, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 99 THR HN 100 ASP QB 4.69 (#peak 1956)
&rst
ixpk= 1956, nxpk= 0, iat=1448, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1466,1467,
&end
#
# 99 THR HN 102 ARG QD 5.45 (#peak 800)
&rst
ixpk= 800, nxpk= 0, iat=1448, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr2=1501,1502,
&end
#
# 99 THR HA 99 THR QG2 3.50 (#peak 2399)
&rst
ixpk= 2399, nxpk= 0, iat=1450, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=1454,1455,1456,
&end
#
# 99 THR HA 100 ASP HN 2.98 (#peak 377)
&rst
ixpk= 377, nxpk= 0, iat=1450,1462, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48, &end
#
# 99 THR HA 100 ASP QB 5.64 (#peak 2451)
&rst
ixpk= 2451, nxpk= 0, iat=1450, -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr2=1466,1467,
&end
#
# 99 THR HA 101 HIS HN 4.27 (#peak 225)
&rst
ixpk= 225, nxpk= 0, iat=1450,1474, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 99 THR HA 102 ARG QD 4.02 (#peak 1676)
&rst
ixpk= 1676, nxpk= 0, iat=1450, -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr2=1501,1502,
&end
#
# 99 THR QG2 100 ASP HN 4.29 (#peak 379)
&rst
ixpk= 379, nxpk= 0, iat= -1,1462, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr1=1454,1455,1456,
&end
#
# 99 THR QG2 102 ARG QD 5.55 (#peak 1665)
&rst
ixpk= 1665, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
igr1=1454,1455,1456,
igr2=1501,1502,
&end
#
# 100 ASP HN 100 ASP QB 3.14 (#peak 378)
&rst
ixpk= 378, nxpk= 0, iat=1462, -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
igr2=1466,1467,
&end
#
# 100 ASP QB 101 HIS HN 4.72 (#peak 1959)
&rst
ixpk= 1959, nxpk= 0, iat= -1,1474, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1466,1467,
&end
#
# 101 HIS HN 101 HIS HB2 3.95 (#peak 803)
&rst
ixpk= 803, nxpk= 0, iat=1474,1478, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 101 HIS HN 102 ARG QG 6.25 (#peak 802)
&rst
ixpk= 802, nxpk= 0, iat=1474, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=1498,1499,
&end
#
# 101 HIS HA 101 HIS HD2 4.19 (#peak 468)
&rst
ixpk= 468, nxpk= 0, iat=1476,1487, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 101 HIS HA 102 ARG HN 3.35 (#peak 437)
&rst
ixpk= 437, nxpk= 0, iat=1476,1491, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 101 HIS HA 102 ARG QD 4.22 (#peak 797)
&rst
ixpk= 797, nxpk= 0, iat=1476, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1501,1502,
&end
#
# 101 HIS HB2 102 ARG HN 5.02 (#peak 632)
&rst
ixpk= 632, nxpk= 0, iat=1478,1491, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 101 HIS HB3 102 ARG HN 5.07 (#peak 1961)
&rst
ixpk= 1961, nxpk= 0, iat=1479,1491, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 101 HIS HD2 102 ARG HN 6.25 (#peak 1960)
&rst
ixpk= 1960, nxpk= 0, iat=1487,1491, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 102 ARG HN 102 ARG QB 3.51 (#peak 440)
&rst
ixpk= 440, nxpk= 0, iat=1491, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2=1495,1496,
&end
#
# 102 ARG HN 102 ARG QD 4.32 (#peak 439)
&rst
ixpk= 439, nxpk= 0, iat=1491, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2=1501,1502,
&end
#
# 102 ARG HN 102 ARG QG 3.94 (#peak 441)
&rst
ixpk= 441, nxpk= 0, iat=1491, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2=1498,1499,
&end
#
# 102 ARG HA 102 ARG QD 4.11 (#peak 798)
&rst
ixpk= 798, nxpk= 0, iat=1493, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2=1501,1502,
&end
#
# 102 ARG HA 102 ARG QG 3.92 (#peak 57)
&rst
ixpk= 57, nxpk= 0, iat=1493, -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr2=1498,1499,
&end
#
# 102 ARG HA 103 SER HN 3.07 (#peak 133)
&rst
ixpk= 133, nxpk= 0, iat=1493,1515, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57, &end
#
# 102 ARG QB 102 ARG QD 3.32 (#peak 801)
&rst
ixpk= 801, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1=1495,1496,
igr2=1501,1502,
&end
#
# 102 ARG QB 102 ARG QG 2.51 (#peak 1441)
&rst
ixpk= 1441, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66,
igr1=1495,1496,
igr2=1498,1499,
&end
#
# 102 ARG QB 103 SER HN 4.13 (#peak 949)
&rst
ixpk= 949, nxpk= 0, iat= -1,1515, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1=1495,1496,
&end
#
# 102 ARG QD 103 SER HN 5.38 (#peak 1963)
&rst
ixpk= 1963, nxpk= 0, iat= -1,1515, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1501,1502,
&end
#
# 102 ARG QG 102 ARG QD 2.95 (#peak 1677)
&rst
ixpk= 1677, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr1=1498,1499,
igr2=1501,1502,
&end
#
# 102 ARG QG 103 SER HN 4.84 (#peak 950)
&rst
ixpk= 950, nxpk= 0, iat= -1,1515, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1=1498,1499,
&end
#
# 102 ARG QG 103 SER QB 6.25 (#peak 2132)
&rst
ixpk= 2132, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr1=1498,1499,
igr2=1519,1520,
&end
#
# 103 SER HN 103 SER QB 3.72 (#peak 930)
&rst
ixpk= 930, nxpk= 0, iat=1515, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr2=1519,1520,
&end
#
# 103 SER HA 103 SER QB 3.01 (#peak 2131)
&rst
ixpk= 2131, nxpk= 0, iat=1517, -1, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
igr2=1519,1520,
&end
#
# 104 SER HN 104 SER QB 3.91 (#peak 1967)
&rst
ixpk= 1967, nxpk= 0, iat=1526, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr2=1530,1531,
&end
#
# 105 SER HN 105 SER QB 3.80 (#peak 855)
&rst
ixpk= 855, nxpk= 0, iat=1537, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr2=1541,1542,
&end
#
# 109 PRO QB 110 GLY HN 4.47 (#peak 153)
&rst
ixpk= 153, nxpk= 0, iat= -1,1601, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=1594,1595,
&end
#
# 109 PRO QB 110 GLY QA 4.86 (#peak 744)
&rst
ixpk= 744, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1=1594,1595,
igr2=1603,1604,
&end
#
# 110 GLY QA 111 SER HN 3.08 (#peak 1462)
&rst
ixpk= 1462, nxpk= 0, iat= -1,1608, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
igr1=1603,1604,
&end
#
# 111 SER HN 111 SER HB2 3.56 (#peak 1972)
&rst
ixpk= 1972, nxpk= 0, iat=1608,1612, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 111 SER HN 111 SER HB3 2.40 (#peak 1973)
&rst
ixpk= 1973, nxpk= 0, iat=1608,1613, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 116 GLN HA 116 GLN QG 3.71 (#peak 2945)
&rst
ixpk= 2945, nxpk= 0, iat=1687, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2=1692,1693,
&end
#
# 116 GLN HA 117 VAL HN 2.71 (#peak 443)
&rst
ixpk= 443, nxpk= 0, iat=1687,1702, r1= 1.30, r2= 1.80, r3= 2.71, r4= 3.21, &end
#
# 116 GLN HA 117 VAL HB 5.11 (#peak 31)
&rst
ixpk= 31, nxpk= 0, iat=1687,1706, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 116 GLN QB 117 VAL HA 5.42 (#peak 2326)
&rst
ixpk= 2326, nxpk= 0, iat= -1,1704, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1=1689,1690,
&end
#
# 116 GLN QB 118 GLN HE21 4.87 (#peak 479)
&rst
ixpk= 479, nxpk= 0, iat= -1,1730, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1=1689,1690,
&end
#
# 116 GLN QG 117 VAL HN 4.04 (#peak 445)
&rst
ixpk= 445, nxpk= 0, iat= -1,1702, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1692,1693,
&end
#
# 116 GLN QG 118 GLN HE21 4.04 (#peak 2947)
&rst
ixpk= 2947, nxpk= 0, iat= -1,1730, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1692,1693,
&end
#
# 117 VAL HN 117 VAL HB 2.97 (#peak 446)
&rst
ixpk= 446, nxpk= 0, iat=1702,1706, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 117 VAL HN 117 VAL QQG 3.02 (#peak 447)
&rst
ixpk= 447, nxpk= 0, iat=1702, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2=1708,1709,1710,1712,1713,1714,
&end
#
# 117 VAL HN 118 GLN HN 3.67 (#peak 248)
&rst
ixpk= 248, nxpk= 0, iat=1702,1718, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 117 VAL HA 117 VAL QQG 3.21 (#peak 2325)
&rst
ixpk= 2325, nxpk= 0, iat=1704, -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr2=1708,1709,1710,1712,1713,1714,
&end
#
# 117 VAL HA 118 GLN HN 2.69 (#peak 250)
&rst
ixpk= 250, nxpk= 0, iat=1704,1718, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19, &end
#
# 117 VAL QQG 118 GLN HN 3.48 (#peak 253)
&rst
ixpk= 253, nxpk= 0, iat= -1,1718, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1=1708,1709,1710,1712,1713,1714,
&end
#
# 117 VAL QQG 118 GLN HE21 5.77 (#peak 1977)
&rst
ixpk= 1977, nxpk= 0, iat= -1,1730, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
igr1=1708,1709,1710,1712,1713,1714,
&end
#
# 117 VAL QQG 118 GLN HE22 5.60 (#peak 1978)
&rst
ixpk= 1978, nxpk= 0, iat= -1,1731, r1= 1.30, r2= 1.80, r3= 7.55, r4= 8.05,
igr1=1708,1709,1710,1712,1713,1714,
&end
#
# 117 VAL QQG 119 GLY HN 4.52 (#peak 1336)
&rst
ixpk= 1336, nxpk= 0, iat= -1,1735, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1=1708,1709,1710,1712,1713,1714,
&end
#
# 118 GLN HN 118 GLN HB2 3.63 (#peak 1974)
&rst
ixpk= 1974, nxpk= 0, iat=1718,1722, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 118 GLN HN 118 GLN HB3 3.37 (#peak 252)
&rst
ixpk= 252, nxpk= 0, iat=1718,1723, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 118 GLN HN 118 GLN HE22 6.09 (#peak 246)
&rst
ixpk= 246, nxpk= 0, iat=1718,1731, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59, &end
#
# 118 GLN HN 118 GLN QG 3.52 (#peak 251)
&rst
ixpk= 251, nxpk= 0, iat=1718, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2=1725,1726,
&end
#
# 118 GLN HA 118 GLN HE21 5.28 (#peak 1229)
&rst
ixpk= 1229, nxpk= 0, iat=1720,1730, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 118 GLN HA 118 GLN HE22 4.68 (#peak 1237)
&rst
ixpk= 1237, nxpk= 0, iat=1720,1731, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 118 GLN HA 119 GLY HN 2.70 (#peak 1350)
&rst
ixpk= 1350, nxpk= 0, iat=1720,1735, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20, &end
#
# 118 GLN HB2 118 GLN HE21 5.09 (#peak 1975)
&rst
ixpk= 1975, nxpk= 0, iat=1722,1730, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 118 GLN HB2 118 GLN QG 2.49 (#peak 1139)
&rst
ixpk= 1139, nxpk= 0, iat=1722, -1, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29,
igr2=1725,1726,
&end
#
# 118 GLN HB2 119 GLY QA 5.37 (#peak 734)
&rst
ixpk= 734, nxpk= 0, iat=1722, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=1737,1738,
&end
#
# 118 GLN HB3 118 GLN HE21 5.46 (#peak 1976)
&rst
ixpk= 1976, nxpk= 0, iat=1723,1730, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 118 GLN QG 118 GLN HE21 3.23 (#peak 1230)
&rst
ixpk= 1230, nxpk= 0, iat= -1,1730, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr1=1725,1726,
&end
#
# 118 GLN QG 118 GLN HE22 3.56 (#peak 1240)
&rst
ixpk= 1240, nxpk= 0, iat= -1,1731, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr1=1725,1726,
&end
#
# 119 GLY HN 119 GLY QA 2.57 (#peak 1351)
&rst
ixpk= 1351, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
igr2=1737,1738,
&end
#
# 119 GLY HN 120 THR HN 3.78 (#peak 1979)
&rst
ixpk= 1979, nxpk= 0, iat=1735,1742, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 119 GLY HN 120 THR QG2 5.66 (#peak 1337)
&rst
ixpk= 1337, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
igr2=1748,1749,1750,
&end
#
# 119 GLY QA 120 THR HN 2.78 (#peak 1159)
&rst
ixpk= 1159, nxpk= 0, iat= -1,1742, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
igr1=1737,1738,
&end
#
# 119 GLY QA 120 THR QG2 5.57 (#peak 1461)
&rst
ixpk= 1461, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1=1737,1738,
igr2=1748,1749,1750,
&end
#
# 119 GLY QA 121 CYS QB 5.16 (#peak 1388)
&rst
ixpk= 1388, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=1737,1738,
igr2=1760,1761,
&end
#
# 119 GLY QA 199 LEU QD1 5.70 (#peak 1424)
&rst
ixpk= 1424, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.68, r4= 8.18,
igr1=1737,1738,
igr2=2865,2866,2867,
&end
#
# 119 GLY QA 199 LEU QD2 5.32 (#peak 1428)
&rst
ixpk= 1428, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr1=1737,1738,
igr2=2869,2870,2871,
&end
#
# 120 THR HN 120 THR HB 3.58 (#peak 1351)
&rst
ixpk= 1351, nxpk= 0, iat=1742,1746, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 120 THR HN 120 THR QG2 4.79 (#peak 1160)
&rst
ixpk= 1160, nxpk= 0, iat=1742, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr2=1748,1749,1750,
&end
#
# 120 THR HN 121 CYS QB 5.14 (#peak 1151)
&rst
ixpk= 1151, nxpk= 0, iat=1742, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2=1760,1761,
&end
#
# 120 THR HN 199 LEU QD2 5.74 (#peak 1152)
&rst
ixpk= 1152, nxpk= 0, iat=1742, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr2=2869,2870,2871,
&end
#
# 120 THR HA 120 THR QG2 3.39 (#peak 230)
&rst
ixpk= 230, nxpk= 0, iat=1744, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2=1748,1749,1750,
&end
#
# 120 THR HA 121 CYS HN 3.26 (#peak 229)
&rst
ixpk= 229, nxpk= 0, iat=1744,1756, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 120 THR HA 121 CYS QB 5.59 (#peak 530)
&rst
ixpk= 530, nxpk= 0, iat=1744, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=1760,1761,
&end
#
# 120 THR HA 167 ASN HA 6.02 (#peak 2471)
&rst
ixpk= 2471, nxpk= 0, iat=1744,2408, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 120 THR HA 167 ASN HD22 5.19 (#peak 224)
&rst
ixpk= 224, nxpk= 0, iat=1744,2416, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 120 THR HB 121 CYS QB 5.67 (#peak 1336)
&rst
ixpk= 1336, nxpk= 0, iat=1746, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr2=1760,1761,
&end
#
# 120 THR HB 167 ASN HD22 5.72 (#peak 1337)
&rst
ixpk= 1337, nxpk= 0, iat=1746,2416, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 120 THR QG2 121 CYS HN 3.98 (#peak 616)
&rst
ixpk= 616, nxpk= 0, iat= -1,1756, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1=1748,1749,1750,
&end
#
# 120 THR QG2 121 CYS HA 4.51 (#peak 1319)
&rst
ixpk= 1319, nxpk= 0, iat= -1,1758, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1748,1749,1750,
&end
#
# 120 THR QG2 121 CYS QB 5.86 (#peak 559)
&rst
ixpk= 559, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.90, r4= 8.40,
igr1=1748,1749,1750,
igr2=1760,1761,
&end
#
# 120 THR QG2 167 ASN HD22 5.71 (#peak 1366)
&rst
ixpk= 1366, nxpk= 0, iat= -1,2416, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr1=1748,1749,1750,
&end
#
# 121 CYS HN 121 CYS QB 3.62 (#peak 1318)
&rst
ixpk= 1318, nxpk= 0, iat=1756, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2=1760,1761,
&end
#
# 121 CYS HA 122 SER HN 3.49 (#peak 2772)
&rst
ixpk= 2772, nxpk= 0, iat=1758,1767, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 121 CYS HA 166 TYR HN 5.64 (#peak 294)
&rst
ixpk= 294, nxpk= 0, iat=1758,2385, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 121 CYS HA 167 ASN HA 3.54 (#peak 367)
&rst
ixpk= 367, nxpk= 0, iat=1758,2408, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 121 CYS HA 168 PRO HD2 5.09 (#peak 2773)
&rst
ixpk= 2773, nxpk= 0, iat=1758,2421, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 121 CYS HA 168 PRO HD3 4.38 (#peak 2794)
&rst
ixpk= 2794, nxpk= 0, iat=1758,2422, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 121 CYS HA 169 ALA HN 6.18 (#peak 635)
&rst
ixpk= 635, nxpk= 0, iat=1758,2434, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68, &end
#
# 121 CYS QB 122 SER HN 3.84 (#peak 600)
&rst
ixpk= 600, nxpk= 0, iat= -1,1767, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1=1760,1761,
&end
#
# 121 CYS QB 151 GLN HE21 5.26 (#peak 1933)
&rst
ixpk= 1933, nxpk= 0, iat= -1,2182, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1=1760,1761,
&end
#
# 121 CYS QB 165 LEU HG 4.50 (#peak 531)
&rst
ixpk= 531, nxpk= 0, iat= -1,2373, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=1760,1761,
&end
#
# 121 CYS QB 165 LEU QD1 3.56 (#peak 532)
&rst
ixpk= 532, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1760,1761,
igr2=2375,2376,2377,
&end
#
# 121 CYS QB 165 LEU QD2 3.42 (#peak 1321)
&rst
ixpk= 1321, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1=1760,1761,
igr2=2379,2380,2381,
&end
#
# 122 SER HN 122 SER HB2 3.74 (#peak 108)
&rst
ixpk= 108, nxpk= 0, iat=1767,1771, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 122 SER HN 165 LEU HA 4.58 (#peak 3201)
&rst
ixpk= 3201, nxpk= 0, iat=1767,2368, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 122 SER HN 166 TYR HN 5.03 (#peak 630)
&rst
ixpk= 630, nxpk= 0, iat=1767,2385, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 122 SER HN 166 TYR QD 5.36 (#peak 583)
&rst
ixpk= 583, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2=2393,2402,
&end
#
# 122 SER HN 166 TYR QE 6.25 (#peak 1836)
&rst
ixpk= 1836, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=2395,2400,
&end
#
# 122 SER HA 123 THR HN 3.50 (#peak 1022)
&rst
ixpk= 1022, nxpk= 0, iat=1769,1778, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 122 SER HA 168 PRO QG 5.70 (#peak 868)
&rst
ixpk= 868, nxpk= 0, iat=1769, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2=2424,2425,
&end
#
# 122 SER HB2 123 THR HN 4.01 (#peak 1023)
&rst
ixpk= 1023, nxpk= 0, iat=1771,1778, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 122 SER HB2 123 THR HA 5.69 (#peak 1874)
&rst
ixpk= 1874, nxpk= 0, iat=1771,1780, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 122 SER HB2 166 TYR HN 5.92 (#peak 296)
&rst
ixpk= 296, nxpk= 0, iat=1771,2385, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 122 SER HB2 166 TYR QD 6.05 (#peak 1922)
&rst
ixpk= 1922, nxpk= 0, iat=1771, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2393,2402,
&end
#
# 122 SER HB2 166 TYR QE 4.77 (#peak 109)
&rst
ixpk= 109, nxpk= 0, iat=1771, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr2=2395,2400,
&end
#
# 122 SER HB3 123 THR HN 4.64 (#peak 1024)
&rst
ixpk= 1024, nxpk= 0, iat=1772,1778, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 122 SER HB3 166 TYR QD 6.17 (#peak 1932)
&rst
ixpk= 1932, nxpk= 0, iat=1772, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr2=2393,2402,
&end
#
# 122 SER HB3 166 TYR QE 4.62 (#peak 119)
&rst
ixpk= 119, nxpk= 0, iat=1772, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=2395,2400,
&end
#
# 122 SER HB3 168 PRO HD2 6.22 (#peak 798)
&rst
ixpk= 798, nxpk= 0, iat=1772,2421, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72, &end
#
# 122 SER HB3 168 PRO HD3 5.92 (#peak 801)
&rst
ixpk= 801, nxpk= 0, iat=1772,2422, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 122 SER HB3 168 PRO QG 3.37 (#peak 1460)
&rst
ixpk= 1460, nxpk= 0, iat=1772, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2=2424,2425,
&end
#
# 123 THR HN 123 THR HB 3.78 (#peak 16)
&rst
ixpk= 16, nxpk= 0, iat=1778,1782, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 123 THR HN 123 THR QG2 4.44 (#peak 1042)
&rst
ixpk= 1042, nxpk= 0, iat=1778, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=1784,1785,1786,
&end
#
# 123 THR HN 124 THR HN 5.60 (#peak 368)
&rst
ixpk= 368, nxpk= 0, iat=1778,1792, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 123 THR HN 166 TYR QD 5.98 (#peak 1003)
&rst
ixpk= 1003, nxpk= 0, iat=1778, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2=2393,2402,
&end
#
# 123 THR HN 166 TYR QE 5.25 (#peak 1004)
&rst
ixpk= 1004, nxpk= 0, iat=1778, -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr2=2395,2400,
&end
#
# 123 THR HA 123 THR QG2 3.59 (#peak 1669)
&rst
ixpk= 1669, nxpk= 0, iat=1780, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2=1784,1785,1786,
&end
#
# 123 THR HA 124 THR HN 3.33 (#peak 254)
&rst
ixpk= 254, nxpk= 0, iat=1780,1792, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 123 THR HA 164 VAL HN 6.16 (#peak 121)
&rst
ixpk= 121, nxpk= 0, iat=1780,2350, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66, &end
#
# 123 THR HA 165 LEU HA 4.32 (#peak 3205)
&rst
ixpk= 3205, nxpk= 0, iat=1780,2368, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 123 THR HA 165 LEU HG 5.95 (#peak 2501)
&rst
ixpk= 2501, nxpk= 0, iat=1780,2373, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 123 THR HA 165 LEU QD2 4.45 (#peak 2503)
&rst
ixpk= 2503, nxpk= 0, iat=1780, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=2379,2380,2381,
&end
#
# 123 THR HA 166 TYR HB3 5.80 (#peak 2500)
&rst
ixpk= 2500, nxpk= 0, iat=1780,2390, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 123 THR HA 166 TYR QD 4.54 (#peak 256)
&rst
ixpk= 256, nxpk= 0, iat=1780, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=2393,2402,
&end
#
# 123 THR HA 166 TYR QE 4.91 (#peak 257)
&rst
ixpk= 257, nxpk= 0, iat=1780, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=2395,2400,
&end
#
# 123 THR HB 124 THR HN 4.48 (#peak 20)
&rst
ixpk= 20, nxpk= 0, iat=1782,1792, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 123 THR HB 165 LEU HA 6.25 (#peak 444)
&rst
ixpk= 444, nxpk= 0, iat=1782,2368, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 123 THR HB 165 LEU QD2 4.53 (#peak 19)
&rst
ixpk= 19, nxpk= 0, iat=1782, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2=2379,2380,2381,
&end
#
# 123 THR HB 166 TYR HN 6.06 (#peak 295)
&rst
ixpk= 295, nxpk= 0, iat=1782,2385, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56, &end
#
# 123 THR QG2 124 THR HN 4.30 (#peak 349)
&rst
ixpk= 349, nxpk= 0, iat= -1,1792, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1=1784,1785,1786,
&end
#
# 123 THR QG2 124 THR QG2 4.78 (#peak 3236)
&rst
ixpk= 3236, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr1=1784,1785,1786,
igr2=1798,1799,1800,
&end
#
# 123 THR QG2 165 LEU QD2 3.71 (#peak 1399)
&rst
ixpk= 1399, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1=1784,1785,1786,
igr2=2379,2380,2381,
&end
#
# 124 THR HN 124 THR QG2 3.50 (#peak 1725)
&rst
ixpk= 1725, nxpk= 0, iat=1792, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=1798,1799,1800,
&end
#
# 124 THR HN 125 LEU HN 6.02 (#peak 369)
&rst
ixpk= 369, nxpk= 0, iat=1792,1806, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 124 THR HN 125 LEU HA 6.25 (#peak 370)
&rst
ixpk= 370, nxpk= 0, iat=1792,1808, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 124 THR HN 163 THR HA 4.78 (#peak 1828)
&rst
ixpk= 1828, nxpk= 0, iat=1792,2338, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 124 THR HN 164 VAL HN 4.47 (#peak 1826)
&rst
ixpk= 1826, nxpk= 0, iat=1792,2350, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 124 THR HN 164 VAL HB 6.25 (#peak 348)
&rst
ixpk= 348, nxpk= 0, iat=1792,2354, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 124 THR HN 164 VAL QG2 5.46 (#peak 1832)
&rst
ixpk= 1832, nxpk= 0, iat=1792, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr2=2360,2361,2362,
&end
#
# 124 THR HN 165 LEU HA 5.56 (#peak 1829)
&rst
ixpk= 1829, nxpk= 0, iat=1792,2368, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06, &end
#
# 124 THR HN 166 TYR QD 5.23 (#peak 342)
&rst
ixpk= 342, nxpk= 0, iat=1792, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2=2393,2402,
&end
#
# 124 THR HN 166 TYR QE 5.14 (#peak 343)
&rst
ixpk= 343, nxpk= 0, iat=1792, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2=2395,2400,
&end
#
# 124 THR HN 176 LEU QD1 5.37 (#peak 1004)
&rst
ixpk= 1004, nxpk= 0, iat=1792, -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr2=2543,2544,2545,
&end
#
# 124 THR HA 124 THR QG2 4.06 (#peak 293)
&rst
ixpk= 293, nxpk= 0, iat=1794, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=1798,1799,1800,
&end
#
# 124 THR HA 125 LEU HN 3.45 (#peak 302)
&rst
ixpk= 302, nxpk= 0, iat=1794,1806, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 124 THR HA 125 LEU HB2 5.74 (#peak 1475)
&rst
ixpk= 1475, nxpk= 0, iat=1794,1810, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 124 THR HA 191 SER HA 4.23 (#peak 3222)
&rst
ixpk= 3222, nxpk= 0, iat=1794,2757, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 124 THR HA 193 SER HN 5.42 (#peak 970)
&rst
ixpk= 970, nxpk= 0, iat=1794,2781, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 124 THR HA 194 CYS HN 6.24 (#peak 2613)
&rst
ixpk= 2613, nxpk= 0, iat=1794,2792, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74, &end
#
# 124 THR HB 125 LEU HN 4.75 (#peak 32)
&rst
ixpk= 32, nxpk= 0, iat=1796,1806, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 124 THR HB 166 TYR QD 6.03 (#peak 1345)
&rst
ixpk= 1345, nxpk= 0, iat=1796, -1, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr2=2393,2402,
&end
#
# 124 THR HB 166 TYR QE 4.73 (#peak 1340)
&rst
ixpk= 1340, nxpk= 0, iat=1796, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=2395,2400,
&end
#
# 124 THR HB 173 PRO QB 4.68 (#peak 1940)
&rst
ixpk= 1940, nxpk= 0, iat=1796, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr2=2497,2498,
&end
#
# 124 THR HB 173 PRO QG 4.51 (#peak 1343)
&rst
ixpk= 1343, nxpk= 0, iat=1796, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=2494,2495,
&end
#
# 124 THR HB 191 SER HA 5.03 (#peak 3229)
&rst
ixpk= 3229, nxpk= 0, iat=1796,2757, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 124 THR HB 194 CYS QB 4.94 (#peak 1391)
&rst
ixpk= 1391, nxpk= 0, iat=1796, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2=2796,2797,
&end
#
# 124 THR QG2 125 LEU HN 4.15 (#peak 67)
&rst
ixpk= 67, nxpk= 0, iat= -1,1806, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1=1798,1799,1800,
&end
#
# 124 THR QG2 125 LEU HA 6.25 (#peak 1579)
&rst
ixpk= 1579, nxpk= 0, iat= -1,1808, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1=1798,1799,1800,
&end
#
# 124 THR QG2 126 ILE HB 4.90 (#peak 3231)
&rst
ixpk= 3231, nxpk= 0, iat= -1,1829, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1=1798,1799,1800,
&end
#
# 124 THR QG2 126 ILE QG2 4.62 (#peak 3287)
&rst
ixpk= 3287, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr1=1798,1799,1800,
igr2=1831,1832,1833,
&end
#
# 124 THR QG2 164 VAL HN 4.33 (#peak 127)
&rst
ixpk= 127, nxpk= 0, iat= -1,2350, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=1798,1799,1800,
&end
#
# 124 THR QG2 166 TYR QD 3.76 (#peak 1731)
&rst
ixpk= 1731, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1=1798,1799,1800,
igr2=2393,2402,
&end
#
# 124 THR QG2 166 TYR QE 3.62 (#peak 1732)
&rst
ixpk= 1732, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1=1798,1799,1800,
igr2=2395,2400,
&end
#
# 124 THR QG2 173 PRO HA 4.03 (#peak 1864)
&rst
ixpk= 1864, nxpk= 0, iat= -1,2500, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1=1798,1799,1800,
&end
#
# 124 THR QG2 173 PRO QB 3.59 (#peak 1202)
&rst
ixpk= 1202, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1=1798,1799,1800,
igr2=2497,2498,
&end
#
# 124 THR QG2 176 LEU QD1 3.29 (#peak 1734)
&rst
ixpk= 1734, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr1=1798,1799,1800,
igr2=2543,2544,2545,
&end
#
# 124 THR QG2 176 LEU QD2 4.35 (#peak 3232)
&rst
ixpk= 3232, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1=1798,1799,1800,
igr2=2547,2548,2549,
&end
#
# 124 THR QG2 191 SER HA 5.22 (#peak 3230)
&rst
ixpk= 3230, nxpk= 0, iat= -1,2757, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1=1798,1799,1800,
&end
#
# 124 THR QG2 191 SER HB2 4.08 (#peak 2052)
&rst
ixpk= 2052, nxpk= 0, iat= -1,2759, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1=1798,1799,1800,
&end
#
# 124 THR QG2 191 SER HB3 3.78 (#peak 2039)
&rst
ixpk= 2039, nxpk= 0, iat= -1,2760, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1=1798,1799,1800,
&end
#
# 124 THR QG2 192 GLU HN 5.16 (#peak 271)
&rst
ixpk= 271, nxpk= 0, iat= -1,2766, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=1798,1799,1800,
&end
#
# 124 THR QG2 193 SER HN 5.93 (#peak 1002)
&rst
ixpk= 1002, nxpk= 0, iat= -1,2781, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr1=1798,1799,1800,
&end
#
# 124 THR QG2 194 CYS QB 4.47 (#peak 1393)
&rst
ixpk= 1393, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1=1798,1799,1800,
igr2=2796,2797,
&end
#
# 125 LEU HN 125 LEU HB2 4.15 (#peak 758)
&rst
ixpk= 758, nxpk= 0, iat=1806,1810, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 125 LEU HN 125 LEU HB3 4.13 (#peak 766)
&rst
ixpk= 766, nxpk= 0, iat=1806,1811, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 125 LEU HN 125 LEU HG 5.20 (#peak 773)
&rst
ixpk= 773, nxpk= 0, iat=1806,1813, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 125 LEU HN 125 LEU QD1 4.45 (#peak 967)
&rst
ixpk= 967, nxpk= 0, iat=1806, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1815,1816,1817,
&end
#
# 125 LEU HN 125 LEU QD2 5.04 (#peak 1085)
&rst
ixpk= 1085, nxpk= 0, iat=1806, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=1819,1820,1821,
&end
#
# 125 LEU HN 126 ILE HN 5.22 (#peak 76)
&rst
ixpk= 76, nxpk= 0, iat=1806,1825, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 125 LEU HN 166 TYR QE 6.25 (#peak 57)
&rst
ixpk= 57, nxpk= 0, iat=1806, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=2395,2400,
&end
#
# 125 LEU HN 191 SER HA 4.40 (#peak 60)
&rst
ixpk= 60, nxpk= 0, iat=1806,2757, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 125 LEU HN 192 GLU HB3 6.25 (#peak 63)
&rst
ixpk= 63, nxpk= 0, iat=1806,2771, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 125 LEU HN 193 SER QB 5.23 (#peak 62)
&rst
ixpk= 62, nxpk= 0, iat=1806, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2=2785,2786,
&end
#
# 125 LEU HA 125 LEU QD1 4.44 (#peak 968)
&rst
ixpk= 968, nxpk= 0, iat=1808, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=1815,1816,1817,
&end
#
# 125 LEU HA 125 LEU QD2 3.51 (#peak 1549)
&rst
ixpk= 1549, nxpk= 0, iat=1808, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=1819,1820,1821,
&end
#
# 125 LEU HA 126 ILE HN 3.33 (#peak 578)
&rst
ixpk= 578, nxpk= 0, iat=1808,1825, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 125 LEU HA 126 ILE HB 5.34 (#peak 1851)
&rst
ixpk= 1851, nxpk= 0, iat=1808,1829, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, &end
#
# 125 LEU HA 162 ALA HN 6.25 (#peak 520)
&rst
ixpk= 520, nxpk= 0, iat=1808,2326, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 125 LEU HA 163 THR HA 4.32 (#peak 515)
&rst
ixpk= 515, nxpk= 0, iat=1808,2338, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 125 LEU HA 164 VAL HN 5.93 (#peak 122)
&rst
ixpk= 122, nxpk= 0, iat=1808,2350, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 125 LEU HB2 125 LEU QD1 3.42 (#peak 762)
&rst
ixpk= 762, nxpk= 0, iat=1810, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2=1815,1816,1817,
&end
#
# 125 LEU HB2 126 ILE HN 5.50 (#peak 187)
&rst
ixpk= 187, nxpk= 0, iat=1810,1825, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 125 LEU HB2 126 ILE HA 6.25 (#peak 1471)
&rst
ixpk= 1471, nxpk= 0, iat=1810,1827, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 125 LEU HB2 190 VAL HN 6.25 (#peak 1801)
&rst
ixpk= 1801, nxpk= 0, iat=1810,2739, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 125 LEU HB2 191 SER HA 5.28 (#peak 3286)
&rst
ixpk= 3286, nxpk= 0, iat=1810,2757, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 125 LEU HB2 193 SER QB 5.18 (#peak 1476)
&rst
ixpk= 1476, nxpk= 0, iat=1810, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2=2785,2786,
&end
#
# 125 LEU HB3 125 LEU QD1 3.37 (#peak 768)
&rst
ixpk= 768, nxpk= 0, iat=1811, -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr2=1815,1816,1817,
&end
#
# 125 LEU HB3 126 ILE HN 4.94 (#peak 721)
&rst
ixpk= 721, nxpk= 0, iat=1811,1825, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 125 LEU HB3 193 SER QB 5.03 (#peak 141)
&rst
ixpk= 141, nxpk= 0, iat=1811, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr2=2785,2786,
&end
#
# 125 LEU HG 126 ILE HN 4.72 (#peak 189)
&rst
ixpk= 189, nxpk= 0, iat=1813,1825, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 125 LEU HG 161 THR HB 4.51 (#peak 13)
&rst
ixpk= 13, nxpk= 0, iat=1813,2316, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 125 LEU HG 162 ALA HN 5.53 (#peak 412)
&rst
ixpk= 412, nxpk= 0, iat=1813,2326, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 125 LEU QD1 126 ILE HN 5.03 (#peak 966)
&rst
ixpk= 966, nxpk= 0, iat= -1,1825, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1815,1816,1817,
&end
#
# 125 LEU QD1 161 THR HB 3.99 (#peak 969)
&rst
ixpk= 969, nxpk= 0, iat= -1,2316, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1=1815,1816,1817,
&end
#
# 125 LEU QD1 162 ALA HN 5.78 (#peak 965)
&rst
ixpk= 965, nxpk= 0, iat= -1,2326, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1=1815,1816,1817,
&end
#
# 125 LEU QD1 163 THR HB 5.01 (#peak 45)
&rst
ixpk= 45, nxpk= 0, iat= -1,2340, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1=1815,1816,1817,
&end
#
# 125 LEU QD2 126 ILE HN 3.61 (#peak 1548)
&rst
ixpk= 1548, nxpk= 0, iat= -1,1825, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1=1819,1820,1821,
&end
#
# 125 LEU QD2 161 THR HN 5.42 (#peak 1462)
&rst
ixpk= 1462, nxpk= 0, iat= -1,2312, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1=1819,1820,1821,
&end
#
# 125 LEU QD2 161 THR HB 3.11 (#peak 1541)
&rst
ixpk= 1541, nxpk= 0, iat= -1,2316, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr1=1819,1820,1821,
&end
#
# 125 LEU QD2 162 ALA HN 3.98 (#peak 1547)
&rst
ixpk= 1547, nxpk= 0, iat= -1,2326, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1=1819,1820,1821,
&end
#
# 126 ILE HN 126 ILE HB 3.88 (#peak 862)
&rst
ixpk= 862, nxpk= 0, iat=1825,1829, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 126 ILE HN 126 ILE QD1 4.43 (#peak 2458)
&rst
ixpk= 2458, nxpk= 0, iat=1825, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2=1838,1839,1840,
&end
#
# 126 ILE HN 126 ILE QG1 4.08 (#peak 191)
&rst
ixpk= 191, nxpk= 0, iat=1825, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2=1835,1836,
&end
#
# 126 ILE HN 126 ILE QG2 4.73 (#peak 192)
&rst
ixpk= 192, nxpk= 0, iat=1825, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=1831,1832,1833,
&end
#
# 126 ILE HN 161 THR HA 5.43 (#peak 1830)
&rst
ixpk= 1830, nxpk= 0, iat=1825,2314, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 126 ILE HN 161 THR HB 5.41 (#peak 1)
&rst
ixpk= 1, nxpk= 0, iat=1825,2316, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 126 ILE HN 161 THR QG2 5.29 (#peak 1497)
&rst
ixpk= 1497, nxpk= 0, iat=1825, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=2318,2319,2320,
&end
#
# 126 ILE HN 162 ALA HN 5.58 (#peak 407)
&rst
ixpk= 407, nxpk= 0, iat=1825,2326, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 126 ILE HN 162 ALA HA 6.25 (#peak 184)
&rst
ixpk= 184, nxpk= 0, iat=1825,2328, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 126 ILE HN 162 ALA QB 4.52 (#peak 1315)
&rst
ixpk= 1315, nxpk= 0, iat=1825, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2=2330,2331,2332,
&end
#
# 126 ILE HN 163 THR HA 5.26 (#peak 203)
&rst
ixpk= 203, nxpk= 0, iat=1825,2338, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 126 ILE HA 126 ILE QD1 4.27 (#peak 2460)
&rst
ixpk= 2460, nxpk= 0, iat=1827, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1838,1839,1840,
&end
#
# 126 ILE HA 126 ILE QG1 3.66 (#peak 2724)
&rst
ixpk= 2724, nxpk= 0, iat=1827, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2=1835,1836,
&end
#
# 126 ILE HA 126 ILE QG2 3.20 (#peak 1811)
&rst
ixpk= 1811, nxpk= 0, iat=1827, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=1831,1832,1833,
&end
#
# 126 ILE HA 189 VAL HA 4.37 (#peak 3221)
&rst
ixpk= 3221, nxpk= 0, iat=1827,2725, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 126 ILE HA 190 VAL HN 3.12 (#peak 1806)
&rst
ixpk= 1806, nxpk= 0, iat=1827,2739, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, &end
#
# 126 ILE HB 126 ILE QD1 3.19 (#peak 1875)
&rst
ixpk= 1875, nxpk= 0, iat=1829, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2=1838,1839,1840,
&end
#
# 126 ILE HB 127 ALA HN 5.75 (#peak 13)
&rst
ixpk= 13, nxpk= 0, iat=1829,1844, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 126 ILE HB 162 ALA HN 5.90 (#peak 411)
&rst
ixpk= 411, nxpk= 0, iat=1829,2326, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40, &end
#
# 126 ILE HB 162 ALA QB 3.99 (#peak 1322)
&rst
ixpk= 1322, nxpk= 0, iat=1829, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=2330,2331,2332,
&end
#
# 126 ILE HB 164 VAL HN 6.25 (#peak 1834)
&rst
ixpk= 1834, nxpk= 0, iat=1829,2350, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 126 ILE QD1 162 ALA QB 4.08 (#peak 2476)
&rst
ixpk= 2476, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1=1838,1839,1840,
igr2=2330,2331,2332,
&end
#
# 126 ILE QD1 176 LEU QB 3.38 (#peak 1877)
&rst
ixpk= 1877, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1=1838,1839,1840,
igr2=2538,2539,
&end
#
# 126 ILE QD1 176 LEU QD1 4.21 (#peak 2463)
&rst
ixpk= 2463, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1=1838,1839,1840,
igr2=2543,2544,2545,
&end
#
# 126 ILE QD1 177 ARG HN 4.25 (#peak 2459)
&rst
ixpk= 2459, nxpk= 0, iat= -1,2553, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1=1838,1839,1840,
&end
#
# 126 ILE QD1 189 VAL HN 5.31 (#peak 1795)
&rst
ixpk= 1795, nxpk= 0, iat= -1,2723, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1=1838,1839,1840,
&end
#
# 126 ILE QG1 127 ALA HN 4.78 (#peak 15)
&rst
ixpk= 15, nxpk= 0, iat= -1,1844, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1835,1836,
&end
#
# 126 ILE QG1 162 ALA HN 4.69 (#peak 414)
&rst
ixpk= 414, nxpk= 0, iat= -1,2326, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=1835,1836,
&end
#
# 126 ILE QG1 162 ALA QB 3.32 (#peak 1605)
&rst
ixpk= 1605, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1=1835,1836,
igr2=2330,2331,2332,
&end
#
# 126 ILE QG1 188 SER HN 5.81 (#peak 1857)
&rst
ixpk= 1857, nxpk= 0, iat= -1,2712, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1=1835,1836,
&end
#
# 126 ILE QG1 189 VAL HA 4.78 (#peak 1385)
&rst
ixpk= 1385, nxpk= 0, iat= -1,2725, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1835,1836,
&end
#
# 126 ILE QG2 127 ALA HN 3.59 (#peak 1809)
&rst
ixpk= 1809, nxpk= 0, iat= -1,1844, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1=1831,1832,1833,
&end
#
# 126 ILE QG2 128 ILE QD1 2.46 (#peak 1894)
&rst
ixpk= 1894, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr1=1831,1832,1833,
igr2=1867,1868,1869,
&end
#
# 126 ILE QG2 162 ALA HN 4.76 (#peak 415)
&rst
ixpk= 415, nxpk= 0, iat= -1,2326, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1831,1832,1833,
&end
#
# 126 ILE QG2 177 ARG HN 5.28 (#peak 1888)
&rst
ixpk= 1888, nxpk= 0, iat= -1,2553, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1=1831,1832,1833,
&end
#
# 126 ILE QG2 177 ARG HA 3.95 (#peak 1813)
&rst
ixpk= 1813, nxpk= 0, iat= -1,2555, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1=1831,1832,1833,
&end
#
# 126 ILE QG2 187 ALA HA 3.95 (#peak 1795)
&rst
ixpk= 1795, nxpk= 0, iat= -1,2704, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1=1831,1832,1833,
&end
#
# 126 ILE QG2 187 ALA QB 3.93 (#peak 1901)
&rst
ixpk= 1901, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1=1831,1832,1833,
igr2=2706,2707,2708,
&end
#
# 126 ILE QG2 188 SER HN 3.95 (#peak 1810)
&rst
ixpk= 1810, nxpk= 0, iat= -1,2712, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1=1831,1832,1833,
&end
#
# 126 ILE QG2 189 VAL HA 4.69 (#peak 1891)
&rst
ixpk= 1891, nxpk= 0, iat= -1,2725, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=1831,1832,1833,
&end
#
# 127 ALA HN 127 ALA QB 3.23 (#peak 1747)
&rst
ixpk= 1747, nxpk= 0, iat=1844, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2=1848,1849,1850,
&end
#
# 127 ALA HN 128 ILE HN 5.49 (#peak 8)
&rst
ixpk= 8, nxpk= 0, iat=1844,1854, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 127 ALA HN 187 ALA HA 6.24 (#peak 9)
&rst
ixpk= 9, nxpk= 0, iat=1844,2704, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74, &end
#
# 127 ALA HN 188 SER HN 4.96 (#peak 7)
&rst
ixpk= 7, nxpk= 0, iat=1844,2712, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 127 ALA HN 188 SER HA 5.50 (#peak 2988)
&rst
ixpk= 2988, nxpk= 0, iat=1844,2714, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 127 ALA HN 188 SER HB2 6.25 (#peak 1789)
&rst
ixpk= 1789, nxpk= 0, iat=1844,2716, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 127 ALA HN 188 SER HB3 6.23 (#peak 1790)
&rst
ixpk= 1790, nxpk= 0, iat=1844,2717, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73, &end
#
# 127 ALA HN 189 VAL HA 5.15 (#peak 11)
&rst
ixpk= 11, nxpk= 0, iat=1844,2725, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 127 ALA HN 190 VAL HN 4.78 (#peak 6)
&rst
ixpk= 6, nxpk= 0, iat=1844,2739, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 127 ALA HN 190 VAL HB 5.95 (#peak 12)
&rst
ixpk= 12, nxpk= 0, iat=1844,2743, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 127 ALA HN 190 VAL QG1 3.60 (#peak 1651)
&rst
ixpk= 1651, nxpk= 0, iat=1844, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2=2745,2746,2747,
&end
#
# 127 ALA HA 128 ILE HN 3.42 (#peak 605)
&rst
ixpk= 605, nxpk= 0, iat=1846,1854, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 127 ALA HA 161 THR HA 3.54 (#peak 364)
&rst
ixpk= 364, nxpk= 0, iat=1846,2314, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 127 ALA HA 162 ALA HN 5.04 (#peak 427)
&rst
ixpk= 427, nxpk= 0, iat=1846,2326, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 127 ALA HA 190 VAL QG1 4.11 (#peak 1677)
&rst
ixpk= 1677, nxpk= 0, iat=1846, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2=2745,2746,2747,
&end
#
# 127 ALA QB 161 THR HA 4.24 (#peak 1736)
&rst
ixpk= 1736, nxpk= 0, iat= -1,2314, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr1=1848,1849,1850,
&end
#
# 127 ALA QB 187 ALA HA 5.27 (#peak 1684)
&rst
ixpk= 1684, nxpk= 0, iat= -1,2704, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr1=1848,1849,1850,
&end
#
# 127 ALA QB 188 SER HN 4.25 (#peak 1748)
&rst
ixpk= 1748, nxpk= 0, iat= -1,2712, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1=1848,1849,1850,
&end
#
# 127 ALA QB 188 SER HB2 4.43 (#peak 107)
&rst
ixpk= 107, nxpk= 0, iat= -1,2716, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=1848,1849,1850,
&end
#
# 127 ALA QB 188 SER HB3 4.02 (#peak 111)
&rst
ixpk= 111, nxpk= 0, iat= -1,2717, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1=1848,1849,1850,
&end
#
# 127 ALA QB 190 VAL HN 4.89 (#peak 1800)
&rst
ixpk= 1800, nxpk= 0, iat= -1,2739, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1=1848,1849,1850,
&end
#
# 127 ALA QB 190 VAL HA 5.03 (#peak 2181)
&rst
ixpk= 2181, nxpk= 0, iat= -1,2741, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1848,1849,1850,
&end
#
# 127 ALA QB 190 VAL HB 5.12 (#peak 77)
&rst
ixpk= 77, nxpk= 0, iat= -1,2743, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1848,1849,1850,
&end
#
# 127 ALA QB 190 VAL QG1 2.73 (#peak 1737)
&rst
ixpk= 1737, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr1=1848,1849,1850,
igr2=2745,2746,2747,
&end
#
# 128 ILE HN 128 ILE HB 4.08 (#peak 339)
&rst
ixpk= 339, nxpk= 0, iat=1854,1858, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 128 ILE HN 128 ILE HG12 5.95 (#peak 338)
&rst
ixpk= 338, nxpk= 0, iat=1854,1864, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 128 ILE HN 128 ILE HG13 4.44 (#peak 341)
&rst
ixpk= 341, nxpk= 0, iat=1854,1865, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 128 ILE HN 128 ILE QD1 4.65 (#peak 2190)
&rst
ixpk= 2190, nxpk= 0, iat=1854, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=1867,1868,1869,
&end
#
# 128 ILE HN 131 MET QE 4.94 (#peak 2067)
&rst
ixpk= 2067, nxpk= 0, iat=1854, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=1901,1902,1903,
&end
#
# 128 ILE HN 160 GLY HA3 6.25 (#peak 1869)
&rst
ixpk= 1869, nxpk= 0, iat=1854,2308, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 128 ILE HN 161 THR HA 4.08 (#peak 361)
&rst
ixpk= 361, nxpk= 0, iat=1854,2314, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 128 ILE HN 161 THR HB 6.25 (#peak 990)
&rst
ixpk= 990, nxpk= 0, iat=1854,2316, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 128 ILE HN 161 THR QG2 5.23 (#peak 340)
&rst
ixpk= 340, nxpk= 0, iat=1854, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr2=2318,2319,2320,
&end
#
# 128 ILE HN 162 ALA HN 5.65 (#peak 324)
&rst
ixpk= 324, nxpk= 0, iat=1854,2326, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 128 ILE HA 128 ILE HG13 3.47 (#peak 2526)
&rst
ixpk= 2526, nxpk= 0, iat=1856,1865, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 128 ILE HA 128 ILE QD1 4.16 (#peak 2191)
&rst
ixpk= 2191, nxpk= 0, iat=1856, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2=1867,1868,1869,
&end
#
# 128 ILE HA 128 ILE QG2 3.72 (#peak 1782)
&rst
ixpk= 1782, nxpk= 0, iat=1856, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2=1860,1861,1862,
&end
#
# 128 ILE HA 131 MET QE 4.48 (#peak 2069)
&rst
ixpk= 2069, nxpk= 0, iat=1856, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2=1901,1902,1903,
&end
#
# 128 ILE HA 186 GLU HN 4.80 (#peak 1773)
&rst
ixpk= 1773, nxpk= 0, iat=1856,2687, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 128 ILE HA 187 ALA HA 3.47 (#peak 643)
&rst
ixpk= 643, nxpk= 0, iat=1856,2704, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 128 ILE HB 128 ILE QD1 3.55 (#peak 3046)
&rst
ixpk= 3046, nxpk= 0, iat=1858, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2=1867,1868,1869,
&end
#
# 128 ILE HB 129 ALA HN 6.25 (#peak 2027)
&rst
ixpk= 2027, nxpk= 0, iat=1858,1873, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 128 ILE HB 131 MET QE 4.72 (#peak 2018)
&rst
ixpk= 2018, nxpk= 0, iat=1858, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2=1901,1902,1903,
&end
#
# 128 ILE HB 131 MET QG 5.32 (#peak 938)
&rst
ixpk= 938, nxpk= 0, iat=1858, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=1897,1898,
&end
#
# 128 ILE HG13 162 ALA HN 5.90 (#peak 1432)
&rst
ixpk= 1432, nxpk= 0, iat=1865,2326, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40, &end
#
# 128 ILE HG13 187 ALA HN 6.25 (#peak 1820)
&rst
ixpk= 1820, nxpk= 0, iat=1865,2702, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 128 ILE HG13 187 ALA HA 4.72 (#peak 898)
&rst
ixpk= 898, nxpk= 0, iat=1865,2704, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 128 ILE HG13 187 ALA QB 3.56 (#peak 1174)
&rst
ixpk= 1174, nxpk= 0, iat=1865, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=2706,2707,2708,
&end
#
# 128 ILE QD1 129 ALA HN 5.77 (#peak 2223)
&rst
ixpk= 2223, nxpk= 0, iat= -1,1873, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1=1867,1868,1869,
&end
#
# 128 ILE QD1 131 MET QE 3.36 (#peak 3052)
&rst
ixpk= 3052, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1=1867,1868,1869,
igr2=1901,1902,1903,
&end
#
# 128 ILE QD1 140 ILE QD1 3.36 (#peak 2194)
&rst
ixpk= 2194, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1=1867,1868,1869,
igr2=2021,2022,2023,
&end
#
# 128 ILE QD1 161 THR HA 4.81 (#peak 2752)
&rst
ixpk= 2752, nxpk= 0, iat= -1,2314, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1=1867,1868,1869,
&end
#
# 128 ILE QD1 162 ALA HN 5.28 (#peak 2189)
&rst
ixpk= 2189, nxpk= 0, iat= -1,2326, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1=1867,1868,1869,
&end
#
# 128 ILE QD1 162 ALA QB 2.65 (#peak 1623)
&rst
ixpk= 1623, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr1=1867,1868,1869,
igr2=2330,2331,2332,
&end
#
# 128 ILE QD1 188 SER HN 5.05 (#peak 1803)
&rst
ixpk= 1803, nxpk= 0, iat= -1,2712, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=1867,1868,1869,
&end
#
# 128 ILE QG2 129 ALA HN 4.41 (#peak 1778)
&rst
ixpk= 1778, nxpk= 0, iat= -1,1873, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1860,1861,1862,
&end
#
# 128 ILE QG2 129 ALA QB 4.47 (#peak 1528)
&rst
ixpk= 1528, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr1=1860,1861,1862,
igr2=1877,1878,1879,
&end
#
# 128 ILE QG2 130 GLY HN 5.64 (#peak 1434)
&rst
ixpk= 1434, nxpk= 0, iat= -1,1883, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1=1860,1861,1862,
&end
#
# 128 ILE QG2 131 MET QE 3.82 (#peak 3279)
&rst
ixpk= 3279, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1=1860,1861,1862,
igr2=1901,1902,1903,
&end
#
# 128 ILE QG2 131 MET QG 3.86 (#peak 3048)
&rst
ixpk= 3048, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=1860,1861,1862,
igr2=1897,1898,
&end
#
# 128 ILE QG2 140 ILE QD1 4.63 (#peak 1785)
&rst
ixpk= 1785, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr1=1860,1861,1862,
igr2=2021,2022,2023,
&end
#
# 128 ILE QG2 185 PHE HN 6.25 (#peak 2061)
&rst
ixpk= 2061, nxpk= 0, iat= -1,2667, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1=1860,1861,1862,
&end
#
# 128 ILE QG2 185 PHE HB2 3.72 (#peak 1784)
&rst
ixpk= 1784, nxpk= 0, iat= -1,2671, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1=1860,1861,1862,
&end
#
# 128 ILE QG2 185 PHE HB3 4.12 (#peak 918)
&rst
ixpk= 918, nxpk= 0, iat= -1,2672, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1860,1861,1862,
&end
#
# 128 ILE QG2 185 PHE QD 4.38 (#peak 1780)
&rst
ixpk= 1780, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1=1860,1861,1862,
igr2=2675,2683,
&end
#
# 128 ILE QG2 186 GLU HN 4.19 (#peak 620)
&rst
ixpk= 620, nxpk= 0, iat= -1,2687, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=1860,1861,1862,
&end
#
# 128 ILE QG2 187 ALA HA 4.69 (#peak 1787)
&rst
ixpk= 1787, nxpk= 0, iat= -1,2704, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=1860,1861,1862,
&end
#
# 128 ILE QG2 187 ALA QB 4.19 (#peak 3176)
&rst
ixpk= 3176, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1860,1861,1862,
igr2=2706,2707,2708,
&end
#
# 128 ILE QG2 188 SER HN 4.91 (#peak 1804)
&rst
ixpk= 1804, nxpk= 0, iat= -1,2712, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1=1860,1861,1862,
&end
#
# 129 ALA HN 129 ALA QB 3.47 (#peak 1690)
&rst
ixpk= 1690, nxpk= 0, iat=1873, -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr2=1877,1878,1879,
&end
#
# 129 ALA HN 130 GLY HN 5.89 (#peak 1426)
&rst
ixpk= 1426, nxpk= 0, iat=1873,1883, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 129 ALA HN 130 GLY HA3 6.25 (#peak 18)
&rst
ixpk= 18, nxpk= 0, iat=1873,1886, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 129 ALA HN 180 ILE QG2 5.37 (#peak 20)
&rst
ixpk= 20, nxpk= 0, iat=1873, -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr2=2603,2604,2605,
&end
#
# 129 ALA HN 185 PHE HB2 6.21 (#peak 4)
&rst
ixpk= 4, nxpk= 0, iat=1873,2671, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71, &end
#
# 129 ALA HN 185 PHE QD 6.25 (#peak 17)
&rst
ixpk= 17, nxpk= 0, iat=1873, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=2675,2683,
&end
#
# 129 ALA HN 186 GLU HN 5.19 (#peak 664)
&rst
ixpk= 664, nxpk= 0, iat=1873,2687, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 129 ALA HN 186 GLU HB2 5.73 (#peak 389)
&rst
ixpk= 389, nxpk= 0, iat=1873,2691, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 129 ALA HN 186 GLU HG2 6.07 (#peak 1774)
&rst
ixpk= 1774, nxpk= 0, iat=1873,2694, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57, &end
#
# 129 ALA HN 187 ALA HN 5.45 (#peak 1823)
&rst
ixpk= 1823, nxpk= 0, iat=1873,2702, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 129 ALA HN 187 ALA HA 5.20 (#peak 2)
&rst
ixpk= 2, nxpk= 0, iat=1873,2704, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 129 ALA HN 187 ALA QB 4.72 (#peak 1916)
&rst
ixpk= 1916, nxpk= 0, iat=1873, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2=2706,2707,2708,
&end
#
# 129 ALA HA 131 MET HN 4.66 (#peak 2002)
&rst
ixpk= 2002, nxpk= 0, iat=1875,1890, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 129 ALA QB 130 GLY HN 3.83 (#peak 1691)
&rst
ixpk= 1691, nxpk= 0, iat= -1,1883, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1=1877,1878,1879,
&end
#
# 129 ALA QB 130 GLY HA2 5.94 (#peak 1386)
&rst
ixpk= 1386, nxpk= 0, iat= -1,1885, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1=1877,1878,1879,
&end
#
# 129 ALA QB 130 GLY HA3 4.63 (#peak 1524)
&rst
ixpk= 1524, nxpk= 0, iat= -1,1886, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=1877,1878,1879,
&end
#
# 129 ALA QB 131 MET HN 4.92 (#peak 629)
&rst
ixpk= 629, nxpk= 0, iat= -1,1890, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr1=1877,1878,1879,
&end
#
# 129 ALA QB 185 PHE QD 6.25 (#peak 1529)
&rst
ixpk= 1529, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.43, r4= 8.93,
igr1=1877,1878,1879,
igr2=2675,2683,
&end
#
# 129 ALA QB 186 GLU HN 4.13 (#peak 1521)
&rst
ixpk= 1521, nxpk= 0, iat= -1,2687, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1=1877,1878,1879,
&end
#
# 129 ALA QB 186 GLU HB2 2.81 (#peak 1708)
&rst
ixpk= 1708, nxpk= 0, iat= -1,2691, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
igr1=1877,1878,1879,
&end
#
# 129 ALA QB 186 GLU HB3 3.53 (#peak 1265)
&rst
ixpk= 1265, nxpk= 0, iat= -1,2692, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=1877,1878,1879,
&end
#
# 129 ALA QB 186 GLU HG3 4.38 (#peak 1525)
&rst
ixpk= 1525, nxpk= 0, iat= -1,2695, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=1877,1878,1879,
&end
#
# 129 ALA QB 187 ALA HA 5.28 (#peak 1522)
&rst
ixpk= 1522, nxpk= 0, iat= -1,2704, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1=1877,1878,1879,
&end
#
# 130 GLY HN 131 MET HN 4.22 (#peak 644)
&rst
ixpk= 644, nxpk= 0, iat=1883,1890, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 130 GLY HN 131 MET QE 6.12 (#peak 1871)
&rst
ixpk= 1871, nxpk= 0, iat=1883, -1, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
igr2=1901,1902,1903,
&end
#
# 130 GLY HN 131 MET QG 6.25 (#peak 1432)
&rst
ixpk= 1432, nxpk= 0, iat=1883, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=1897,1898,
&end
#
# 130 GLY HN 185 PHE HB3 6.22 (#peak 1431)
&rst
ixpk= 1431, nxpk= 0, iat=1883,2672, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72, &end
#
# 130 GLY HN 185 PHE QD 5.72 (#peak 1420)
&rst
ixpk= 1420, nxpk= 0, iat=1883, -1, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr2=2675,2683,
&end
#
# 130 GLY HN 187 ALA QB 6.25 (#peak 1435)
&rst
ixpk= 1435, nxpk= 0, iat=1883, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr2=2706,2707,2708,
&end
#
# 130 GLY HA2 185 PHE HA 4.63 (#peak 1945)
&rst
ixpk= 1945, nxpk= 0, iat=1885,2669, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 130 GLY HA2 185 PHE QD 5.06 (#peak 1384)
&rst
ixpk= 1384, nxpk= 0, iat=1885, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=2675,2683,
&end
#
# 130 GLY HA3 132 THR QG2 5.52 (#peak 1356)
&rst
ixpk= 1356, nxpk= 0, iat=1886, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2=1913,1914,1915,
&end
#
# 130 GLY HA3 185 PHE HA 4.66 (#peak 1944)
&rst
ixpk= 1944, nxpk= 0, iat=1886,2669, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 130 GLY HA3 185 PHE QD 5.69 (#peak 3179)
&rst
ixpk= 3179, nxpk= 0, iat=1886, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr2=2675,2683,
&end
#
# 131 MET HN 131 MET QE 4.21 (#peak 2066)
&rst
ixpk= 2066, nxpk= 0, iat=1890, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=1901,1902,1903,
&end
#
# 131 MET HN 131 MET QG 4.36 (#peak 1248)
&rst
ixpk= 1248, nxpk= 0, iat=1890, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1897,1898,
&end
#
# 131 MET HN 157 LEU QD1 5.72 (#peak 1860)
&rst
ixpk= 1860, nxpk= 0, iat=1890, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr2=2270,2271,2272,
&end
#
# 131 MET HN 157 LEU QD2 5.92 (#peak 1859)
&rst
ixpk= 1859, nxpk= 0, iat=1890, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=2274,2275,2276,
&end
#
# 131 MET HN 185 PHE HB3 5.67 (#peak 645)
&rst
ixpk= 645, nxpk= 0, iat=1890,2672, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 131 MET HA 157 LEU QD2 4.03 (#peak 1130)
&rst
ixpk= 1130, nxpk= 0, iat=1892, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=2274,2275,2276,
&end
#
# 131 MET QB 131 MET QE 3.23 (#peak 2073)
&rst
ixpk= 2073, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1=1894,1895,
igr2=1901,1902,1903,
&end
#
# 131 MET QB 132 THR HA 5.67 (#peak 2358)
&rst
ixpk= 2358, nxpk= 0, iat= -1,1909, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1=1894,1895,
&end
#
# 131 MET QE 140 ILE QD1 3.65 (#peak 3047)
&rst
ixpk= 3047, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=1901,1902,1903,
igr2=2021,2022,2023,
&end
#
# 131 MET QE 157 LEU QD2 3.53 (#peak 1560)
&rst
ixpk= 1560, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr1=1901,1902,1903,
igr2=2274,2275,2276,
&end
#
# 131 MET QE 160 GLY HN 3.94 (#peak 1825)
&rst
ixpk= 1825, nxpk= 0, iat= -1,2305, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1=1901,1902,1903,
&end
#
# 131 MET QE 160 GLY HA2 4.10 (#peak 688)
&rst
ixpk= 688, nxpk= 0, iat= -1,2307, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=1901,1902,1903,
&end
#
# 131 MET QE 160 GLY HA3 3.18 (#peak 1829)
&rst
ixpk= 1829, nxpk= 0, iat= -1,2308, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr1=1901,1902,1903,
&end
#
# 131 MET QE 161 THR HN 4.14 (#peak 1826)
&rst
ixpk= 1826, nxpk= 0, iat= -1,2312, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1=1901,1902,1903,
&end
#
# 131 MET QE 161 THR HA 4.47 (#peak 1827)
&rst
ixpk= 1827, nxpk= 0, iat= -1,2314, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1901,1902,1903,
&end
#
# 131 MET QG 131 MET QE 3.09 (#peak 1832)
&rst
ixpk= 1832, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr1=1897,1898,
igr2=1901,1902,1903,
&end
#
# 131 MET QG 140 ILE QD1 4.34 (#peak 269)
&rst
ixpk= 269, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=1897,1898,
igr2=2021,2022,2023,
&end
#
# 132 THR HA 132 THR QG2 3.32 (#peak 1639)
&rst
ixpk= 1639, nxpk= 0, iat=1909, -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr2=1913,1914,1915,
&end
#
# 132 THR HA 157 LEU QD2 4.67 (#peak 2360)
&rst
ixpk= 2360, nxpk= 0, iat=1909, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2274,2275,2276,
&end
#
# 132 THR QG2 133 CYS HN 5.32 (#peak 1353)
&rst
ixpk= 1353, nxpk= 0, iat= -1,1921, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1=1913,1914,1915,
&end
#
# 132 THR QG2 133 CYS HB3 4.55 (#peak 1638)
&rst
ixpk= 1638, nxpk= 0, iat= -1,1926, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1=1913,1914,1915,
&end
#
# 132 THR QG2 135 SER HN 6.25 (#peak 1360)
&rst
ixpk= 1360, nxpk= 0, iat= -1,1942, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1=1913,1914,1915,
&end
#
# 132 THR QG2 157 LEU QD1 5.29 (#peak 1359)
&rst
ixpk= 1359, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr1=1913,1914,1915,
igr2=2270,2271,2272,
&end
#
# 133 CYS HN 134 ALA QB 5.63 (#peak 1091)
&rst
ixpk= 1091, nxpk= 0, iat=1921, -1, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr2=1936,1937,1938,
&end
#
# 133 CYS HN 136 CYS HB2 6.14 (#peak 1085)
&rst
ixpk= 1085, nxpk= 0, iat=1921,1957, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64, &end
#
# 133 CYS HN 157 LEU QD2 4.56 (#peak 1134)
&rst
ixpk= 1134, nxpk= 0, iat=1921, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2=2274,2275,2276,
&end
#
# 133 CYS HA 134 ALA QB 4.32 (#peak 113)
&rst
ixpk= 113, nxpk= 0, iat=1923, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=1936,1937,1938,
&end
#
# 133 CYS HA 157 LEU QD1 4.41 (#peak 3144)
&rst
ixpk= 3144, nxpk= 0, iat=1923, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=2270,2271,2272,
&end
#
# 133 CYS HA 157 LEU QD2 4.51 (#peak 112)
&rst
ixpk= 112, nxpk= 0, iat=1923, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2=2274,2275,2276,
&end
#
# 133 CYS HB2 134 ALA HN 5.25 (#peak 370)
&rst
ixpk= 370, nxpk= 0, iat=1925,1932, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 133 CYS HB2 134 ALA QB 5.72 (#peak 427)
&rst
ixpk= 427, nxpk= 0, iat=1925, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr2=1936,1937,1938,
&end
#
# 133 CYS HB2 135 SER QB 6.06 (#peak 3255)
&rst
ixpk= 3255, nxpk= 0, iat=1925, -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
igr2=1946,1947,
&end
#
# 133 CYS HB2 136 CYS HN 4.09 (#peak 1946)
&rst
ixpk= 1946, nxpk= 0, iat=1925,1953, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 133 CYS HB2 157 LEU QD2 5.36 (#peak 425)
&rst
ixpk= 425, nxpk= 0, iat=1925, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr2=2274,2275,2276,
&end
#
# 133 CYS HB3 134 ALA HN 4.93 (#peak 373)
&rst
ixpk= 373, nxpk= 0, iat=1926,1932, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 133 CYS HB3 134 ALA QB 5.26 (#peak 372)
&rst
ixpk= 372, nxpk= 0, iat=1926, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2=1936,1937,1938,
&end
#
# 133 CYS HB3 135 SER HA 6.25 (#peak 428)
&rst
ixpk= 428, nxpk= 0, iat=1926,1944, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 133 CYS HB3 136 CYS HN 4.06 (#peak 1947)
&rst
ixpk= 1947, nxpk= 0, iat=1926,1953, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 133 CYS HB3 157 LEU QD1 5.23 (#peak 1003)
&rst
ixpk= 1003, nxpk= 0, iat=1926, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr2=2270,2271,2272,
&end
#
# 133 CYS HB3 157 LEU QD2 5.49 (#peak 377)
&rst
ixpk= 377, nxpk= 0, iat=1926, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr2=2274,2275,2276,
&end
#
# 134 ALA HN 134 ALA QB 4.05 (#peak 1772)
&rst
ixpk= 1772, nxpk= 0, iat=1932, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2=1936,1937,1938,
&end
#
# 134 ALA HN 157 LEU QD2 6.15 (#peak 258)
&rst
ixpk= 258, nxpk= 0, iat=1932, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2274,2275,2276,
&end
#
# 134 ALA HA 136 CYS HB3 5.71 (#peak 260)
&rst
ixpk= 260, nxpk= 0, iat=1934,1958, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 134 ALA HA 137 VAL HN 5.56 (#peak 259)
&rst
ixpk= 259, nxpk= 0, iat=1934,1964, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06, &end
#
# 134 ALA HA 157 LEU QD1 3.81 (#peak 513)
&rst
ixpk= 513, nxpk= 0, iat=1934, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2=2270,2271,2272,
&end
#
# 134 ALA QB 135 SER HN 4.98 (#peak 2013)
&rst
ixpk= 2013, nxpk= 0, iat= -1,1942, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1=1936,1937,1938,
&end
#
# 134 ALA QB 135 SER HA 6.22 (#peak 2369)
&rst
ixpk= 2369, nxpk= 0, iat= -1,1944, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
igr1=1936,1937,1938,
&end
#
# 134 ALA QB 136 CYS HN 4.75 (#peak 522)
&rst
ixpk= 522, nxpk= 0, iat= -1,1953, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=1936,1937,1938,
&end
#
# 134 ALA QB 137 VAL HN 4.87 (#peak 820)
&rst
ixpk= 820, nxpk= 0, iat= -1,1964, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=1936,1937,1938,
&end
#
# 135 SER HN 136 CYS HN 6.15 (#peak 510)
&rst
ixpk= 510, nxpk= 0, iat=1942,1953, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 135 SER HA 137 VAL HN 5.91 (#peak 816)
&rst
ixpk= 816, nxpk= 0, iat=1944,1964, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 135 SER HA 137 VAL QG1 5.52 (#peak 3256)
&rst
ixpk= 3256, nxpk= 0, iat=1944, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2=1970,1971,1972,
&end
#
# 135 SER HA 138 HIS HN 4.49 (#peak 1087)
&rst
ixpk= 1087, nxpk= 0, iat=1944,1980, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 135 SER HA 138 HIS HB2 5.41 (#peak 689)
&rst
ixpk= 689, nxpk= 0, iat=1944,1984, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 135 SER HA 138 HIS HB3 5.12 (#peak 2368)
&rst
ixpk= 2368, nxpk= 0, iat=1944,1985, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 135 SER HA 138 HIS HD2 6.25 (#peak 2327)
&rst
ixpk= 2327, nxpk= 0, iat=1944,1993, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 136 CYS HN 136 CYS HB3 4.11 (#peak 468)
&rst
ixpk= 468, nxpk= 0, iat=1953,1958, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 136 CYS HN 137 VAL HN 4.06 (#peak 812)
&rst
ixpk= 812, nxpk= 0, iat=1953,1964, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 136 CYS HN 137 VAL HB 5.04 (#peak 511)
&rst
ixpk= 511, nxpk= 0, iat=1953,1968, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 136 CYS HN 137 VAL QG2 4.92 (#peak 488)
&rst
ixpk= 488, nxpk= 0, iat=1953, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2=1974,1975,1976,
&end
#
# 136 CYS HN 138 HIS HD2 6.25 (#peak 1874)
&rst
ixpk= 1874, nxpk= 0, iat=1953,1993, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 136 CYS HN 157 LEU QD1 5.09 (#peak 1033)
&rst
ixpk= 1033, nxpk= 0, iat=1953, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2=2270,2271,2272,
&end
#
# 136 CYS HN 157 LEU QD2 5.23 (#peak 2000)
&rst
ixpk= 2000, nxpk= 0, iat=1953, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr2=2274,2275,2276,
&end
#
# 136 CYS HA 138 HIS HN 4.64 (#peak 1066)
&rst
ixpk= 1066, nxpk= 0, iat=1955,1980, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 136 CYS HA 139 SER HN 4.33 (#peak 2051)
&rst
ixpk= 2051, nxpk= 0, iat=1955,1997, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 136 CYS HA 140 ILE QD1 6.03 (#peak 2363)
&rst
ixpk= 2363, nxpk= 0, iat=1955, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr2=2021,2022,2023,
&end
#
# 136 CYS HB2 137 VAL HN 5.00 (#peak 1411)
&rst
ixpk= 1411, nxpk= 0, iat=1957,1964, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 136 CYS HB2 157 LEU QD2 5.42 (#peak 756)
&rst
ixpk= 756, nxpk= 0, iat=1957, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr2=2274,2275,2276,
&end
#
# 136 CYS HB3 137 VAL HN 4.75 (#peak 1387)
&rst
ixpk= 1387, nxpk= 0, iat=1958,1964, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 136 CYS HB3 140 ILE QD1 5.86 (#peak 769)
&rst
ixpk= 769, nxpk= 0, iat=1958, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2=2021,2022,2023,
&end
#
# 136 CYS HB3 157 LEU QD2 4.97 (#peak 1559)
&rst
ixpk= 1559, nxpk= 0, iat=1958, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=2274,2275,2276,
&end
#
# 137 VAL HN 137 VAL HB 4.13 (#peak 819)
&rst
ixpk= 819, nxpk= 0, iat=1964,1968, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 137 VAL HN 137 VAL QG1 4.25 (#peak 822)
&rst
ixpk= 822, nxpk= 0, iat=1964, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=1970,1971,1972,
&end
#
# 137 VAL HN 137 VAL QG2 4.01 (#peak 821)
&rst
ixpk= 821, nxpk= 0, iat=1964, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=1974,1975,1976,
&end
#
# 137 VAL HN 138 HIS HN 4.66 (#peak 1057)
&rst
ixpk= 1057, nxpk= 0, iat=1964,1980, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 137 VAL HN 138 HIS HD2 5.42 (#peak 813)
&rst
ixpk= 813, nxpk= 0, iat=1964,1993, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 137 VAL HN 139 SER HN 6.00 (#peak 791)
&rst
ixpk= 791, nxpk= 0, iat=1964,1997, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 137 VAL HN 140 ILE HN 6.25 (#peak 1873)
&rst
ixpk= 1873, nxpk= 0, iat=1964,2008, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 137 VAL HA 137 VAL QG1 3.49 (#peak 53)
&rst
ixpk= 53, nxpk= 0, iat=1966, -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr2=1970,1971,1972,
&end
#
# 137 VAL HA 137 VAL QG2 3.55 (#peak 52)
&rst
ixpk= 52, nxpk= 0, iat=1966, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2=1974,1975,1976,
&end
#
# 137 VAL HA 140 ILE HN 5.40 (#peak 50)
&rst
ixpk= 50, nxpk= 0, iat=1966,2008, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 137 VAL HA 140 ILE HB 5.12 (#peak 57)
&rst
ixpk= 57, nxpk= 0, iat=1966,2012, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 137 VAL HA 140 ILE QD1 4.64 (#peak 56)
&rst
ixpk= 56, nxpk= 0, iat=1966, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=2021,2022,2023,
&end
#
# 137 VAL HA 141 GLU HN 6.20 (#peak 882)
&rst
ixpk= 882, nxpk= 0, iat=1966,2027, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70, &end
#
# 137 VAL HB 138 HIS HN 4.20 (#peak 1067)
&rst
ixpk= 1067, nxpk= 0, iat=1968,1980, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 137 VAL HB 138 HIS HD2 6.11 (#peak 265)
&rst
ixpk= 265, nxpk= 0, iat=1968,1993, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61, &end
#
# 137 VAL QG1 138 HIS HN 4.15 (#peak 1865)
&rst
ixpk= 1865, nxpk= 0, iat= -1,1980, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1=1970,1971,1972,
&end
#
# 137 VAL QG1 138 HIS HB2 6.07 (#peak 690)
&rst
ixpk= 690, nxpk= 0, iat= -1,1984, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr1=1970,1971,1972,
&end
#
# 137 VAL QG1 138 HIS HB3 5.98 (#peak 668)
&rst
ixpk= 668, nxpk= 0, iat= -1,1985, r1= 1.30, r2= 1.80, r3= 7.18, r4= 7.68,
igr1=1970,1971,1972,
&end
#
# 137 VAL QG1 139 SER HN 4.61 (#peak 951)
&rst
ixpk= 951, nxpk= 0, iat= -1,1997, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=1970,1971,1972,
&end
#
# 137 VAL QG1 141 GLU QG 3.80 (#peak 1013)
&rst
ixpk= 1013, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1=1970,1971,1972,
igr2=2034,2035,
&end
#
# 137 VAL QG1 155 VAL HN 4.77 (#peak 1530)
&rst
ixpk= 1530, nxpk= 0, iat= -1,2234, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1=1970,1971,1972,
&end
#
# 137 VAL QG2 138 HIS HN 3.99 (#peak 1866)
&rst
ixpk= 1866, nxpk= 0, iat= -1,1980, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1=1974,1975,1976,
&end
#
# 137 VAL QG2 139 SER HN 6.25 (#peak 1872)
&rst
ixpk= 1872, nxpk= 0, iat= -1,1997, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1=1974,1975,1976,
&end
#
# 137 VAL QG2 141 GLU HN 5.07 (#peak 2004)
&rst
ixpk= 2004, nxpk= 0, iat= -1,2027, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1=1974,1975,1976,
&end
#
# 137 VAL QG2 157 LEU HN 4.97 (#peak 1862)
&rst
ixpk= 1862, nxpk= 0, iat= -1,2261, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=1974,1975,1976,
&end
#
# 138 HIS HN 138 HIS HB2 4.12 (#peak 1355)
&rst
ixpk= 1355, nxpk= 0, iat=1980,1984, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 138 HIS HN 138 HIS HB3 3.87 (#peak 1059)
&rst
ixpk= 1059, nxpk= 0, iat=1980,1985, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 138 HIS HN 138 HIS HD2 5.51 (#peak 1056)
&rst
ixpk= 1056, nxpk= 0, iat=1980,1993, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 138 HIS HN 139 SER HN 4.50 (#peak 933)
&rst
ixpk= 933, nxpk= 0, iat=1980,1997, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 138 HIS HN 140 ILE HN 6.14 (#peak 1877)
&rst
ixpk= 1877, nxpk= 0, iat=1980,2008, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64, &end
#
# 138 HIS HB2 141 GLU HB3 5.35 (#peak 687)
&rst
ixpk= 687, nxpk= 0, iat=1984,2032, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 138 HIS HB3 139 SER HN 4.09 (#peak 934)
&rst
ixpk= 934, nxpk= 0, iat=1985,1997, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 139 SER HN 139 SER QB 3.10 (#peak 906)
&rst
ixpk= 906, nxpk= 0, iat=1997, -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
igr2=2001,2002,
&end
#
# 139 SER HN 140 ILE HN 4.23 (#peak 932)
&rst
ixpk= 932, nxpk= 0, iat=1997,2008, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 139 SER HN 141 GLU HB3 5.91 (#peak 931)
&rst
ixpk= 931, nxpk= 0, iat=1997,2032, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 139 SER HA 141 GLU HN 6.25 (#peak 2513)
&rst
ixpk= 2513, nxpk= 0, iat=1999,2027, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 139 SER QB 140 ILE HN 4.99 (#peak 323)
&rst
ixpk= 323, nxpk= 0, iat= -1,2008, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1=2001,2002,
&end
#
# 139 SER QB 141 GLU HN 6.25 (#peak 904)
&rst
ixpk= 904, nxpk= 0, iat= -1,2027, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=2001,2002,
&end
#
# 139 SER QB 142 GLY HN 5.59 (#peak 1465)
&rst
ixpk= 1465, nxpk= 0, iat= -1,2042, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1=2001,2002,
&end
#
# 140 ILE HN 140 ILE HG12 5.84 (#peak 620)
&rst
ixpk= 620, nxpk= 0, iat=2008,2018, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 140 ILE HN 140 ILE HG13 4.36 (#peak 328)
&rst
ixpk= 328, nxpk= 0, iat=2008,2019, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 140 ILE HN 140 ILE QD1 4.57 (#peak 1870)
&rst
ixpk= 1870, nxpk= 0, iat=2008, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2=2021,2022,2023,
&end
#
# 140 ILE HN 140 ILE QG2 3.92 (#peak 1796)
&rst
ixpk= 1796, nxpk= 0, iat=2008, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=2014,2015,2016,
&end
#
# 140 ILE HN 141 GLU HN 5.36 (#peak 881)
&rst
ixpk= 881, nxpk= 0, iat=2008,2027, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 140 ILE HN 141 GLU HB3 6.01 (#peak 327)
&rst
ixpk= 327, nxpk= 0, iat=2008,2032, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 140 ILE HN 142 GLY HN 4.47 (#peak 360)
&rst
ixpk= 360, nxpk= 0, iat=2008,2042, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 140 ILE HA 140 ILE HG12 4.22 (#peak 1802)
&rst
ixpk= 1802, nxpk= 0, iat=2010,2018, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 140 ILE HA 140 ILE HG13 4.06 (#peak 1827)
&rst
ixpk= 1827, nxpk= 0, iat=2010,2019, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 140 ILE HA 140 ILE QD1 4.45 (#peak 1878)
&rst
ixpk= 1878, nxpk= 0, iat=2010, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=2021,2022,2023,
&end
#
# 140 ILE HA 140 ILE QG2 3.14 (#peak 1816)
&rst
ixpk= 1816, nxpk= 0, iat=2010, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2=2014,2015,2016,
&end
#
# 140 ILE HA 144 ILE QD1 4.49 (#peak 3211)
&rst
ixpk= 3211, nxpk= 0, iat=2010, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=2079,2080,2081,
&end
#
# 140 ILE HB 141 GLU HN 5.18 (#peak 2315)
&rst
ixpk= 2315, nxpk= 0, iat=2012,2027, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 140 ILE HB 141 GLU HA 5.59 (#peak 2607)
&rst
ixpk= 2607, nxpk= 0, iat=2012,2029, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 140 ILE HG13 141 GLU HN 5.88 (#peak 898)
&rst
ixpk= 898, nxpk= 0, iat=2019,2027, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 140 ILE HG13 142 GLY HN 5.77 (#peak 1472)
&rst
ixpk= 1472, nxpk= 0, iat=2019,2042, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27, &end
#
# 140 ILE QD1 141 GLU HN 5.44 (#peak 2429)
&rst
ixpk= 2429, nxpk= 0, iat= -1,2027, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1=2021,2022,2023,
&end
#
# 140 ILE QD1 180 ILE QG2 4.93 (#peak 1706)
&rst
ixpk= 1706, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr1=2021,2022,2023,
igr2=2603,2604,2605,
&end
#
# 140 ILE QG2 140 ILE HG12 3.53 (#peak 1963)
&rst
ixpk= 1963, nxpk= 0, iat= -1,2018, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=2014,2015,2016,
&end
#
# 140 ILE QG2 140 ILE QD1 2.87 (#peak 1879)
&rst
ixpk= 1879, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr1=2014,2015,2016,
igr2=2021,2022,2023,
&end
#
# 140 ILE QG2 141 GLU HN 4.41 (#peak 1960)
&rst
ixpk= 1960, nxpk= 0, iat= -1,2027, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=2014,2015,2016,
&end
#
# 140 ILE QG2 141 GLU HA 4.54 (#peak 2606)
&rst
ixpk= 2606, nxpk= 0, iat= -1,2029, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1=2014,2015,2016,
&end
#
# 141 GLU HN 141 GLU HB3 3.96 (#peak 541)
&rst
ixpk= 541, nxpk= 0, iat=2027,2032, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 141 GLU HN 141 GLU QG 5.32 (#peak 1036)
&rst
ixpk= 1036, nxpk= 0, iat=2027, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=2034,2035,
&end
#
# 141 GLU HN 142 GLY HN 4.85 (#peak 2005)
&rst
ixpk= 2005, nxpk= 0, iat=2027,2042, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 141 GLU HA 141 GLU QG 3.91 (#peak 2605)
&rst
ixpk= 2605, nxpk= 0, iat=2029, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr2=2034,2035,
&end
#
# 141 GLU HA 153 ILE HB 5.32 (#peak 291)
&rst
ixpk= 291, nxpk= 0, iat=2029,2208, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 141 GLU HA 153 ILE HG12 5.42 (#peak 1350)
&rst
ixpk= 1350, nxpk= 0, iat=2029,2214, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 141 GLU HA 153 ILE HG13 4.37 (#peak 1930)
&rst
ixpk= 1930, nxpk= 0, iat=2029,2215, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 141 GLU HA 153 ILE QD1 3.43 (#peak 1865)
&rst
ixpk= 1865, nxpk= 0, iat=2029, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2=2217,2218,2219,
&end
#
# 141 GLU HA 153 ILE QG2 3.36 (#peak 290)
&rst
ixpk= 290, nxpk= 0, iat=2029, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2=2210,2211,2212,
&end
#
# 141 GLU HB2 142 GLY HN 4.34 (#peak 1881)
&rst
ixpk= 1881, nxpk= 0, iat=2031,2042, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 141 GLU HB3 142 GLY HN 4.38 (#peak 1471)
&rst
ixpk= 1471, nxpk= 0, iat=2032,2042, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 141 GLU HB3 142 GLY HA2 5.94 (#peak 1232)
&rst
ixpk= 1232, nxpk= 0, iat=2032,2044, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 141 GLU QG 153 ILE HN 5.68 (#peak 2382)
&rst
ixpk= 2382, nxpk= 0, iat= -1,2204, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1=2034,2035,
&end
#
# 141 GLU QG 153 ILE HG13 5.79 (#peak 585)
&rst
ixpk= 585, nxpk= 0, iat= -1,2215, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=2034,2035,
&end
#
# 141 GLU QG 153 ILE QD1 3.70 (#peak 2354)
&rst
ixpk= 2354, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr1=2034,2035,
igr2=2217,2218,2219,
&end
#
# 141 GLU QG 153 ILE QG2 3.66 (#peak 2249)
&rst
ixpk= 2249, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=2034,2035,
igr2=2210,2211,2212,
&end
#
# 142 GLY HN 143 MET HN 4.45 (#peak 1876)
&rst
ixpk= 1876, nxpk= 0, iat=2042,2049, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 142 GLY HN 144 ILE HG12 6.25 (#peak 1474)
&rst
ixpk= 1474, nxpk= 0, iat=2042,2076, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 143 MET HN 144 ILE HG13 6.25 (#peak 740)
&rst
ixpk= 740, nxpk= 0, iat=2049,2077, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 143 MET HA 143 MET QE 3.59 (#peak 2832)
&rst
ixpk= 2832, nxpk= 0, iat=2051, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2=2060,2061,2062,
&end
#
# 143 MET HA 144 ILE QD1 6.01 (#peak 2830)
&rst
ixpk= 2830, nxpk= 0, iat=2051, -1, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
igr2=2079,2080,2081,
&end
#
# 143 MET HA 145 SER HN 5.01 (#peak 1314)
&rst
ixpk= 1314, nxpk= 0, iat=2051,2085, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 143 MET HA 146 GLN HN 6.25 (#peak 2833)
&rst
ixpk= 2833, nxpk= 0, iat=2051,2096, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 143 MET HA 146 GLN HE21 3.87 (#peak 1197)
&rst
ixpk= 1197, nxpk= 0, iat=2051,2108, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 143 MET HA 146 GLN HE22 4.12 (#peak 1203)
&rst
ixpk= 1203, nxpk= 0, iat=2051,2109, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 143 MET HB2 143 MET QE 3.33 (#peak 95)
&rst
ixpk= 95, nxpk= 0, iat=2053, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2=2060,2061,2062,
&end
#
# 143 MET HB2 144 ILE HN 4.67 (#peak 1184)
&rst
ixpk= 1184, nxpk= 0, iat=2053,2066, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 143 MET HB2 144 ILE QD1 4.16 (#peak 1897)
&rst
ixpk= 1897, nxpk= 0, iat=2053, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2=2079,2080,2081,
&end
#
# 143 MET HB2 144 ILE QG2 5.42 (#peak 97)
&rst
ixpk= 97, nxpk= 0, iat=2053, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr2=2072,2073,2074,
&end
#
# 143 MET HB3 144 ILE HN 5.23 (#peak 63)
&rst
ixpk= 63, nxpk= 0, iat=2054,2066, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 144 ILE HN 144 ILE HB 3.84 (#peak 1076)
&rst
ixpk= 1076, nxpk= 0, iat=2066,2070, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 144 ILE HN 144 ILE HG12 4.61 (#peak 728)
&rst
ixpk= 728, nxpk= 0, iat=2066,2076, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 144 ILE HN 144 ILE HG13 4.61 (#peak 1416)
&rst
ixpk= 1416, nxpk= 0, iat=2066,2077, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 144 ILE HN 144 ILE QD1 3.97 (#peak 730)
&rst
ixpk= 730, nxpk= 0, iat=2066, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2=2079,2080,2081,
&end
#
# 144 ILE HN 144 ILE QG2 4.01 (#peak 729)
&rst
ixpk= 729, nxpk= 0, iat=2066, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=2072,2073,2074,
&end
#
# 144 ILE HN 145 SER HN 4.82 (#peak 1312)
&rst
ixpk= 1312, nxpk= 0, iat=2066,2085, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 144 ILE HN 146 GLN HN 6.25 (#peak 776)
&rst
ixpk= 776, nxpk= 0, iat=2066,2096, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 144 ILE HA 144 ILE QD1 3.58 (#peak 1896)
&rst
ixpk= 1896, nxpk= 0, iat=2068, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2=2079,2080,2081,
&end
#
# 144 ILE HA 144 ILE QG2 3.15 (#peak 1735)
&rst
ixpk= 1735, nxpk= 0, iat=2068, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2=2072,2073,2074,
&end
#
# 144 ILE HA 146 GLN HN 4.94 (#peak 253)
&rst
ixpk= 253, nxpk= 0, iat=2068,2096, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 144 ILE HA 147 LEU HN 5.15 (#peak 2489)
&rst
ixpk= 2489, nxpk= 0, iat=2068,2113, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 144 ILE HA 147 LEU HB2 6.25 (#peak 1973)
&rst
ixpk= 1973, nxpk= 0, iat=2068,2117, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 144 ILE HA 147 LEU HB3 6.25 (#peak 2000)
&rst
ixpk= 2000, nxpk= 0, iat=2068,2118, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 144 ILE HA 147 LEU HG 3.87 (#peak 250)
&rst
ixpk= 250, nxpk= 0, iat=2068,2120, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 144 ILE HA 147 LEU QQD 3.15 (#peak 251)
&rst
ixpk= 251, nxpk= 0, iat=2068, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr2=2126,2127,2128,2122,2123,2124,
&end
#
# 144 ILE HB 144 ILE QD1 3.92 (#peak 2892)
&rst
ixpk= 2892, nxpk= 0, iat=2070, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=2079,2080,2081,
&end
#
# 144 ILE HB 145 SER HN 4.35 (#peak 1318)
&rst
ixpk= 1318, nxpk= 0, iat=2070,2085, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 144 ILE HG12 145 SER HN 5.21 (#peak 1319)
&rst
ixpk= 1319, nxpk= 0, iat=2076,2085, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 144 ILE HG13 145 SER HN 5.15 (#peak 1879)
&rst
ixpk= 1879, nxpk= 0, iat=2077,2085, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 144 ILE QD1 145 SER HN 4.53 (#peak 1321)
&rst
ixpk= 1321, nxpk= 0, iat= -1,2085, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1=2079,2080,2081,
&end
#
# 144 ILE QD1 146 GLN HN 6.25 (#peak 2889)
&rst
ixpk= 2889, nxpk= 0, iat= -1,2096, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1=2079,2080,2081,
&end
#
# 144 ILE QD1 179 ALA QB 3.97 (#peak 2894)
&rst
ixpk= 2894, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1=2079,2080,2081,
igr2=2591,2592,2593,
&end
#
# 144 ILE QG2 145 SER HN 4.26 (#peak 1320)
&rst
ixpk= 1320, nxpk= 0, iat= -1,2085, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1=2072,2073,2074,
&end
#
# 144 ILE QG2 146 GLN HN 5.64 (#peak 1624)
&rst
ixpk= 1624, nxpk= 0, iat= -1,2096, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1=2072,2073,2074,
&end
#
# 145 SER HN 145 SER HB3 3.57 (#peak 1315)
&rst
ixpk= 1315, nxpk= 0, iat=2085,2090, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 145 SER HN 146 GLN HN 4.29 (#peak 1030)
&rst
ixpk= 1030, nxpk= 0, iat=2085,2096, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 145 SER HN 146 GLN HB2 5.86 (#peak 1317)
&rst
ixpk= 1317, nxpk= 0, iat=2085,2100, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 145 SER HN 153 ILE QG2 4.91 (#peak 2242)
&rst
ixpk= 2242, nxpk= 0, iat=2085, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=2210,2211,2212,
&end
#
# 145 SER HA 147 LEU HN 4.69 (#peak 495)
&rst
ixpk= 495, nxpk= 0, iat=2087,2113, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 145 SER HA 150 VAL HB 5.15 (#peak 2514)
&rst
ixpk= 2514, nxpk= 0, iat=2087,2158, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 145 SER HA 150 VAL QG2 3.07 (#peak 1704)
&rst
ixpk= 1704, nxpk= 0, iat=2087, -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr2=2164,2165,2166,
&end
#
# 145 SER HA 153 ILE QG2 3.71 (#peak 247)
&rst
ixpk= 247, nxpk= 0, iat=2087, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2=2210,2211,2212,
&end
#
# 145 SER HB2 146 GLN HN 5.69 (#peak 2228)
&rst
ixpk= 2228, nxpk= 0, iat=2089,2096, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 145 SER HB2 153 ILE QD1 4.42 (#peak 1864)
&rst
ixpk= 1864, nxpk= 0, iat=2089, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=2217,2218,2219,
&end
#
# 145 SER HB2 153 ILE QG2 3.22 (#peak 1848)
&rst
ixpk= 1848, nxpk= 0, iat=2089, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2=2210,2211,2212,
&end
#
# 145 SER HB3 146 GLN HN 4.49 (#peak 198)
&rst
ixpk= 198, nxpk= 0, iat=2090,2096, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 145 SER HB3 146 GLN HE22 6.10 (#peak 1204)
&rst
ixpk= 1204, nxpk= 0, iat=2090,2109, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60, &end
#
# 145 SER HB3 146 GLN HG2 5.52 (#peak 2854)
&rst
ixpk= 2854, nxpk= 0, iat=2090,2103, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 145 SER HB3 146 GLN HG3 5.84 (#peak 2861)
&rst
ixpk= 2861, nxpk= 0, iat=2090,2104, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 145 SER HB3 153 ILE QG2 3.96 (#peak 2246)
&rst
ixpk= 2246, nxpk= 0, iat=2090, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2=2210,2211,2212,
&end
#
# 146 GLN HN 146 GLN HB2 3.74 (#peak 1036)
&rst
ixpk= 1036, nxpk= 0, iat=2096,2100, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 146 GLN HN 146 GLN HB3 4.13 (#peak 1309)
&rst
ixpk= 1309, nxpk= 0, iat=2096,2101, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 146 GLN HN 146 GLN HG2 3.91 (#peak 1097)
&rst
ixpk= 1097, nxpk= 0, iat=2096,2103, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 146 GLN HN 146 GLN HG3 4.26 (#peak 2858)
&rst
ixpk= 2858, nxpk= 0, iat=2096,2104, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 146 GLN HN 147 LEU HN 3.90 (#peak 1031)
&rst
ixpk= 1031, nxpk= 0, iat=2096,2113, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 146 GLN HN 147 LEU HB2 6.25 (#peak 1970)
&rst
ixpk= 1970, nxpk= 0, iat=2096,2117, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 146 GLN HN 147 LEU QQD 4.22 (#peak 1038)
&rst
ixpk= 1038, nxpk= 0, iat=2096, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=2126,2127,2128,2122,2123,2124,
&end
#
# 146 GLN HN 150 VAL QG2 5.39 (#peak 1515)
&rst
ixpk= 1515, nxpk= 0, iat=2096, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2=2164,2165,2166,
&end
#
# 146 GLN HN 153 ILE QG2 6.05 (#peak 2222)
&rst
ixpk= 2222, nxpk= 0, iat=2096, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2210,2211,2212,
&end
#
# 146 GLN HA 146 GLN HB3 3.00 (#peak 132)
&rst
ixpk= 132, nxpk= 0, iat=2098,2101, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 146 GLN HA 146 GLN HG2 3.63 (#peak 1098)
&rst
ixpk= 1098, nxpk= 0, iat=2098,2103, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 146 GLN HA 146 GLN HG3 3.47 (#peak 1101)
&rst
ixpk= 1101, nxpk= 0, iat=2098,2104, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 146 GLN HB2 147 LEU HA 5.58 (#peak 334)
&rst
ixpk= 334, nxpk= 0, iat=2100,2115, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 146 GLN HB2 147 LEU QQD 6.25 (#peak 499)
&rst
ixpk= 499, nxpk= 0, iat=2100, -1, r1= 1.30, r2= 1.80, r3= 8.43, r4= 8.93,
igr2=2126,2127,2128,2122,2123,2124,
&end
#
# 146 GLN HB3 146 GLN HE22 4.49 (#peak 1207)
&rst
ixpk= 1207, nxpk= 0, iat=2101,2109, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 146 GLN HB3 147 LEU HN 5.43 (#peak 508)
&rst
ixpk= 508, nxpk= 0, iat=2101,2113, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 146 GLN HG2 147 LEU HN 5.42 (#peak 497)
&rst
ixpk= 497, nxpk= 0, iat=2103,2113, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 146 GLN HG2 147 LEU QQD 6.24 (#peak 2856)
&rst
ixpk= 2856, nxpk= 0, iat=2103, -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
igr2=2126,2127,2128,2122,2123,2124,
&end
#
# 147 LEU HN 147 LEU HB2 4.16 (#peak 888)
&rst
ixpk= 888, nxpk= 0, iat=2113,2117, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 147 LEU HN 147 LEU HB3 4.16 (#peak 928)
&rst
ixpk= 928, nxpk= 0, iat=2113,2118, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 147 LEU HN 147 LEU HG 3.64 (#peak 499)
&rst
ixpk= 499, nxpk= 0, iat=2113,2120, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 147 LEU HN 147 LEU QQD 3.47 (#peak 501)
&rst
ixpk= 501, nxpk= 0, iat=2113, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=2126,2127,2128,2122,2123,2124,
&end
#
# 147 LEU HN 148 GLU HN 4.96 (#peak 478)
&rst
ixpk= 478, nxpk= 0, iat=2113,2132, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 147 LEU HA 147 LEU QQD 3.47 (#peak 333)
&rst
ixpk= 333, nxpk= 0, iat=2115, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=2126,2127,2128,2122,2123,2124,
&end
#
# 147 LEU HA 148 GLU HN 3.00 (#peak 540)
&rst
ixpk= 540, nxpk= 0, iat=2115,2132, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 147 LEU HB2 147 LEU QQD 2.94 (#peak 890)
&rst
ixpk= 890, nxpk= 0, iat=2117, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2=2126,2127,2128,2122,2123,2124,
&end
#
# 147 LEU HB2 148 GLU HN 4.82 (#peak 920)
&rst
ixpk= 920, nxpk= 0, iat=2117,2132, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 147 LEU HB3 147 LEU QQD 3.06 (#peak 931)
&rst
ixpk= 931, nxpk= 0, iat=2118, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2=2126,2127,2128,2122,2123,2124,
&end
#
# 147 LEU HB3 148 GLU HN 4.44 (#peak 927)
&rst
ixpk= 927, nxpk= 0, iat=2118,2132, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 147 LEU HG 148 GLU HN 5.73 (#peak 867)
&rst
ixpk= 867, nxpk= 0, iat=2120,2132, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 147 LEU HG 150 VAL QG1 3.81 (#peak 1093)
&rst
ixpk= 1093, nxpk= 0, iat=2120, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2=2160,2161,2162,
&end
#
# 147 LEU QQD 148 GLU HN 3.51 (#peak 1627)
&rst
ixpk= 1627, nxpk= 0, iat= -1,2132, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1=2126,2127,2128,2122,2123,2124,
&end
#
# 147 LEU QQD 148 GLU HA 4.29 (#peak 2904)
&rst
ixpk= 2904, nxpk= 0, iat= -1,2134, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1=2126,2127,2128,2122,2123,2124,
&end
#
# 147 LEU QQD 150 VAL HN 3.75 (#peak 549)
&rst
ixpk= 549, nxpk= 0, iat= -1,2154, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1=2126,2127,2128,2122,2123,2124,
&end
#
# 147 LEU QQD 150 VAL HB 3.87 (#peak 177)
&rst
ixpk= 177, nxpk= 0, iat= -1,2158, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1=2126,2127,2128,2122,2123,2124,
&end
#
# 148 GLU HN 148 GLU HG3 3.78 (#peak 2626)
&rst
ixpk= 2626, nxpk= 0, iat=2132,2140, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 148 GLU HN 150 VAL HN 5.88 (#peak 231)
&rst
ixpk= 231, nxpk= 0, iat=2132,2154, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 148 GLU HA 148 GLU HG2 3.70 (#peak 1051)
&rst
ixpk= 1051, nxpk= 0, iat=2134,2139, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 148 GLU HA 148 GLU HG3 3.96 (#peak 2902)
&rst
ixpk= 2902, nxpk= 0, iat=2134,2140, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 148 GLU HA 149 GLY HN 2.77 (#peak 390)
&rst
ixpk= 390, nxpk= 0, iat=2134,2147, r1= 1.30, r2= 1.80, r3= 2.77, r4= 3.27, &end
#
# 148 GLU HA 149 GLY HA3 5.09 (#peak 2849)
&rst
ixpk= 2849, nxpk= 0, iat=2134,2150, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 148 GLU HA 150 VAL HN 3.90 (#peak 574)
&rst
ixpk= 574, nxpk= 0, iat=2134,2154, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 148 GLU HB3 149 GLY HN 4.12 (#peak 1332)
&rst
ixpk= 1332, nxpk= 0, iat=2137,2147, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 148 GLU HG2 170 VAL QQG 4.39 (#peak 1057)
&rst
ixpk= 1057, nxpk= 0, iat=2139, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2=2450,2451,2452,2454,2455,2456,
&end
#
# 148 GLU HG3 149 GLY HN 4.26 (#peak 1342)
&rst
ixpk= 1342, nxpk= 0, iat=2140,2147, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 149 GLY HN 150 VAL HN 4.12 (#peak 547)
&rst
ixpk= 547, nxpk= 0, iat=2147,2154, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 149 GLY HN 150 VAL QG1 5.17 (#peak 1117)
&rst
ixpk= 1117, nxpk= 0, iat=2147, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=2160,2161,2162,
&end
#
# 149 GLY HN 167 ASN HB2 6.04 (#peak 1341)
&rst
ixpk= 1341, nxpk= 0, iat=2147,2410, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54, &end
#
# 149 GLY HN 167 ASN HD21 6.25 (#peak 1354)
&rst
ixpk= 1354, nxpk= 0, iat=2147,2415, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 149 GLY HN 170 VAL HB 6.25 (#peak 2704)
&rst
ixpk= 2704, nxpk= 0, iat=2147,2448, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 149 GLY HN 170 VAL QQG 4.09 (#peak 1343)
&rst
ixpk= 1343, nxpk= 0, iat=2147, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=2450,2451,2452,2454,2455,2456,
&end
#
# 149 GLY HN 171 ILE QG2 5.04 (#peak 1841)
&rst
ixpk= 1841, nxpk= 0, iat=2147, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=2466,2467,2468,
&end
#
# 149 GLY HA2 167 ASN HN 5.63 (#peak 752)
&rst
ixpk= 752, nxpk= 0, iat=2149,2406, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 149 GLY HA2 167 ASN HB2 4.69 (#peak 727)
&rst
ixpk= 727, nxpk= 0, iat=2149,2410, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 149 GLY HA2 170 VAL HB 4.15 (#peak 775)
&rst
ixpk= 775, nxpk= 0, iat=2149,2448, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 149 GLY HA2 170 VAL QQG 3.80 (#peak 1406)
&rst
ixpk= 1406, nxpk= 0, iat=2149, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=2450,2451,2452,2454,2455,2456,
&end
#
# 149 GLY HA2 171 ILE HB 6.25 (#peak 1768)
&rst
ixpk= 1768, nxpk= 0, iat=2149,2464, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 149 GLY HA2 171 ILE QG2 3.43 (#peak 1836)
&rst
ixpk= 1836, nxpk= 0, iat=2149, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2=2466,2467,2468,
&end
#
# 149 GLY HA3 167 ASN HN 4.70 (#peak 719)
&rst
ixpk= 719, nxpk= 0, iat=2150,2406, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 149 GLY HA3 167 ASN HB2 4.57 (#peak 979)
&rst
ixpk= 979, nxpk= 0, iat=2150,2410, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 149 GLY HA3 167 ASN HB3 4.17 (#peak 986)
&rst
ixpk= 986, nxpk= 0, iat=2150,2411, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 149 GLY HA3 170 VAL HN 6.25 (#peak 1006)
&rst
ixpk= 1006, nxpk= 0, iat=2150,2444, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 149 GLY HA3 170 VAL HB 3.88 (#peak 1071)
&rst
ixpk= 1071, nxpk= 0, iat=2150,2448, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 149 GLY HA3 170 VAL QQG 3.48 (#peak 754)
&rst
ixpk= 754, nxpk= 0, iat=2150, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr2=2450,2451,2452,2454,2455,2456,
&end
#
# 149 GLY HA3 171 ILE HB 5.53 (#peak 853)
&rst
ixpk= 853, nxpk= 0, iat=2150,2464, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 149 GLY HA3 171 ILE QG2 3.88 (#peak 1838)
&rst
ixpk= 1838, nxpk= 0, iat=2150, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2=2466,2467,2468,
&end
#
# 150 VAL HN 150 VAL HB 3.35 (#peak 1219)
&rst
ixpk= 1219, nxpk= 0, iat=2154,2158, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 150 VAL HN 150 VAL QG1 3.21 (#peak 1553)
&rst
ixpk= 1553, nxpk= 0, iat=2154, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2=2160,2161,2162,
&end
#
# 150 VAL HN 150 VAL QG2 4.82 (#peak 1510)
&rst
ixpk= 1510, nxpk= 0, iat=2154, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=2164,2165,2166,
&end
#
# 150 VAL HN 151 GLN HN 5.48 (#peak 573)
&rst
ixpk= 573, nxpk= 0, iat=2154,2170, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 150 VAL HN 166 TYR HA 5.65 (#peak 523)
&rst
ixpk= 523, nxpk= 0, iat=2154,2387, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 150 VAL HA 150 VAL QG1 3.42 (#peak 147)
&rst
ixpk= 147, nxpk= 0, iat=2156, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2=2160,2161,2162,
&end
#
# 150 VAL HA 150 VAL QG2 3.40 (#peak 1512)
&rst
ixpk= 1512, nxpk= 0, iat=2156, -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr2=2164,2165,2166,
&end
#
# 150 VAL HA 151 GLN HA 6.10 (#peak 54)
&rst
ixpk= 54, nxpk= 0, iat=2156,2172, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60, &end
#
# 150 VAL HA 152 GLN HN 5.09 (#peak 2053)
&rst
ixpk= 2053, nxpk= 0, iat=2156,2187, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 150 VAL HA 166 TYR HA 3.55 (#peak 498)
&rst
ixpk= 498, nxpk= 0, iat=2156,2387, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 150 VAL HA 166 TYR HB2 4.34 (#peak 146)
&rst
ixpk= 146, nxpk= 0, iat=2156,2389, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 150 VAL HA 167 ASN HN 5.89 (#peak 737)
&rst
ixpk= 737, nxpk= 0, iat=2156,2406, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 150 VAL HB 151 GLN HN 5.34 (#peak 117)
&rst
ixpk= 117, nxpk= 0, iat=2158,2170, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, &end
#
# 150 VAL QG1 166 TYR HA 5.78 (#peak 1118)
&rst
ixpk= 1118, nxpk= 0, iat= -1,2387, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1=2160,2161,2162,
&end
#
# 150 VAL QG2 151 GLN HN 3.81 (#peak 1703)
&rst
ixpk= 1703, nxpk= 0, iat= -1,2170, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1=2164,2165,2166,
&end
#
# 150 VAL QG2 152 GLN HN 4.15 (#peak 1509)
&rst
ixpk= 1509, nxpk= 0, iat= -1,2187, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1=2164,2165,2166,
&end
#
# 150 VAL QG2 153 ILE QG2 2.50 (#peak 1712)
&rst
ixpk= 1712, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr1=2164,2165,2166,
igr2=2210,2211,2212,
&end
#
# 150 VAL QG2 166 TYR HA 5.01 (#peak 1511)
&rst
ixpk= 1511, nxpk= 0, iat= -1,2387, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1=2164,2165,2166,
&end
#
# 150 VAL QG2 166 TYR HB2 5.82 (#peak 1513)
&rst
ixpk= 1513, nxpk= 0, iat= -1,2389, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr1=2164,2165,2166,
&end
#
# 151 GLN HN 151 GLN HG2 4.61 (#peak 1105)
&rst
ixpk= 1105, nxpk= 0, iat=2170,2177, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 151 GLN HN 152 GLN HN 4.42 (#peak 1009)
&rst
ixpk= 1009, nxpk= 0, iat=2170,2187, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 151 GLN HN 166 TYR HA 5.23 (#peak 114)
&rst
ixpk= 114, nxpk= 0, iat=2170,2387, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 151 GLN HA 151 GLN HG2 3.55 (#peak 1159)
&rst
ixpk= 1159, nxpk= 0, iat=2172,2177, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 151 GLN HA 151 GLN HG3 4.24 (#peak 1143)
&rst
ixpk= 1143, nxpk= 0, iat=2172,2178, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 151 GLN HB2 152 GLN HN 4.27 (#peak 1292)
&rst
ixpk= 1292, nxpk= 0, iat=2174,2187, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 151 GLN HB2 165 LEU QD1 4.04 (#peak 1328)
&rst
ixpk= 1328, nxpk= 0, iat=2174, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2=2375,2376,2377,
&end
#
# 151 GLN HB2 166 TYR HA 6.18 (#peak 460)
&rst
ixpk= 460, nxpk= 0, iat=2174,2387, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68, &end
#
# 151 GLN HB3 151 GLN HE21 5.04 (#peak 1325)
&rst
ixpk= 1325, nxpk= 0, iat=2175,2182, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 151 GLN HB3 152 GLN HN 3.92 (#peak 1013)
&rst
ixpk= 1013, nxpk= 0, iat=2175,2187, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 151 GLN HB3 165 LEU HA 6.07 (#peak 509)
&rst
ixpk= 509, nxpk= 0, iat=2175,2368, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57, &end
#
# 151 GLN HE21 165 LEU QD1 4.15 (#peak 1326)
&rst
ixpk= 1326, nxpk= 0, iat=2182, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2=2375,2376,2377,
&end
#
# 151 GLN HE22 152 GLN HN 6.19 (#peak 1329)
&rst
ixpk= 1329, nxpk= 0, iat=2183,2187, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69, &end
#
# 151 GLN HE22 152 GLN HA 6.03 (#peak 470)
&rst
ixpk= 470, nxpk= 0, iat=2183,2189, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 151 GLN HE22 152 GLN HB2 5.89 (#peak 3028)
&rst
ixpk= 3028, nxpk= 0, iat=2183,2191, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 151 GLN HE22 165 LEU QD1 3.94 (#peak 1310)
&rst
ixpk= 1310, nxpk= 0, iat=2183, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=2375,2376,2377,
&end
#
# 151 GLN HE22 165 LEU QD2 5.17 (#peak 1098)
&rst
ixpk= 1098, nxpk= 0, iat=2183, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=2379,2380,2381,
&end
#
# 151 GLN HG2 152 GLN HN 5.36 (#peak 1136)
&rst
ixpk= 1136, nxpk= 0, iat=2177,2187, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 151 GLN HG3 151 GLN HE21 3.87 (#peak 1324)
&rst
ixpk= 1324, nxpk= 0, iat=2178,2182, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 151 GLN HG3 165 LEU HG 4.80 (#peak 1406)
&rst
ixpk= 1406, nxpk= 0, iat=2178,2373, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 151 GLN HG3 165 LEU QD1 4.00 (#peak 2953)
&rst
ixpk= 2953, nxpk= 0, iat=2178, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=2375,2376,2377,
&end
#
# 152 GLN HN 152 GLN HG2 5.20 (#peak 1012)
&rst
ixpk= 1012, nxpk= 0, iat=2187,2194, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 152 GLN HN 153 ILE HN 5.45 (#peak 519)
&rst
ixpk= 519, nxpk= 0, iat=2187,2204, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 152 GLN HN 153 ILE QG2 5.06 (#peak 1923)
&rst
ixpk= 1923, nxpk= 0, iat=2187, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2=2210,2211,2212,
&end
#
# 152 GLN HN 164 VAL HA 5.86 (#peak 1814)
&rst
ixpk= 1814, nxpk= 0, iat=2187,2352, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 152 GLN HN 165 LEU HN 4.99 (#peak 993)
&rst
ixpk= 993, nxpk= 0, iat=2187,2366, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 152 GLN HN 165 LEU HA 6.25 (#peak 412)
&rst
ixpk= 412, nxpk= 0, iat=2187,2368, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 152 GLN HN 165 LEU HB2 4.21 (#peak 813)
&rst
ixpk= 813, nxpk= 0, iat=2187,2370, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 152 GLN HN 165 LEU HB3 4.24 (#peak 816)
&rst
ixpk= 816, nxpk= 0, iat=2187,2371, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 152 GLN HN 165 LEU HG 4.94 (#peak 1404)
&rst
ixpk= 1404, nxpk= 0, iat=2187,2373, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 152 GLN HN 165 LEU QD1 3.89 (#peak 1922)
&rst
ixpk= 1922, nxpk= 0, iat=2187, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2=2375,2376,2377,
&end
#
# 152 GLN HN 165 LEU QD2 5.31 (#peak 1097)
&rst
ixpk= 1097, nxpk= 0, iat=2187, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2=2379,2380,2381,
&end
#
# 152 GLN HN 166 TYR HN 6.25 (#peak 262)
&rst
ixpk= 262, nxpk= 0, iat=2187,2385, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 152 GLN HN 166 TYR HA 5.19 (#peak 497)
&rst
ixpk= 497, nxpk= 0, iat=2187,2387, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 152 GLN HA 152 GLN HG2 3.77 (#peak 168)
&rst
ixpk= 168, nxpk= 0, iat=2189,2194, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 152 GLN HA 153 ILE HN 3.07 (#peak 477)
&rst
ixpk= 477, nxpk= 0, iat=2189,2204, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57, &end
#
# 152 GLN HA 153 ILE QG2 3.94 (#peak 1847)
&rst
ixpk= 1847, nxpk= 0, iat=2189, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=2210,2211,2212,
&end
#
# 152 GLN HB2 153 ILE HN 4.64 (#peak 3030)
&rst
ixpk= 3030, nxpk= 0, iat=2191,2204, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 152 GLN HB2 165 LEU HB2 3.90 (#peak 812)
&rst
ixpk= 812, nxpk= 0, iat=2191,2370, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 152 GLN HB3 152 GLN HG3 2.85 (#peak 2943)
&rst
ixpk= 2943, nxpk= 0, iat=2192,2195, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35, &end
#
# 152 GLN HB3 153 ILE HN 4.37 (#peak 532)
&rst
ixpk= 532, nxpk= 0, iat=2192,2204, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 152 GLN HB3 153 ILE HA 6.00 (#peak 2788)
&rst
ixpk= 2788, nxpk= 0, iat=2192,2206, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 152 GLN HB3 154 SER HB2 6.25 (#peak 3042)
&rst
ixpk= 3042, nxpk= 0, iat=2192,2227, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 152 GLN HB3 165 LEU HN 4.50 (#peak 1938)
&rst
ixpk= 1938, nxpk= 0, iat=2192,2366, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 152 GLN HB3 165 LEU HB2 4.57 (#peak 1636)
&rst
ixpk= 1636, nxpk= 0, iat=2192,2370, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 152 GLN HB3 165 LEU HB3 3.71 (#peak 814)
&rst
ixpk= 814, nxpk= 0, iat=2192,2371, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 152 GLN HG2 153 ILE HN 4.32 (#peak 1110)
&rst
ixpk= 1110, nxpk= 0, iat=2194,2204, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 152 GLN HG2 165 LEU HN 5.07 (#peak 1939)
&rst
ixpk= 1939, nxpk= 0, iat=2194,2366, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 152 GLN HG3 153 ILE HN 4.49 (#peak 2834)
&rst
ixpk= 2834, nxpk= 0, iat=2195,2204, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 153 ILE HN 153 ILE HG13 6.19 (#peak 551)
&rst
ixpk= 551, nxpk= 0, iat=2204,2215, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69, &end
#
# 153 ILE HN 153 ILE QD1 4.75 (#peak 597)
&rst
ixpk= 597, nxpk= 0, iat=2204, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=2217,2218,2219,
&end
#
# 153 ILE HN 153 ILE QG2 3.26 (#peak 1845)
&rst
ixpk= 1845, nxpk= 0, iat=2204, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=2210,2211,2212,
&end
#
# 153 ILE HN 154 SER HN 4.94 (#peak 580)
&rst
ixpk= 580, nxpk= 0, iat=2204,2223, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 153 ILE HA 153 ILE HG12 4.02 (#peak 1332)
&rst
ixpk= 1332, nxpk= 0, iat=2206,2214, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 153 ILE HA 153 ILE QD1 4.25 (#peak 1863)
&rst
ixpk= 1863, nxpk= 0, iat=2206, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=2217,2218,2219,
&end
#
# 153 ILE HA 153 ILE QG2 3.67 (#peak 378)
&rst
ixpk= 378, nxpk= 0, iat=2206, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2=2210,2211,2212,
&end
#
# 153 ILE HA 154 SER HN 3.38 (#peak 374)
&rst
ixpk= 374, nxpk= 0, iat=2206,2223, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 153 ILE HA 154 SER HB2 4.92 (#peak 375)
&rst
ixpk= 375, nxpk= 0, iat=2206,2227, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 153 ILE HA 154 SER HB3 5.81 (#peak 2792)
&rst
ixpk= 2792, nxpk= 0, iat=2206,2228, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 153 ILE HA 164 VAL HA 3.82 (#peak 271)
&rst
ixpk= 271, nxpk= 0, iat=2206,2352, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 153 ILE HA 164 VAL QG1 4.66 (#peak 1592)
&rst
ixpk= 1592, nxpk= 0, iat=2206, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2=2356,2357,2358,
&end
#
# 153 ILE HA 164 VAL QG2 4.16 (#peak 2791)
&rst
ixpk= 2791, nxpk= 0, iat=2206, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2=2360,2361,2362,
&end
#
# 153 ILE HA 165 LEU HN 4.70 (#peak 46)
&rst
ixpk= 46, nxpk= 0, iat=2206,2366, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 153 ILE HB 153 ILE QD1 3.14 (#peak 1853)
&rst
ixpk= 1853, nxpk= 0, iat=2208, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2=2217,2218,2219,
&end
#
# 153 ILE HB 154 SER HN 4.29 (#peak 1847)
&rst
ixpk= 1847, nxpk= 0, iat=2208,2223, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 153 ILE HB 164 VAL HA 5.07 (#peak 3246)
&rst
ixpk= 3246, nxpk= 0, iat=2208,2352, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 153 ILE HB 164 VAL HB 3.77 (#peak 1936)
&rst
ixpk= 1936, nxpk= 0, iat=2208,2354, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 153 ILE HB 164 VAL QG1 4.63 (#peak 3241)
&rst
ixpk= 3241, nxpk= 0, iat=2208, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=2356,2357,2358,
&end
#
# 153 ILE HB 164 VAL QG2 4.71 (#peak 3197)
&rst
ixpk= 3197, nxpk= 0, iat=2208, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=2360,2361,2362,
&end
#
# 153 ILE HG12 154 SER HN 4.25 (#peak 1334)
&rst
ixpk= 1334, nxpk= 0, iat=2214,2223, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 153 ILE HG12 154 SER HA 5.29 (#peak 1333)
&rst
ixpk= 1333, nxpk= 0, iat=2214,2225, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 153 ILE HG12 164 VAL HA 6.17 (#peak 571)
&rst
ixpk= 571, nxpk= 0, iat=2214,2352, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67, &end
#
# 153 ILE HG12 164 VAL QG1 4.53 (#peak 3240)
&rst
ixpk= 3240, nxpk= 0, iat=2214, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2=2356,2357,2358,
&end
#
# 153 ILE HG12 164 VAL QG2 4.94 (#peak 3198)
&rst
ixpk= 3198, nxpk= 0, iat=2214, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=2360,2361,2362,
&end
#
# 153 ILE HG13 154 SER HN 5.22 (#peak 582)
&rst
ixpk= 582, nxpk= 0, iat=2215,2223, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 153 ILE HG13 154 SER HB3 5.93 (#peak 552)
&rst
ixpk= 552, nxpk= 0, iat=2215,2228, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 153 ILE HG13 164 VAL QG2 4.63 (#peak 3200)
&rst
ixpk= 3200, nxpk= 0, iat=2215, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=2360,2361,2362,
&end
#
# 153 ILE QD1 154 SER HN 4.62 (#peak 1846)
&rst
ixpk= 1846, nxpk= 0, iat= -1,2223, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr1=2217,2218,2219,
&end
#
# 153 ILE QD1 164 VAL HA 5.11 (#peak 3191)
&rst
ixpk= 3191, nxpk= 0, iat= -1,2352, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1=2217,2218,2219,
&end
#
# 153 ILE QD1 164 VAL HB 4.03 (#peak 1937)
&rst
ixpk= 1937, nxpk= 0, iat= -1,2354, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1=2217,2218,2219,
&end
#
# 153 ILE QG2 153 ILE QD1 3.06 (#peak 2251)
&rst
ixpk= 2251, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1=2210,2211,2212,
igr2=2217,2218,2219,
&end
#
# 153 ILE QG2 154 SER HN 4.28 (#peak 1845)
&rst
ixpk= 1845, nxpk= 0, iat= -1,2223, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=2210,2211,2212,
&end
#
# 153 ILE QG2 154 SER HA 5.99 (#peak 167)
&rst
ixpk= 167, nxpk= 0, iat= -1,2225, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
igr1=2210,2211,2212,
&end
#
# 153 ILE QG2 164 VAL QG2 4.89 (#peak 3199)
&rst
ixpk= 3199, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1=2210,2211,2212,
igr2=2360,2361,2362,
&end
#
# 153 ILE QG2 165 LEU HN 5.35 (#peak 1856)
&rst
ixpk= 1856, nxpk= 0, iat= -1,2366, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr1=2210,2211,2212,
&end
#
# 154 SER HN 154 SER HB2 4.05 (#peak 133)
&rst
ixpk= 133, nxpk= 0, iat=2223,2227, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 154 SER HN 155 VAL HN 5.92 (#peak 646)
&rst
ixpk= 646, nxpk= 0, iat=2223,2234, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 154 SER HN 163 THR HN 5.23 (#peak 603)
&rst
ixpk= 603, nxpk= 0, iat=2223,2336, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 154 SER HN 163 THR HB 6.25 (#peak 1941)
&rst
ixpk= 1941, nxpk= 0, iat=2223,2340, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 154 SER HN 163 THR QG2 4.22 (#peak 1844)
&rst
ixpk= 1844, nxpk= 0, iat=2223, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=2342,2343,2344,
&end
#
# 154 SER HN 164 VAL HA 5.07 (#peak 1921)
&rst
ixpk= 1921, nxpk= 0, iat=2223,2352, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 154 SER HN 164 VAL QG1 4.29 (#peak 1588)
&rst
ixpk= 1588, nxpk= 0, iat=2223, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=2356,2357,2358,
&end
#
# 154 SER HN 164 VAL QG2 5.17 (#peak 1726)
&rst
ixpk= 1726, nxpk= 0, iat=2223, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=2360,2361,2362,
&end
#
# 154 SER HN 165 LEU HN 6.25 (#peak 42)
&rst
ixpk= 42, nxpk= 0, iat=2223,2366, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 154 SER HA 155 VAL HN 3.26 (#peak 464)
&rst
ixpk= 464, nxpk= 0, iat=2225,2234, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 154 SER HA 155 VAL QQG 4.97 (#peak 117)
&rst
ixpk= 117, nxpk= 0, iat=2225, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr2=2240,2241,2242,2244,2245,2246,
&end
#
# 154 SER HB2 155 VAL HN 5.18 (#peak 132)
&rst
ixpk= 132, nxpk= 0, iat=2227,2234, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 154 SER HB2 163 THR HN 5.00 (#peak 3289)
&rst
ixpk= 3289, nxpk= 0, iat=2227,2336, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 154 SER HB3 155 VAL HN 4.65 (#peak 134)
&rst
ixpk= 134, nxpk= 0, iat=2228,2234, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 154 SER HB3 163 THR HN 5.51 (#peak 3288)
&rst
ixpk= 3288, nxpk= 0, iat=2228,2336, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 155 VAL HN 155 VAL HB 3.94 (#peak 1183)
&rst
ixpk= 1183, nxpk= 0, iat=2234,2238, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 155 VAL HN 155 VAL QQG 4.74 (#peak 1306)
&rst
ixpk= 1306, nxpk= 0, iat=2234, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr2=2240,2241,2242,2244,2245,2246,
&end
#
# 155 VAL HN 156 SER HN 6.25 (#peak 527)
&rst
ixpk= 527, nxpk= 0, iat=2234,2250, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 155 VAL HA 155 VAL QQG 3.73 (#peak 1603)
&rst
ixpk= 1603, nxpk= 0, iat=2236, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=2240,2241,2242,2244,2245,2246,
&end
#
# 155 VAL HA 156 SER HN 3.23 (#peak 265)
&rst
ixpk= 265, nxpk= 0, iat=2236,2250, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 155 VAL HA 161 THR HN 4.88 (#peak 1854)
&rst
ixpk= 1854, nxpk= 0, iat=2236,2312, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 155 VAL HA 162 ALA HA 4.38 (#peak 918)
&rst
ixpk= 918, nxpk= 0, iat=2236,2328, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 155 VAL HA 163 THR HN 4.24 (#peak 1849)
&rst
ixpk= 1849, nxpk= 0, iat=2236,2336, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 155 VAL HB 156 SER HN 3.98 (#peak 2018)
&rst
ixpk= 2018, nxpk= 0, iat=2238,2250, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 155 VAL HB 163 THR HN 5.58 (#peak 1850)
&rst
ixpk= 1850, nxpk= 0, iat=2238,2336, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 155 VAL QQG 156 SER HN 3.76 (#peak 1629)
&rst
ixpk= 1629, nxpk= 0, iat= -1,2250, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1=2240,2241,2242,2244,2245,2246,
&end
#
# 155 VAL QQG 156 SER HB2 5.70 (#peak 1310)
&rst
ixpk= 1310, nxpk= 0, iat= -1,2254, r1= 1.30, r2= 1.80, r3= 7.68, r4= 8.18,
igr1=2240,2241,2242,2244,2245,2246,
&end
#
# 155 VAL QQG 161 THR HN 4.82 (#peak 1463)
&rst
ixpk= 1463, nxpk= 0, iat= -1,2312, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=2240,2241,2242,2244,2245,2246,
&end
#
# 155 VAL QQG 163 THR HN 4.87 (#peak 1852)
&rst
ixpk= 1852, nxpk= 0, iat= -1,2336, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1=2240,2241,2242,2244,2245,2246,
&end
#
# 156 SER HN 156 SER HB2 4.00 (#peak 1817)
&rst
ixpk= 1817, nxpk= 0, iat=2250,2254, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 156 SER HN 156 SER HB3 4.04 (#peak 202)
&rst
ixpk= 202, nxpk= 0, iat=2250,2255, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 156 SER HN 159 GLU HN 5.64 (#peak 1853)
&rst
ixpk= 1853, nxpk= 0, iat=2250,2290, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 156 SER HN 160 GLY HN 6.25 (#peak 1360)
&rst
ixpk= 1360, nxpk= 0, iat=2250,2305, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 156 SER HN 160 GLY HA2 5.45 (#peak 1856)
&rst
ixpk= 1856, nxpk= 0, iat=2250,2307, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 156 SER HN 161 THR HN 4.43 (#peak 1453)
&rst
ixpk= 1453, nxpk= 0, iat=2250,2312, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 156 SER HN 162 ALA HA 4.22 (#peak 1920)
&rst
ixpk= 1920, nxpk= 0, iat=2250,2328, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 156 SER HB2 157 LEU HN 4.42 (#peak 1815)
&rst
ixpk= 1815, nxpk= 0, iat=2254,2261, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 156 SER HB3 157 LEU HN 4.92 (#peak 1816)
&rst
ixpk= 1816, nxpk= 0, iat=2255,2261, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 157 LEU HN 157 LEU HB2 4.14 (#peak 1842)
&rst
ixpk= 1842, nxpk= 0, iat=2261,2265, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 157 LEU HN 157 LEU HB3 3.74 (#peak 863)
&rst
ixpk= 863, nxpk= 0, iat=2261,2266, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 157 LEU HN 157 LEU HG 4.94 (#peak 911)
&rst
ixpk= 911, nxpk= 0, iat=2261,2268, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 157 LEU HN 157 LEU QD1 5.07 (#peak 1530)
&rst
ixpk= 1530, nxpk= 0, iat=2261, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr2=2270,2271,2272,
&end
#
# 157 LEU HN 157 LEU QD2 4.34 (#peak 29)
&rst
ixpk= 29, nxpk= 0, iat=2261, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2=2274,2275,2276,
&end
#
# 157 LEU HN 158 ALA HN 4.30 (#peak 673)
&rst
ixpk= 673, nxpk= 0, iat=2261,2280, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 157 LEU HN 158 ALA QB 5.25 (#peak 1725)
&rst
ixpk= 1725, nxpk= 0, iat=2261, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2=2284,2285,2286,
&end
#
# 157 LEU HN 159 GLU HN 6.05 (#peak 23)
&rst
ixpk= 23, nxpk= 0, iat=2261,2290, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 157 LEU HA 157 LEU QD1 3.81 (#peak 1030)
&rst
ixpk= 1030, nxpk= 0, iat=2263, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2=2270,2271,2272,
&end
#
# 157 LEU HA 157 LEU QD2 3.39 (#peak 2911)
&rst
ixpk= 2911, nxpk= 0, iat=2263, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2=2274,2275,2276,
&end
#
# 157 LEU HA 159 GLU HN 6.01 (#peak 2906)
&rst
ixpk= 2906, nxpk= 0, iat=2263,2290, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 157 LEU HA 160 GLY HA2 5.12 (#peak 3218)
&rst
ixpk= 3218, nxpk= 0, iat=2263,2307, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 157 LEU HA 160 GLY HA3 5.23 (#peak 3219)
&rst
ixpk= 3219, nxpk= 0, iat=2263,2308, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 157 LEU HA 161 THR HN 5.09 (#peak 3220)
&rst
ixpk= 3220, nxpk= 0, iat=2263,2312, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 157 LEU HB3 157 LEU QD1 2.88 (#peak 1032)
&rst
ixpk= 1032, nxpk= 0, iat=2266, -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
igr2=2270,2271,2272,
&end
#
# 157 LEU HB3 157 LEU QD2 3.77 (#peak 1137)
&rst
ixpk= 1137, nxpk= 0, iat=2266, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2=2274,2275,2276,
&end
#
# 157 LEU HB3 158 ALA HN 5.49 (#peak 926)
&rst
ixpk= 926, nxpk= 0, iat=2266,2280, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 157 LEU HG 158 ALA HN 5.58 (#peak 913)
&rst
ixpk= 913, nxpk= 0, iat=2268,2280, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 157 LEU QD1 158 ALA HN 4.79 (#peak 1029)
&rst
ixpk= 1029, nxpk= 0, iat= -1,2280, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1=2270,2271,2272,
&end
#
# 157 LEU QD2 158 ALA HN 4.95 (#peak 679)
&rst
ixpk= 679, nxpk= 0, iat= -1,2280, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1=2274,2275,2276,
&end
#
# 157 LEU QD2 159 GLU HN 6.25 (#peak 1216)
&rst
ixpk= 1216, nxpk= 0, iat= -1,2290, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1=2274,2275,2276,
&end
#
# 157 LEU QD2 160 GLY HN 5.05 (#peak 1373)
&rst
ixpk= 1373, nxpk= 0, iat= -1,2305, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=2274,2275,2276,
&end
#
# 157 LEU QD2 160 GLY HA2 6.25 (#peak 1265)
&rst
ixpk= 1265, nxpk= 0, iat= -1,2307, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1=2274,2275,2276,
&end
#
# 157 LEU QD2 160 GLY HA3 5.23 (#peak 1558)
&rst
ixpk= 1558, nxpk= 0, iat= -1,2308, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1=2274,2275,2276,
&end
#
# 158 ALA HN 158 ALA QB 3.08 (#peak 1765)
&rst
ixpk= 1765, nxpk= 0, iat=2280, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr2=2284,2285,2286,
&end
#
# 158 ALA HN 159 GLU HN 4.49 (#peak 675)
&rst
ixpk= 675, nxpk= 0, iat=2280,2290, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 158 ALA HN 159 GLU QG 4.78 (#peak 677)
&rst
ixpk= 677, nxpk= 0, iat=2280, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=2297,2298,
&end
#
# 158 ALA HN 160 GLY HN 6.25 (#peak 674)
&rst
ixpk= 674, nxpk= 0, iat=2280,2305, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 158 ALA HN 161 THR HN 5.32 (#peak 1917)
&rst
ixpk= 1917, nxpk= 0, iat=2280,2312, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 158 ALA QB 159 GLU HN 3.62 (#peak 1766)
&rst
ixpk= 1766, nxpk= 0, iat= -1,2290, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1=2284,2285,2286,
&end
#
# 158 ALA QB 159 GLU QG 3.30 (#peak 1764)
&rst
ixpk= 1764, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,
igr1=2284,2285,2286,
igr2=2297,2298,
&end
#
# 158 ALA QB 160 GLY HN 4.76 (#peak 1372)
&rst
ixpk= 1372, nxpk= 0, iat= -1,2305, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=2284,2285,2286,
&end
#
# 158 ALA QB 161 THR HN 5.17 (#peak 1918)
&rst
ixpk= 1918, nxpk= 0, iat= -1,2312, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1=2284,2285,2286,
&end
#
# 159 GLU HN 159 GLU HB2 3.72 (#peak 1224)
&rst
ixpk= 1224, nxpk= 0, iat=2290,2294, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 159 GLU HN 159 GLU HB3 4.12 (#peak 1295)
&rst
ixpk= 1295, nxpk= 0, iat=2290,2295, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 159 GLU HN 159 GLU QG 3.65 (#peak 1043)
&rst
ixpk= 1043, nxpk= 0, iat=2290, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2=2297,2298,
&end
#
# 159 GLU HN 160 GLY HN 4.51 (#peak 1364)
&rst
ixpk= 1364, nxpk= 0, iat=2290,2305, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 159 GLU HN 160 GLY HA2 6.25 (#peak 1266)
&rst
ixpk= 1266, nxpk= 0, iat=2290,2307, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 159 GLU HN 160 GLY HA3 5.86 (#peak 1267)
&rst
ixpk= 1267, nxpk= 0, iat=2290,2308, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 159 GLU HN 161 THR HN 5.45 (#peak 1449)
&rst
ixpk= 1449, nxpk= 0, iat=2290,2312, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 159 GLU HN 161 THR QG2 6.01 (#peak 1227)
&rst
ixpk= 1227, nxpk= 0, iat=2290, -1, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
igr2=2318,2319,2320,
&end
#
# 159 GLU HA 159 GLU QG 3.20 (#peak 1044)
&rst
ixpk= 1044, nxpk= 0, iat=2292, -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
igr2=2297,2298,
&end
#
# 159 GLU HA 161 THR HN 5.57 (#peak 1457)
&rst
ixpk= 1457, nxpk= 0, iat=2292,2312, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 159 GLU HB2 160 GLY HN 4.39 (#peak 1370)
&rst
ixpk= 1370, nxpk= 0, iat=2294,2305, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 159 GLU HB2 160 GLY HA3 6.25 (#peak 1244)
&rst
ixpk= 1244, nxpk= 0, iat=2294,2308, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 159 GLU HB2 161 THR HN 4.45 (#peak 1459)
&rst
ixpk= 1459, nxpk= 0, iat=2294,2312, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 159 GLU HB2 161 THR QG2 4.32 (#peak 1451)
&rst
ixpk= 1451, nxpk= 0, iat=2294, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=2318,2319,2320,
&end
#
# 159 GLU HB3 159 GLU QG 2.81 (#peak 1268)
&rst
ixpk= 1268, nxpk= 0, iat=2295, -1, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,
igr2=2297,2298,
&end
#
# 159 GLU HB3 160 GLY HN 5.64 (#peak 440)
&rst
ixpk= 440, nxpk= 0, iat=2295,2305, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 159 GLU HB3 161 THR HN 6.10 (#peak 395)
&rst
ixpk= 395, nxpk= 0, iat=2295,2312, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60, &end
#
# 159 GLU QG 160 GLY HN 4.93 (#peak 2549)
&rst
ixpk= 2549, nxpk= 0, iat= -1,2305, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr1=2297,2298,
&end
#
# 160 GLY HN 161 THR HN 4.11 (#peak 1454)
&rst
ixpk= 1454, nxpk= 0, iat=2305,2312, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 160 GLY HN 161 THR HA 6.25 (#peak 1361)
&rst
ixpk= 1361, nxpk= 0, iat=2305,2314, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 160 GLY HN 161 THR QG2 5.28 (#peak 1362)
&rst
ixpk= 1362, nxpk= 0, iat=2305, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2=2318,2319,2320,
&end
#
# 160 GLY HA2 161 THR QG2 6.21 (#peak 1260)
&rst
ixpk= 1260, nxpk= 0, iat=2307, -1, r1= 1.30, r2= 1.80, r3= 7.46, r4= 7.96,
igr2=2318,2319,2320,
&end
#
# 161 THR HN 161 THR QG2 4.05 (#peak 1675)
&rst
ixpk= 1675, nxpk= 0, iat=2312, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2=2318,2319,2320,
&end
#
# 161 THR HN 162 ALA HN 5.46 (#peak 1452)
&rst
ixpk= 1452, nxpk= 0, iat=2312,2326, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 161 THR HA 161 THR QG2 3.36 (#peak 1693)
&rst
ixpk= 1693, nxpk= 0, iat=2314, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2=2318,2319,2320,
&end
#
# 161 THR HA 162 ALA HN 3.37 (#peak 362)
&rst
ixpk= 362, nxpk= 0, iat=2314,2326, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 161 THR HB 162 ALA HN 3.71 (#peak 11)
&rst
ixpk= 11, nxpk= 0, iat=2316,2326, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 161 THR HB 162 ALA QB 4.77 (#peak 1320)
&rst
ixpk= 1320, nxpk= 0, iat=2316, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr2=2330,2331,2332,
&end
#
# 161 THR QG2 162 ALA HN 4.19 (#peak 1445)
&rst
ixpk= 1445, nxpk= 0, iat= -1,2326, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=2318,2319,2320,
&end
#
# 162 ALA HN 162 ALA QB 3.67 (#peak 1620)
&rst
ixpk= 1620, nxpk= 0, iat=2326, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2=2330,2331,2332,
&end
#
# 162 ALA HA 163 THR HN 3.18 (#peak 658)
&rst
ixpk= 658, nxpk= 0, iat=2328,2336, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68, &end
#
# 162 ALA QB 163 THR HN 3.85 (#peak 1621)
&rst
ixpk= 1621, nxpk= 0, iat= -1,2336, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1=2330,2331,2332,
&end
#
# 163 THR HN 163 THR HB 3.75 (#peak 40)
&rst
ixpk= 40, nxpk= 0, iat=2336,2340, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 163 THR HN 164 VAL HN 6.25 (#peak 120)
&rst
ixpk= 120, nxpk= 0, iat=2336,2350, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 163 THR HA 163 THR QG2 3.52 (#peak 220)
&rst
ixpk= 220, nxpk= 0, iat=2338, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2=2342,2343,2344,
&end
#
# 163 THR HA 164 VAL HN 3.16 (#peak 215)
&rst
ixpk= 215, nxpk= 0, iat=2338,2350, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, &end
#
# 163 THR HB 164 VAL HN 5.40 (#peak 124)
&rst
ixpk= 124, nxpk= 0, iat=2340,2350, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 163 THR QG2 164 VAL HN 4.39 (#peak 126)
&rst
ixpk= 126, nxpk= 0, iat= -1,2350, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr1=2342,2343,2344,
&end
#
# 164 VAL HN 164 VAL HB 4.06 (#peak 1119)
&rst
ixpk= 1119, nxpk= 0, iat=2350,2354, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 164 VAL HN 164 VAL QG2 3.58 (#peak 1722)
&rst
ixpk= 1722, nxpk= 0, iat=2350, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2=2360,2361,2362,
&end
#
# 164 VAL HN 176 LEU QD1 6.13 (#peak 139)
&rst
ixpk= 139, nxpk= 0, iat=2350, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr2=2543,2544,2545,
&end
#
# 164 VAL HA 164 VAL QG1 3.33 (#peak 1593)
&rst
ixpk= 1593, nxpk= 0, iat=2352, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2=2356,2357,2358,
&end
#
# 164 VAL HA 164 VAL QG2 3.48 (#peak 1728)
&rst
ixpk= 1728, nxpk= 0, iat=2352, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr2=2360,2361,2362,
&end
#
# 164 VAL HA 165 LEU HN 3.34 (#peak 270)
&rst
ixpk= 270, nxpk= 0, iat=2352,2366, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 164 VAL HA 165 LEU HB2 5.87 (#peak 1639)
&rst
ixpk= 1639, nxpk= 0, iat=2352,2370, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 164 VAL HA 165 LEU HB3 5.87 (#peak 1645)
&rst
ixpk= 1645, nxpk= 0, iat=2352,2371, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 164 VAL HB 176 LEU QD1 5.83 (#peak 2881)
&rst
ixpk= 2881, nxpk= 0, iat=2354, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr2=2543,2544,2545,
&end
#
# 164 VAL QG1 165 LEU HN 4.47 (#peak 1196)
&rst
ixpk= 1196, nxpk= 0, iat= -1,2366, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=2356,2357,2358,
&end
#
# 164 VAL QG1 176 LEU QD1 4.13 (#peak 1200)
&rst
ixpk= 1200, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1=2356,2357,2358,
igr2=2543,2544,2545,
&end
#
# 164 VAL QG2 166 TYR QD 4.80 (#peak 1727)
&rst
ixpk= 1727, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr1=2360,2361,2362,
igr2=2393,2402,
&end
#
# 164 VAL QG2 176 LEU QD1 3.35 (#peak 1730)
&rst
ixpk= 1730, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1=2360,2361,2362,
igr2=2543,2544,2545,
&end
#
# 165 LEU HN 165 LEU HB2 3.99 (#peak 811)
&rst
ixpk= 811, nxpk= 0, iat=2366,2370, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 165 LEU HN 165 LEU HB3 3.86 (#peak 815)
&rst
ixpk= 815, nxpk= 0, iat=2366,2371, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 165 LEU HN 166 TYR HN 5.01 (#peak 1840)
&rst
ixpk= 1840, nxpk= 0, iat=2366,2385, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 165 LEU HN 166 TYR QD 6.25 (#peak 44)
&rst
ixpk= 44, nxpk= 0, iat=2366, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=2393,2402,
&end
#
# 165 LEU HA 165 LEU HG 4.17 (#peak 1382)
&rst
ixpk= 1382, nxpk= 0, iat=2368,2373, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 165 LEU HA 165 LEU QD1 4.10 (#peak 999)
&rst
ixpk= 999, nxpk= 0, iat=2368, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr2=2375,2376,2377,
&end
#
# 165 LEU HA 165 LEU QD2 3.72 (#peak 562)
&rst
ixpk= 562, nxpk= 0, iat=2368, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2=2379,2380,2381,
&end
#
# 165 LEU HA 166 TYR HB3 5.40 (#peak 445)
&rst
ixpk= 445, nxpk= 0, iat=2368,2390, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 165 LEU HA 166 TYR QD 4.40 (#peak 569)
&rst
ixpk= 569, nxpk= 0, iat=2368, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2=2393,2402,
&end
#
# 165 LEU HB2 165 LEU QD2 3.84 (#peak 1638)
&rst
ixpk= 1638, nxpk= 0, iat=2370, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2=2379,2380,2381,
&end
#
# 165 LEU HB2 166 TYR HN 4.83 (#peak 1632)
&rst
ixpk= 1632, nxpk= 0, iat=2370,2385, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 165 LEU HB3 165 LEU QD1 4.13 (#peak 1647)
&rst
ixpk= 1647, nxpk= 0, iat=2371, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2=2375,2376,2377,
&end
#
# 165 LEU HB3 166 TYR HN 5.09 (#peak 1641)
&rst
ixpk= 1641, nxpk= 0, iat=2371,2385, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 165 LEU HG 166 TYR HN 6.18 (#peak 299)
&rst
ixpk= 299, nxpk= 0, iat=2373,2385, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68, &end
#
# 165 LEU QD1 166 TYR HN 5.20 (#peak 300)
&rst
ixpk= 300, nxpk= 0, iat= -1,2385, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=2375,2376,2377,
&end
#
# 166 TYR HN 166 TYR QD 4.42 (#peak 291)
&rst
ixpk= 291, nxpk= 0, iat=2385, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2=2393,2402,
&end
#
# 166 TYR HN 166 TYR QE 5.40 (#peak 292)
&rst
ixpk= 292, nxpk= 0, iat=2385, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=2395,2400,
&end
#
# 166 TYR HN 176 LEU QD1 6.25 (#peak 301)
&rst
ixpk= 301, nxpk= 0, iat=2385, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr2=2543,2544,2545,
&end
#
# 166 TYR HA 166 TYR QD 4.34 (#peak 494)
&rst
ixpk= 494, nxpk= 0, iat=2387, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr2=2393,2402,
&end
#
# 166 TYR HA 167 ASN HN 3.41 (#peak 496)
&rst
ixpk= 496, nxpk= 0, iat=2387,2406, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 166 TYR HA 171 ILE QG2 5.00 (#peak 2113)
&rst
ixpk= 2113, nxpk= 0, iat=2387, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=2466,2467,2468,
&end
#
# 166 TYR HB2 167 ASN HN 4.24 (#peak 851)
&rst
ixpk= 851, nxpk= 0, iat=2389,2406, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 166 TYR HB2 171 ILE QG2 5.12 (#peak 1944)
&rst
ixpk= 1944, nxpk= 0, iat=2389, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr2=2466,2467,2468,
&end
#
# 166 TYR HB2 176 LEU QD1 5.02 (#peak 883)
&rst
ixpk= 883, nxpk= 0, iat=2389, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=2543,2544,2545,
&end
#
# 166 TYR HB3 167 ASN HN 4.30 (#peak 877)
&rst
ixpk= 877, nxpk= 0, iat=2390,2406, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 166 TYR HB3 176 LEU QD1 5.15 (#peak 876)
&rst
ixpk= 876, nxpk= 0, iat=2390, -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr2=2543,2544,2545,
&end
#
# 166 TYR HB3 176 LEU QD2 5.21 (#peak 1533)
&rst
ixpk= 1533, nxpk= 0, iat=2390, -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr2=2547,2548,2549,
&end
#
# 166 TYR QD 167 ASN HN 5.10 (#peak 749)
&rst
ixpk= 749, nxpk= 0, iat= -1,2406, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=2393,2402,
&end
#
# 166 TYR QD 167 ASN HA 6.25 (#peak 1069)
&rst
ixpk= 1069, nxpk= 0, iat= -1,2408, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=2393,2402,
&end
#
# 166 TYR QD 168 PRO HA 3.69 (#peak 181)
&rst
ixpk= 181, nxpk= 0, iat= -1,2430, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr1=2393,2402,
&end
#
# 166 TYR QD 168 PRO HB2 5.41 (#peak 1175)
&rst
ixpk= 1175, nxpk= 0, iat= -1,2427, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1=2393,2402,
&end
#
# 166 TYR QD 168 PRO HB3 6.20 (#peak 66)
&rst
ixpk= 66, nxpk= 0, iat= -1,2428, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr1=2393,2402,
&end
#
# 166 TYR QD 168 PRO QG 6.25 (#peak 908)
&rst
ixpk= 908, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr1=2393,2402,
igr2=2424,2425,
&end
#
# 166 TYR QD 169 ALA HN 6.25 (#peak 596)
&rst
ixpk= 596, nxpk= 0, iat= -1,2434, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=2393,2402,
&end
#
# 166 TYR QD 171 ILE HN 5.35 (#peak 483)
&rst
ixpk= 483, nxpk= 0, iat= -1,2460, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1=2393,2402,
&end
#
# 166 TYR QD 171 ILE QD1 5.85 (#peak 2256)
&rst
ixpk= 2256, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.89, r4= 8.39,
igr1=2393,2402,
igr2=2473,2474,2475,
&end
#
# 166 TYR QD 171 ILE QG2 3.22 (#peak 1835)
&rst
ixpk= 1835, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1=2393,2402,
igr2=2466,2467,2468,
&end
#
# 166 TYR QD 172 SER HA 6.25 (#peak 280)
&rst
ixpk= 280, nxpk= 0, iat= -1,2481, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=2393,2402,
&end
#
# 166 TYR QD 176 LEU QD1 4.32 (#peak 1514)
&rst
ixpk= 1514, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1=2393,2402,
igr2=2543,2544,2545,
&end
#
# 166 TYR QD 176 LEU QD2 5.69 (#peak 1061)
&rst
ixpk= 1061, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.67, r4= 8.17,
igr1=2393,2402,
igr2=2547,2548,2549,
&end
#
# 166 TYR QE 167 ASN HA 5.67 (#peak 1040)
&rst
ixpk= 1040, nxpk= 0, iat= -1,2408, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1=2395,2400,
&end
#
# 166 TYR QE 168 PRO HA 3.35 (#peak 182)
&rst
ixpk= 182, nxpk= 0, iat= -1,2430, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr1=2395,2400,
&end
#
# 166 TYR QE 168 PRO HB2 3.59 (#peak 1176)
&rst
ixpk= 1176, nxpk= 0, iat= -1,2427, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=2395,2400,
&end
#
# 166 TYR QE 168 PRO HB3 4.57 (#peak 1194)
&rst
ixpk= 1194, nxpk= 0, iat= -1,2428, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1=2395,2400,
&end
#
# 166 TYR QE 168 PRO HD3 6.25 (#peak 781)
&rst
ixpk= 781, nxpk= 0, iat= -1,2422, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=2395,2400,
&end
#
# 166 TYR QE 168 PRO QG 5.11 (#peak 873)
&rst
ixpk= 873, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1=2395,2400,
igr2=2424,2425,
&end
#
# 166 TYR QE 169 ALA HN 5.74 (#peak 632)
&rst
ixpk= 632, nxpk= 0, iat= -1,2434, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1=2395,2400,
&end
#
# 166 TYR QE 171 ILE HN 5.65 (#peak 484)
&rst
ixpk= 484, nxpk= 0, iat= -1,2460, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1=2395,2400,
&end
#
# 166 TYR QE 172 SER HA 4.15 (#peak 531)
&rst
ixpk= 531, nxpk= 0, iat= -1,2481, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=2395,2400,
&end
#
# 166 TYR QE 173 PRO HD2 4.47 (#peak 622)
&rst
ixpk= 622, nxpk= 0, iat= -1,2491, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=2395,2400,
&end
#
# 166 TYR QE 173 PRO HD3 3.95 (#peak 627)
&rst
ixpk= 627, nxpk= 0, iat= -1,2492, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1=2395,2400,
&end
#
# 166 TYR QE 173 PRO QG 5.84 (#peak 658)
&rst
ixpk= 658, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr1=2395,2400,
igr2=2494,2495,
&end
#
# 166 TYR QE 176 LEU QD1 5.92 (#peak 974)
&rst
ixpk= 974, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr1=2395,2400,
igr2=2543,2544,2545,
&end
#
# 167 ASN HN 167 ASN HB2 4.00 (#peak 976)
&rst
ixpk= 976, nxpk= 0, iat=2406,2410, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 167 ASN HN 167 ASN HB3 4.05 (#peak 982)
&rst
ixpk= 982, nxpk= 0, iat=2406,2411, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 167 ASN HN 167 ASN HD21 5.75 (#peak 736)
&rst
ixpk= 736, nxpk= 0, iat=2406,2415, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 167 ASN HN 168 PRO HD3 5.46 (#peak 753)
&rst
ixpk= 753, nxpk= 0, iat=2406,2422, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 167 ASN HN 171 ILE QG2 4.89 (#peak 2109)
&rst
ixpk= 2109, nxpk= 0, iat=2406, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2=2466,2467,2468,
&end
#
# 167 ASN HA 167 ASN HD21 5.64 (#peak 1258)
&rst
ixpk= 1258, nxpk= 0, iat=2408,2415, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 167 ASN HA 167 ASN HD22 6.25 (#peak 1247)
&rst
ixpk= 1247, nxpk= 0, iat=2408,2416, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 167 ASN HA 168 PRO HD2 3.12 (#peak 665)
&rst
ixpk= 665, nxpk= 0, iat=2408,2421, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, &end
#
# 167 ASN HA 168 PRO HD3 3.42 (#peak 666)
&rst
ixpk= 666, nxpk= 0, iat=2408,2422, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 167 ASN HA 168 PRO QG 4.34 (#peak 1453)
&rst
ixpk= 1453, nxpk= 0, iat=2408, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr2=2424,2425,
&end
#
# 167 ASN HA 169 ALA HN 4.99 (#peak 634)
&rst
ixpk= 634, nxpk= 0, iat=2408,2434, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 167 ASN HA 169 ALA QB 5.94 (#peak 1724)
&rst
ixpk= 1724, nxpk= 0, iat=2408, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr2=2438,2439,2440,
&end
#
# 167 ASN HA 170 VAL HN 4.89 (#peak 669)
&rst
ixpk= 669, nxpk= 0, iat=2408,2444, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 167 ASN HA 170 VAL HB 5.25 (#peak 1066)
&rst
ixpk= 1066, nxpk= 0, iat=2408,2448, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 167 ASN HB2 167 ASN HD21 3.92 (#peak 977)
&rst
ixpk= 977, nxpk= 0, iat=2410,2415, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 167 ASN HB2 168 PRO HD3 5.10 (#peak 2269)
&rst
ixpk= 2269, nxpk= 0, iat=2410,2422, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 167 ASN HB2 169 ALA HN 6.12 (#peak 622)
&rst
ixpk= 622, nxpk= 0, iat=2410,2434, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62, &end
#
# 167 ASN HB2 169 ALA QB 6.25 (#peak 1697)
&rst
ixpk= 1697, nxpk= 0, iat=2410, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr2=2438,2439,2440,
&end
#
# 167 ASN HB2 170 VAL HB 4.12 (#peak 1072)
&rst
ixpk= 1072, nxpk= 0, iat=2410,2448, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 167 ASN HB2 170 VAL QQG 4.01 (#peak 980)
&rst
ixpk= 980, nxpk= 0, iat=2410, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2=2450,2451,2452,2454,2455,2456,
&end
#
# 167 ASN HB3 167 ASN HD21 3.91 (#peak 984)
&rst
ixpk= 984, nxpk= 0, iat=2411,2415, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 167 ASN HB3 169 ALA QB 5.44 (#peak 990)
&rst
ixpk= 990, nxpk= 0, iat=2411, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr2=2438,2439,2440,
&end
#
# 167 ASN HB3 170 VAL HB 4.30 (#peak 999)
&rst
ixpk= 999, nxpk= 0, iat=2411,2448, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 167 ASN HB3 171 ILE HN 4.21 (#peak 2272)
&rst
ixpk= 2272, nxpk= 0, iat=2411,2460, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 167 ASN HD21 168 PRO HD3 6.20 (#peak 1270)
&rst
ixpk= 1270, nxpk= 0, iat=2415,2422, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70, &end
#
# 167 ASN HD21 169 ALA QB 5.82 (#peak 1246)
&rst
ixpk= 1246, nxpk= 0, iat=2415, -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr2=2438,2439,2440,
&end
#
# 167 ASN HD21 170 VAL HB 5.97 (#peak 1271)
&rst
ixpk= 1271, nxpk= 0, iat=2415,2448, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 167 ASN HD21 170 VAL QQG 4.46 (#peak 1261)
&rst
ixpk= 1261, nxpk= 0, iat=2415, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr2=2450,2451,2452,2454,2455,2456,
&end
#
# 167 ASN HD22 169 ALA HN 6.25 (#peak 651)
&rst
ixpk= 651, nxpk= 0, iat=2416,2434, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 167 ASN HD22 169 ALA QB 4.46 (#peak 1693)
&rst
ixpk= 1693, nxpk= 0, iat=2416, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2=2438,2439,2440,
&end
#
# 167 ASN HD22 170 VAL QQG 3.49 (#peak 1653)
&rst
ixpk= 1653, nxpk= 0, iat=2416, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2=2450,2451,2452,2454,2455,2456,
&end
#
# 168 PRO HA 169 ALA HA 5.96 (#peak 597)
&rst
ixpk= 597, nxpk= 0, iat=2430,2436, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 168 PRO HA 169 ALA QB 6.25 (#peak 2173)
&rst
ixpk= 2173, nxpk= 0, iat=2430, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr2=2438,2439,2440,
&end
#
# 168 PRO HA 170 VAL HN 5.76 (#peak 1026)
&rst
ixpk= 1026, nxpk= 0, iat=2430,2444, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 168 PRO HA 171 ILE HN 4.42 (#peak 179)
&rst
ixpk= 179, nxpk= 0, iat=2430,2460, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 168 PRO HA 171 ILE QG2 4.93 (#peak 2204)
&rst
ixpk= 2204, nxpk= 0, iat=2430, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2=2466,2467,2468,
&end
#
# 168 PRO HB2 198 PRO HD2 6.10 (#peak 21)
&rst
ixpk= 21, nxpk= 0, iat=2427,2843, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60, &end
#
# 168 PRO HB3 198 PRO HD2 4.62 (#peak 43)
&rst
ixpk= 43, nxpk= 0, iat=2428,2843, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 168 PRO HD2 169 ALA HN 4.43 (#peak 607)
&rst
ixpk= 607, nxpk= 0, iat=2421,2434, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 168 PRO HD3 169 ALA HN 4.86 (#peak 638)
&rst
ixpk= 638, nxpk= 0, iat=2422,2434, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 168 PRO HD3 169 ALA QB 5.93 (#peak 1695)
&rst
ixpk= 1695, nxpk= 0, iat=2422, -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr2=2438,2439,2440,
&end
#
# 168 PRO QG 169 ALA HN 4.23 (#peak 1454)
&rst
ixpk= 1454, nxpk= 0, iat= -1,2434, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr1=2424,2425,
&end
#
# 168 PRO QG 169 ALA QB 6.05 (#peak 907)
&rst
ixpk= 907, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1=2424,2425,
igr2=2438,2439,2440,
&end
#
# 169 ALA HN 169 ALA QB 2.74 (#peak 1758)
&rst
ixpk= 1758, nxpk= 0, iat=2434, -1, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
igr2=2438,2439,2440,
&end
#
# 169 ALA HN 170 VAL QQG 4.25 (#peak 641)
&rst
ixpk= 641, nxpk= 0, iat=2434, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr2=2450,2451,2452,2454,2455,2456,
&end
#
# 169 ALA HA 170 VAL QQG 4.88 (#peak 596)
&rst
ixpk= 596, nxpk= 0, iat=2436, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2=2450,2451,2452,2454,2455,2456,
&end
#
# 169 ALA QB 170 VAL HN 4.47 (#peak 1027)
&rst
ixpk= 1027, nxpk= 0, iat= -1,2444, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=2438,2439,2440,
&end
#
# 169 ALA QB 170 VAL HA 4.98 (#peak 2299)
&rst
ixpk= 2299, nxpk= 0, iat= -1,2446, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1=2438,2439,2440,
&end
#
# 170 VAL HN 170 VAL HB 3.54 (#peak 1068)
&rst
ixpk= 1068, nxpk= 0, iat=2444,2448, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 170 VAL HN 170 VAL QQG 3.01 (#peak 1678)
&rst
ixpk= 1678, nxpk= 0, iat=2444, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2=2450,2451,2452,2454,2455,2456,
&end
#
# 170 VAL HN 171 ILE HN 3.73 (#peak 481)
&rst
ixpk= 481, nxpk= 0, iat=2444,2460, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 170 VAL HN 171 ILE QG2 4.91 (#peak 2111)
&rst
ixpk= 2111, nxpk= 0, iat=2444, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=2466,2467,2468,
&end
#
# 170 VAL HA 170 VAL QQG 2.64 (#peak 1679)
&rst
ixpk= 1679, nxpk= 0, iat=2446, -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
igr2=2450,2451,2452,2454,2455,2456,
&end
#
# 170 VAL HB 171 ILE HN 3.72 (#peak 1067)
&rst
ixpk= 1067, nxpk= 0, iat=2448,2460, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 170 VAL QQG 171 ILE HN 3.94 (#peak 508)
&rst
ixpk= 508, nxpk= 0, iat= -1,2460, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1=2450,2451,2452,2454,2455,2456,
&end
#
# 171 ILE HN 171 ILE HG13 6.06 (#peak 408)
&rst
ixpk= 408, nxpk= 0, iat=2460,2471, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56, &end
#
# 171 ILE HN 171 ILE QD1 5.50 (#peak 2254)
&rst
ixpk= 2254, nxpk= 0, iat=2460, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=2473,2474,2475,
&end
#
# 171 ILE HN 171 ILE QG2 3.33 (#peak 1834)
&rst
ixpk= 1834, nxpk= 0, iat=2460, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2=2466,2467,2468,
&end
#
# 171 ILE HN 172 SER HN 6.25 (#peak 454)
&rst
ixpk= 454, nxpk= 0, iat=2460,2479, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 171 ILE HA 171 ILE HG12 3.71 (#peak 1270)
&rst
ixpk= 1270, nxpk= 0, iat=2462,2470, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 171 ILE HA 171 ILE HG13 4.05 (#peak 1272)
&rst
ixpk= 1272, nxpk= 0, iat=2462,2471, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 171 ILE HA 171 ILE QD1 4.28 (#peak 2257)
&rst
ixpk= 2257, nxpk= 0, iat=2462, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2=2473,2474,2475,
&end
#
# 171 ILE HA 171 ILE QG2 3.52 (#peak 1837)
&rst
ixpk= 1837, nxpk= 0, iat=2462, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2=2466,2467,2468,
&end
#
# 171 ILE HB 171 ILE QD1 3.55 (#peak 2260)
&rst
ixpk= 2260, nxpk= 0, iat=2464, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2=2473,2474,2475,
&end
#
# 171 ILE HB 172 SER HN 4.54 (#peak 838)
&rst
ixpk= 838, nxpk= 0, iat=2464,2479, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 171 ILE HG12 172 SER HN 3.92 (#peak 1269)
&rst
ixpk= 1269, nxpk= 0, iat=2470,2479, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 171 ILE HG13 172 SER HN 3.93 (#peak 1271)
&rst
ixpk= 1271, nxpk= 0, iat=2471,2479, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 171 ILE HG13 175 GLU HB2 6.21 (#peak 430)
&rst
ixpk= 430, nxpk= 0, iat=2471,2523, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71, &end
#
# 171 ILE HG13 175 GLU HG2 4.46 (#peak 1273)
&rst
ixpk= 1273, nxpk= 0, iat=2471,2526, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 171 ILE QD1 172 SER HN 4.02 (#peak 2255)
&rst
ixpk= 2255, nxpk= 0, iat= -1,2479, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1=2473,2474,2475,
&end
#
# 171 ILE QD1 175 GLU HA 5.74 (#peak 2700)
&rst
ixpk= 2700, nxpk= 0, iat= -1,2521, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr1=2473,2474,2475,
&end
#
# 171 ILE QD1 175 GLU HB2 4.18 (#peak 1843)
&rst
ixpk= 1843, nxpk= 0, iat= -1,2523, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=2473,2474,2475,
&end
#
# 171 ILE QD1 175 GLU HG2 4.64 (#peak 2259)
&rst
ixpk= 2259, nxpk= 0, iat= -1,2526, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=2473,2474,2475,
&end
#
# 171 ILE QD1 176 LEU HA 3.70 (#peak 401)
&rst
ixpk= 401, nxpk= 0, iat= -1,2536, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1=2473,2474,2475,
&end
#
# 171 ILE QD1 176 LEU QB 4.72 (#peak 1763)
&rst
ixpk= 1763, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1=2473,2474,2475,
igr2=2538,2539,
&end
#
# 171 ILE QD1 176 LEU QD1 4.74 (#peak 2261)
&rst
ixpk= 2261, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
igr1=2473,2474,2475,
igr2=2543,2544,2545,
&end
#
# 171 ILE QG2 172 SER HN 4.42 (#peak 969)
&rst
ixpk= 969, nxpk= 0, iat= -1,2479, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1=2466,2467,2468,
&end
#
# 171 ILE QG2 172 SER HA 5.47 (#peak 324)
&rst
ixpk= 324, nxpk= 0, iat= -1,2481, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr1=2466,2467,2468,
&end
#
# 171 ILE QG2 173 PRO HD3 5.54 (#peak 900)
&rst
ixpk= 900, nxpk= 0, iat= -1,2492, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr1=2466,2467,2468,
&end
#
# 171 ILE QG2 176 LEU QD1 4.72 (#peak 2119)
&rst
ixpk= 2119, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1=2466,2467,2468,
igr2=2543,2544,2545,
&end
#
# 172 SER HN 173 PRO HD3 5.25 (#peak 649)
&rst
ixpk= 649, nxpk= 0, iat=2479,2492, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 172 SER HN 175 GLU HG2 4.79 (#peak 967)
&rst
ixpk= 967, nxpk= 0, iat=2479,2526, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 172 SER HA 173 PRO HD2 3.77 (#peak 623)
&rst
ixpk= 623, nxpk= 0, iat=2481,2491, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 172 SER HA 173 PRO HD3 3.61 (#peak 628)
&rst
ixpk= 628, nxpk= 0, iat=2481,2492, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 172 SER HA 173 PRO QB 6.25 (#peak 122)
&rst
ixpk= 122, nxpk= 0, iat=2481, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=2497,2498,
&end
#
# 172 SER HA 173 PRO QG 5.30 (#peak 1380)
&rst
ixpk= 1380, nxpk= 0, iat=2481, -1, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr2=2494,2495,
&end
#
# 172 SER HA 174 GLU HN 5.56 (#peak 323)
&rst
ixpk= 323, nxpk= 0, iat=2481,2504, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06, &end
#
# 172 SER HA 175 GLU HN 6.25 (#peak 690)
&rst
ixpk= 690, nxpk= 0, iat=2481,2519, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 172 SER HB2 174 GLU HN 4.58 (#peak 66)
&rst
ixpk= 66, nxpk= 0, iat=2483,2504, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 172 SER HB2 175 GLU HB3 6.15 (#peak 1790)
&rst
ixpk= 1790, nxpk= 0, iat=2483,2524, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 172 SER HB2 175 GLU HG2 4.74 (#peak 69)
&rst
ixpk= 69, nxpk= 0, iat=2483,2526, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 172 SER HB2 175 GLU HG3 6.13 (#peak 1786)
&rst
ixpk= 1786, nxpk= 0, iat=2483,2527, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63, &end
#
# 172 SER HB3 174 GLU HN 5.54 (#peak 1793)
&rst
ixpk= 1793, nxpk= 0, iat=2484,2504, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 172 SER HB3 175 GLU HG3 5.89 (#peak 1796)
&rst
ixpk= 1796, nxpk= 0, iat=2484,2527, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 173 PRO HA 176 LEU HN 4.14 (#peak 78)
&rst
ixpk= 78, nxpk= 0, iat=2500,2534, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 173 PRO HA 176 LEU QB 3.33 (#peak 81)
&rst
ixpk= 81, nxpk= 0, iat=2500, -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
igr2=2538,2539,
&end
#
# 173 PRO HA 176 LEU QD1 3.31 (#peak 1491)
&rst
ixpk= 1491, nxpk= 0, iat=2500, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2=2543,2544,2545,
&end
#
# 173 PRO HA 176 LEU QD2 3.98 (#peak 83)
&rst
ixpk= 83, nxpk= 0, iat=2500, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=2547,2548,2549,
&end
#
# 173 PRO HD2 174 GLU HN 2.96 (#peak 1052)
&rst
ixpk= 1052, nxpk= 0, iat=2491,2504, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46, &end
#
# 173 PRO HD2 175 GLU HN 5.29 (#peak 621)
&rst
ixpk= 621, nxpk= 0, iat=2491,2519, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 173 PRO QB 174 GLU HG2 4.80 (#peak 138)
&rst
ixpk= 138, nxpk= 0, iat= -1,2511, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=2497,2498,
&end
#
# 173 PRO QB 176 LEU QD1 5.10 (#peak 1203)
&rst
ixpk= 1203, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1=2497,2498,
igr2=2543,2544,2545,
&end
#
# 174 GLU HN 174 GLU HB2 3.86 (#peak 1376)
&rst
ixpk= 1376, nxpk= 0, iat=2504,2508, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 174 GLU HN 174 GLU HG2 4.47 (#peak 1073)
&rst
ixpk= 1073, nxpk= 0, iat=2504,2511, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 174 GLU HN 174 GLU HG3 4.84 (#peak 2678)
&rst
ixpk= 2678, nxpk= 0, iat=2504,2512, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 174 GLU HN 175 GLU HN 4.54 (#peak 1071)
&rst
ixpk= 1071, nxpk= 0, iat=2504,2519, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 174 GLU HN 175 GLU HG3 4.99 (#peak 1074)
&rst
ixpk= 1074, nxpk= 0, iat=2504,2527, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 174 GLU HN 189 VAL QG2 6.00 (#peak 1065)
&rst
ixpk= 1065, nxpk= 0, iat=2504, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2733,2734,2735,
&end
#
# 174 GLU HA 177 ARG QG 5.60 (#peak 2764)
&rst
ixpk= 2764, nxpk= 0, iat=2506, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2=2560,2561,
&end
#
# 174 GLU HA 189 VAL QG2 4.23 (#peak 353)
&rst
ixpk= 353, nxpk= 0, iat=2506, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=2733,2734,2735,
&end
#
# 174 GLU HB2 175 GLU HN 4.14 (#peak 1342)
&rst
ixpk= 1342, nxpk= 0, iat=2508,2519, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 174 GLU HB3 175 GLU HN 5.17 (#peak 704)
&rst
ixpk= 704, nxpk= 0, iat=2509,2519, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 174 GLU HG2 175 GLU HN 5.50 (#peak 2677)
&rst
ixpk= 2677, nxpk= 0, iat=2511,2519, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 174 GLU HG2 189 VAL QG2 5.92 (#peak 2676)
&rst
ixpk= 2676, nxpk= 0, iat=2511, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=2733,2734,2735,
&end
#
# 174 GLU HG3 175 GLU HN 5.69 (#peak 2679)
&rst
ixpk= 2679, nxpk= 0, iat=2512,2519, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 175 GLU HN 175 GLU HB3 4.09 (#peak 708)
&rst
ixpk= 708, nxpk= 0, iat=2519,2524, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 175 GLU HN 175 GLU HG2 3.71 (#peak 1035)
&rst
ixpk= 1035, nxpk= 0, iat=2519,2526, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 175 GLU HN 175 GLU HG3 3.88 (#peak 707)
&rst
ixpk= 707, nxpk= 0, iat=2519,2527, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 175 GLU HA 175 GLU HB2 2.95 (#peak 358)
&rst
ixpk= 358, nxpk= 0, iat=2521,2523, r1= 1.30, r2= 1.80, r3= 2.95, r4= 3.45, &end
#
# 175 GLU HA 178 ALA QB 3.30 (#peak 346)
&rst
ixpk= 346, nxpk= 0, iat=2521, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2=2581,2582,2583,
&end
#
# 176 LEU HN 176 LEU HG 3.85 (#peak 1463)
&rst
ixpk= 1463, nxpk= 0, iat=2534,2541, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 176 LEU HN 176 LEU QD1 4.16 (#peak 1490)
&rst
ixpk= 1490, nxpk= 0, iat=2534, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2=2543,2544,2545,
&end
#
# 176 LEU HN 176 LEU QD2 4.18 (#peak 1531)
&rst
ixpk= 1531, nxpk= 0, iat=2534, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2=2547,2548,2549,
&end
#
# 176 LEU HN 177 ARG HN 4.71 (#peak 512)
&rst
ixpk= 512, nxpk= 0, iat=2534,2553, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 176 LEU HA 176 LEU HG 3.37 (#peak 400)
&rst
ixpk= 400, nxpk= 0, iat=2536,2541, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 176 LEU HA 176 LEU QD1 4.43 (#peak 412)
&rst
ixpk= 412, nxpk= 0, iat=2536, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2=2543,2544,2545,
&end
#
# 176 LEU HA 176 LEU QD2 3.05 (#peak 1532)
&rst
ixpk= 1532, nxpk= 0, iat=2536, -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
igr2=2547,2548,2549,
&end
#
# 176 LEU HA 178 ALA HN 6.25 (#peak 593)
&rst
ixpk= 593, nxpk= 0, iat=2536,2577, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 176 LEU HA 179 ALA QB 3.46 (#peak 1790)
&rst
ixpk= 1790, nxpk= 0, iat=2536, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2=2591,2592,2593,
&end
#
# 176 LEU HA 180 ILE QD1 4.24 (#peak 2428)
&rst
ixpk= 2428, nxpk= 0, iat=2536, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr2=2610,2611,2612,
&end
#
# 176 LEU QB 176 LEU QD1 3.25 (#peak 1492)
&rst
ixpk= 1492, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1=2538,2539,
igr2=2543,2544,2545,
&end
#
# 176 LEU QB 176 LEU QD2 3.59 (#peak 1512)
&rst
ixpk= 1512, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1=2538,2539,
igr2=2547,2548,2549,
&end
#
# 176 LEU QB 177 ARG HN 4.43 (#peak 836)
&rst
ixpk= 836, nxpk= 0, iat= -1,2553, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1=2538,2539,
&end
#
# 176 LEU QB 177 ARG HA 4.22 (#peak 316)
&rst
ixpk= 316, nxpk= 0, iat= -1,2555, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1=2538,2539,
&end
#
# 176 LEU QB 177 ARG QD 5.63 (#peak 1716)
&rst
ixpk= 1716, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr1=2538,2539,
igr2=2563,2564,
&end
#
# 176 LEU QD1 177 ARG HN 5.08 (#peak 1005)
&rst
ixpk= 1005, nxpk= 0, iat= -1,2553, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1=2543,2544,2545,
&end
#
# 176 LEU QD2 177 ARG HN 4.97 (#peak 1062)
&rst
ixpk= 1062, nxpk= 0, iat= -1,2553, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=2547,2548,2549,
&end
#
# 177 ARG HN 177 ARG QB 3.73 (#peak 1368)
&rst
ixpk= 1368, nxpk= 0, iat=2553, -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr2=2557,2558,
&end
#
# 177 ARG HA 177 ARG QG 3.80 (#peak 312)
&rst
ixpk= 312, nxpk= 0, iat=2555, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr2=2560,2561,
&end
#
# 177 ARG HA 178 ALA HA 4.94 (#peak 517)
&rst
ixpk= 517, nxpk= 0, iat=2555,2579, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 177 ARG HA 180 ILE HN 4.43 (#peak 315)
&rst
ixpk= 315, nxpk= 0, iat=2555,2597, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 177 ARG HA 180 ILE QD1 3.94 (#peak 1881)
&rst
ixpk= 1881, nxpk= 0, iat=2555, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=2610,2611,2612,
&end
#
# 177 ARG HA 181 GLU QG 6.25 (#peak 2536)
&rst
ixpk= 2536, nxpk= 0, iat=2555, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=2623,2624,
&end
#
# 177 ARG HA 187 ALA QB 3.60 (#peak 318)
&rst
ixpk= 318, nxpk= 0, iat=2555, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2=2706,2707,2708,
&end
#
# 177 ARG QB 178 ALA HA 5.11 (#peak 617)
&rst
ixpk= 617, nxpk= 0, iat= -1,2579, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1=2557,2558,
&end
#
# 177 ARG QD 187 ALA QB 3.96 (#peak 826)
&rst
ixpk= 826, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=2563,2564,
igr2=2706,2707,2708,
&end
#
# 177 ARG QD 188 SER HN 6.08 (#peak 1108)
&rst
ixpk= 1108, nxpk= 0, iat= -1,2712, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1=2563,2564,
&end
#
# 177 ARG QD 188 SER HA 3.91 (#peak 824)
&rst
ixpk= 824, nxpk= 0, iat= -1,2714, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1=2563,2564,
&end
#
# 177 ARG QD 189 VAL HN 4.84 (#peak 827)
&rst
ixpk= 827, nxpk= 0, iat= -1,2723, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1=2563,2564,
&end
#
# 177 ARG QD 189 VAL QG2 4.89 (#peak 823)
&rst
ixpk= 823, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=2563,2564,
igr2=2733,2734,2735,
&end
#
# 177 ARG QG 188 SER HA 6.25 (#peak 962)
&rst
ixpk= 962, nxpk= 0, iat= -1,2714, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=2560,2561,
&end
#
# 178 ALA HN 178 ALA QB 3.52 (#peak 591)
&rst
ixpk= 591, nxpk= 0, iat=2577, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2=2581,2582,2583,
&end
#
# 178 ALA HN 179 ALA HN 3.96 (#peak 643)
&rst
ixpk= 643, nxpk= 0, iat=2577,2587, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 178 ALA HA 181 GLU QB 3.43 (#peak 553)
&rst
ixpk= 553, nxpk= 0, iat=2579, -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
igr2=2620,2621,
&end
#
# 178 ALA HA 181 GLU QG 5.27 (#peak 2541)
&rst
ixpk= 2541, nxpk= 0, iat=2579, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2=2623,2624,
&end
#
# 178 ALA HA 187 ALA QB 6.05 (#peak 1171)
&rst
ixpk= 1171, nxpk= 0, iat=2579, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2706,2707,2708,
&end
#
# 179 ALA HN 179 ALA QB 3.20 (#peak 1852)
&rst
ixpk= 1852, nxpk= 0, iat=2587, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=2591,2592,2593,
&end
#
# 179 ALA HN 187 ALA QB 5.03 (#peak 626)
&rst
ixpk= 626, nxpk= 0, iat=2587, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2=2706,2707,2708,
&end
#
# 179 ALA HA 180 ILE QD1 5.58 (#peak 510)
&rst
ixpk= 510, nxpk= 0, iat=2589, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr2=2610,2611,2612,
&end
#
# 179 ALA HA 182 ASP HN 4.47 (#peak 586)
&rst
ixpk= 586, nxpk= 0, iat=2589,2631, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 179 ALA HA 182 ASP HB2 3.78 (#peak 944)
&rst
ixpk= 944, nxpk= 0, iat=2589,2635, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 179 ALA HA 182 ASP HB3 4.25 (#peak 2047)
&rst
ixpk= 2047, nxpk= 0, iat=2589,2636, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 179 ALA QB 180 ILE HN 4.05 (#peak 732)
&rst
ixpk= 732, nxpk= 0, iat= -1,2597, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1=2591,2592,2593,
&end
#
# 179 ALA QB 180 ILE QD1 3.50 (#peak 1855)
&rst
ixpk= 1855, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=2591,2592,2593,
igr2=2610,2611,2612,
&end
#
# 179 ALA QB 180 ILE QG1 4.40 (#peak 1791)
&rst
ixpk= 1791, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1=2591,2592,2593,
igr2=2607,2608,
&end
#
# 179 ALA QB 181 GLU HN 5.23 (#peak 358)
&rst
ixpk= 358, nxpk= 0, iat= -1,2616, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1=2591,2592,2593,
&end
#
# 179 ALA QB 182 ASP HN 5.12 (#peak 590)
&rst
ixpk= 590, nxpk= 0, iat= -1,2631, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=2591,2592,2593,
&end
#
# 179 ALA QB 182 ASP HB2 4.81 (#peak 2045)
&rst
ixpk= 2045, nxpk= 0, iat= -1,2635, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1=2591,2592,2593,
&end
#
# 179 ALA QB 182 ASP HB3 5.59 (#peak 2026)
&rst
ixpk= 2026, nxpk= 0, iat= -1,2636, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr1=2591,2592,2593,
&end
#
# 180 ILE HN 180 ILE HB 3.71 (#peak 1016)
&rst
ixpk= 1016, nxpk= 0, iat=2597,2601, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 180 ILE HN 180 ILE QD1 3.74 (#peak 1882)
&rst
ixpk= 1882, nxpk= 0, iat=2597, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=2610,2611,2612,
&end
#
# 180 ILE HN 180 ILE QG1 3.86 (#peak 734)
&rst
ixpk= 734, nxpk= 0, iat=2597, -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr2=2607,2608,
&end
#
# 180 ILE HN 180 ILE QG2 4.21 (#peak 1769)
&rst
ixpk= 1769, nxpk= 0, iat=2597, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=2603,2604,2605,
&end
#
# 180 ILE HN 181 GLU HN 4.28 (#peak 720)
&rst
ixpk= 720, nxpk= 0, iat=2597,2616, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 180 ILE HN 181 GLU QG 5.98 (#peak 2539)
&rst
ixpk= 2539, nxpk= 0, iat=2597, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2=2623,2624,
&end
#
# 180 ILE HN 187 ALA QB 4.53 (#peak 1563)
&rst
ixpk= 1563, nxpk= 0, iat=2597, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2=2706,2707,2708,
&end
#
# 180 ILE HA 180 ILE QD1 4.27 (#peak 2475)
&rst
ixpk= 2475, nxpk= 0, iat=2599, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=2610,2611,2612,
&end
#
# 180 ILE HA 180 ILE QG1 4.06 (#peak 1277)
&rst
ixpk= 1277, nxpk= 0, iat=2599, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=2607,2608,
&end
#
# 180 ILE HA 180 ILE QG2 3.94 (#peak 1924)
&rst
ixpk= 1924, nxpk= 0, iat=2599, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=2603,2604,2605,
&end
#
# 180 ILE HA 182 ASP HN 6.25 (#peak 587)
&rst
ixpk= 587, nxpk= 0, iat=2599,2631, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 180 ILE HA 183 MET HN 4.58 (#peak 1017)
&rst
ixpk= 1017, nxpk= 0, iat=2599,2643, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 180 ILE HA 183 MET HB2 5.05 (#peak 90)
&rst
ixpk= 90, nxpk= 0, iat=2599,2647, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 180 ILE HB 181 GLU HN 4.18 (#peak 1015)
&rst
ixpk= 1015, nxpk= 0, iat=2601,2616, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 180 ILE HB 187 ALA QB 5.59 (#peak 2345)
&rst
ixpk= 2345, nxpk= 0, iat=2601, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2=2706,2707,2708,
&end
#
# 180 ILE QG1 181 GLU HN 6.16 (#peak 493)
&rst
ixpk= 493, nxpk= 0, iat= -1,2616, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr1=2607,2608,
&end
#
# 180 ILE QG1 182 ASP HN 6.25 (#peak 2048)
&rst
ixpk= 2048, nxpk= 0, iat= -1,2631, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=2607,2608,
&end
#
# 180 ILE QG1 183 MET HN 6.25 (#peak 998)
&rst
ixpk= 998, nxpk= 0, iat= -1,2643, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=2607,2608,
&end
#
# 180 ILE QG1 184 GLY HN 6.25 (#peak 2046)
&rst
ixpk= 2046, nxpk= 0, iat= -1,2660, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=2607,2608,
&end
#
# 180 ILE QG1 185 PHE HN 6.25 (#peak 831)
&rst
ixpk= 831, nxpk= 0, iat= -1,2667, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=2607,2608,
&end
#
# 180 ILE QG1 187 ALA HN 6.25 (#peak 1819)
&rst
ixpk= 1819, nxpk= 0, iat= -1,2702, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=2607,2608,
&end
#
# 180 ILE QG2 181 GLU HN 4.25 (#peak 1768)
&rst
ixpk= 1768, nxpk= 0, iat= -1,2616, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1=2603,2604,2605,
&end
#
# 180 ILE QG2 181 GLU HA 4.20 (#peak 1702)
&rst
ixpk= 1702, nxpk= 0, iat= -1,2618, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=2603,2604,2605,
&end
#
# 180 ILE QG2 182 ASP HN 6.25 (#peak 2047)
&rst
ixpk= 2047, nxpk= 0, iat= -1,2631, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1=2603,2604,2605,
&end
#
# 180 ILE QG2 183 MET HN 5.16 (#peak 999)
&rst
ixpk= 999, nxpk= 0, iat= -1,2643, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=2603,2604,2605,
&end
#
# 180 ILE QG2 184 GLY HN 6.17 (#peak 1477)
&rst
ixpk= 1477, nxpk= 0, iat= -1,2660, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1=2603,2604,2605,
&end
#
# 180 ILE QG2 185 PHE HN 4.67 (#peak 830)
&rst
ixpk= 830, nxpk= 0, iat= -1,2667, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=2603,2604,2605,
&end
#
# 180 ILE QG2 185 PHE HA 4.51 (#peak 1770)
&rst
ixpk= 1770, nxpk= 0, iat= -1,2669, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=2603,2604,2605,
&end
#
# 180 ILE QG2 185 PHE HB2 4.18 (#peak 870)
&rst
ixpk= 870, nxpk= 0, iat= -1,2671, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=2603,2604,2605,
&end
#
# 180 ILE QG2 185 PHE HB3 3.75 (#peak 1753)
&rst
ixpk= 1753, nxpk= 0, iat= -1,2672, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1=2603,2604,2605,
&end
#
# 180 ILE QG2 185 PHE QD 4.01 (#peak 1772)
&rst
ixpk= 1772, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr1=2603,2604,2605,
igr2=2675,2683,
&end
#
# 180 ILE QG2 186 GLU HN 5.83 (#peak 2056)
&rst
ixpk= 2056, nxpk= 0, iat= -1,2687, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1=2603,2604,2605,
&end
#
# 180 ILE QG2 187 ALA HN 5.63 (#peak 1818)
&rst
ixpk= 1818, nxpk= 0, iat= -1,2702, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1=2603,2604,2605,
&end
#
# 180 ILE QG2 187 ALA HA 5.64 (#peak 1692)
&rst
ixpk= 1692, nxpk= 0, iat= -1,2704, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1=2603,2604,2605,
&end
#
# 180 ILE QG2 187 ALA QB 3.10 (#peak 1565)
&rst
ixpk= 1565, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1=2603,2604,2605,
igr2=2706,2707,2708,
&end
#
# 181 GLU HN 181 GLU QB 3.37 (#peak 1323)
&rst
ixpk= 1323, nxpk= 0, iat=2616, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2=2620,2621,
&end
#
# 181 GLU HN 181 GLU QG 4.37 (#peak 2538)
&rst
ixpk= 2538, nxpk= 0, iat=2616, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=2623,2624,
&end
#
# 181 GLU HN 185 PHE HN 5.37 (#peak 770)
&rst
ixpk= 770, nxpk= 0, iat=2616,2667, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 181 GLU HN 187 ALA HN 6.25 (#peak 1822)
&rst
ixpk= 1822, nxpk= 0, iat=2616,2702, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 181 GLU HN 187 ALA QB 4.73 (#peak 1168)
&rst
ixpk= 1168, nxpk= 0, iat=2616, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=2706,2707,2708,
&end
#
# 181 GLU HA 181 GLU QG 2.76 (#peak 352)
&rst
ixpk= 352, nxpk= 0, iat=2618, -1, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,
igr2=2623,2624,
&end
#
# 181 GLU HA 184 GLY HN 5.62 (#peak 1475)
&rst
ixpk= 1475, nxpk= 0, iat=2618,2660, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 181 GLU HA 185 PHE HN 4.47 (#peak 793)
&rst
ixpk= 793, nxpk= 0, iat=2618,2667, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 181 GLU HA 185 PHE HB2 4.62 (#peak 1967)
&rst
ixpk= 1967, nxpk= 0, iat=2618,2671, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 181 GLU QB 182 ASP HN 4.23 (#peak 589)
&rst
ixpk= 589, nxpk= 0, iat= -1,2631, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr1=2620,2621,
&end
#
# 181 GLU QB 185 PHE HN 4.97 (#peak 608)
&rst
ixpk= 608, nxpk= 0, iat= -1,2667, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=2620,2621,
&end
#
# 181 GLU QB 187 ALA QB 4.94 (#peak 610)
&rst
ixpk= 610, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr1=2620,2621,
igr2=2706,2707,2708,
&end
#
# 181 GLU QG 185 PHE HN 5.74 (#peak 2544)
&rst
ixpk= 2544, nxpk= 0, iat= -1,2667, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1=2623,2624,
&end
#
# 181 GLU QG 186 GLU HN 6.25 (#peak 649)
&rst
ixpk= 649, nxpk= 0, iat= -1,2687, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=2623,2624,
&end
#
# 181 GLU QG 186 GLU HG2 3.34 (#peak 1040)
&rst
ixpk= 1040, nxpk= 0, iat= -1,2694, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr1=2623,2624,
&end
#
# 181 GLU QG 187 ALA HN 5.38 (#peak 132)
&rst
ixpk= 132, nxpk= 0, iat= -1,2702, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=2623,2624,
&end
#
# 181 GLU QG 187 ALA QB 5.04 (#peak 2543)
&rst
ixpk= 2543, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=2623,2624,
igr2=2706,2707,2708,
&end
#
# 182 ASP HN 182 ASP HB2 3.36 (#peak 942)
&rst
ixpk= 942, nxpk= 0, iat=2631,2635, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, &end
#
# 182 ASP HN 182 ASP HB3 3.82 (#peak 588)
&rst
ixpk= 588, nxpk= 0, iat=2631,2636, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 182 ASP HN 183 MET HN 4.22 (#peak 584)
&rst
ixpk= 584, nxpk= 0, iat=2631,2643, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 182 ASP HN 184 GLY HN 5.56 (#peak 1479)
&rst
ixpk= 1479, nxpk= 0, iat=2631,2660, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06, &end
#
# 182 ASP HN 185 PHE HN 5.66 (#peak 601)
&rst
ixpk= 601, nxpk= 0, iat=2631,2667, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16, &end
#
# 182 ASP HA 184 GLY HN 5.22 (#peak 1482)
&rst
ixpk= 1482, nxpk= 0, iat=2633,2660, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 182 ASP HA 185 PHE HN 6.04 (#peak 48)
&rst
ixpk= 48, nxpk= 0, iat=2633,2667, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54, &end
#
# 182 ASP HB3 183 MET HN 4.65 (#peak 2046)
&rst
ixpk= 2046, nxpk= 0, iat=2636,2643, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 183 MET HN 183 MET HB3 4.04 (#peak 1019)
&rst
ixpk= 1019, nxpk= 0, iat=2643,2648, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 183 MET HN 184 GLY HN 4.30 (#peak 996)
&rst
ixpk= 996, nxpk= 0, iat=2643,2660, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 183 MET HN 184 GLY HA2 5.08 (#peak 1016)
&rst
ixpk= 1016, nxpk= 0, iat=2643,2662, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 183 MET HN 184 GLY HA3 5.29 (#peak 783)
&rst
ixpk= 783, nxpk= 0, iat=2643,2663, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 183 MET HN 185 PHE HN 4.22 (#peak 824)
&rst
ixpk= 824, nxpk= 0, iat=2643,2667, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 183 MET HN 185 PHE QD 4.87 (#peak 1028)
&rst
ixpk= 1028, nxpk= 0, iat=2643, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2=2675,2683,
&end
#
# 183 MET HA 184 GLY HA2 5.13 (#peak 16)
&rst
ixpk= 16, nxpk= 0, iat=2645,2662, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 183 MET HA 185 PHE HN 6.12 (#peak 794)
&rst
ixpk= 794, nxpk= 0, iat=2645,2667, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62, &end
#
# 183 MET HB2 184 GLY HN 6.21 (#peak 1485)
&rst
ixpk= 1485, nxpk= 0, iat=2647,2660, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71, &end
#
# 183 MET HB3 184 GLY HN 5.15 (#peak 1486)
&rst
ixpk= 1486, nxpk= 0, iat=2648,2660, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 183 MET HB3 184 GLY HA2 4.73 (#peak 777)
&rst
ixpk= 777, nxpk= 0, iat=2648,2662, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 183 MET HB3 185 PHE HN 4.91 (#peak 828)
&rst
ixpk= 828, nxpk= 0, iat=2648,2667, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 183 MET HB3 185 PHE QD 4.63 (#peak 1158)
&rst
ixpk= 1158, nxpk= 0, iat=2648, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=2675,2683,
&end
#
# 184 GLY HN 185 PHE HN 3.97 (#peak 823)
&rst
ixpk= 823, nxpk= 0, iat=2660,2667, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 184 GLY HN 185 PHE QD 5.20 (#peak 1481)
&rst
ixpk= 1481, nxpk= 0, iat=2660, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2=2675,2683,
&end
#
# 185 PHE HN 185 PHE QD 3.89 (#peak 792)
&rst
ixpk= 792, nxpk= 0, iat=2667, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2=2675,2683,
&end
#
# 185 PHE HN 186 GLU HN 5.35 (#peak 680)
&rst
ixpk= 680, nxpk= 0, iat=2667,2687, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 185 PHE HN 186 GLU HG2 6.25 (#peak 2627)
&rst
ixpk= 2627, nxpk= 0, iat=2667,2694, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 185 PHE HN 187 ALA HN 6.25 (#peak 1825)
&rst
ixpk= 1825, nxpk= 0, iat=2667,2702, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 185 PHE HA 185 PHE QD 3.47 (#peak 2)
&rst
ixpk= 2, nxpk= 0, iat=2669, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr2=2675,2683,
&end
#
# 185 PHE HA 186 GLU HN 3.50 (#peak 4)
&rst
ixpk= 4, nxpk= 0, iat=2669,2687, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 185 PHE HB2 186 GLU HN 4.06 (#peak 905)
&rst
ixpk= 905, nxpk= 0, iat=2671,2687, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 185 PHE HB3 186 GLU HN 4.58 (#peak 912)
&rst
ixpk= 912, nxpk= 0, iat=2672,2687, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 185 PHE QD 186 GLU HN 4.19 (#peak 618)
&rst
ixpk= 618, nxpk= 0, iat= -1,2687, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1=2675,2683,
&end
#
# 186 GLU HN 186 GLU HB2 3.86 (#peak 619)
&rst
ixpk= 619, nxpk= 0, iat=2687,2691, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 186 GLU HN 186 GLU HG2 4.15 (#peak 650)
&rst
ixpk= 650, nxpk= 0, iat=2687,2694, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 186 GLU HN 186 GLU HG3 4.85 (#peak 2630)
&rst
ixpk= 2630, nxpk= 0, iat=2687,2695, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 186 GLU HN 187 ALA HN 5.64 (#peak 129)
&rst
ixpk= 129, nxpk= 0, iat=2687,2702, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 186 GLU HA 186 GLU HG2 3.54 (#peak 469)
&rst
ixpk= 469, nxpk= 0, iat=2689,2694, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 186 GLU HA 186 GLU HG3 4.14 (#peak 2631)
&rst
ixpk= 2631, nxpk= 0, iat=2689,2695, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 186 GLU HB2 187 ALA HN 4.38 (#peak 135)
&rst
ixpk= 135, nxpk= 0, iat=2691,2702, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 186 GLU HB3 187 ALA HN 4.76 (#peak 388)
&rst
ixpk= 388, nxpk= 0, iat=2692,2702, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 186 GLU HB3 187 ALA HA 5.79 (#peak 640)
&rst
ixpk= 640, nxpk= 0, iat=2692,2704, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 186 GLU HG2 187 ALA HN 4.54 (#peak 133)
&rst
ixpk= 133, nxpk= 0, iat=2694,2702, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 186 GLU HG3 187 ALA HN 4.77 (#peak 134)
&rst
ixpk= 134, nxpk= 0, iat=2695,2702, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 187 ALA HN 188 SER HN 5.89 (#peak 1821)
&rst
ixpk= 1821, nxpk= 0, iat=2702,2712, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 187 ALA HA 188 SER HN 3.27 (#peak 642)
&rst
ixpk= 642, nxpk= 0, iat=2704,2712, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 187 ALA HA 188 SER HB2 4.86 (#peak 106)
&rst
ixpk= 106, nxpk= 0, iat=2704,2716, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 187 ALA HA 188 SER HB3 4.59 (#peak 89)
&rst
ixpk= 89, nxpk= 0, iat=2704,2717, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 187 ALA QB 188 SER HN 3.87 (#peak 1566)
&rst
ixpk= 1566, nxpk= 0, iat= -1,2712, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1=2706,2707,2708,
&end
#
# 187 ALA QB 189 VAL HN 5.68 (#peak 172)
&rst
ixpk= 172, nxpk= 0, iat= -1,2723, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1=2706,2707,2708,
&end
#
# 188 SER HN 188 SER HB2 4.14 (#peak 105)
&rst
ixpk= 105, nxpk= 0, iat=2712,2716, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 188 SER HN 189 VAL HN 5.54 (#peak 166)
&rst
ixpk= 166, nxpk= 0, iat=2712,2723, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 188 SER HA 189 VAL HN 3.22 (#peak 426)
&rst
ixpk= 426, nxpk= 0, iat=2714,2723, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 188 SER HA 189 VAL QG1 4.11 (#peak 416)
&rst
ixpk= 416, nxpk= 0, iat=2714, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2=2729,2730,2731,
&end
#
# 188 SER HA 189 VAL QG2 5.67 (#peak 1531)
&rst
ixpk= 1531, nxpk= 0, iat=2714, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr2=2733,2734,2735,
&end
#
# 188 SER HB2 189 VAL HN 4.04 (#peak 104)
&rst
ixpk= 104, nxpk= 0, iat=2716,2723, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 188 SER HB3 189 VAL HN 4.62 (#peak 1871)
&rst
ixpk= 1871, nxpk= 0, iat=2717,2723, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 189 VAL HN 189 VAL HB 4.05 (#peak 171)
&rst
ixpk= 171, nxpk= 0, iat=2723,2727, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 189 VAL HN 189 VAL QG2 3.99 (#peak 173)
&rst
ixpk= 173, nxpk= 0, iat=2723, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=2733,2734,2735,
&end
#
# 189 VAL HA 189 VAL QG2 3.08 (#peak 156)
&rst
ixpk= 156, nxpk= 0, iat=2725, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr2=2733,2734,2735,
&end
#
# 189 VAL QG1 190 VAL HN 4.30 (#peak 1501)
&rst
ixpk= 1501, nxpk= 0, iat= -1,2739, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1=2729,2730,2731,
&end
#
# 189 VAL QG2 190 VAL HN 4.46 (#peak 1799)
&rst
ixpk= 1799, nxpk= 0, iat= -1,2739, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr1=2733,2734,2735,
&end
#
# 190 VAL HN 190 VAL QG1 3.41 (#peak 1652)
&rst
ixpk= 1652, nxpk= 0, iat=2739, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2=2745,2746,2747,
&end
#
# 190 VAL HN 191 SER HN 4.61 (#peak 1983)
&rst
ixpk= 1983, nxpk= 0, iat=2739,2755, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 190 VAL HA 190 VAL QG1 3.20 (#peak 2210)
&rst
ixpk= 2210, nxpk= 0, iat=2741, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=2745,2746,2747,
&end
#
# 190 VAL HA 192 GLU HN 5.60 (#peak 1985)
&rst
ixpk= 1985, nxpk= 0, iat=2741,2766, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 190 VAL HB 191 SER HN 4.29 (#peak 956)
&rst
ixpk= 956, nxpk= 0, iat=2743,2755, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 190 VAL QG1 191 SER HN 4.14 (#peak 955)
&rst
ixpk= 955, nxpk= 0, iat= -1,2755, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1=2745,2746,2747,
&end
#
# 191 SER HN 192 GLU HN 4.43 (#peak 266)
&rst
ixpk= 266, nxpk= 0, iat=2755,2766, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 191 SER HB2 192 GLU HN 4.46 (#peak 2035)
&rst
ixpk= 2035, nxpk= 0, iat=2759,2766, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 192 GLU HN 192 GLU HB3 3.90 (#peak 270)
&rst
ixpk= 270, nxpk= 0, iat=2766,2771, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 192 GLU HN 192 GLU QG 4.10 (#peak 269)
&rst
ixpk= 269, nxpk= 0, iat=2766, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2=2773,2774,
&end
#
# 192 GLU HN 193 SER HN 4.43 (#peak 1981)
&rst
ixpk= 1981, nxpk= 0, iat=2766,2781, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 192 GLU HN 193 SER QB 4.59 (#peak 268)
&rst
ixpk= 268, nxpk= 0, iat=2766, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=2785,2786,
&end
#
# 192 GLU HA 192 GLU QG 4.02 (#peak 2622)
&rst
ixpk= 2622, nxpk= 0, iat=2768, -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr2=2773,2774,
&end
#
# 192 GLU HA 193 SER HN 3.45 (#peak 971)
&rst
ixpk= 971, nxpk= 0, iat=2768,2781, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 192 GLU HA 193 SER QB 6.25 (#peak 37)
&rst
ixpk= 37, nxpk= 0, iat=2768, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=2785,2786,
&end
#
# 192 GLU HB2 193 SER HN 5.39 (#peak 1810)
&rst
ixpk= 1810, nxpk= 0, iat=2770,2781, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 192 GLU HB2 193 SER QB 6.25 (#peak 302)
&rst
ixpk= 302, nxpk= 0, iat=2770, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=2785,2786,
&end
#
# 192 GLU HB3 193 SER HN 5.45 (#peak 974)
&rst
ixpk= 974, nxpk= 0, iat=2771,2781, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 192 GLU HB3 193 SER QB 6.25 (#peak 305)
&rst
ixpk= 305, nxpk= 0, iat=2771, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=2785,2786,
&end
#
# 192 GLU QG 193 SER HN 4.50 (#peak 973)
&rst
ixpk= 973, nxpk= 0, iat= -1,2781, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=2773,2774,
&end
#
# 192 GLU QG 193 SER QB 6.25 (#peak 140)
&rst
ixpk= 140, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr1=2773,2774,
igr2=2785,2786,
&end
#
# 193 SER HN 193 SER QB 3.54 (#peak 1001)
&rst
ixpk= 1001, nxpk= 0, iat=2781, -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
igr2=2785,2786,
&end
#
# 193 SER HN 194 CYS QB 5.94 (#peak 972)
&rst
ixpk= 972, nxpk= 0, iat=2781, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr2=2796,2797,
&end
#
# 193 SER HA 194 CYS HN 3.29 (#peak 479)
&rst
ixpk= 479, nxpk= 0, iat=2783,2792, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 193 SER QB 194 CYS HN 4.42 (#peak 506)
&rst
ixpk= 506, nxpk= 0, iat= -1,2792, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1=2785,2786,
&end
#
# 194 CYS HN 194 CYS QB 3.68 (#peak 480)
&rst
ixpk= 480, nxpk= 0, iat=2792, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2=2796,2797,
&end
#
# 194 CYS HA 195 SER HN 3.31 (#peak 796)
&rst
ixpk= 796, nxpk= 0, iat=2794,2803, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 194 CYS QB 195 SER HN 4.11 (#peak 798)
&rst
ixpk= 798, nxpk= 0, iat= -1,2803, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1=2796,2797,
&end
#
# 194 CYS QB 195 SER HA 5.11 (#peak 2796)
&rst
ixpk= 2796, nxpk= 0, iat= -1,2805, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1=2796,2797,
&end
#
# 194 CYS QB 196 THR HN 6.25 (#peak 1988)
&rst
ixpk= 1988, nxpk= 0, iat= -1,2814, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=2796,2797,
&end
#
# 195 SER HN 195 SER QB 3.77 (#peak 797)
&rst
ixpk= 797, nxpk= 0, iat=2803, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2=2807,2808,
&end
#
# 195 SER HN 196 THR HN 4.69 (#peak 795)
&rst
ixpk= 795, nxpk= 0, iat=2803,2814, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 195 SER HN 196 THR QG2 6.25 (#peak 799)
&rst
ixpk= 799, nxpk= 0, iat=2803, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr2=2820,2821,2822,
&end
#
# 195 SER HA 196 THR HN 3.13 (#peak 1079)
&rst
ixpk= 1079, nxpk= 0, iat=2805,2814, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63, &end
#
# 195 SER HA 196 THR QG2 5.05 (#peak 2777)
&rst
ixpk= 2777, nxpk= 0, iat=2805, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=2820,2821,2822,
&end
#
# 195 SER QB 196 THR HN 4.26 (#peak 1081)
&rst
ixpk= 1081, nxpk= 0, iat= -1,2814, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1=2807,2808,
&end
#
# 196 THR HN 196 THR HB 3.85 (#peak 1987)
&rst
ixpk= 1987, nxpk= 0, iat=2814,2818, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 196 THR HN 196 THR QG2 3.90 (#peak 1083)
&rst
ixpk= 1083, nxpk= 0, iat=2814, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=2820,2821,2822,
&end
#
# 196 THR HN 197 ASN HN 3.98 (#peak 433)
&rst
ixpk= 433, nxpk= 0, iat=2814,2828, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 196 THR HA 196 THR QG2 3.23 (#peak 233)
&rst
ixpk= 233, nxpk= 0, iat=2816, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2=2820,2821,2822,
&end
#
# 196 THR HA 197 ASN HN 3.52 (#peak 434)
&rst
ixpk= 434, nxpk= 0, iat=2816,2828, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 196 THR HA 197 ASN HB3 6.15 (#peak 2446)
&rst
ixpk= 2446, nxpk= 0, iat=2816,2833, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 196 THR QG2 197 ASN HN 4.43 (#peak 424)
&rst
ixpk= 424, nxpk= 0, iat= -1,2828, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=2820,2821,2822,
&end
#
# 197 ASN HN 197 ASN HB2 3.85 (#peak 436)
&rst
ixpk= 436, nxpk= 0, iat=2828,2832, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 197 ASN HN 197 ASN HB3 3.87 (#peak 1989)
&rst
ixpk= 1989, nxpk= 0, iat=2828,2833, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 197 ASN HN 198 PRO HD3 4.93 (#peak 435)
&rst
ixpk= 435, nxpk= 0, iat=2828,2844, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 197 ASN HA 198 PRO HD2 3.01 (#peak 787)
&rst
ixpk= 787, nxpk= 0, iat=2830,2843, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, &end
#
# 197 ASN HA 198 PRO HD3 2.93 (#peak 604)
&rst
ixpk= 604, nxpk= 0, iat=2830,2844, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43, &end
#
# 197 ASN HA 198 PRO QG 4.66 (#peak 603)
&rst
ixpk= 603, nxpk= 0, iat=2830, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr2=2846,2847,
&end
#
# 197 ASN HB2 198 PRO HD3 5.67 (#peak 855)
&rst
ixpk= 855, nxpk= 0, iat=2832,2844, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 197 ASN HB2 199 LEU HN 4.23 (#peak 1990)
&rst
ixpk= 1990, nxpk= 0, iat=2832,2856, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 197 ASN HB2 200 GLY HN 5.69 (#peak 1396)
&rst
ixpk= 1396, nxpk= 0, iat=2832,2875, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 197 ASN HB3 198 PRO HD2 5.27 (#peak 2280)
&rst
ixpk= 2280, nxpk= 0, iat=2833,2843, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 197 ASN HB3 200 GLY HN 6.25 (#peak 1991)
&rst
ixpk= 1991, nxpk= 0, iat=2833,2875, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 198 PRO HB2 199 LEU HN 3.82 (#peak 613)
&rst
ixpk= 613, nxpk= 0, iat=2849,2856, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 198 PRO HB2 200 GLY HN 6.25 (#peak 1965)
&rst
ixpk= 1965, nxpk= 0, iat=2849,2875, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 198 PRO HB3 199 LEU HN 4.18 (#peak 614)
&rst
ixpk= 614, nxpk= 0, iat=2850,2856, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 198 PRO HB3 200 GLY HN 6.08 (#peak 1408)
&rst
ixpk= 1408, nxpk= 0, iat=2850,2875, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58, &end
#
# 198 PRO HD2 199 LEU HN 4.00 (#peak 611)
&rst
ixpk= 611, nxpk= 0, iat=2843,2856, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 198 PRO HD2 199 LEU QB 4.88 (#peak 844)
&rst
ixpk= 844, nxpk= 0, iat=2843, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2=2860,2861,
&end
#
# 198 PRO HD3 199 LEU HN 4.93 (#peak 633)
&rst
ixpk= 633, nxpk= 0, iat=2844,2856, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 198 PRO QG 199 LEU HN 3.99 (#peak 1566)
&rst
ixpk= 1566, nxpk= 0, iat= -1,2856, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1=2846,2847,
&end
#
# 199 LEU HN 199 LEU HA 2.92 (#peak 610)
&rst
ixpk= 610, nxpk= 0, iat=2856,2858, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42, &end
#
# 199 LEU HN 199 LEU QB 2.79 (#peak 615)
&rst
ixpk= 615, nxpk= 0, iat=2856, -1, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,
igr2=2860,2861,
&end
#
# 199 LEU HN 199 LEU QD1 4.55 (#peak 617)
&rst
ixpk= 617, nxpk= 0, iat=2856, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2=2865,2866,2867,
&end
#
# 199 LEU HA 200 GLY HN 3.42 (#peak 1406)
&rst
ixpk= 1406, nxpk= 0, iat=2858,2875, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 199 LEU QB 199 LEU QD1 3.02 (#peak 1204)
&rst
ixpk= 1204, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr1=2860,2861,
igr2=2865,2866,2867,
&end
#
# 199 LEU QB 199 LEU QD2 2.81 (#peak 1075)
&rst
ixpk= 1075, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr1=2860,2861,
igr2=2869,2870,2871,
&end
#
# 199 LEU QB 200 GLY HN 3.79 (#peak 1409)
&rst
ixpk= 1409, nxpk= 0, iat= -1,2875, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr1=2860,2861,
&end
#
# 199 LEU QB 200 GLY QA 5.42 (#peak 1433)
&rst
ixpk= 1433, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1=2860,2861,
igr2=2877,2878,
&end
#
# 199 LEU QD1 200 GLY HN 4.70 (#peak 1410)
&rst
ixpk= 1410, nxpk= 0, iat= -1,2875, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1=2865,2866,2867,
&end
#
# 199 LEU QD1 201 ASN HD21 5.23 (#peak 1193)
&rst
ixpk= 1193, nxpk= 0, iat= -1,2891, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1=2865,2866,2867,
&end
#
# 199 LEU QD1 201 ASN HD22 5.26 (#peak 1214)
&rst
ixpk= 1214, nxpk= 0, iat= -1,2892, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1=2865,2866,2867,
&end
#
# 199 LEU QD2 201 ASN HB3 5.53 (#peak 2313)
&rst
ixpk= 2313, nxpk= 0, iat= -1,2887, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1=2869,2870,2871,
&end
#
# 200 GLY HN 200 GLY QA 2.83 (#peak 1407)
&rst
ixpk= 1407, nxpk= 0, iat=2875, -1, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
igr2=2877,2878,
&end
#
# 200 GLY QA 201 ASN HN 3.12 (#peak 781)
&rst
ixpk= 781, nxpk= 0, iat= -1,2882, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
igr1=2877,2878,
&end
#
# 200 GLY QA 201 ASN HB2 5.79 (#peak 1390)
&rst
ixpk= 1390, nxpk= 0, iat= -1,2886, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=2877,2878,
&end
#
# 200 GLY QA 202 HIS HN 4.68 (#peak 285)
&rst
ixpk= 285, nxpk= 0, iat= -1,2896, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1=2877,2878,
&end
#
# 201 ASN HN 201 ASN HB2 3.89 (#peak 782)
&rst
ixpk= 782, nxpk= 0, iat=2882,2886, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 201 ASN HN 201 ASN HB3 3.82 (#peak 2303)
&rst
ixpk= 2303, nxpk= 0, iat=2882,2887, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 201 ASN HN 201 ASN HD21 6.25 (#peak 759)
&rst
ixpk= 759, nxpk= 0, iat=2882,2891, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 201 ASN HN 202 HIS HN 3.76 (#peak 283)
&rst
ixpk= 283, nxpk= 0, iat=2882,2896, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 201 ASN HA 201 ASN HD21 3.28 (#peak 1196)
&rst
ixpk= 1196, nxpk= 0, iat=2884,2891, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 201 ASN HA 201 ASN HD22 3.63 (#peak 1200)
&rst
ixpk= 1200, nxpk= 0, iat=2884,2892, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 201 ASN HA 202 HIS HN 3.50 (#peak 522)
&rst
ixpk= 522, nxpk= 0, iat=2884,2896, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 201 ASN HB2 201 ASN HD21 3.86 (#peak 2277)
&rst
ixpk= 2277, nxpk= 0, iat=2886,2891, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 201 ASN HB3 201 ASN HD21 3.99 (#peak 1213)
&rst
ixpk= 1213, nxpk= 0, iat=2887,2891, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 201 ASN HB3 201 ASN HD22 3.82 (#peak 1201)
&rst
ixpk= 1201, nxpk= 0, iat=2887,2892, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 202 HIS HN 202 HIS HB2 3.99 (#peak 1996)
&rst
ixpk= 1996, nxpk= 0, iat=2896,2900, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 202 HIS HN 202 HIS HB3 3.79 (#peak 286)
&rst
ixpk= 286, nxpk= 0, iat=2896,2901, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
# 2922 atoms read from pdb file ../PreP_PDB/str_1/prm_1.pdb.
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