NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
492461 |
2kc0   |
16058 | cing | 1-original | 2 | AMBER | distance | NOE | ambi |
#
# 3 ALA QB 4 ALA HN 4.37 (#peak 3680)
&rst
ixpk= 3680, nxpk= 0, iat= -1, 47, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
rk2=50.0, rk3=50.0, ir6=1, ialtd=0,
igr1= 41, 42, 43,
&end
#
# 4 ALA HN 4 ALA QB 3.91 (#peak 3679)
&rst
ixpk= 3679, nxpk= 0, iat= 47, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2= 51, 52, 53,
&end
#
# 5 ASP HN 6 ILE HN 5.31 (#peak 3684)
&rst
ixpk= 3684, nxpk= 0, iat= 57, 69, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 5 ASP HA 8 ALA HN 5.63 (#peak 3713)
&rst
ixpk= 3713, nxpk= 0, iat= 59, 95, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 5 ASP HA 8 ALA QB 6.15 (#peak 4380)
&rst
ixpk= 4380, nxpk= 0, iat= 59, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2= 99, 100, 101,
&end
#
# 5 ASP HB2 6 ILE HN 4.40 (#peak 3689)
&rst
ixpk= 3689, nxpk= 0, iat= 61, 69, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 5 ASP HB3 6 ILE HN 4.62 (#peak 3688)
&rst
ixpk= 3688, nxpk= 0, iat= 62, 69, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 6 ILE HN 6 ILE HB 3.82 (#peak 3695)
&rst
ixpk= 3695, nxpk= 0, iat= 69, 73, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 6 ILE HN 6 ILE HG12 3.83 (#peak 3696)
&rst
ixpk= 3696, nxpk= 0, iat= 69, 79, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 6 ILE HN 6 ILE HG13 3.72 (#peak 3697)
&rst
ixpk= 3697, nxpk= 0, iat= 69, 80, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 6 ILE HN 6 ILE QD1 4.43 (#peak 3699)
&rst
ixpk= 3699, nxpk= 0, iat= 69, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2= 82, 83, 84,
&end
#
# 6 ILE HN 6 ILE QG2 4.40 (#peak 3698)
&rst
ixpk= 3698, nxpk= 0, iat= 69, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2= 75, 76, 77,
&end
#
# 6 ILE HN 7 GLY HN 4.39 (#peak 3736)
&rst
ixpk= 3736, nxpk= 0, iat= 69, 88, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 6 ILE HN 7 GLY QA 4.81 (#peak 3694)
&rst
ixpk= 3694, nxpk= 0, iat= 69, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 90, 91,
&end
#
# 6 ILE HN 8 ALA HN 3.94 (#peak 3740)
&rst
ixpk= 3740, nxpk= 0, iat= 69, 95, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 6 ILE HA 8 ALA HN 4.75 (#peak 3711)
&rst
ixpk= 3711, nxpk= 0, iat= 71, 95, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 6 ILE HB 7 GLY QA 6.15 (#peak 4451)
&rst
ixpk= 4451, nxpk= 0, iat= 73, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2= 90, 91,
&end
#
# 6 ILE HG12 7 GLY QA 6.15 (#peak 4376)
&rst
ixpk= 4376, nxpk= 0, iat= 79, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2= 90, 91,
&end
#
# 6 ILE HG12 8 ALA HN 6.14 (#peak 3725)
&rst
ixpk= 3725, nxpk= 0, iat= 79, 95, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64, &end
#
# 6 ILE HG13 8 ALA HN 5.98 (#peak 3724)
&rst
ixpk= 3724, nxpk= 0, iat= 80, 95, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 6 ILE QD1 9 GLY HA2 6.15 (#peak 4359)
&rst
ixpk= 4359, nxpk= 0, iat= -1, 107, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 82, 83, 84,
&end
#
# 6 ILE QG2 7 GLY QA 6.15 (#peak 4374)
&rst
ixpk= 4374, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1= 75, 76, 77,
igr2= 90, 91,
&end
#
# 6 ILE QG2 8 ALA HN 5.52 (#peak 3723)
&rst
ixpk= 3723, nxpk= 0, iat= -1, 95, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr1= 75, 76, 77,
&end
#
# 7 GLY HN 8 ALA HN 4.77 (#peak 3727)
&rst
ixpk= 3727, nxpk= 0, iat= 88, 95, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 7 GLY QA 10 LEU QD1 6.15 (#peak 4375)
&rst
ixpk= 4375, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1= 90, 91,
igr2= 121, 122, 123,
&end
#
# 7 GLY QA 8 ALA HN 3.23 (#peak 3710)
&rst
ixpk= 3710, nxpk= 0, iat= -1, 95, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr1= 90, 91,
&end
#
# 7 GLY QA 8 ALA QB 4.37 (#peak 4508)
&rst
ixpk= 4508, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr1= 90, 91,
igr2= 99, 100, 101,
&end
#
# 8 ALA HN 8 ALA QB 3.40 (#peak 3721)
&rst
ixpk= 3721, nxpk= 0, iat= 95, -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr2= 99, 100, 101,
&end
#
# 8 ALA HN 9 GLY HN 4.57 (#peak 3728)
&rst
ixpk= 3728, nxpk= 0, iat= 95, 105, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 8 ALA HA 10 LEU HN 4.89 (#peak 3718)
&rst
ixpk= 3718, nxpk= 0, iat= 97, 112, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 8 ALA HA 11 ALA HN 5.54 (#peak 3730)
&rst
ixpk= 3730, nxpk= 0, iat= 97, 131, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 8 ALA QB 10 LEU HN 3.82 (#peak 4794)
&rst
ixpk= 4794, nxpk= 0, iat= -1, 112, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1= 99, 100, 101,
&end
#
# 8 ALA QB 45 GLN HA 5.20 (#peak 4480)
&rst
ixpk= 4480, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1= 99, 100, 101,
&end
#
# 8 ALA QB 45 GLN HB2 4.69 (#peak 4483)
&rst
ixpk= 4483, nxpk= 0, iat= -1, 667, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 99, 100, 101,
&end
#
# 8 ALA QB 45 GLN HB3 3.94 (#peak 4482)
&rst
ixpk= 4482, nxpk= 0, iat= -1, 668, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1= 99, 100, 101,
&end
#
# 8 ALA QB 45 GLN HG2 5.29 (#peak 4485)
&rst
ixpk= 4485, nxpk= 0, iat= -1, 670, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 99, 100, 101,
&end
#
# 8 ALA QB 45 GLN HG3 5.07 (#peak 13154)
&rst
ixpk= 13154, nxpk= 0, iat= -1, 671, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 99, 100, 101,
&end
#
# 8 ALA QB 69 ARG QD 4.39 (#peak 4487)
&rst
ixpk= 4487, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 99, 100, 101,
igr2=1022,1023,
&end
#
# 8 ALA QB 9 GLY HN 3.73 (#peak 3722)
&rst
ixpk= 3722, nxpk= 0, iat= -1, 105, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 99, 100, 101,
&end
#
# 9 GLY HN 10 LEU HN 4.07 (#peak 2502)
&rst
ixpk= 2502, nxpk= 0, iat= 105, 112, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 9 GLY HN 10 LEU QD1 6.15 (#peak 1689)
&rst
ixpk= 1689, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2= 121, 122, 123,
&end
#
# 9 GLY HN 10 LEU QD2 6.15 (#peak 3615)
&rst
ixpk= 3615, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2= 125, 126, 127,
&end
#
# 9 GLY HN 11 ALA HN 6.15 (#peak 3729)
&rst
ixpk= 3729, nxpk= 0, iat= 105, 131, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 9 GLY HA2 12 ASP HN 4.84 (#peak 4343)
&rst
ixpk= 4343, nxpk= 0, iat= 107, 141, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 9 GLY HA2 12 ASP HB2 6.15 (#peak 4391)
&rst
ixpk= 4391, nxpk= 0, iat= 107, 145, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 9 GLY HA2 12 ASP HB3 6.15 (#peak 4393)
&rst
ixpk= 4393, nxpk= 0, iat= 107, 146, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 9 GLY HA3 12 ASP HB2 5.99 (#peak 4389)
&rst
ixpk= 4389, nxpk= 0, iat= 108, 145, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49, &end
#
# 9 GLY HA3 12 ASP HB3 6.15 (#peak 4394)
&rst
ixpk= 4394, nxpk= 0, iat= 108, 146, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 10 LEU HN 10 LEU HB2 3.61 (#peak 2826)
&rst
ixpk= 2826, nxpk= 0, iat= 112, 116, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 10 LEU HN 10 LEU HB3 4.13 (#peak 802)
&rst
ixpk= 802, nxpk= 0, iat= 112, 117, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 10 LEU HN 10 LEU HG 4.15 (#peak 3568)
&rst
ixpk= 3568, nxpk= 0, iat= 112, 119, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 10 LEU HN 10 LEU QD1 3.61 (#peak 805)
&rst
ixpk= 805, nxpk= 0, iat= 112, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2= 121, 122, 123,
&end
#
# 10 LEU HN 10 LEU QD2 4.42 (#peak 809)
&rst
ixpk= 809, nxpk= 0, iat= 112, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2= 125, 126, 127,
&end
#
# 10 LEU HN 11 ALA HN 3.70 (#peak 1439)
&rst
ixpk= 1439, nxpk= 0, iat= 112, 131, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 10 LEU HN 11 ALA QB 6.15 (#peak 3121)
&rst
ixpk= 3121, nxpk= 0, iat= 112, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2= 135, 136, 137,
&end
#
# 10 LEU HN 12 ASP HN 5.19 (#peak 3632)
&rst
ixpk= 3632, nxpk= 0, iat= 112, 141, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 10 LEU HA 10 LEU QD2 5.47 (#peak 3612)
&rst
ixpk= 3612, nxpk= 0, iat= 114, -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr2= 125, 126, 127,
&end
#
# 10 LEU HA 12 ASP HN 4.65 (#peak 3894)
&rst
ixpk= 3894, nxpk= 0, iat= 114, 141, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 10 LEU HA 13 ALA HN 4.76 (#peak 4341)
&rst
ixpk= 4341, nxpk= 0, iat= 114, 153, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 10 LEU HA 13 ALA QB 5.70 (#peak 4397)
&rst
ixpk= 4397, nxpk= 0, iat= 114, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr2= 157, 158, 159,
&end
#
# 10 LEU HB2 11 ALA HN 4.43 (#peak 1437)
&rst
ixpk= 1437, nxpk= 0, iat= 116, 131, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 10 LEU HB3 11 ALA HN 4.21 (#peak 1438)
&rst
ixpk= 1438, nxpk= 0, iat= 117, 131, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 10 LEU HG 11 ALA HN 4.52 (#peak 4793)
&rst
ixpk= 4793, nxpk= 0, iat= 119, 131, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 10 LEU QD1 11 ALA HN 4.37 (#peak 1442)
&rst
ixpk= 1442, nxpk= 0, iat= -1, 131, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 121, 122, 123,
&end
#
# 10 LEU QD1 44 ALA QB 3.97 (#peak 4564)
&rst
ixpk= 4564, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 121, 122, 123,
igr2= 657, 658, 659,
&end
#
# 10 LEU QD1 69 ARG HN 5.25 (#peak 4316)
&rst
ixpk= 4316, nxpk= 0, iat= -1,1012, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 121, 122, 123,
&end
#
# 10 LEU QD2 11 ALA HN 4.88 (#peak 1448)
&rst
ixpk= 1448, nxpk= 0, iat= -1, 131, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 125, 126, 127,
&end
#
# 10 LEU QD2 11 ALA QB 6.15 (#peak 3613)
&rst
ixpk= 3613, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1= 125, 126, 127,
igr2= 135, 136, 137,
&end
#
# 10 LEU QD2 44 ALA QB 3.86 (#peak 4563)
&rst
ixpk= 4563, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 125, 126, 127,
igr2= 657, 658, 659,
&end
#
# 10 LEU QD2 68 SER QB 3.95 (#peak 6391)
&rst
ixpk= 6391, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 125, 126, 127,
igr2=1005,1006,
&end
#
# 10 LEU QD2 69 ARG HN 4.97 (#peak 4317)
&rst
ixpk= 4317, nxpk= 0, iat= -1,1012, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 125, 126, 127,
&end
#
# 10 LEU QD2 70 PHE QD 5.88 (#peak 12160)
&rst
ixpk= 12160, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
igr1= 125, 126, 127,
igr2=1044,1052,
&end
#
# 10 LEU QD2 70 PHE QE 3.50 (#peak 12159)
&rst
ixpk= 12159, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr1= 125, 126, 127,
igr2=1046,1050,
&end
#
# 11 ALA HN 11 ALA QB 2.68 (#peak 2825)
&rst
ixpk= 2825, nxpk= 0, iat= 131, -1, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,
igr2= 135, 136, 137,
&end
#
# 11 ALA HN 12 ASP HN 3.63 (#peak 1434)
&rst
ixpk= 1434, nxpk= 0, iat= 131, 141, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 11 ALA HN 12 ASP HB3 5.27 (#peak 1443)
&rst
ixpk= 1443, nxpk= 0, iat= 131, 146, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 11 ALA HN 45 GLN HB2 5.12 (#peak 4327)
&rst
ixpk= 4327, nxpk= 0, iat= 131, 667, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 11 ALA HN 45 GLN HB3 5.45 (#peak 4328)
&rst
ixpk= 4328, nxpk= 0, iat= 131, 668, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 11 ALA HN 45 GLN HG2 5.50 (#peak 4330)
&rst
ixpk= 4330, nxpk= 0, iat= 131, 670, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 ALA HN 45 GLN HG3 5.37 (#peak 4333)
&rst
ixpk= 4333, nxpk= 0, iat= 131, 671, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 11 ALA HA 14 LEU HN 5.44 (#peak 4696)
&rst
ixpk= 4696, nxpk= 0, iat= 133, 163, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 11 ALA HA 46 GLY HN 6.15 (#peak 4755)
&rst
ixpk= 4755, nxpk= 0, iat= 133, 680, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 11 ALA HA 47 ALA HN 4.69 (#peak 4756)
&rst
ixpk= 4756, nxpk= 0, iat= 133, 687, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 11 ALA QB 12 ASP HN 3.38 (#peak 9)
&rst
ixpk= 9, nxpk= 0, iat= -1, 141, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr1= 135, 136, 137,
&end
#
# 11 ALA QB 12 ASP HA 6.15 (#peak 3124)
&rst
ixpk= 3124, nxpk= 0, iat= -1, 143, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 135, 136, 137,
&end
#
# 11 ALA QB 12 ASP HB3 6.15 (#peak 3123)
&rst
ixpk= 3123, nxpk= 0, iat= -1, 146, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 135, 136, 137,
&end
#
# 11 ALA QB 46 GLY HN 4.66 (#peak 4751)
&rst
ixpk= 4751, nxpk= 0, iat= -1, 680, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 135, 136, 137,
&end
#
# 11 ALA QB 47 ALA HN 4.45 (#peak 4752)
&rst
ixpk= 4752, nxpk= 0, iat= -1, 687, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 135, 136, 137,
&end
#
# 12 ASP HN 12 ASP HB2 3.63 (#peak 1)
&rst
ixpk= 1, nxpk= 0, iat= 141, 145, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 12 ASP HN 12 ASP HB3 3.52 (#peak 6)
&rst
ixpk= 6, nxpk= 0, iat= 141, 146, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 12 ASP HN 13 ALA HN 3.68 (#peak 3)
&rst
ixpk= 3, nxpk= 0, iat= 141, 153, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 12 ASP HN 15 THR HN 6.08 (#peak 4334)
&rst
ixpk= 4334, nxpk= 0, iat= 141, 182, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58, &end
#
# 12 ASP HB2 13 ALA HN 4.85 (#peak 4335)
&rst
ixpk= 4335, nxpk= 0, iat= 145, 153, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 12 ASP HB2 13 ALA QB 6.15 (#peak 1432)
&rst
ixpk= 1432, nxpk= 0, iat= 145, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2= 157, 158, 159,
&end
#
# 12 ASP HB3 13 ALA HN 3.95 (#peak 197)
&rst
ixpk= 197, nxpk= 0, iat= 146, 153, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 13 ALA HN 13 ALA QB 3.14 (#peak 195)
&rst
ixpk= 195, nxpk= 0, iat= 153, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2= 157, 158, 159,
&end
#
# 13 ALA HN 14 LEU HN 4.02 (#peak 196)
&rst
ixpk= 196, nxpk= 0, iat= 153, 163, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 13 ALA HN 14 LEU HB2 6.15 (#peak 3357)
&rst
ixpk= 3357, nxpk= 0, iat= 153, 167, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 13 ALA HN 15 THR HN 6.15 (#peak 3855)
&rst
ixpk= 3855, nxpk= 0, iat= 153, 182, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 13 ALA HA 15 THR HN 6.15 (#peak 3856)
&rst
ixpk= 3856, nxpk= 0, iat= 155, 182, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 13 ALA HA 16 ALA QB 6.15 (#peak 4400)
&rst
ixpk= 4400, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2= 200, 201, 202,
&end
#
# 13 ALA QB 14 LEU HN 3.70 (#peak 1106)
&rst
ixpk= 1106, nxpk= 0, iat= -1, 163, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1= 157, 158, 159,
&end
#
# 13 ALA QB 14 LEU HA 5.55 (#peak 2682)
&rst
ixpk= 2682, nxpk= 0, iat= -1, 165, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1= 157, 158, 159,
&end
#
# 13 ALA QB 18 LEU QD1 6.15 (#peak 4761)
&rst
ixpk= 4761, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1= 157, 158, 159,
igr2= 229, 230, 231,
&end
#
# 13 ALA QB 18 LEU QD2 6.15 (#peak 4760)
&rst
ixpk= 4760, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1= 157, 158, 159,
igr2= 233, 234, 235,
&end
#
# 13 ALA QB 57 LEU QQD 4.63 (#peak 4544)
&rst
ixpk= 4544, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.50, r4= 8.00,
igr1= 157, 158, 159,
igr2= 833, 834, 835, 829, 830, 831,
&end
#
# 13 ALA QB 62 LEU QQD 3.68 (#peak 4550)
&rst
ixpk= 4550, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 157, 158, 159,
igr2= 909, 910, 911, 905, 906, 907,
&end
#
# 14 LEU HN 14 LEU HG 4.88 (#peak 3556)
&rst
ixpk= 3556, nxpk= 0, iat= 163, 170, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 14 LEU HN 14 LEU QQD 4.60 (#peak 3557)
&rst
ixpk= 3557, nxpk= 0, iat= 163, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2= 176, 177, 178, 172, 173, 174,
&end
#
# 14 LEU HN 15 THR HN 4.31 (#peak 1977)
&rst
ixpk= 1977, nxpk= 0, iat= 163, 182, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 14 LEU HN 15 THR QG2 5.31 (#peak 1107)
&rst
ixpk= 1107, nxpk= 0, iat= 163, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2= 188, 189, 190,
&end
#
# 14 LEU HA 14 LEU HG 4.15 (#peak 3249)
&rst
ixpk= 3249, nxpk= 0, iat= 165, 170, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 14 LEU HA 14 LEU QQD 5.01 (#peak 3717)
&rst
ixpk= 3717, nxpk= 0, iat= 165, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr2= 176, 177, 178, 172, 173, 174,
&end
#
# 14 LEU HB2 15 THR HN 4.52 (#peak 1985)
&rst
ixpk= 1985, nxpk= 0, iat= 167, 182, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 14 LEU HB2 48 GLU HN 4.79 (#peak 4736)
&rst
ixpk= 4736, nxpk= 0, iat= 167, 697, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 14 LEU HB3 15 THR HN 3.98 (#peak 1976)
&rst
ixpk= 1976, nxpk= 0, iat= 168, 182, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 14 LEU HG 15 THR HN 6.05 (#peak 1983)
&rst
ixpk= 1983, nxpk= 0, iat= 170, 182, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 14 LEU HG 44 ALA HN 4.53 (#peak 4807)
&rst
ixpk= 4807, nxpk= 0, iat= 170, 653, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 14 LEU HG 47 ALA HN 5.50 (#peak 4338)
&rst
ixpk= 4338, nxpk= 0, iat= 170, 687, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 14 LEU HG 47 ALA QB 3.41 (#peak 4561)
&rst
ixpk= 4561, nxpk= 0, iat= 170, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2= 691, 692, 693,
&end
#
# 14 LEU HG 48 GLU HN 4.79 (#peak 4312)
&rst
ixpk= 4312, nxpk= 0, iat= 170, 697, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 14 LEU HG 49 LYS HN 4.93 (#peak 4361)
&rst
ixpk= 4361, nxpk= 0, iat= 170, 712, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 14 LEU HG 70 PHE HZ 3.82 (#peak 4362)
&rst
ixpk= 4362, nxpk= 0, iat= 170,1048, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 14 LEU HG 70 PHE QD 4.52 (#peak 12641)
&rst
ixpk= 12641, nxpk= 0, iat= 170, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=1044,1052,
&end
#
# 14 LEU HG 70 PHE QE 3.68 (#peak 4409)
&rst
ixpk= 4409, nxpk= 0, iat= 170, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2=1046,1050,
&end
#
# 14 LEU QQD 15 THR HN 4.43 (#peak 1986)
&rst
ixpk= 1986, nxpk= 0, iat= -1, 182, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 176, 177, 178, 172, 173, 174,
&end
#
# 14 LEU QQD 44 ALA HN 5.33 (#peak 4806)
&rst
ixpk= 4806, nxpk= 0, iat= -1, 653, r1= 1.30, r2= 1.80, r3= 7.18, r4= 7.68,
igr1= 176, 177, 178, 172, 173, 174,
&end
#
# 14 LEU QQD 47 ALA QB 4.22 (#peak 4562)
&rst
ixpk= 4562, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1= 176, 177, 178, 172, 173, 174,
igr2= 691, 692, 693,
&end
#
# 14 LEU QQD 48 GLU HN 5.86 (#peak 4313)
&rst
ixpk= 4313, nxpk= 0, iat= -1, 697, r1= 1.30, r2= 1.80, r3= 7.90, r4= 8.40,
igr1= 176, 177, 178, 172, 173, 174,
&end
#
# 14 LEU QQD 70 PHE HZ 3.83 (#peak 4546)
&rst
ixpk= 4546, nxpk= 0, iat= -1,1048, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1= 176, 177, 178, 172, 173, 174,
&end
#
# 14 LEU QQD 70 PHE QE 3.72 (#peak 4547)
&rst
ixpk= 4547, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 176, 177, 178, 172, 173, 174,
igr2=1046,1050,
&end
#
# 15 THR HN 15 THR QG2 3.77 (#peak 1978)
&rst
ixpk= 1978, nxpk= 0, iat= 182, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2= 188, 189, 190,
&end
#
# 15 THR HN 16 ALA HN 3.67 (#peak 2236)
&rst
ixpk= 2236, nxpk= 0, iat= 182, 196, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 15 THR HN 16 ALA QB 6.15 (#peak 2656)
&rst
ixpk= 2656, nxpk= 0, iat= 182, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2= 200, 201, 202,
&end
#
# 15 THR HB 16 ALA HN 4.21 (#peak 2235)
&rst
ixpk= 2235, nxpk= 0, iat= 186, 196, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 15 THR QG2 16 ALA HN 4.60 (#peak 2232)
&rst
ixpk= 2232, nxpk= 0, iat= -1, 196, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1= 188, 189, 190,
&end
#
# 15 THR QG2 47 ALA QB 3.36 (#peak 4560)
&rst
ixpk= 4560, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1= 188, 189, 190,
igr2= 691, 692, 693,
&end
#
# 15 THR QG2 48 GLU HN 4.95 (#peak 4315)
&rst
ixpk= 4315, nxpk= 0, iat= -1, 697, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1= 188, 189, 190,
&end
#
# 16 ALA HN 16 ALA QB 3.27 (#peak 2234)
&rst
ixpk= 2234, nxpk= 0, iat= 196, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 200, 201, 202,
&end
#
# 16 ALA HN 17 PRO HD2 4.81 (#peak 2227)
&rst
ixpk= 2227, nxpk= 0, iat= 196, 207, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 16 ALA HN 17 PRO HD3 5.66 (#peak 2233)
&rst
ixpk= 2233, nxpk= 0, iat= 196, 208, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16, &end
#
# 16 ALA QB 17 PRO HD2 5.77 (#peak 2652)
&rst
ixpk= 2652, nxpk= 0, iat= -1, 207, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 200, 201, 202,
&end
#
# 16 ALA QB 17 PRO HD3 5.74 (#peak 2655)
&rst
ixpk= 2655, nxpk= 0, iat= -1, 208, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr1= 200, 201, 202,
&end
#
# 17 PRO HA 18 LEU HN 3.55 (#peak 2397)
&rst
ixpk= 2397, nxpk= 0, iat= 216, 220, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 17 PRO HB2 18 LEU HN 3.43 (#peak 2388)
&rst
ixpk= 2388, nxpk= 0, iat= 213, 220, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 17 PRO HB3 18 LEU HN 4.19 (#peak 4697)
&rst
ixpk= 4697, nxpk= 0, iat= 214, 220, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 17 PRO HG2 18 LEU HN 4.95 (#peak 2398)
&rst
ixpk= 2398, nxpk= 0, iat= 210, 220, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 17 PRO HG3 18 LEU HN 4.91 (#peak 2393)
&rst
ixpk= 2393, nxpk= 0, iat= 211, 220, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 18 LEU HN 18 LEU HB2 3.81 (#peak 2389)
&rst
ixpk= 2389, nxpk= 0, iat= 220, 224, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 18 LEU HN 18 LEU QD1 4.43 (#peak 3600)
&rst
ixpk= 3600, nxpk= 0, iat= 220, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2= 229, 230, 231,
&end
#
# 18 LEU HN 18 LEU QD2 4.86 (#peak 2394)
&rst
ixpk= 2394, nxpk= 0, iat= 220, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2= 233, 234, 235,
&end
#
# 18 LEU HN 19 ASP HN 4.51 (#peak 2392)
&rst
ixpk= 2392, nxpk= 0, iat= 220, 239, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 18 LEU HB2 18 LEU QD2 4.16 (#peak 1555)
&rst
ixpk= 1555, nxpk= 0, iat= 224, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2= 233, 234, 235,
&end
#
# 18 LEU HB2 19 ASP HN 3.92 (#peak 359)
&rst
ixpk= 359, nxpk= 0, iat= 224, 239, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 18 LEU HB2 60 GLY HN 6.15 (#peak 4738)
&rst
ixpk= 4738, nxpk= 0, iat= 224, 867, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 18 LEU HB2 62 LEU QQD 6.15 (#peak 4443)
&rst
ixpk= 4443, nxpk= 0, iat= 224, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr2= 909, 910, 911, 905, 906, 907,
&end
#
# 18 LEU HB3 19 ASP HN 4.10 (#peak 363)
&rst
ixpk= 363, nxpk= 0, iat= 225, 239, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 18 LEU HB3 60 GLY HN 6.15 (#peak 4739)
&rst
ixpk= 4739, nxpk= 0, iat= 225, 867, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 18 LEU HG 62 LEU QQD 3.62 (#peak 4444)
&rst
ixpk= 4444, nxpk= 0, iat= 227, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2= 909, 910, 911, 905, 906, 907,
&end
#
# 18 LEU QD1 19 ASP HN 4.79 (#peak 3602)
&rst
ixpk= 3602, nxpk= 0, iat= -1, 239, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 229, 230, 231,
&end
#
# 18 LEU QD1 19 ASP HB3 6.15 (#peak 4586)
&rst
ixpk= 4586, nxpk= 0, iat= -1, 244, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 229, 230, 231,
&end
#
# 18 LEU QD1 59 THR HN 5.60 (#peak 4546)
&rst
ixpk= 4546, nxpk= 0, iat= -1, 853, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 229, 230, 231,
&end
#
# 18 LEU QD1 60 GLY HN 5.42 (#peak 4547)
&rst
ixpk= 4547, nxpk= 0, iat= -1, 867, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1= 229, 230, 231,
&end
#
# 18 LEU QD1 62 LEU QQD 3.27 (#peak 4445)
&rst
ixpk= 4445, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr1= 229, 230, 231,
igr2= 909, 910, 911, 905, 906, 907,
&end
#
# 18 LEU QD2 19 ASP HN 5.57 (#peak 3601)
&rst
ixpk= 3601, nxpk= 0, iat= -1, 239, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1= 233, 234, 235,
&end
#
# 18 LEU QD2 59 THR HN 4.95 (#peak 4545)
&rst
ixpk= 4545, nxpk= 0, iat= -1, 853, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1= 233, 234, 235,
&end
#
# 18 LEU QD2 62 LEU QQD 3.28 (#peak 4446)
&rst
ixpk= 4446, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 233, 234, 235,
igr2= 909, 910, 911, 905, 906, 907,
&end
#
# 19 ASP HN 19 ASP HB2 3.93 (#peak 364)
&rst
ixpk= 364, nxpk= 0, iat= 239, 243, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 19 ASP HN 19 ASP HB3 3.98 (#peak 360)
&rst
ixpk= 360, nxpk= 0, iat= 239, 244, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 19 ASP HB2 22 ASP HN 4.87 (#peak 4318)
&rst
ixpk= 4318, nxpk= 0, iat= 243, 290, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 19 ASP HB2 61 LYS QB 6.15 (#peak 4731)
&rst
ixpk= 4731, nxpk= 0, iat= 243, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2= 878, 879,
&end
#
# 19 ASP HB3 21 LYS HN 5.50 (#peak 4321)
&rst
ixpk= 4321, nxpk= 0, iat= 244, 268, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 19 ASP HB3 22 ASP HN 4.84 (#peak 4320)
&rst
ixpk= 4320, nxpk= 0, iat= 244, 290, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 20 HIS HA 22 ASP HN 5.10 (#peak 4808)
&rst
ixpk= 4808, nxpk= 0, iat= 253, 290, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 20 HIS HA 26 GLN HE21 5.34 (#peak 4519)
&rst
ixpk= 4519, nxpk= 0, iat= 253, 362, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, &end
#
# 20 HIS HA 26 GLN HE22 4.52 (#peak 4521)
&rst
ixpk= 4521, nxpk= 0, iat= 253, 363, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 20 HIS QB 22 ASP HN 5.38 (#peak 4319)
&rst
ixpk= 4319, nxpk= 0, iat= -1, 290, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1= 255, 256,
&end
#
# 20 HIS QB 26 GLN HE21 5.58 (#peak 4518)
&rst
ixpk= 4518, nxpk= 0, iat= -1, 362, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1= 255, 256,
&end
#
# 20 HIS QB 26 GLN HE22 4.91 (#peak 4520)
&rst
ixpk= 4520, nxpk= 0, iat= -1, 363, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1= 255, 256,
&end
#
# 21 LYS HN 21 LYS HG2 3.71 (#peak 2063)
&rst
ixpk= 2063, nxpk= 0, iat= 268, 275, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 21 LYS HN 21 LYS HG3 4.43 (#peak 2059)
&rst
ixpk= 2059, nxpk= 0, iat= 268, 276, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 21 LYS HN 21 LYS QE 5.42 (#peak 2061)
&rst
ixpk= 2061, nxpk= 0, iat= 268, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2= 281, 282,
&end
#
# 21 LYS HN 22 ASP HN 4.43 (#peak 155)
&rst
ixpk= 155, nxpk= 0, iat= 268, 290, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 21 LYS HA 26 GLN HE21 6.09 (#peak 4537)
&rst
ixpk= 4537, nxpk= 0, iat= 270, 362, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59, &end
#
# 21 LYS HA 26 GLN HE22 4.97 (#peak 4536)
&rst
ixpk= 4536, nxpk= 0, iat= 270, 363, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 21 LYS HG2 22 ASP HN 4.66 (#peak 3588)
&rst
ixpk= 3588, nxpk= 0, iat= 275, 290, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 21 LYS HG3 22 ASP HN 5.45 (#peak 3589)
&rst
ixpk= 3589, nxpk= 0, iat= 276, 290, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 21 LYS QB 22 ASP HN 4.33 (#peak 3586)
&rst
ixpk= 3586, nxpk= 0, iat= -1, 290, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 272, 273,
&end
#
# 21 LYS QD 22 ASP HN 4.67 (#peak 3587)
&rst
ixpk= 3587, nxpk= 0, iat= -1, 290, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 278, 279,
&end
#
# 22 ASP HN 22 ASP HB2 4.17 (#peak 156)
&rst
ixpk= 156, nxpk= 0, iat= 290, 294, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 22 ASP HN 22 ASP HB3 4.13 (#peak 151)
&rst
ixpk= 151, nxpk= 0, iat= 290, 295, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 22 ASP HN 23 LYS HN 4.96 (#peak 728)
&rst
ixpk= 728, nxpk= 0, iat= 290, 302, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 22 ASP HN 24 GLY HN 6.15 (#peak 4347)
&rst
ixpk= 4347, nxpk= 0, iat= 290, 324, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 22 ASP HN 26 GLN HE21 5.03 (#peak 4353)
&rst
ixpk= 4353, nxpk= 0, iat= 290, 362, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 22 ASP HN 26 GLN HE22 5.92 (#peak 4348)
&rst
ixpk= 4348, nxpk= 0, iat= 290, 363, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 22 ASP HA 23 LYS QD 5.55 (#peak 1867)
&rst
ixpk= 1867, nxpk= 0, iat= 292, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2= 312, 313,
&end
#
# 22 ASP HA 24 GLY HN 5.88 (#peak 4535)
&rst
ixpk= 4535, nxpk= 0, iat= 292, 324, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 22 ASP HB2 23 LYS HN 4.33 (#peak 734)
&rst
ixpk= 734, nxpk= 0, iat= 294, 302, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 22 ASP HB3 23 LYS HN 4.21 (#peak 729)
&rst
ixpk= 729, nxpk= 0, iat= 295, 302, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 22 ASP HB3 23 LYS QD 6.15 (#peak 1392)
&rst
ixpk= 1392, nxpk= 0, iat= 295, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2= 312, 313,
&end
#
# 23 LYS HN 23 LYS HG2 3.16 (#peak 731)
&rst
ixpk= 731, nxpk= 0, iat= 302, 309, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, &end
#
# 23 LYS HN 24 GLY HN 4.57 (#peak 2010)
&rst
ixpk= 2010, nxpk= 0, iat= 302, 324, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 23 LYS HN 26 GLN HG2 6.15 (#peak 4742)
&rst
ixpk= 4742, nxpk= 0, iat= 302, 357, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 23 LYS HN 26 GLN HG3 6.15 (#peak 4743)
&rst
ixpk= 4743, nxpk= 0, iat= 302, 358, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 23 LYS HG2 24 GLY HN 4.91 (#peak 2013)
&rst
ixpk= 2013, nxpk= 0, iat= 309, 324, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 23 LYS HG3 24 GLY HN 6.15 (#peak 3884)
&rst
ixpk= 3884, nxpk= 0, iat= 310, 324, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 23 LYS QB 24 GLY HN 4.73 (#peak 3886)
&rst
ixpk= 3886, nxpk= 0, iat= -1, 324, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 306, 307,
&end
#
# 23 LYS QD 24 GLY HN 4.42 (#peak 3885)
&rst
ixpk= 3885, nxpk= 0, iat= -1, 324, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1= 312, 313,
&end
#
# 24 GLY HN 25 LEU HA 5.47 (#peak 4512)
&rst
ixpk= 4512, nxpk= 0, iat= 324, 333, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 24 GLY HN 26 GLN HN 6.15 (#peak 3871)
&rst
ixpk= 3871, nxpk= 0, iat= 324, 350, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 24 GLY HN 26 GLN HG2 5.18 (#peak 4513)
&rst
ixpk= 4513, nxpk= 0, iat= 324, 357, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 24 GLY HN 26 GLN HG3 5.20 (#peak 4514)
&rst
ixpk= 4514, nxpk= 0, iat= 324, 358, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 24 GLY HA2 25 LEU HB2 6.15 (#peak 4611)
&rst
ixpk= 4611, nxpk= 0, iat= 326, 335, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 24 GLY HA2 25 LEU HB3 6.15 (#peak 4612)
&rst
ixpk= 4612, nxpk= 0, iat= 326, 336, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 24 GLY HA3 26 GLN HN 6.15 (#peak 3874)
&rst
ixpk= 3874, nxpk= 0, iat= 327, 350, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 25 LEU HN 25 LEU HB3 4.14 (#peak 1001)
&rst
ixpk= 1001, nxpk= 0, iat= 331, 336, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 25 LEU HN 25 LEU QD1 4.51 (#peak 998)
&rst
ixpk= 998, nxpk= 0, iat= 331, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2= 340, 341, 342,
&end
#
# 25 LEU HA 130 GLY HA2 6.15 (#peak 4667)
&rst
ixpk= 4667, nxpk= 0, iat= 333,1991, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 25 LEU HA 25 LEU QD1 6.15 (#peak 1961)
&rst
ixpk= 1961, nxpk= 0, iat= 333, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2= 340, 341, 342,
&end
#
# 25 LEU HA 25 LEU QD2 5.94 (#peak 590)
&rst
ixpk= 590, nxpk= 0, iat= 333, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr2= 344, 345, 346,
&end
#
# 25 LEU HA 26 GLN HA 4.59 (#peak 4432)
&rst
ixpk= 4432, nxpk= 0, iat= 333, 352, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 25 LEU HB2 26 GLN HN 4.73 (#peak 783)
&rst
ixpk= 783, nxpk= 0, iat= 335, 350, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 25 LEU HB2 27 SER HN 6.15 (#peak 3590)
&rst
ixpk= 3590, nxpk= 0, iat= 335, 367, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 25 LEU HB3 25 LEU QD2 3.27 (#peak 592)
&rst
ixpk= 592, nxpk= 0, iat= 336, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 344, 345, 346,
&end
#
# 25 LEU HB3 27 SER HN 5.24 (#peak 3579)
&rst
ixpk= 3579, nxpk= 0, iat= 336, 367, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 25 LEU HB3 99 ALA HN 6.15 (#peak 4670)
&rst
ixpk= 4670, nxpk= 0, iat= 336,1505, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 25 LEU HG 27 SER HN 4.08 (#peak 4734)
&rst
ixpk= 4734, nxpk= 0, iat= 338, 367, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 25 LEU QD1 130 GLY HN 5.96 (#peak 4398)
&rst
ixpk= 4398, nxpk= 0, iat= -1,1989, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr1= 340, 341, 342,
&end
#
# 25 LEU QD1 130 GLY HA2 6.15 (#peak 4665)
&rst
ixpk= 4665, nxpk= 0, iat= -1,1991, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 340, 341, 342,
&end
#
# 25 LEU QD1 130 GLY HA3 6.15 (#peak 4664)
&rst
ixpk= 4664, nxpk= 0, iat= -1,1992, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 340, 341, 342,
&end
#
# 25 LEU QD1 27 SER HN 4.87 (#peak 3581)
&rst
ixpk= 3581, nxpk= 0, iat= -1, 367, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1= 340, 341, 342,
&end
#
# 25 LEU QD1 99 ALA HN 4.22 (#peak 4669)
&rst
ixpk= 4669, nxpk= 0, iat= -1,1505, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 340, 341, 342,
&end
#
# 25 LEU QD2 130 GLY HA3 6.15 (#peak 4668)
&rst
ixpk= 4668, nxpk= 0, iat= -1,1992, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 344, 345, 346,
&end
#
# 25 LEU QD2 26 GLN HN 4.41 (#peak 782)
&rst
ixpk= 782, nxpk= 0, iat= -1, 350, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 344, 345, 346,
&end
#
# 25 LEU QD2 27 SER HN 4.03 (#peak 3580)
&rst
ixpk= 3580, nxpk= 0, iat= -1, 367, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 344, 345, 346,
&end
#
# 25 LEU QD2 99 ALA HN 5.26 (#peak 4668)
&rst
ixpk= 4668, nxpk= 0, iat= -1,1505, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1= 344, 345, 346,
&end
#
# 26 GLN HN 26 GLN HG2 4.83 (#peak 781)
&rst
ixpk= 781, nxpk= 0, iat= 350, 357, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 26 GLN HN 27 SER HN 4.51 (#peak 83)
&rst
ixpk= 83, nxpk= 0, iat= 350, 367, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 26 GLN HN 27 SER HB2 6.01 (#peak 4089)
&rst
ixpk= 4089, nxpk= 0, iat= 350, 371, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 26 GLN HA 26 GLN HE22 6.15 (#peak 4538)
&rst
ixpk= 4538, nxpk= 0, iat= 352, 363, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 26 GLN HA 60 GLY HN 4.56 (#peak 4532)
&rst
ixpk= 4532, nxpk= 0, iat= 352, 867, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 26 GLN HB2 27 SER HN 4.63 (#peak 3495)
&rst
ixpk= 3495, nxpk= 0, iat= 354, 367, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 26 GLN HB2 60 GLY HN 5.33 (#peak 4528)
&rst
ixpk= 4528, nxpk= 0, iat= 354, 867, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 26 GLN HB3 27 SER HN 4.58 (#peak 3494)
&rst
ixpk= 3494, nxpk= 0, iat= 355, 367, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 26 GLN HB3 60 GLY HN 6.15 (#peak 4529)
&rst
ixpk= 4529, nxpk= 0, iat= 355, 867, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 26 GLN HB3 61 LYS HN 5.95 (#peak 4530)
&rst
ixpk= 4530, nxpk= 0, iat= 355, 874, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 26 GLN HE21 60 GLY HA2 5.11 (#peak 4750)
&rst
ixpk= 4750, nxpk= 0, iat= 362, 869, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 26 GLN HE22 60 GLY HA3 6.12 (#peak 4526)
&rst
ixpk= 4526, nxpk= 0, iat= 363, 870, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62, &end
#
# 26 GLN HG2 27 SER HN 5.58 (#peak 81)
&rst
ixpk= 81, nxpk= 0, iat= 357, 367, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 26 GLN HG2 60 GLY HN 6.15 (#peak 4527)
&rst
ixpk= 4527, nxpk= 0, iat= 357, 867, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 26 GLN HG3 26 GLN HE21 4.09 (#peak 2717)
&rst
ixpk= 2717, nxpk= 0, iat= 358, 362, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 27 SER HN 129 ALA QB 6.04 (#peak 4509)
&rst
ixpk= 4509, nxpk= 0, iat= 367, -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr2=1983,1984,1985,
&end
#
# 27 SER HN 28 LEU HN 4.66 (#peak 2075)
&rst
ixpk= 2075, nxpk= 0, iat= 367, 378, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 27 SER HA 28 LEU HA 5.20 (#peak 12495)
&rst
ixpk= 12495, nxpk= 0, iat= 369, 380, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 27 SER HA 28 LEU QD1 6.15 (#peak 1564)
&rst
ixpk= 1564, nxpk= 0, iat= 369, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2= 387, 388, 389,
&end
#
# 27 SER HA 59 THR HN 4.58 (#peak 3598)
&rst
ixpk= 3598, nxpk= 0, iat= 369, 853, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 27 SER HB2 28 LEU HN 3.73 (#peak 2086)
&rst
ixpk= 2086, nxpk= 0, iat= 371, 378, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 27 SER HB2 59 THR HN 4.07 (#peak 3807)
&rst
ixpk= 3807, nxpk= 0, iat= 371, 853, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 27 SER HB3 28 LEU HN 4.66 (#peak 2081)
&rst
ixpk= 2081, nxpk= 0, iat= 372, 378, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 27 SER HB3 59 THR HN 5.45 (#peak 3808)
&rst
ixpk= 3808, nxpk= 0, iat= 372, 853, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 28 LEU HN 28 LEU HG 5.32 (#peak 2085)
&rst
ixpk= 2085, nxpk= 0, iat= 378, 385, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 28 LEU HN 28 LEU QD1 4.50 (#peak 2082)
&rst
ixpk= 2082, nxpk= 0, iat= 378, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 387, 388, 389,
&end
#
# 28 LEU HN 29 THR HN 4.56 (#peak 2359)
&rst
ixpk= 2359, nxpk= 0, iat= 378, 397, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 28 LEU HN 56 SER HA 5.92 (#peak 4688)
&rst
ixpk= 4688, nxpk= 0, iat= 378, 811, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 28 LEU HN 57 LEU HN 4.63 (#peak 4094)
&rst
ixpk= 4094, nxpk= 0, iat= 378, 820, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 28 LEU HN 57 LEU O 2.40
&rst
ixpk= 4094, nxpk= 0, iat= 378, 837, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 28 LEU HN 58 ASN HA 5.81 (#peak 4689)
&rst
ixpk= 4689, nxpk= 0, iat= 378, 841, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 28 LEU HN 59 THR HN 6.01 (#peak 3599)
&rst
ixpk= 3599, nxpk= 0, iat= 378, 853, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 28 LEU HN 59 THR QG2 4.85 (#peak 3978)
&rst
ixpk= 3978, nxpk= 0, iat= 378, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2= 859, 860, 861,
&end
#
# 28 LEU HA 28 LEU QD1 6.15 (#peak 3490)
&rst
ixpk= 3490, nxpk= 0, iat= 380, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2= 387, 388, 389,
&end
#
# 28 LEU HA 29 THR HN 3.19 (#peak 2360)
&rst
ixpk= 2360, nxpk= 0, iat= 380, 397, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69, &end
#
# 28 LEU HG 29 THR HN 5.10 (#peak 2361)
&rst
ixpk= 2361, nxpk= 0, iat= 385, 397, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 28 LEU N 57 LEU O 3.30
&rst
ixpk= 2361, nxpk= 0, iat= 377, 837, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 28 LEU QD1 100 LEU HN 4.97 (#peak 3931)
&rst
ixpk= 3931, nxpk= 0, iat= -1,1515, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 387, 388, 389,
&end
#
# 28 LEU QD1 101 THR HB 4.93 (#peak 4394)
&rst
ixpk= 4394, nxpk= 0, iat= -1,1538, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 387, 388, 389,
&end
#
# 28 LEU QD1 127 ASP HB2 5.13 (#peak 4310)
&rst
ixpk= 4310, nxpk= 0, iat= -1,1952, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr1= 387, 388, 389,
&end
#
# 28 LEU QD1 127 ASP HB3 5.57 (#peak 4311)
&rst
ixpk= 4311, nxpk= 0, iat= -1,1953, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1= 387, 388, 389,
&end
#
# 28 LEU QD1 129 ALA HN 4.84 (#peak 4400)
&rst
ixpk= 4400, nxpk= 0, iat= -1,1979, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 387, 388, 389,
&end
#
# 28 LEU QD1 29 THR HN 4.37 (#peak 4171)
&rst
ixpk= 4171, nxpk= 0, iat= -1, 397, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 387, 388, 389,
&end
#
# 28 LEU QD1 90 PHE HZ 4.69 (#peak 12541)
&rst
ixpk= 12541, nxpk= 0, iat= -1,1365, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 387, 388, 389,
&end
#
# 28 LEU QD1 90 PHE QE 4.41 (#peak 13004)
&rst
ixpk= 13004, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1= 387, 388, 389,
igr2=1363,1367,
&end
#
# 28 LEU QD2 100 LEU HN 5.35 (#peak 3427)
&rst
ixpk= 3427, nxpk= 0, iat= -1,1515, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr1= 391, 392, 393,
&end
#
# 28 LEU QD2 101 THR HN 4.77 (#peak 4548)
&rst
ixpk= 4548, nxpk= 0, iat= -1,1534, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 391, 392, 393,
&end
#
# 28 LEU QD2 129 ALA HN 4.64 (#peak 4401)
&rst
ixpk= 4401, nxpk= 0, iat= -1,1979, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 391, 392, 393,
&end
#
# 28 LEU QD2 130 GLY HN 6.00 (#peak 4403)
&rst
ixpk= 4403, nxpk= 0, iat= -1,1989, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 391, 392, 393,
&end
#
# 28 LEU QD2 29 THR HN 4.49 (#peak 4170)
&rst
ixpk= 4170, nxpk= 0, iat= -1, 397, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 391, 392, 393,
&end
#
# 29 THR HN 129 ALA QB 5.07 (#peak 4404)
&rst
ixpk= 4404, nxpk= 0, iat= 397, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr2=1983,1984,1985,
&end
#
# 29 THR HN 29 THR HB 3.33 (#peak 2358)
&rst
ixpk= 2358, nxpk= 0, iat= 397, 401, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 29 THR HN 29 THR QG2 4.51 (#peak 2357)
&rst
ixpk= 2357, nxpk= 0, iat= 397, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2= 403, 404, 405,
&end
#
# 29 THR HN 30 LEU HN 4.60 (#peak 3202)
&rst
ixpk= 3202, nxpk= 0, iat= 397, 411, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 29 THR HN 31 ASP HN 6.15 (#peak 4477)
&rst
ixpk= 4477, nxpk= 0, iat= 397, 430, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 29 THR HA 56 SER HA 6.15 (#peak 4570)
&rst
ixpk= 4570, nxpk= 0, iat= 399, 811, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 29 THR HA 57 LEU HN 6.15 (#peak 4569)
&rst
ixpk= 4569, nxpk= 0, iat= 399, 820, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 29 THR HB 30 LEU HN 4.61 (#peak 1581)
&rst
ixpk= 1581, nxpk= 0, iat= 401, 411, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 29 THR QG2 30 LEU HN 4.17 (#peak 1579)
&rst
ixpk= 1579, nxpk= 0, iat= -1, 411, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1= 403, 404, 405,
&end
#
# 30 LEU HN 30 LEU HG 6.15 (#peak 2485)
&rst
ixpk= 2485, nxpk= 0, iat= 411, 418, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 30 LEU HN 30 LEU QD1 4.35 (#peak 1586)
&rst
ixpk= 1586, nxpk= 0, iat= 411, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 420, 421, 422,
&end
#
# 30 LEU HN 30 LEU QD2 5.84 (#peak 1583)
&rst
ixpk= 1583, nxpk= 0, iat= 411, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr2= 424, 425, 426,
&end
#
# 30 LEU HN 31 ASP HN 4.56 (#peak 1582)
&rst
ixpk= 1582, nxpk= 0, iat= 411, 430, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 30 LEU HN 55 ASP HN 5.26 (#peak 4097)
&rst
ixpk= 4097, nxpk= 0, iat= 411, 797, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 30 LEU HN 55 ASP O 2.40
&rst
ixpk= 4097, nxpk= 0, iat= 411, 807, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 30 LEU HN 56 SER HN 6.15 (#peak 3809)
&rst
ixpk= 3809, nxpk= 0, iat= 411, 809, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 30 LEU HN 56 SER HA 5.73 (#peak 3595)
&rst
ixpk= 3595, nxpk= 0, iat= 411, 811, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 30 LEU HN 57 LEU HN 5.99 (#peak 3591)
&rst
ixpk= 3591, nxpk= 0, iat= 411, 820, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49, &end
#
# 30 LEU HB2 31 ASP HN 4.62 (#peak 1530)
&rst
ixpk= 1530, nxpk= 0, iat= 415, 430, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 30 LEU HB2 34 VAL HN 5.57 (#peak 3988)
&rst
ixpk= 3988, nxpk= 0, iat= 415, 470, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 30 LEU HG 34 VAL HN 4.74 (#peak 3986)
&rst
ixpk= 3986, nxpk= 0, iat= 418, 470, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 30 LEU N 55 ASP O 3.30
&rst
ixpk= 3986, nxpk= 0, iat= 410, 807, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 30 LEU QD1 101 THR QG2 6.15 (#peak 4769)
&rst
ixpk= 4769, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1= 420, 421, 422,
igr2=1540,1541,1542,
&end
#
# 30 LEU QD1 103 PHE HZ 5.51 (#peak 12966)
&rst
ixpk= 12966, nxpk= 0, iat= -1,1570, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 420, 421, 422,
&end
#
# 30 LEU QD1 103 PHE QE 4.93 (#peak 12975)
&rst
ixpk= 12975, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr1= 420, 421, 422,
igr2=1568,1572,
&end
#
# 30 LEU QD1 31 ASP HN 4.91 (#peak 1531)
&rst
ixpk= 1531, nxpk= 0, iat= -1, 430, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 420, 421, 422,
&end
#
# 30 LEU QD1 33 SER HN 6.09 (#peak 3956)
&rst
ixpk= 3956, nxpk= 0, iat= -1, 459, r1= 1.30, r2= 1.80, r3= 7.31, r4= 7.81,
igr1= 420, 421, 422,
&end
#
# 30 LEU QD1 33 SER HB2 4.47 (#peak 4378)
&rst
ixpk= 4378, nxpk= 0, iat= -1, 463, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 420, 421, 422,
&end
#
# 30 LEU QD1 33 SER HB3 3.80 (#peak 4377)
&rst
ixpk= 4377, nxpk= 0, iat= -1, 464, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1= 420, 421, 422,
&end
#
# 30 LEU QD1 51 TYR QE 4.14 (#peak 4276)
&rst
ixpk= 4276, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 420, 421, 422,
igr2= 758, 763,
&end
#
# 30 LEU QD1 56 SER HN 6.15 (#peak 3958)
&rst
ixpk= 3958, nxpk= 0, iat= -1, 809, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 420, 421, 422,
&end
#
# 30 LEU QD1 56 SER HA 4.63 (#peak 12629)
&rst
ixpk= 12629, nxpk= 0, iat= -1, 811, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1= 420, 421, 422,
&end
#
# 30 LEU QD1 90 PHE HZ 3.23 (#peak 13161)
&rst
ixpk= 13161, nxpk= 0, iat= -1,1365, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr1= 420, 421, 422,
&end
#
# 30 LEU QD2 103 PHE HZ 4.58 (#peak 12689)
&rst
ixpk= 12689, nxpk= 0, iat= -1,1570, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 424, 425, 426,
&end
#
# 30 LEU QD2 33 SER HN 6.15 (#peak 3960)
&rst
ixpk= 3960, nxpk= 0, iat= -1, 459, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 424, 425, 426,
&end
#
# 30 LEU QD2 34 VAL HN 4.84 (#peak 3989)
&rst
ixpk= 3989, nxpk= 0, iat= -1, 470, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 424, 425, 426,
&end
#
# 30 LEU QD2 51 TYR QD 3.59 (#peak 4278)
&rst
ixpk= 4278, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 424, 425, 426,
igr2= 756, 765,
&end
#
# 30 LEU QD2 51 TYR QE 4.15 (#peak 4277)
&rst
ixpk= 4277, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1= 424, 425, 426,
igr2= 758, 763,
&end
#
# 30 LEU QD2 55 ASP HN 5.82 (#peak 4265)
&rst
ixpk= 4265, nxpk= 0, iat= -1, 797, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr1= 424, 425, 426,
&end
#
# 30 LEU QD2 56 SER HN 5.61 (#peak 3959)
&rst
ixpk= 3959, nxpk= 0, iat= -1, 809, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 424, 425, 426,
&end
#
# 30 LEU QD2 90 PHE HZ 3.20 (#peak 13160)
&rst
ixpk= 13160, nxpk= 0, iat= -1,1365, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1= 424, 425, 426,
&end
#
# 30 LEU QD2 90 PHE QD 4.70 (#peak 12061)
&rst
ixpk= 12061, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 424, 425, 426,
igr2=1361,1369,
&end
#
# 30 LEU QD2 90 PHE QE 3.90 (#peak 12052)
&rst
ixpk= 12052, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 424, 425, 426,
igr2=1363,1367,
&end
#
# 31 ASP HN 31 ASP HB3 4.13 (#peak 1525)
&rst
ixpk= 1525, nxpk= 0, iat= 430, 435, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 31 ASP HN 32 GLN HN 4.60 (#peak 1526)
&rst
ixpk= 1526, nxpk= 0, iat= 430, 442, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 31 ASP HB2 32 GLN HN 4.48 (#peak 1046)
&rst
ixpk= 1046, nxpk= 0, iat= 434, 442, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 31 ASP HB3 32 GLN HN 4.83 (#peak 1041)
&rst
ixpk= 1041, nxpk= 0, iat= 435, 442, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 32 GLN HN 32 GLN HE21 5.42 (#peak 1040)
&rst
ixpk= 1040, nxpk= 0, iat= 442, 454, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 32 GLN HN 32 GLN HG2 4.91 (#peak 1044)
&rst
ixpk= 1044, nxpk= 0, iat= 442, 449, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 32 GLN HN 32 GLN HG3 4.97 (#peak 1038)
&rst
ixpk= 1038, nxpk= 0, iat= 442, 450, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 32 GLN HN 33 SER HN 4.60 (#peak 621)
&rst
ixpk= 621, nxpk= 0, iat= 442, 459, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 32 GLN HA 32 GLN HE21 5.82 (#peak 771)
&rst
ixpk= 771, nxpk= 0, iat= 444, 454, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 32 GLN HB2 32 GLN HE21 4.32 (#peak 777)
&rst
ixpk= 777, nxpk= 0, iat= 446, 454, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 32 GLN HB2 32 GLN HE22 5.57 (#peak 1116)
&rst
ixpk= 1116, nxpk= 0, iat= 446, 455, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 32 GLN HB2 33 SER HN 4.64 (#peak 623)
&rst
ixpk= 623, nxpk= 0, iat= 446, 459, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 32 GLN HB3 32 GLN HE21 4.16 (#peak 778)
&rst
ixpk= 778, nxpk= 0, iat= 447, 454, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 32 GLN HB3 33 SER HN 4.61 (#peak 626)
&rst
ixpk= 626, nxpk= 0, iat= 447, 459, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 32 GLN HE21 33 SER HN 4.48 (#peak 773)
&rst
ixpk= 773, nxpk= 0, iat= 454, 459, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 32 GLN HG2 32 GLN HE21 3.70 (#peak 776)
&rst
ixpk= 776, nxpk= 0, iat= 449, 454, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 32 GLN HG2 33 SER HN 5.66 (#peak 622)
&rst
ixpk= 622, nxpk= 0, iat= 449, 459, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16, &end
#
# 32 GLN HG3 32 GLN HE21 3.79 (#peak 772)
&rst
ixpk= 772, nxpk= 0, iat= 450, 454, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 32 GLN HG3 33 SER HN 6.06 (#peak 619)
&rst
ixpk= 619, nxpk= 0, iat= 450, 459, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56, &end
#
# 33 SER HN 34 VAL HN 4.03 (#peak 2726)
&rst
ixpk= 2726, nxpk= 0, iat= 459, 470, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 33 SER HA 103 PHE HZ 3.78 (#peak 12450)
&rst
ixpk= 12450, nxpk= 0, iat= 461,1570, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 33 SER HA 103 PHE QD 4.47 (#peak 12319)
&rst
ixpk= 12319, nxpk= 0, iat= 461, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2=1566,1574,
&end
#
# 33 SER HA 103 PHE QE 3.81 (#peak 12454)
&rst
ixpk= 12454, nxpk= 0, iat= 461, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1568,1572,
&end
#
# 33 SER HA 40 LEU QD1 6.15 (#peak 13180)
&rst
ixpk= 13180, nxpk= 0, iat= 461, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2= 592, 593, 594,
&end
#
# 33 SER HA 90 PHE HZ 6.15 (#peak 12998)
&rst
ixpk= 12998, nxpk= 0, iat= 461,1365, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 33 SER HA 90 PHE QE 4.84 (#peak 12401)
&rst
ixpk= 12401, nxpk= 0, iat= 461, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2=1363,1367,
&end
#
# 33 SER HB2 103 PHE QD 5.64 (#peak 12832)
&rst
ixpk= 12832, nxpk= 0, iat= 463, -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr2=1566,1574,
&end
#
# 33 SER HB2 103 PHE QE 4.55 (#peak 12453)
&rst
ixpk= 12453, nxpk= 0, iat= 463, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2=1568,1572,
&end
#
# 33 SER HB2 34 VAL HN 4.36 (#peak 2730)
&rst
ixpk= 2730, nxpk= 0, iat= 463, 470, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 33 SER HB2 90 PHE HZ 5.85 (#peak 12999)
&rst
ixpk= 12999, nxpk= 0, iat= 463,1365, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 33 SER HB3 103 PHE HZ 5.07 (#peak 12448)
&rst
ixpk= 12448, nxpk= 0, iat= 464,1570, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 33 SER HB3 103 PHE QD 6.15 (#peak 12831)
&rst
ixpk= 12831, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=1566,1574,
&end
#
# 33 SER HB3 103 PHE QE 4.39 (#peak 12452)
&rst
ixpk= 12452, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr2=1568,1572,
&end
#
# 33 SER HB3 34 VAL HN 4.69 (#peak 2724)
&rst
ixpk= 2724, nxpk= 0, iat= 464, 470, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 33 SER HB3 90 PHE HZ 5.57 (#peak 13000)
&rst
ixpk= 13000, nxpk= 0, iat= 464,1365, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 33 SER HB3 90 PHE QE 4.56 (#peak 12457)
&rst
ixpk= 12457, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=1363,1367,
&end
#
# 34 VAL HN 103 PHE HZ 5.60 (#peak 3984)
&rst
ixpk= 3984, nxpk= 0, iat= 470,1570, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 34 VAL HN 34 VAL QG1 4.27 (#peak 2729)
&rst
ixpk= 2729, nxpk= 0, iat= 470, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2= 476, 477, 478,
&end
#
# 34 VAL HN 34 VAL QG2 4.37 (#peak 2733)
&rst
ixpk= 2733, nxpk= 0, iat= 470, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr2= 480, 481, 482,
&end
#
# 34 VAL HN 35 ARG HN 4.74 (#peak 2725)
&rst
ixpk= 2725, nxpk= 0, iat= 470, 486, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 34 VAL QG1 35 ARG HN 4.91 (#peak 490)
&rst
ixpk= 490, nxpk= 0, iat= -1, 486, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 476, 477, 478,
&end
#
# 34 VAL QG1 37 ASN HN 5.45 (#peak 4690)
&rst
ixpk= 4690, nxpk= 0, iat= -1, 532, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr1= 476, 477, 478,
&end
#
# 34 VAL QG1 38 GLU HN 4.93 (#peak 4036)
&rst
ixpk= 4036, nxpk= 0, iat= -1, 546, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 476, 477, 478,
&end
#
# 34 VAL QG1 52 GLY HN 6.15 (#peak 4251)
&rst
ixpk= 4251, nxpk= 0, iat= -1, 769, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 476, 477, 478,
&end
#
# 34 VAL QG1 53 ASN HN 5.26 (#peak 4250)
&rst
ixpk= 4250, nxpk= 0, iat= -1, 776, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1= 476, 477, 478,
&end
#
# 34 VAL QG2 35 ARG HN 4.42 (#peak 494)
&rst
ixpk= 494, nxpk= 0, iat= -1, 486, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 480, 481, 482,
&end
#
# 34 VAL QG2 35 ARG HB2 6.15 (#peak 3906)
&rst
ixpk= 3906, nxpk= 0, iat= -1, 490, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 480, 481, 482,
&end
#
# 34 VAL QG2 38 GLU HN 4.61 (#peak 4037)
&rst
ixpk= 4037, nxpk= 0, iat= -1, 546, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 480, 481, 482,
&end
#
# 34 VAL QG2 52 GLY HN 6.15 (#peak 4252)
&rst
ixpk= 4252, nxpk= 0, iat= -1, 769, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 480, 481, 482,
&end
#
# 34 VAL QG2 53 ASN HN 4.72 (#peak 4249)
&rst
ixpk= 4249, nxpk= 0, iat= -1, 776, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1= 480, 481, 482,
&end
#
# 35 ARG HN 35 ARG HB3 3.81 (#peak 493)
&rst
ixpk= 493, nxpk= 0, iat= 486, 491, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 35 ARG HN 35 ARG HG2 4.32 (#peak 495)
&rst
ixpk= 495, nxpk= 0, iat= 486, 493, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 35 ARG HN 35 ARG HG3 3.80 (#peak 491)
&rst
ixpk= 491, nxpk= 0, iat= 486, 494, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 35 ARG HN 35 ARG QD 4.43 (#peak 488)
&rst
ixpk= 488, nxpk= 0, iat= 486, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2= 496, 497,
&end
#
# 35 ARG HN 36 LYS HN 4.61 (#peak 2119)
&rst
ixpk= 2119, nxpk= 0, iat= 486, 510, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 35 ARG HA 38 GLU HN 5.83 (#peak 4425)
&rst
ixpk= 4425, nxpk= 0, iat= 488, 546, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 35 ARG HB2 36 LYS HN 4.63 (#peak 2120)
&rst
ixpk= 2120, nxpk= 0, iat= 490, 510, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 35 ARG HB3 36 LYS HN 4.05 (#peak 2126)
&rst
ixpk= 2126, nxpk= 0, iat= 491, 510, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 35 ARG HB3 37 ASN HN 6.09 (#peak 4802)
&rst
ixpk= 4802, nxpk= 0, iat= 491, 532, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59, &end
#
# 35 ARG HB3 37 ASN HD21 5.91 (#peak 4798)
&rst
ixpk= 4798, nxpk= 0, iat= 491, 541, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 35 ARG HG2 36 LYS HN 4.59 (#peak 4801)
&rst
ixpk= 4801, nxpk= 0, iat= 493, 510, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 35 ARG HG2 37 ASN HN 5.36 (#peak 4796)
&rst
ixpk= 4796, nxpk= 0, iat= 493, 532, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 35 ARG HG2 37 ASN HD21 5.71 (#peak 4800)
&rst
ixpk= 4800, nxpk= 0, iat= 493, 541, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 35 ARG HG2 38 GLU HN 5.08 (#peak 4039)
&rst
ixpk= 4039, nxpk= 0, iat= 493, 546, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 35 ARG HG3 36 LYS HN 4.64 (#peak 2124)
&rst
ixpk= 2124, nxpk= 0, iat= 494, 510, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 35 ARG HG3 37 ASN HN 5.36 (#peak 4795)
&rst
ixpk= 4795, nxpk= 0, iat= 494, 532, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 35 ARG HG3 37 ASN HD21 5.73 (#peak 4799)
&rst
ixpk= 4799, nxpk= 0, iat= 494, 541, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 35 ARG HG3 38 GLU HN 4.49 (#peak 4038)
&rst
ixpk= 4038, nxpk= 0, iat= 494, 546, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 35 ARG QD 36 LYS HN 4.40 (#peak 2122)
&rst
ixpk= 2122, nxpk= 0, iat= -1, 510, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1= 496, 497,
&end
#
# 36 LYS HN 36 LYS HB2 3.36 (#peak 2127)
&rst
ixpk= 2127, nxpk= 0, iat= 510, 514, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, &end
#
# 36 LYS HN 36 LYS HB3 3.98 (#peak 2121)
&rst
ixpk= 2121, nxpk= 0, iat= 510, 515, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 36 LYS HN 36 LYS QE 4.87 (#peak 2125)
&rst
ixpk= 2125, nxpk= 0, iat= 510, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2= 523, 524,
&end
#
# 36 LYS HA 37 ASN HA 6.15 (#peak 3735)
&rst
ixpk= 3735, nxpk= 0, iat= 512, 534, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 36 LYS HA 38 GLU HN 5.30 (#peak 4035)
&rst
ixpk= 4035, nxpk= 0, iat= 512, 546, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 36 LYS HA 53 ASN HB2 6.15 (#peak 4594)
&rst
ixpk= 4594, nxpk= 0, iat= 512, 780, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 36 LYS HA 53 ASN HB3 6.15 (#peak 4595)
&rst
ixpk= 4595, nxpk= 0, iat= 512, 781, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 36 LYS HB2 37 ASN HN 3.74 (#peak 663)
&rst
ixpk= 663, nxpk= 0, iat= 514, 532, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 36 LYS HB2 37 ASN HD21 5.35 (#peak 4797)
&rst
ixpk= 4797, nxpk= 0, iat= 514, 541, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 36 LYS HB2 37 ASN HD22 5.72 (#peak 1652)
&rst
ixpk= 1652, nxpk= 0, iat= 514, 542, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 37 ASN HN 37 ASN HB2 4.14 (#peak 661)
&rst
ixpk= 661, nxpk= 0, iat= 532, 536, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 37 ASN HN 38 GLU HN 4.79 (#peak 291)
&rst
ixpk= 291, nxpk= 0, iat= 532, 546, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 37 ASN HN 38 GLU HB2 5.91 (#peak 662)
&rst
ixpk= 662, nxpk= 0, iat= 532, 550, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 37 ASN HA 37 ASN HD21 4.16 (#peak 1252)
&rst
ixpk= 1252, nxpk= 0, iat= 534, 541, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 37 ASN HA 37 ASN HD22 5.57 (#peak 1649)
&rst
ixpk= 1649, nxpk= 0, iat= 534, 542, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 37 ASN HB2 37 ASN HD22 3.72 (#peak 1650)
&rst
ixpk= 1650, nxpk= 0, iat= 536, 542, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 37 ASN HB2 38 GLU HN 5.27 (#peak 293)
&rst
ixpk= 293, nxpk= 0, iat= 536, 546, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 37 ASN HB2 76 ILE HB 6.15 (#peak 4715)
&rst
ixpk= 4715, nxpk= 0, iat= 536,1152, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 37 ASN HB2 76 ILE HG12 6.15 (#peak 4716)
&rst
ixpk= 4716, nxpk= 0, iat= 536,1158, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 37 ASN HB2 76 ILE QD1 6.15 (#peak 4717)
&rst
ixpk= 4717, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1161,1162,1163,
&end
#
# 37 ASN HB3 37 ASN HD21 4.07 (#peak 1255)
&rst
ixpk= 1255, nxpk= 0, iat= 537, 541, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 37 ASN HB3 38 GLU HN 4.76 (#peak 299)
&rst
ixpk= 299, nxpk= 0, iat= 537, 546, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 37 ASN HB3 76 ILE HG12 6.15 (#peak 4719)
&rst
ixpk= 4719, nxpk= 0, iat= 537,1158, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 37 ASN HB3 76 ILE QD1 6.15 (#peak 4718)
&rst
ixpk= 4718, nxpk= 0, iat= 537, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1161,1162,1163,
&end
#
# 37 ASN HD22 38 GLU HN 6.15 (#peak 295)
&rst
ixpk= 295, nxpk= 0, iat= 542, 546, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 38 GLU HN 38 GLU HB2 3.61 (#peak 297)
&rst
ixpk= 297, nxpk= 0, iat= 546, 550, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 38 GLU HN 39 LYS HN 4.59 (#peak 289)
&rst
ixpk= 289, nxpk= 0, iat= 546, 561, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 38 GLU HN 76 ILE QD1 4.70 (#peak 4702)
&rst
ixpk= 4702, nxpk= 0, iat= 546, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2=1161,1162,1163,
&end
#
# 38 GLU HB2 39 LYS HN 4.90 (#peak 187)
&rst
ixpk= 187, nxpk= 0, iat= 550, 561, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 38 GLU HB2 76 ILE HG12 6.15 (#peak 4721)
&rst
ixpk= 4721, nxpk= 0, iat= 550,1158, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 38 GLU HB3 76 ILE HG12 6.15 (#peak 4722)
&rst
ixpk= 4722, nxpk= 0, iat= 551,1158, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 39 LYS HN 39 LYS HG2 4.62 (#peak 3528)
&rst
ixpk= 3528, nxpk= 0, iat= 561, 568, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 39 LYS HN 39 LYS HG3 4.99 (#peak 3529)
&rst
ixpk= 3529, nxpk= 0, iat= 561, 569, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 39 LYS HN 39 LYS QD 5.07 (#peak 3526)
&rst
ixpk= 3526, nxpk= 0, iat= 561, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2= 571, 572,
&end
#
# 39 LYS HN 75 GLN HN 5.51 (#peak 3547)
&rst
ixpk= 3547, nxpk= 0, iat= 561,1131, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 39 LYS HN 75 GLN QB 4.92 (#peak 3553)
&rst
ixpk= 3553, nxpk= 0, iat= 561, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=1135,1136,
&end
#
# 39 LYS HN 75 GLN QG 5.40 (#peak 3552)
&rst
ixpk= 3552, nxpk= 0, iat= 561, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=1138,1139,
&end
#
# 39 LYS HN 76 ILE HA 6.15 (#peak 3545)
&rst
ixpk= 3545, nxpk= 0, iat= 561,1150, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 39 LYS HN 76 ILE HG13 5.45 (#peak 4706)
&rst
ixpk= 4706, nxpk= 0, iat= 561,1159, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 39 LYS HN 76 ILE QD1 5.11 (#peak 4704)
&rst
ixpk= 4704, nxpk= 0, iat= 561, -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr2=1161,1162,1163,
&end
#
# 39 LYS HN 76 ILE QG2 4.95 (#peak 4705)
&rst
ixpk= 4705, nxpk= 0, iat= 561, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2=1154,1155,1156,
&end
#
# 39 LYS HA 39 LYS QD 5.72 (#peak 831)
&rst
ixpk= 831, nxpk= 0, iat= 563, -1, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr2= 571, 572,
&end
#
# 39 LYS HA 39 LYS QE 5.54 (#peak 596)
&rst
ixpk= 596, nxpk= 0, iat= 563, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr2= 574, 575,
&end
#
# 39 LYS HA 40 LEU HB2 6.15 (#peak 2298)
&rst
ixpk= 2298, nxpk= 0, iat= 563, 587, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 39 LYS HA 53 ASN HN 4.83 (#peak 4246)
&rst
ixpk= 4246, nxpk= 0, iat= 563, 776, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 39 LYS HG2 75 GLN HN 5.48 (#peak 3550)
&rst
ixpk= 3550, nxpk= 0, iat= 568,1131, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 39 LYS HG3 39 LYS QE 3.75 (#peak 597)
&rst
ixpk= 597, nxpk= 0, iat= 569, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr2= 574, 575,
&end
#
# 39 LYS HG3 40 LEU HN 6.15 (#peak 3534)
&rst
ixpk= 3534, nxpk= 0, iat= 569, 583, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 39 LYS QB 39 LYS QE 3.94 (#peak 598)
&rst
ixpk= 598, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1= 565, 566,
igr2= 574, 575,
&end
#
# 39 LYS QB 40 LEU HN 6.13 (#peak 3532)
&rst
ixpk= 3532, nxpk= 0, iat= -1, 583, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr1= 565, 566,
&end
#
# 39 LYS QB 75 GLN HN 5.28 (#peak 3548)
&rst
ixpk= 3548, nxpk= 0, iat= -1,1131, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 565, 566,
&end
#
# 39 LYS QB 75 GLN HE21 4.20 (#peak 4023)
&rst
ixpk= 4023, nxpk= 0, iat= -1,1143, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr1= 565, 566,
&end
#
# 39 LYS QB 75 GLN HE22 5.58 (#peak 4026)
&rst
ixpk= 4026, nxpk= 0, iat= -1,1144, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1= 565, 566,
&end
#
# 39 LYS QD 40 LEU HN 5.05 (#peak 3531)
&rst
ixpk= 3531, nxpk= 0, iat= -1, 583, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1= 571, 572,
&end
#
# 39 LYS QD 75 GLN HN 5.36 (#peak 3549)
&rst
ixpk= 3549, nxpk= 0, iat= -1,1131, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1= 571, 572,
&end
#
# 39 LYS QD 75 GLN HE21 4.03 (#peak 4022)
&rst
ixpk= 4022, nxpk= 0, iat= -1,1143, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr1= 571, 572,
&end
#
# 39 LYS QD 75 GLN HE22 5.18 (#peak 4025)
&rst
ixpk= 4025, nxpk= 0, iat= -1,1144, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 571, 572,
&end
#
# 40 LEU HN 40 LEU HB3 4.05 (#peak 1605)
&rst
ixpk= 1605, nxpk= 0, iat= 583, 588, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 40 LEU HN 40 LEU HG 5.88 (#peak 3530)
&rst
ixpk= 3530, nxpk= 0, iat= 583, 590, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 40 LEU HN 40 LEU QD1 4.54 (#peak 1608)
&rst
ixpk= 1608, nxpk= 0, iat= 583, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2= 592, 593, 594,
&end
#
# 40 LEU HN 41 LYS HN 6.15 (#peak 3498)
&rst
ixpk= 3498, nxpk= 0, iat= 583, 602, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 40 LEU HN 51 TYR HN 6.15 (#peak 3612)
&rst
ixpk= 3612, nxpk= 0, iat= 583, 748, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 40 LEU HN 51 TYR O 2.40
&rst
ixpk= 3612, nxpk= 0, iat= 583, 767, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 40 LEU HA 40 LEU QD1 6.15 (#peak 2693)
&rst
ixpk= 2693, nxpk= 0, iat= 585, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2= 592, 593, 594,
&end
#
# 40 LEU HA 74 ARG HA 3.43 (#peak 12264)
&rst
ixpk= 12264, nxpk= 0, iat= 585,1109, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 40 LEU HB3 74 ARG HA 6.15 (#peak 4522)
&rst
ixpk= 4522, nxpk= 0, iat= 588,1109, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 40 LEU N 51 TYR O 3.30
&rst
ixpk= 4522, nxpk= 0, iat= 582, 767, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 40 LEU O 51 TYR HN 2.40
&rst
ixpk= 4522, nxpk= 0, iat= 600, 748, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 40 LEU O 51 TYR N 3.30
&rst
ixpk= 4522, nxpk= 0, iat= 600, 747, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 40 LEU QD1 103 PHE HZ 4.05 (#peak 12143)
&rst
ixpk= 12143, nxpk= 0, iat= -1,1570, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 592, 593, 594,
&end
#
# 40 LEU QD1 103 PHE QD 6.15 (#peak 12190)
&rst
ixpk= 12190, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1= 592, 593, 594,
igr2=1566,1574,
&end
#
# 40 LEU QD1 103 PHE QE 4.38 (#peak 12193)
&rst
ixpk= 12193, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 592, 593, 594,
igr2=1568,1572,
&end
#
# 40 LEU QD1 41 LYS HN 4.49 (#peak 2363)
&rst
ixpk= 2363, nxpk= 0, iat= -1, 602, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 592, 593, 594,
&end
#
# 40 LEU QD1 51 TYR HN 5.90 (#peak 12057)
&rst
ixpk= 12057, nxpk= 0, iat= -1, 748, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr1= 592, 593, 594,
&end
#
# 40 LEU QD1 51 TYR HB2 6.15 (#peak 4499)
&rst
ixpk= 4499, nxpk= 0, iat= -1, 752, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 592, 593, 594,
&end
#
# 40 LEU QD1 51 TYR HB3 6.15 (#peak 4505)
&rst
ixpk= 4505, nxpk= 0, iat= -1, 753, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 592, 593, 594,
&end
#
# 40 LEU QD1 51 TYR QE 3.10 (#peak 11716)
&rst
ixpk= 11716, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1= 592, 593, 594,
igr2= 758, 763,
&end
#
# 40 LEU QD1 73 ILE HN 5.79 (#peak 3509)
&rst
ixpk= 3509, nxpk= 0, iat= -1,1088, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr1= 592, 593, 594,
&end
#
# 40 LEU QD1 74 ARG HA 6.13 (#peak 12149)
&rst
ixpk= 12149, nxpk= 0, iat= -1,1109, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr1= 592, 593, 594,
&end
#
# 40 LEU QD1 90 PHE QD 5.03 (#peak 12069)
&rst
ixpk= 12069, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr1= 592, 593, 594,
igr2=1361,1369,
&end
#
# 40 LEU QD1 90 PHE QE 5.26 (#peak 12070)
&rst
ixpk= 12070, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr1= 592, 593, 594,
igr2=1363,1367,
&end
#
# 41 LYS HN 41 LYS HB2 4.07 (#peak 2362)
&rst
ixpk= 2362, nxpk= 0, iat= 602, 606, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 41 LYS HN 41 LYS HB3 4.20 (#peak 2368)
&rst
ixpk= 2368, nxpk= 0, iat= 602, 607, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 41 LYS HN 41 LYS QE 5.26 (#peak 2369)
&rst
ixpk= 2369, nxpk= 0, iat= 602, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 615, 616,
&end
#
# 41 LYS HN 73 ILE HN 5.30 (#peak 3507)
&rst
ixpk= 3507, nxpk= 0, iat= 602,1088, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 41 LYS HN 73 ILE O 2.40
&rst
ixpk= 3507, nxpk= 0, iat= 602,1105, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 41 LYS HN 73 ILE QD1 4.70 (#peak 3510)
&rst
ixpk= 3510, nxpk= 0, iat= 602, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2=1101,1102,1103,
&end
#
# 41 LYS HN 73 ILE QG2 5.38 (#peak 3511)
&rst
ixpk= 3511, nxpk= 0, iat= 602, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr2=1094,1095,1096,
&end
#
# 41 LYS HN 74 ARG HA 5.39 (#peak 3503)
&rst
ixpk= 3503, nxpk= 0, iat= 602,1109, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 41 LYS HA 42 LEU HB2 6.15 (#peak 4144)
&rst
ixpk= 4144, nxpk= 0, iat= 604, 628, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 41 LYS HA 50 THR HA 2.89 (#peak 12275)
&rst
ixpk= 12275, nxpk= 0, iat= 604, 736, r1= 1.30, r2= 1.80, r3= 2.89, r4= 3.39, &end
#
# 41 LYS HB2 42 LEU HN 4.46 (#peak 1140)
&rst
ixpk= 1140, nxpk= 0, iat= 606, 624, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 41 LYS HB2 42 LEU HA 6.15 (#peak 2187)
&rst
ixpk= 2187, nxpk= 0, iat= 606, 626, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 41 LYS N 73 ILE O 3.30
&rst
ixpk= 2187, nxpk= 0, iat= 601,1105, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 41 LYS O 73 ILE HN 2.40
&rst
ixpk= 2187, nxpk= 0, iat= 622,1088, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 41 LYS O 73 ILE N 3.30
&rst
ixpk= 2187, nxpk= 0, iat= 622,1087, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 41 LYS QE 42 LEU HN 6.15 (#peak 2984)
&rst
ixpk= 2984, nxpk= 0, iat= -1, 624, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1= 615, 616,
&end
#
# 41 LYS QE 49 LYS HN 5.44 (#peak 4469)
&rst
ixpk= 4469, nxpk= 0, iat= -1, 712, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 615, 616,
&end
#
# 41 LYS QG 41 LYS QD 2.79 (#peak 3556)
&rst
ixpk= 3556, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
igr1= 609, 610,
igr2= 612, 613,
&end
#
# 42 LEU HN 42 LEU HG 5.16 (#peak 1142)
&rst
ixpk= 1142, nxpk= 0, iat= 624, 631, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 42 LEU HN 42 LEU QD1 4.63 (#peak 1143)
&rst
ixpk= 1143, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2= 633, 634, 635,
&end
#
# 42 LEU HN 42 LEU QD2 4.63 (#peak 1147)
&rst
ixpk= 1147, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2= 637, 638, 639,
&end
#
# 42 LEU HN 43 ALA HN 5.62 (#peak 3524)
&rst
ixpk= 3524, nxpk= 0, iat= 624, 643, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 42 LEU HN 49 LYS O 2.40
&rst
ixpk= 3524, nxpk= 0, iat= 624, 732, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 42 LEU HN 49 LYS QD 5.79 (#peak 3628)
&rst
ixpk= 3628, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2= 722, 723,
&end
#
# 42 LEU HN 49 LYS QG 5.23 (#peak 3627)
&rst
ixpk= 3627, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2= 719, 720,
&end
#
# 42 LEU HN 50 THR HA 5.28 (#peak 3623)
&rst
ixpk= 3623, nxpk= 0, iat= 624, 736, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 42 LEU HN 50 THR QG2 4.92 (#peak 3193)
&rst
ixpk= 3193, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2= 740, 741, 742,
&end
#
# 42 LEU HN 51 TYR QD 5.46 (#peak 4809)
&rst
ixpk= 4809, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr2= 756, 765,
&end
#
# 42 LEU HN 51 TYR QE 4.81 (#peak 4810)
&rst
ixpk= 4810, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 758, 763,
&end
#
# 42 LEU HA 42 LEU QD2 6.15 (#peak 3922)
&rst
ixpk= 3922, nxpk= 0, iat= 626, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2= 637, 638, 639,
&end
#
# 42 LEU HB3 43 ALA HN 4.26 (#peak 366)
&rst
ixpk= 366, nxpk= 0, iat= 629, 643, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 42 LEU HB3 49 LYS HN 4.12 (#peak 3630)
&rst
ixpk= 3630, nxpk= 0, iat= 629, 712, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 42 LEU HG 43 ALA HN 4.86 (#peak 369)
&rst
ixpk= 369, nxpk= 0, iat= 631, 643, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 42 LEU HG 49 LYS HN 5.25 (#peak 3631)
&rst
ixpk= 3631, nxpk= 0, iat= 631, 712, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 42 LEU HG 70 PHE QD 4.31 (#peak 12505)
&rst
ixpk= 12505, nxpk= 0, iat= 631, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=1044,1052,
&end
#
# 42 LEU HG 70 PHE QE 5.19 (#peak 12502)
&rst
ixpk= 12502, nxpk= 0, iat= 631, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr2=1046,1050,
&end
#
# 42 LEU N 49 LYS O 3.30
&rst
ixpk= 12502, nxpk= 0, iat= 623, 732, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 42 LEU QD1 43 ALA HN 4.57 (#peak 371)
&rst
ixpk= 371, nxpk= 0, iat= -1, 643, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 633, 634, 635,
&end
#
# 42 LEU QD1 49 LYS HN 6.15 (#peak 3629)
&rst
ixpk= 3629, nxpk= 0, iat= -1, 712, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 633, 634, 635,
&end
#
# 42 LEU QD1 51 TYR QD 4.95 (#peak 500)
&rst
ixpk= 500, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1= 633, 634, 635,
igr2= 756, 765,
&end
#
# 42 LEU QD1 51 TYR QE 3.85 (#peak 13087)
&rst
ixpk= 13087, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 633, 634, 635,
igr2= 758, 763,
&end
#
# 42 LEU QD1 57 LEU HG 6.15 (#peak 4772)
&rst
ixpk= 4772, nxpk= 0, iat= -1, 827, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 633, 634, 635,
&end
#
# 42 LEU QD1 57 LEU QQD 3.12 (#peak 4340)
&rst
ixpk= 4340, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1= 633, 634, 635,
igr2= 833, 834, 835, 829, 830, 831,
&end
#
# 42 LEU QD1 70 PHE QD 4.39 (#peak 4261)
&rst
ixpk= 4261, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 633, 634, 635,
igr2=1044,1052,
&end
#
# 42 LEU QD1 72 PHE HA 4.01 (#peak 4260)
&rst
ixpk= 4260, nxpk= 0, iat= -1,1070, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1= 633, 634, 635,
&end
#
# 42 LEU QD1 72 PHE QD 4.13 (#peak 4259)
&rst
ixpk= 4259, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 633, 634, 635,
igr2=1076,1084,
&end
#
# 42 LEU QD1 90 PHE QD 3.99 (#peak 12129)
&rst
ixpk= 12129, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1= 633, 634, 635,
igr2=1361,1369,
&end
#
# 42 LEU QD1 90 PHE QE 4.36 (#peak 12125)
&rst
ixpk= 12125, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 633, 634, 635,
igr2=1363,1367,
&end
#
# 42 LEU QD2 43 ALA HN 4.23 (#peak 375)
&rst
ixpk= 375, nxpk= 0, iat= -1, 643, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 637, 638, 639,
&end
#
# 42 LEU QD2 57 LEU HG 6.15 (#peak 4771)
&rst
ixpk= 4771, nxpk= 0, iat= -1, 827, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 637, 638, 639,
&end
#
# 42 LEU QD2 57 LEU QQD 3.78 (#peak 12012)
&rst
ixpk= 12012, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 637, 638, 639,
igr2= 833, 834, 835, 829, 830, 831,
&end
#
# 42 LEU QD2 70 PHE QD 4.48 (#peak 2593)
&rst
ixpk= 2593, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1= 637, 638, 639,
igr2=1044,1052,
&end
#
# 42 LEU QD2 70 PHE QE 5.64 (#peak 7853)
&rst
ixpk= 7853, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.60, r4= 8.10,
igr1= 637, 638, 639,
igr2=1046,1050,
&end
#
# 42 LEU QD2 72 PHE HA 4.13 (#peak 5561)
&rst
ixpk= 5561, nxpk= 0, iat= -1,1070, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1= 637, 638, 639,
&end
#
# 42 LEU QD2 72 PHE HB2 4.18 (#peak 3928)
&rst
ixpk= 3928, nxpk= 0, iat= -1,1072, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1= 637, 638, 639,
&end
#
# 42 LEU QD2 72 PHE HB3 4.45 (#peak 4263)
&rst
ixpk= 4263, nxpk= 0, iat= -1,1073, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 637, 638, 639,
&end
#
# 42 LEU QD2 72 PHE QD 4.19 (#peak 4258)
&rst
ixpk= 4258, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1= 637, 638, 639,
igr2=1076,1084,
&end
#
# 42 LEU QD2 90 PHE QD 4.13 (#peak 5553)
&rst
ixpk= 5553, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 637, 638, 639,
igr2=1361,1369,
&end
#
# 42 LEU QD2 90 PHE QE 4.11 (#peak 12192)
&rst
ixpk= 12192, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 637, 638, 639,
igr2=1363,1367,
&end
#
# 43 ALA HN 43 ALA QB 3.71 (#peak 373)
&rst
ixpk= 373, nxpk= 0, iat= 643, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 647, 648, 649,
&end
#
# 43 ALA HN 44 ALA HN 4.86 (#peak 503)
&rst
ixpk= 503, nxpk= 0, iat= 643, 653, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 43 ALA HN 70 PHE QD 6.00 (#peak 3515)
&rst
ixpk= 3515, nxpk= 0, iat= 643, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1044,1052,
&end
#
# 43 ALA HN 71 ASP HN 5.47 (#peak 3522)
&rst
ixpk= 3522, nxpk= 0, iat= 643,1056, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 43 ALA HN 71 ASP HB2 6.15 (#peak 3519)
&rst
ixpk= 3519, nxpk= 0, iat= 643,1060, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 43 ALA HN 71 ASP HB3 5.94 (#peak 3518)
&rst
ixpk= 3518, nxpk= 0, iat= 643,1061, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 43 ALA HN 71 ASP O 2.40
&rst
ixpk= 3518, nxpk= 0, iat= 643,1066, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 43 ALA HN 72 PHE HA 5.29 (#peak 3516)
&rst
ixpk= 3516, nxpk= 0, iat= 643,1070, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 43 ALA HA 44 ALA HN 3.47 (#peak 504)
&rst
ixpk= 504, nxpk= 0, iat= 645, 653, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 43 ALA HA 47 ALA HN 5.44 (#peak 4340)
&rst
ixpk= 4340, nxpk= 0, iat= 645, 687, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 43 ALA HA 48 GLU HN 5.36 (#peak 4805)
&rst
ixpk= 4805, nxpk= 0, iat= 645, 697, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 43 ALA HA 48 GLU HA 3.79 (#peak 12262)
&rst
ixpk= 12262, nxpk= 0, iat= 645, 699, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 43 ALA HA 49 LYS HN 4.81 (#peak 4339)
&rst
ixpk= 4339, nxpk= 0, iat= 645, 712, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 43 ALA N 71 ASP O 3.30
&rst
ixpk= 4339, nxpk= 0, iat= 642,1066, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 43 ALA O 71 ASP HN 2.40
&rst
ixpk= 4339, nxpk= 0, iat= 651,1056, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 43 ALA O 71 ASP N 3.30
&rst
ixpk= 4339, nxpk= 0, iat= 651,1055, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 43 ALA QB 44 ALA HN 3.34 (#peak 507)
&rst
ixpk= 507, nxpk= 0, iat= -1, 653, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr1= 647, 648, 649,
&end
#
# 43 ALA QB 71 ASP HN 4.71 (#peak 3517)
&rst
ixpk= 3517, nxpk= 0, iat= -1,1056, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 647, 648, 649,
&end
#
# 44 ALA HN 44 ALA QB 3.52 (#peak 500)
&rst
ixpk= 500, nxpk= 0, iat= 653, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2= 657, 658, 659,
&end
#
# 44 ALA HN 45 GLN HN 5.18 (#peak 1625)
&rst
ixpk= 1625, nxpk= 0, iat= 653, 663, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 44 ALA HN 48 GLU HA 5.22 (#peak 3196)
&rst
ixpk= 3196, nxpk= 0, iat= 653, 699, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 44 ALA HN 48 GLU HB2 5.90 (#peak 3834)
&rst
ixpk= 3834, nxpk= 0, iat= 653, 701, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40, &end
#
# 44 ALA HN 48 GLU HB3 5.22 (#peak 4314)
&rst
ixpk= 4314, nxpk= 0, iat= 653, 702, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 44 ALA HA 45 GLN HA 6.15 (#peak 3518)
&rst
ixpk= 3518, nxpk= 0, iat= 655, 665, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 44 ALA HA 46 GLY HN 4.88 (#peak 4757)
&rst
ixpk= 4757, nxpk= 0, iat= 655, 680, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 44 ALA HA 47 ALA HN 5.75 (#peak 4466)
&rst
ixpk= 4466, nxpk= 0, iat= 655, 687, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 44 ALA QB 45 GLN HN 3.86 (#peak 1621)
&rst
ixpk= 1621, nxpk= 0, iat= -1, 663, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1= 657, 658, 659,
&end
#
# 44 ALA QB 45 GLN HA 6.15 (#peak 344)
&rst
ixpk= 344, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 657, 658, 659,
&end
#
# 44 ALA QB 45 GLN HE21 5.34 (#peak 4047)
&rst
ixpk= 4047, nxpk= 0, iat= -1, 675, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr1= 657, 658, 659,
&end
#
# 44 ALA QB 45 GLN HE22 5.76 (#peak 3565)
&rst
ixpk= 3565, nxpk= 0, iat= -1, 676, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
igr1= 657, 658, 659,
&end
#
# 44 ALA QB 45 GLN HG3 6.15 (#peak 2595)
&rst
ixpk= 2595, nxpk= 0, iat= -1, 671, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 657, 658, 659,
&end
#
# 44 ALA QB 46 GLY HN 4.88 (#peak 4046)
&rst
ixpk= 4046, nxpk= 0, iat= -1, 680, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 657, 658, 659,
&end
#
# 44 ALA QB 47 ALA HN 4.90 (#peak 3622)
&rst
ixpk= 3622, nxpk= 0, iat= -1, 687, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 657, 658, 659,
&end
#
# 44 ALA QB 70 PHE QD 3.46 (#peak 4407)
&rst
ixpk= 4407, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1= 657, 658, 659,
igr2=1044,1052,
&end
#
# 44 ALA QB 70 PHE QE 3.58 (#peak 4408)
&rst
ixpk= 4408, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 657, 658, 659,
igr2=1046,1050,
&end
#
# 45 GLN HN 45 GLN HB3 4.19 (#peak 1626)
&rst
ixpk= 1626, nxpk= 0, iat= 663, 668, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 45 GLN HN 45 GLN HE21 5.39 (#peak 3562)
&rst
ixpk= 3562, nxpk= 0, iat= 663, 675, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 45 GLN HN 45 GLN HG2 5.26 (#peak 1622)
&rst
ixpk= 1622, nxpk= 0, iat= 663, 670, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 45 GLN HN 45 GLN HG3 5.32 (#peak 1632)
&rst
ixpk= 1632, nxpk= 0, iat= 663, 671, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 45 GLN HN 46 GLY HN 4.21 (#peak 1624)
&rst
ixpk= 1624, nxpk= 0, iat= 663, 680, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 45 GLN HN 46 GLY HA2 5.73 (#peak 1630)
&rst
ixpk= 1630, nxpk= 0, iat= 663, 682, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 45 GLN HN 47 ALA HN 5.80 (#peak 4464)
&rst
ixpk= 4464, nxpk= 0, iat= 663, 687, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 45 GLN HA 45 GLN HE21 4.61 (#peak 1660)
&rst
ixpk= 1660, nxpk= 0, iat= 665, 675, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 45 GLN HA 45 GLN HE22 5.24 (#peak 3563)
&rst
ixpk= 3563, nxpk= 0, iat= 665, 676, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 45 GLN HA 47 ALA HN 5.22 (#peak 3617)
&rst
ixpk= 3617, nxpk= 0, iat= 665, 687, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 45 GLN HB2 46 GLY HN 5.03 (#peak 3229)
&rst
ixpk= 3229, nxpk= 0, iat= 667, 680, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 45 GLN HB2 47 ALA HN 5.61 (#peak 3621)
&rst
ixpk= 3621, nxpk= 0, iat= 667, 687, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 45 GLN HB3 45 GLN HE21 4.38 (#peak 1661)
&rst
ixpk= 1661, nxpk= 0, iat= 668, 675, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 45 GLN HB3 45 GLN HE22 6.15 (#peak 1375)
&rst
ixpk= 1375, nxpk= 0, iat= 668, 676, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 45 GLN HB3 46 GLY HN 4.37 (#peak 216)
&rst
ixpk= 216, nxpk= 0, iat= 668, 680, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 45 GLN HB3 47 ALA HN 5.35 (#peak 3620)
&rst
ixpk= 3620, nxpk= 0, iat= 668, 687, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 45 GLN HE21 69 ARG QD 5.31 (#peak 4335)
&rst
ixpk= 4335, nxpk= 0, iat= 675, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=1022,1023,
&end
#
# 45 GLN HE21 69 ARG QG 5.02 (#peak 4044)
&rst
ixpk= 4044, nxpk= 0, iat= 675, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2=1019,1020,
&end
#
# 45 GLN HE22 69 ARG QD 4.49 (#peak 4336)
&rst
ixpk= 4336, nxpk= 0, iat= 676, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1022,1023,
&end
#
# 45 GLN HE22 69 ARG QG 4.88 (#peak 3570)
&rst
ixpk= 3570, nxpk= 0, iat= 676, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2=1019,1020,
&end
#
# 45 GLN HG2 45 GLN HE21 3.97 (#peak 3228)
&rst
ixpk= 3228, nxpk= 0, iat= 670, 675, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 45 GLN HG2 46 GLY HN 5.61 (#peak 3227)
&rst
ixpk= 3227, nxpk= 0, iat= 670, 680, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 45 GLN HG2 47 ALA HN 6.06 (#peak 3618)
&rst
ixpk= 3618, nxpk= 0, iat= 670, 687, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56, &end
#
# 45 GLN HG3 46 GLY HN 5.04 (#peak 221)
&rst
ixpk= 221, nxpk= 0, iat= 671, 680, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 46 GLY HN 47 ALA HN 3.34 (#peak 1258)
&rst
ixpk= 1258, nxpk= 0, iat= 680, 687, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 46 GLY HN 47 ALA HA 6.15 (#peak 1573)
&rst
ixpk= 1573, nxpk= 0, iat= 680, 689, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 47 ALA HN 48 GLU HN 4.97 (#peak 3195)
&rst
ixpk= 3195, nxpk= 0, iat= 687, 697, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 47 ALA HA 48 GLU HN 2.79 (#peak 1171)
&rst
ixpk= 1171, nxpk= 0, iat= 689, 697, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29, &end
#
# 47 ALA HA 48 GLU HB2 6.15 (#peak 404)
&rst
ixpk= 404, nxpk= 0, iat= 689, 701, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 47 ALA QB 48 GLU HN 3.62 (#peak 1173)
&rst
ixpk= 1173, nxpk= 0, iat= -1, 697, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1= 691, 692, 693,
&end
#
# 47 ALA QB 48 GLU HB2 5.77 (#peak 407)
&rst
ixpk= 407, nxpk= 0, iat= -1, 701, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 691, 692, 693,
&end
#
# 47 ALA QB 70 PHE HZ 5.66 (#peak 4410)
&rst
ixpk= 4410, nxpk= 0, iat= -1,1048, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
igr1= 691, 692, 693,
&end
#
# 47 ALA QB 70 PHE QE 4.91 (#peak 4411)
&rst
ixpk= 4411, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 691, 692, 693,
igr2=1046,1050,
&end
#
# 48 GLU HN 48 GLU QG 4.13 (#peak 1177)
&rst
ixpk= 1177, nxpk= 0, iat= 697, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2= 704, 705,
&end
#
# 48 GLU HN 49 LYS HN 4.69 (#peak 2097)
&rst
ixpk= 2097, nxpk= 0, iat= 697, 712, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 48 GLU HB2 49 LYS HN 4.19 (#peak 2092)
&rst
ixpk= 2092, nxpk= 0, iat= 701, 712, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 49 LYS HN 49 LYS HB3 3.66 (#peak 2101)
&rst
ixpk= 2101, nxpk= 0, iat= 712, 717, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 49 LYS HN 50 THR HN 4.58 (#peak 2186)
&rst
ixpk= 2186, nxpk= 0, iat= 712, 734, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 49 LYS HA 50 THR HN 3.56 (#peak 2182)
&rst
ixpk= 2182, nxpk= 0, iat= 714, 734, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 49 LYS QD 50 THR HN 4.07 (#peak 2184)
&rst
ixpk= 2184, nxpk= 0, iat= -1, 734, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1= 722, 723,
&end
#
# 50 THR HN 50 THR HB 3.79 (#peak 2185)
&rst
ixpk= 2185, nxpk= 0, iat= 734, 738, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 50 THR HN 50 THR QG2 3.84 (#peak 2183)
&rst
ixpk= 2183, nxpk= 0, iat= 734, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2= 740, 741, 742,
&end
#
# 50 THR HB 51 TYR HN 5.51 (#peak 1164)
&rst
ixpk= 1164, nxpk= 0, iat= 738, 748, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 50 THR QG2 51 TYR HN 4.37 (#peak 1162)
&rst
ixpk= 1162, nxpk= 0, iat= -1, 748, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 740, 741, 742,
&end
#
# 51 TYR HN 51 TYR QD 5.57 (#peak 1163)
&rst
ixpk= 1163, nxpk= 0, iat= 748, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr2= 756, 765,
&end
#
# 51 TYR HN 52 GLY HN 5.44 (#peak 1167)
&rst
ixpk= 1167, nxpk= 0, iat= 748, 769, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 51 TYR HB2 52 GLY HN 6.00 (#peak 2512)
&rst
ixpk= 2512, nxpk= 0, iat= 752, 769, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 51 TYR HB3 52 GLY HN 6.15 (#peak 2530)
&rst
ixpk= 2530, nxpk= 0, iat= 753, 769, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 51 TYR QD 52 GLY HN 5.53 (#peak 2515)
&rst
ixpk= 2515, nxpk= 0, iat= -1, 769, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1= 756, 765,
&end
#
# 51 TYR QD 55 ASP HN 5.40 (#peak 3848)
&rst
ixpk= 3848, nxpk= 0, iat= -1, 797, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1= 756, 765,
&end
#
# 51 TYR QD 55 ASP HB2 4.34 (#peak 12229)
&rst
ixpk= 12229, nxpk= 0, iat= -1, 801, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1= 756, 765,
&end
#
# 51 TYR QD 56 SER HN 5.36 (#peak 3845)
&rst
ixpk= 3845, nxpk= 0, iat= -1, 809, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1= 756, 765,
&end
#
# 51 TYR QD 57 LEU QQD 5.46 (#peak 11990)
&rst
ixpk= 11990, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.26, r4= 8.76,
igr1= 756, 765,
igr2= 833, 834, 835, 829, 830, 831,
&end
#
# 51 TYR QE 56 SER HN 5.96 (#peak 3846)
&rst
ixpk= 3846, nxpk= 0, iat= -1, 809, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1= 758, 763,
&end
#
# 52 GLY HN 53 ASN HN 4.59 (#peak 2601)
&rst
ixpk= 2601, nxpk= 0, iat= 769, 776, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 52 GLY HN 55 ASP HB2 6.15 (#peak 4263)
&rst
ixpk= 4263, nxpk= 0, iat= 769, 801, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 52 GLY HN 55 ASP HB3 5.05 (#peak 4264)
&rst
ixpk= 4264, nxpk= 0, iat= 769, 802, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 53 ASN HN 53 ASN HB2 4.06 (#peak 2596)
&rst
ixpk= 2596, nxpk= 0, iat= 776, 780, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 53 ASN HN 53 ASN HB3 4.04 (#peak 2597)
&rst
ixpk= 2597, nxpk= 0, iat= 776, 781, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 53 ASN HN 54 GLY HN 5.07 (#peak 3472)
&rst
ixpk= 3472, nxpk= 0, iat= 776, 790, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 53 ASN HB3 54 GLY HN 4.59 (#peak 2472)
&rst
ixpk= 2472, nxpk= 0, iat= 781, 790, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 54 GLY HN 55 ASP HN 3.82 (#peak 888)
&rst
ixpk= 888, nxpk= 0, iat= 790, 797, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 55 ASP HN 55 ASP HB2 3.89 (#peak 889)
&rst
ixpk= 889, nxpk= 0, iat= 797, 801, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 55 ASP HN 55 ASP HB3 3.79 (#peak 885)
&rst
ixpk= 885, nxpk= 0, iat= 797, 802, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 55 ASP HN 56 SER HN 4.45 (#peak 887)
&rst
ixpk= 887, nxpk= 0, iat= 797, 809, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 55 ASP HN 56 SER HB3 5.56 (#peak 886)
&rst
ixpk= 886, nxpk= 0, iat= 797, 814, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06, &end
#
# 55 ASP HB2 56 SER HN 5.91 (#peak 1747)
&rst
ixpk= 1747, nxpk= 0, iat= 801, 809, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 55 ASP HB3 56 SER HN 3.69 (#peak 1743)
&rst
ixpk= 1743, nxpk= 0, iat= 802, 809, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 56 SER HN 56 SER HB2 4.11 (#peak 1736)
&rst
ixpk= 1736, nxpk= 0, iat= 809, 813, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 56 SER HN 56 SER HB3 4.15 (#peak 1744)
&rst
ixpk= 1744, nxpk= 0, iat= 809, 814, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 56 SER HN 57 LEU HN 4.52 (#peak 1741)
&rst
ixpk= 1741, nxpk= 0, iat= 809, 820, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 56 SER HA 57 LEU QQD 6.15 (#peak 2707)
&rst
ixpk= 2707, nxpk= 0, iat= 811, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr2= 833, 834, 835, 829, 830, 831,
&end
#
# 56 SER HB2 57 LEU HN 4.70 (#peak 735)
&rst
ixpk= 735, nxpk= 0, iat= 813, 820, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 56 SER HB3 57 LEU HN 4.57 (#peak 741)
&rst
ixpk= 741, nxpk= 0, iat= 814, 820, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 57 LEU HN 57 LEU QQD 4.43 (#peak 736)
&rst
ixpk= 736, nxpk= 0, iat= 820, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2= 833, 834, 835, 829, 830, 831,
&end
#
# 57 LEU HA 57 LEU QQD 5.97 (#peak 509)
&rst
ixpk= 509, nxpk= 0, iat= 822, -1, r1= 1.30, r2= 1.80, r3= 8.05, r4= 8.55,
igr2= 833, 834, 835, 829, 830, 831,
&end
#
# 57 LEU HA 58 ASN HB2 6.15 (#peak 2226)
&rst
ixpk= 2226, nxpk= 0, iat= 822, 843, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 57 LEU HG 59 THR HN 6.08 (#peak 4544)
&rst
ixpk= 4544, nxpk= 0, iat= 827, 853, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58, &end
#
# 57 LEU HG 70 PHE QD 5.83 (#peak 12462)
&rst
ixpk= 12462, nxpk= 0, iat= 827, -1, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
igr2=1044,1052,
&end
#
# 57 LEU HG 70 PHE QE 4.36 (#peak 12463)
&rst
ixpk= 12463, nxpk= 0, iat= 827, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1046,1050,
&end
#
# 57 LEU QQD 58 ASN HN 4.17 (#peak 2467)
&rst
ixpk= 2467, nxpk= 0, iat= -1, 839, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 833, 834, 835, 829, 830, 831,
&end
#
# 57 LEU QQD 58 ASN HA 6.15 (#peak 512)
&rst
ixpk= 512, nxpk= 0, iat= -1, 841, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1= 833, 834, 835, 829, 830, 831,
&end
#
# 57 LEU QQD 58 ASN HB3 6.15 (#peak 510)
&rst
ixpk= 510, nxpk= 0, iat= -1, 844, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1= 833, 834, 835, 829, 830, 831,
&end
#
# 57 LEU QQD 59 THR HN 5.93 (#peak 4645)
&rst
ixpk= 4645, nxpk= 0, iat= -1, 853, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
igr1= 833, 834, 835, 829, 830, 831,
&end
#
# 57 LEU QQD 70 PHE QD 5.73 (#peak 12291)
&rst
ixpk= 12291, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.67, r4= 9.17,
igr1= 833, 834, 835, 829, 830, 831,
igr2=1044,1052,
&end
#
# 57 LEU QQD 70 PHE QE 4.66 (#peak 11961)
&rst
ixpk= 11961, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1= 833, 834, 835, 829, 830, 831,
igr2=1046,1050,
&end
#
# 57 LEU QQD 90 PHE HZ 3.97 (#peak 12299)
&rst
ixpk= 12299, nxpk= 0, iat= -1,1365, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1= 833, 834, 835, 829, 830, 831,
&end
#
# 57 LEU QQD 90 PHE QD 5.68 (#peak 12215)
&rst
ixpk= 12215, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.59, r4= 9.09,
igr1= 833, 834, 835, 829, 830, 831,
igr2=1361,1369,
&end
#
# 57 LEU QQD 90 PHE QE 4.36 (#peak 12212)
&rst
ixpk= 12212, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
igr1= 833, 834, 835, 829, 830, 831,
igr2=1363,1367,
&end
#
# 58 ASN HN 59 THR HN 6.15 (#peak 3636)
&rst
ixpk= 3636, nxpk= 0, iat= 839, 853, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 58 ASN HN 59 THR QG2 5.64 (#peak 2468)
&rst
ixpk= 2468, nxpk= 0, iat= 839, -1, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr2= 859, 860, 861,
&end
#
# 58 ASN HB2 59 THR HN 5.46 (#peak 4524)
&rst
ixpk= 4524, nxpk= 0, iat= 843, 853, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 58 ASN HB3 59 THR HN 4.59 (#peak 906)
&rst
ixpk= 906, nxpk= 0, iat= 844, 853, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 58 ASN HB3 60 GLY HN 6.15 (#peak 4740)
&rst
ixpk= 4740, nxpk= 0, iat= 844, 867, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 59 THR HN 59 THR QG2 3.85 (#peak 909)
&rst
ixpk= 909, nxpk= 0, iat= 853, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2= 859, 860, 861,
&end
#
# 59 THR HN 60 GLY HN 4.61 (#peak 907)
&rst
ixpk= 907, nxpk= 0, iat= 853, 867, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 59 THR QG2 60 GLY HN 4.95 (#peak 4531)
&rst
ixpk= 4531, nxpk= 0, iat= -1, 867, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1= 859, 860, 861,
&end
#
# 60 GLY HN 61 LYS HN 4.63 (#peak 631)
&rst
ixpk= 631, nxpk= 0, iat= 867, 874, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 61 LYS HN 61 LYS QB 4.08 (#peak 634)
&rst
ixpk= 634, nxpk= 0, iat= 874, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2= 878, 879,
&end
#
# 61 LYS HN 61 LYS QE 4.44 (#peak 630)
&rst
ixpk= 630, nxpk= 0, iat= 874, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2= 887, 888,
&end
#
# 61 LYS HN 61 LYS QG 4.61 (#peak 633)
&rst
ixpk= 633, nxpk= 0, iat= 874, -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr2= 881, 882,
&end
#
# 61 LYS HN 62 LEU HN 4.64 (#peak 632)
&rst
ixpk= 632, nxpk= 0, iat= 874, 896, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 61 LYS HA 61 LYS QE 6.15 (#peak 658)
&rst
ixpk= 658, nxpk= 0, iat= 876, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2= 887, 888,
&end
#
# 61 LYS QB 62 LEU HN 4.12 (#peak 1941)
&rst
ixpk= 1941, nxpk= 0, iat= -1, 896, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1= 878, 879,
&end
#
# 61 LYS QG 62 LEU HN 4.07 (#peak 1940)
&rst
ixpk= 1940, nxpk= 0, iat= -1, 896, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1= 881, 882,
&end
#
# 62 LEU HN 62 LEU HG 6.15 (#peak 4462)
&rst
ixpk= 4462, nxpk= 0, iat= 896, 903, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 62 LEU HN 62 LEU QQD 4.17 (#peak 3817)
&rst
ixpk= 3817, nxpk= 0, iat= 896, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2= 909, 910, 911, 905, 906, 907,
&end
#
# 62 LEU HN 63 LYS HN 4.53 (#peak 1327)
&rst
ixpk= 1327, nxpk= 0, iat= 896, 915, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 62 LEU HA 62 LEU QQD 4.73 (#peak 1838)
&rst
ixpk= 1838, nxpk= 0, iat= 898, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2= 909, 910, 911, 905, 906, 907,
&end
#
# 62 LEU HG 63 LYS HN 4.55 (#peak 4559)
&rst
ixpk= 4559, nxpk= 0, iat= 903, 915, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 62 LEU QQD 63 LYS HN 3.93 (#peak 1325)
&rst
ixpk= 1325, nxpk= 0, iat= -1, 915, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 909, 910, 911, 905, 906, 907,
&end
#
# 63 LYS HN 64 ASN HN 6.15 (#peak 3638)
&rst
ixpk= 3638, nxpk= 0, iat= 915, 937, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 63 LYS HA 63 LYS QD 3.80 (#peak 3938)
&rst
ixpk= 3938, nxpk= 0, iat= 917, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr2= 925, 926,
&end
#
# 63 LYS HA 64 ASN HN 3.28 (#peak 107)
&rst
ixpk= 107, nxpk= 0, iat= 917, 937, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 63 LYS HA 64 ASN HD21 6.15 (#peak 3944)
&rst
ixpk= 3944, nxpk= 0, iat= 917, 946, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 63 LYS HE3 64 ASN HN 4.44 (#peak 102)
&rst
ixpk= 102, nxpk= 0, iat= 929, 937, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 63 LYS HG2 64 ASN HN 5.29 (#peak 4564)
&rst
ixpk= 4564, nxpk= 0, iat= 922, 937, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 63 LYS HG3 64 ASN HN 5.47 (#peak 4563)
&rst
ixpk= 4563, nxpk= 0, iat= 923, 937, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 63 LYS QB 64 ASN HN 3.93 (#peak 100)
&rst
ixpk= 100, nxpk= 0, iat= -1, 937, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1= 919, 920,
&end
#
# 63 LYS QB 64 ASN HA 6.15 (#peak 1512)
&rst
ixpk= 1512, nxpk= 0, iat= -1, 939, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1= 919, 920,
&end
#
# 63 LYS QD 64 ASN HN 3.51 (#peak 96)
&rst
ixpk= 96, nxpk= 0, iat= -1, 937, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr1= 925, 926,
&end
#
# 64 ASN HN 64 ASN HD21 4.55 (#peak 104)
&rst
ixpk= 104, nxpk= 0, iat= 937, 946, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 64 ASN HN 64 ASN HD22 4.71 (#peak 612)
&rst
ixpk= 612, nxpk= 0, iat= 937, 947, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 64 ASN HN 65 ASP HN 4.46 (#peak 97)
&rst
ixpk= 97, nxpk= 0, iat= 937, 951, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 64 ASN HN 65 ASP HA 6.15 (#peak 106)
&rst
ixpk= 106, nxpk= 0, iat= 937, 953, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 64 ASN HA 64 ASN HD21 6.15 (#peak 1513)
&rst
ixpk= 1513, nxpk= 0, iat= 939, 946, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 64 ASN HA 64 ASN HD22 6.15 (#peak 1511)
&rst
ixpk= 1511, nxpk= 0, iat= 939, 947, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 64 ASN HB2 65 ASP HN 4.60 (#peak 598)
&rst
ixpk= 598, nxpk= 0, iat= 941, 951, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 64 ASN HB2 66 LYS HN 6.12 (#peak 4235)
&rst
ixpk= 4235, nxpk= 0, iat= 941, 963, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62, &end
#
# 64 ASN HB3 64 ASN HD21 3.72 (#peak 1868)
&rst
ixpk= 1868, nxpk= 0, iat= 942, 946, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 64 ASN HB3 64 ASN HD22 4.04 (#peak 613)
&rst
ixpk= 613, nxpk= 0, iat= 942, 947, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 64 ASN HB3 65 ASP HN 4.64 (#peak 594)
&rst
ixpk= 594, nxpk= 0, iat= 942, 951, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 64 ASN HB3 66 LYS HN 5.71 (#peak 4236)
&rst
ixpk= 4236, nxpk= 0, iat= 942, 963, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 65 ASP HN 66 LYS HN 4.30 (#peak 1676)
&rst
ixpk= 1676, nxpk= 0, iat= 951, 963, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 65 ASP HA 93 TYR QD 4.67 (#peak 12532)
&rst
ixpk= 12532, nxpk= 0, iat= 953, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1414,1423,
&end
#
# 65 ASP HA 93 TYR QE 3.89 (#peak 12663)
&rst
ixpk= 12663, nxpk= 0, iat= 953, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2=1416,1421,
&end
#
# 65 ASP HB2 66 LYS HN 4.97 (#peak 1680)
&rst
ixpk= 1680, nxpk= 0, iat= 955, 963, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 66 LYS HN 66 LYS HB2 4.07 (#peak 1678)
&rst
ixpk= 1678, nxpk= 0, iat= 963, 967, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 66 LYS HN 66 LYS HB3 3.97 (#peak 1679)
&rst
ixpk= 1679, nxpk= 0, iat= 963, 968, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 66 LYS HN 66 LYS HG2 4.20 (#peak 1684)
&rst
ixpk= 1684, nxpk= 0, iat= 963, 970, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 66 LYS HN 66 LYS HG3 4.66 (#peak 1675)
&rst
ixpk= 1675, nxpk= 0, iat= 963, 971, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 66 LYS HN 67 VAL HN 4.72 (#peak 1681)
&rst
ixpk= 1681, nxpk= 0, iat= 963, 985, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 66 LYS HN 93 TYR QD 4.27 (#peak 13141)
&rst
ixpk= 13141, nxpk= 0, iat= 963, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=1414,1423,
&end
#
# 66 LYS HN 93 TYR QE 4.50 (#peak 3843)
&rst
ixpk= 3843, nxpk= 0, iat= 963, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr2=1416,1421,
&end
#
# 66 LYS HN 94 LYS HN 5.25 (#peak 4230)
&rst
ixpk= 4230, nxpk= 0, iat= 963,1427, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 66 LYS HN 94 LYS HA 5.65 (#peak 4233)
&rst
ixpk= 4233, nxpk= 0, iat= 963,1429, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 66 LYS HN 94 LYS QB 5.17 (#peak 4242)
&rst
ixpk= 4242, nxpk= 0, iat= 963, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2=1431,1432,
&end
#
# 66 LYS HN 94 LYS QD 4.66 (#peak 4708)
&rst
ixpk= 4708, nxpk= 0, iat= 963, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr2=1437,1438,
&end
#
# 66 LYS HN 95 GLN HA 6.15 (#peak 4232)
&rst
ixpk= 4232, nxpk= 0, iat= 963,1451, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 66 LYS HN 95 GLN QG 6.15 (#peak 4758)
&rst
ixpk= 4758, nxpk= 0, iat= 963, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=1456,1457,
&end
#
# 66 LYS HA 67 VAL HN 3.36 (#peak 1420)
&rst
ixpk= 1420, nxpk= 0, iat= 965, 985, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, &end
#
# 66 LYS HA 67 VAL QQG 6.15 (#peak 1043)
&rst
ixpk= 1043, nxpk= 0, iat= 965, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr2= 991, 992, 993, 995, 996, 997,
&end
#
# 66 LYS HA 93 TYR QD 4.79 (#peak 12657)
&rst
ixpk= 12657, nxpk= 0, iat= 965, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2=1414,1423,
&end
#
# 66 LYS HA 93 TYR QE 3.81 (#peak 8220)
&rst
ixpk= 8220, nxpk= 0, iat= 965, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1416,1421,
&end
#
# 66 LYS HB2 67 VAL HN 4.41 (#peak 1421)
&rst
ixpk= 1421, nxpk= 0, iat= 967, 985, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 66 LYS HB3 66 LYS QE 5.30 (#peak 2388)
&rst
ixpk= 2388, nxpk= 0, iat= 968, -1, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr2= 976, 977,
&end
#
# 66 LYS HB3 67 VAL HN 4.58 (#peak 1422)
&rst
ixpk= 1422, nxpk= 0, iat= 968, 985, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 66 LYS HB3 67 VAL QQG 6.15 (#peak 1589)
&rst
ixpk= 1589, nxpk= 0, iat= 968, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr2= 991, 992, 993, 995, 996, 997,
&end
#
# 66 LYS HG2 67 VAL HN 4.72 (#peak 1426)
&rst
ixpk= 1426, nxpk= 0, iat= 970, 985, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 66 LYS HG2 94 LYS QB 3.38 (#peak 4355)
&rst
ixpk= 4355, nxpk= 0, iat= 970, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr2=1431,1432,
&end
#
# 66 LYS HG3 94 LYS QB 3.29 (#peak 4351)
&rst
ixpk= 4351, nxpk= 0, iat= 971, -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr2=1431,1432,
&end
#
# 66 LYS O 94 LYS HN 2.40
&rst
ixpk= 4351, nxpk= 0, iat= 983,1427, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 66 LYS O 94 LYS N 3.30
&rst
ixpk= 4351, nxpk= 0, iat= 983,1426, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 67 VAL HN 67 VAL HB 3.92 (#peak 1419)
&rst
ixpk= 1419, nxpk= 0, iat= 985, 989, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 67 VAL HN 67 VAL QQG 3.34 (#peak 1425)
&rst
ixpk= 1425, nxpk= 0, iat= 985, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 991, 992, 993, 995, 996, 997,
&end
#
# 67 VAL HN 68 SER HN 5.52 (#peak 3641)
&rst
ixpk= 3641, nxpk= 0, iat= 985,1001, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 67 VAL HN 93 TYR QD 5.88 (#peak 3842)
&rst
ixpk= 3842, nxpk= 0, iat= 985, -1, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
igr2=1414,1423,
&end
#
# 67 VAL HN 93 TYR QE 5.31 (#peak 3841)
&rst
ixpk= 3841, nxpk= 0, iat= 985, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=1416,1421,
&end
#
# 67 VAL HA 93 TYR QD 3.81 (#peak 12658)
&rst
ixpk= 12658, nxpk= 0, iat= 987, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1414,1423,
&end
#
# 67 VAL HA 93 TYR QE 5.43 (#peak 12662)
&rst
ixpk= 12662, nxpk= 0, iat= 987, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr2=1416,1421,
&end
#
# 67 VAL HA 94 LYS HN 6.05 (#peak 4231)
&rst
ixpk= 4231, nxpk= 0, iat= 987,1427, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 67 VAL QQG 149 THR HB 5.51 (#peak 4448)
&rst
ixpk= 4448, nxpk= 0, iat= -1,2273, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
igr1= 991, 992, 993, 995, 996, 997,
&end
#
# 67 VAL QQG 149 THR QG2 4.28 (#peak 4449)
&rst
ixpk= 4449, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 991, 992, 993, 995, 996, 997,
igr2=2275,2276,2277,
&end
#
# 67 VAL QQG 68 SER HN 3.73 (#peak 640)
&rst
ixpk= 640, nxpk= 0, iat= -1,1001, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1= 991, 992, 993, 995, 996, 997,
&end
#
# 67 VAL QQG 93 TYR HA 6.15 (#peak 1157)
&rst
ixpk= 1157, nxpk= 0, iat= -1,1408, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1= 991, 992, 993, 995, 996, 997,
&end
#
# 67 VAL QQG 93 TYR QD 3.37 (#peak 9622)
&rst
ixpk= 9622, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 991, 992, 993, 995, 996, 997,
igr2=1414,1423,
&end
#
# 67 VAL QQG 93 TYR QE 6.15 (#peak 4531)
&rst
ixpk= 4531, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.31, r4= 9.81,
igr1= 991, 992, 993, 995, 996, 997,
igr2=1416,1421,
&end
#
# 67 VAL QQG 94 LYS HN 4.55 (#peak 4709)
&rst
ixpk= 4709, nxpk= 0, iat= -1,1427, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1= 991, 992, 993, 995, 996, 997,
&end
#
# 68 SER HN 92 VAL HN 6.11 (#peak 3444)
&rst
ixpk= 3444, nxpk= 0, iat=1001,1390, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61, &end
#
# 68 SER HN 92 VAL O 2.40
&rst
ixpk= 3444, nxpk= 0, iat=1001,1404, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 68 SER N 92 VAL O 3.30
&rst
ixpk= 3444, nxpk= 0, iat=1000,1404, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 68 SER O 92 VAL HN 2.40
&rst
ixpk= 3444, nxpk= 0, iat=1010,1390, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 68 SER O 92 VAL N 3.30
&rst
ixpk= 3444, nxpk= 0, iat=1010,1389, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 69 ARG HN 69 ARG QD 4.70 (#peak 945)
&rst
ixpk= 945, nxpk= 0, iat=1012, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=1022,1023,
&end
#
# 69 ARG HN 69 ARG QG 4.13 (#peak 944)
&rst
ixpk= 944, nxpk= 0, iat=1012, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1019,1020,
&end
#
# 69 ARG HN 70 PHE HN 4.76 (#peak 947)
&rst
ixpk= 947, nxpk= 0, iat=1012,1036, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 69 ARG HA 91 GLN HA 3.69 (#peak 4334)
&rst
ixpk= 4334, nxpk= 0, iat=1014,1375, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 70 PHE HN 70 PHE QD 4.45 (#peak 2511)
&rst
ixpk= 2511, nxpk= 0, iat=1036, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr2=1044,1052,
&end
#
# 70 PHE HN 90 PHE O 2.40
&rst
ixpk= 2511, nxpk= 0, iat=1036,1371, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 70 PHE HN 90 PHE QD 6.15 (#peak 3829)
&rst
ixpk= 3829, nxpk= 0, iat=1036, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=1361,1369,
&end
#
# 70 PHE HA 71 ASP HA 6.15 (#peak 1284)
&rst
ixpk= 1284, nxpk= 0, iat=1038,1058, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 70 PHE N 90 PHE O 3.30
&rst
ixpk= 1284, nxpk= 0, iat=1035,1371, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 70 PHE QB 71 ASP HN 4.38 (#peak 2680)
&rst
ixpk= 2680, nxpk= 0, iat= -1,1056, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=1040,1041,
&end
#
# 70 PHE QB 72 PHE QD 4.82 (#peak 11971)
&rst
ixpk= 11971, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1=1040,1041,
igr2=1076,1084,
&end
#
# 70 PHE QD 71 ASP HN 4.40 (#peak 2689)
&rst
ixpk= 2689, nxpk= 0, iat= -1,1056, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=1044,1052,
&end
#
# 70 PHE QD 90 PHE QD 3.69 (#peak 11914)
&rst
ixpk= 11914, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1=1044,1052,
igr2=1361,1369,
&end
#
# 70 PHE QD 90 PHE QE 4.78 (#peak 12598)
&rst
ixpk= 12598, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1=1044,1052,
igr2=1363,1367,
&end
#
# 70 PHE QD 92 VAL HN 6.15 (#peak 12445)
&rst
ixpk= 12445, nxpk= 0, iat= -1,1390, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1044,1052,
&end
#
# 70 PHE QD 92 VAL QG1 4.07 (#peak 13148)
&rst
ixpk= 13148, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1=1044,1052,
igr2=1396,1397,1398,
&end
#
# 70 PHE QE 90 PHE QD 5.26 (#peak 11913)
&rst
ixpk= 11913, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr1=1046,1050,
igr2=1361,1369,
&end
#
# 70 PHE QE 90 PHE QE 6.15 (#peak 12599)
&rst
ixpk= 12599, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.75, r4= 8.25,
igr1=1046,1050,
igr2=1363,1367,
&end
#
# 70 PHE QE 92 VAL HB 4.78 (#peak 12981)
&rst
ixpk= 12981, nxpk= 0, iat= -1,1394, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1046,1050,
&end
#
# 70 PHE QE 92 VAL QG1 4.35 (#peak 12241)
&rst
ixpk= 12241, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1=1046,1050,
igr2=1396,1397,1398,
&end
#
# 70 PHE QE 92 VAL QG2 4.43 (#peak 12615)
&rst
ixpk= 12615, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=1046,1050,
igr2=1400,1401,1402,
&end
#
# 71 ASP HN 71 ASP HB2 3.88 (#peak 2688)
&rst
ixpk= 2688, nxpk= 0, iat=1056,1060, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 71 ASP HN 71 ASP HB3 3.92 (#peak 2684)
&rst
ixpk= 2684, nxpk= 0, iat=1056,1061, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 71 ASP HA 72 PHE HA 6.15 (#peak 3215)
&rst
ixpk= 3215, nxpk= 0, iat=1058,1070, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 71 ASP HA 88 GLY HN 5.85 (#peak 3912)
&rst
ixpk= 3912, nxpk= 0, iat=1058,1331, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 71 ASP HA 89 GLU HA 3.72 (#peak 12267)
&rst
ixpk= 12267, nxpk= 0, iat=1058,1340, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 71 ASP HB2 72 PHE HN 4.68 (#peak 1087)
&rst
ixpk= 1087, nxpk= 0, iat=1060,1068, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 72 PHE HN 73 ILE HN 5.51 (#peak 1200)
&rst
ixpk= 1200, nxpk= 0, iat=1068,1088, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 72 PHE HN 88 GLY HN 4.60 (#peak 3448)
&rst
ixpk= 3448, nxpk= 0, iat=1068,1331, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 72 PHE HN 88 GLY O 2.40
&rst
ixpk= 3448, nxpk= 0, iat=1068,1336, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 72 PHE HN 89 GLU HA 5.02 (#peak 3459)
&rst
ixpk= 3459, nxpk= 0, iat=1068,1340, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 72 PHE HN 90 PHE HN 5.47 (#peak 3449)
&rst
ixpk= 3449, nxpk= 0, iat=1068,1353, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 72 PHE HA 73 ILE QD1 6.15 (#peak 3219)
&rst
ixpk= 3219, nxpk= 0, iat=1070, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1101,1102,1103,
&end
#
# 72 PHE HB2 73 ILE HN 5.05 (#peak 8948)
&rst
ixpk= 8948, nxpk= 0, iat=1072,1088, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 72 PHE HB3 73 ILE HN 5.69 (#peak 3521)
&rst
ixpk= 3521, nxpk= 0, iat=1073,1088, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 72 PHE N 88 GLY O 3.30
&rst
ixpk= 3521, nxpk= 0, iat=1067,1336, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 72 PHE O 88 GLY HN 2.40
&rst
ixpk= 3521, nxpk= 0, iat=1086,1331, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 72 PHE O 88 GLY N 3.30
&rst
ixpk= 3521, nxpk= 0, iat=1086,1330, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 73 ILE HN 73 ILE HG12 5.07 (#peak 1199)
&rst
ixpk= 1199, nxpk= 0, iat=1088,1098, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 73 ILE HN 73 ILE HG13 5.80 (#peak 1207)
&rst
ixpk= 1207, nxpk= 0, iat=1088,1099, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 73 ILE HN 73 ILE QD1 4.95 (#peak 1203)
&rst
ixpk= 1203, nxpk= 0, iat=1088, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2=1101,1102,1103,
&end
#
# 73 ILE HN 73 ILE QG2 5.36 (#peak 1205)
&rst
ixpk= 1205, nxpk= 0, iat=1088, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr2=1094,1095,1096,
&end
#
# 73 ILE HN 74 ARG HN 5.11 (#peak 125)
&rst
ixpk= 125, nxpk= 0, iat=1088,1107, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 73 ILE HA 73 ILE QD1 6.15 (#peak 2338)
&rst
ixpk= 2338, nxpk= 0, iat=1090, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1101,1102,1103,
&end
#
# 73 ILE HA 88 GLY HN 5.12 (#peak 3451)
&rst
ixpk= 3451, nxpk= 0, iat=1090,1331, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 73 ILE HB 74 ARG HN 4.30 (#peak 126)
&rst
ixpk= 126, nxpk= 0, iat=1092,1107, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 73 ILE QD1 74 ARG HN 5.68 (#peak 128)
&rst
ixpk= 128, nxpk= 0, iat= -1,1107, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1=1101,1102,1103,
&end
#
# 73 ILE QG2 74 ARG HN 4.31 (#peak 130)
&rst
ixpk= 130, nxpk= 0, iat= -1,1107, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1=1094,1095,1096,
&end
#
# 73 ILE QG2 86 GLU HN 5.24 (#peak 4716)
&rst
ixpk= 4716, nxpk= 0, iat= -1,1305, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1=1094,1095,1096,
&end
#
# 74 ARG HN 74 ARG QD 5.89 (#peak 4715)
&rst
ixpk= 4715, nxpk= 0, iat=1107, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1117,1118,
&end
#
# 74 ARG HN 86 GLU HN 5.04 (#peak 3890)
&rst
ixpk= 3890, nxpk= 0, iat=1107,1305, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 74 ARG HN 86 GLU HB2 6.15 (#peak 4102)
&rst
ixpk= 4102, nxpk= 0, iat=1107,1309, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 74 ARG HN 86 GLU HB3 6.15 (#peak 4103)
&rst
ixpk= 4103, nxpk= 0, iat=1107,1310, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 74 ARG HN 86 GLU O 2.40
&rst
ixpk= 4103, nxpk= 0, iat=1107,1318, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 74 ARG HN 87 SER HA 5.87 (#peak 3461)
&rst
ixpk= 3461, nxpk= 0, iat=1107,1322, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 74 ARG HN 88 GLY HN 5.79 (#peak 3452)
&rst
ixpk= 3452, nxpk= 0, iat=1107,1331, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 74 ARG N 86 GLU O 3.30
&rst
ixpk= 3452, nxpk= 0, iat=1106,1318, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 74 ARG QB 75 GLN HN 6.15 (#peak 3831)
&rst
ixpk= 3831, nxpk= 0, iat= -1,1131, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1111,1112,
&end
#
# 74 ARG QB 86 GLU HN 5.94 (#peak 4714)
&rst
ixpk= 4714, nxpk= 0, iat= -1,1305, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1=1111,1112,
&end
#
# 74 ARG QG 86 GLU HN 4.52 (#peak 4710)
&rst
ixpk= 4710, nxpk= 0, iat= -1,1305, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1=1114,1115,
&end
#
# 75 GLN HN 75 GLN QB 4.20 (#peak 112)
&rst
ixpk= 112, nxpk= 0, iat=1131, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=1135,1136,
&end
#
# 75 GLN HN 76 ILE HN 4.88 (#peak 1228)
&rst
ixpk= 1228, nxpk= 0, iat=1131,1148, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 75 GLN HA 76 ILE QG2 6.15 (#peak 1082)
&rst
ixpk= 1082, nxpk= 0, iat=1133, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1154,1155,1156,
&end
#
# 75 GLN HE21 82 LEU QD2 5.75 (#peak 4120)
&rst
ixpk= 4120, nxpk= 0, iat=1143, -1, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr2=1247,1248,1249,
&end
#
# 75 GLN HE22 82 LEU QD2 5.61 (#peak 4123)
&rst
ixpk= 4123, nxpk= 0, iat=1144, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr2=1247,1248,1249,
&end
#
# 75 GLN QB 75 GLN HE21 4.32 (#peak 93)
&rst
ixpk= 93, nxpk= 0, iat= -1,1143, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1=1135,1136,
&end
#
# 75 GLN QB 75 GLN HE22 4.20 (#peak 2523)
&rst
ixpk= 2523, nxpk= 0, iat= -1,1144, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr1=1135,1136,
&end
#
# 75 GLN QB 76 ILE HN 4.15 (#peak 4014)
&rst
ixpk= 4014, nxpk= 0, iat= -1,1148, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=1135,1136,
&end
#
# 75 GLN QG 76 ILE HN 4.44 (#peak 4015)
&rst
ixpk= 4015, nxpk= 0, iat= -1,1148, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1=1138,1139,
&end
#
# 76 ILE HN 76 ILE HG12 4.77 (#peak 1233)
&rst
ixpk= 1233, nxpk= 0, iat=1148,1158, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 76 ILE HN 76 ILE QG2 3.77 (#peak 1230)
&rst
ixpk= 1230, nxpk= 0, iat=1148, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2=1154,1155,1156,
&end
#
# 76 ILE HN 77 GLU HN 5.29 (#peak 3463)
&rst
ixpk= 3463, nxpk= 0, iat=1148,1167, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 76 ILE HN 78 VAL HN 5.86 (#peak 4135)
&rst
ixpk= 4135, nxpk= 0, iat=1148,1182, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 76 ILE HN 83 ILE HN 5.48 (#peak 4134)
&rst
ixpk= 4134, nxpk= 0, iat=1148,1253, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 76 ILE HA 76 ILE QD1 6.15 (#peak 3963)
&rst
ixpk= 3963, nxpk= 0, iat=1150, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1161,1162,1163,
&end
#
# 76 ILE HA 77 GLU HN 3.40 (#peak 2712)
&rst
ixpk= 2712, nxpk= 0, iat=1150,1167, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 76 ILE HG12 77 GLU HN 3.97 (#peak 2711)
&rst
ixpk= 2711, nxpk= 0, iat=1158,1167, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 76 ILE QD1 77 GLU HN 4.67 (#peak 2710)
&rst
ixpk= 2710, nxpk= 0, iat= -1,1167, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=1161,1162,1163,
&end
#
# 77 GLU HN 77 GLU HG2 5.13 (#peak 3539)
&rst
ixpk= 3539, nxpk= 0, iat=1167,1174, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 77 GLU HN 77 GLU HG3 5.16 (#peak 2705)
&rst
ixpk= 2705, nxpk= 0, iat=1167,1175, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 77 GLU HN 78 VAL HN 4.58 (#peak 2713)
&rst
ixpk= 2713, nxpk= 0, iat=1167,1182, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 77 GLU HA 78 VAL HN 3.28 (#peak 2620)
&rst
ixpk= 2620, nxpk= 0, iat=1169,1182, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 77 GLU HA 78 VAL HB 6.15 (#peak 1806)
&rst
ixpk= 1806, nxpk= 0, iat=1169,1186, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 77 GLU HA 80 GLY HN 6.15 (#peak 4601)
&rst
ixpk= 4601, nxpk= 0, iat=1169,1210, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 77 GLU HA 81 GLN HN 4.34 (#peak 3471)
&rst
ixpk= 3471, nxpk= 0, iat=1169,1217, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 77 GLU HA 82 LEU QD1 6.15 (#peak 4613)
&rst
ixpk= 4613, nxpk= 0, iat=1169, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1243,1244,1245,
&end
#
# 77 GLU HA 82 LEU QD2 6.15 (#peak 4614)
&rst
ixpk= 4614, nxpk= 0, iat=1169, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1247,1248,1249,
&end
#
# 77 GLU HA 83 ILE HN 5.35 (#peak 3469)
&rst
ixpk= 3469, nxpk= 0, iat=1169,1253, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 77 GLU HB2 81 GLN HN 5.77 (#peak 4057)
&rst
ixpk= 4057, nxpk= 0, iat=1171,1217, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27, &end
#
# 77 GLU HB3 78 VAL HN 6.15 (#peak 2360)
&rst
ixpk= 2360, nxpk= 0, iat=1172,1182, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 77 GLU HB3 80 GLY HN 6.15 (#peak 4053)
&rst
ixpk= 4053, nxpk= 0, iat=1172,1210, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 77 GLU HB3 81 GLN HN 4.90 (#peak 4060)
&rst
ixpk= 4060, nxpk= 0, iat=1172,1217, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 77 GLU HG2 78 VAL HN 6.15 (#peak 2874)
&rst
ixpk= 2874, nxpk= 0, iat=1174,1182, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 77 GLU HG2 80 GLY HN 4.48 (#peak 4054)
&rst
ixpk= 4054, nxpk= 0, iat=1174,1210, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 77 GLU HG2 81 GLN HN 4.71 (#peak 4058)
&rst
ixpk= 4058, nxpk= 0, iat=1174,1217, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 77 GLU HG3 78 VAL HN 6.10 (#peak 522)
&rst
ixpk= 522, nxpk= 0, iat=1175,1182, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60, &end
#
# 77 GLU HG3 80 GLY HN 5.03 (#peak 4056)
&rst
ixpk= 4056, nxpk= 0, iat=1175,1210, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 77 GLU HG3 81 GLN HN 6.15 (#peak 4059)
&rst
ixpk= 4059, nxpk= 0, iat=1175,1217, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 78 VAL HN 78 VAL QQG 3.29 (#peak 2618)
&rst
ixpk= 2618, nxpk= 0, iat=1182, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2=1188,1189,1190,1192,1193,1194,
&end
#
# 78 VAL HN 79 ASP HN 5.81 (#peak 3464)
&rst
ixpk= 3464, nxpk= 0, iat=1182,1198, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 78 VAL HN 80 GLY HN 4.83 (#peak 3467)
&rst
ixpk= 3467, nxpk= 0, iat=1182,1210, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 78 VAL HN 81 GLN HN 4.26 (#peak 4009)
&rst
ixpk= 4009, nxpk= 0, iat=1182,1217, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 78 VAL HN 83 ILE HN 5.39 (#peak 4013)
&rst
ixpk= 4013, nxpk= 0, iat=1182,1253, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 78 VAL HB 79 ASP HN 4.37 (#peak 1893)
&rst
ixpk= 1893, nxpk= 0, iat=1186,1198, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 78 VAL HB 79 ASP HA 6.15 (#peak 4618)
&rst
ixpk= 4618, nxpk= 0, iat=1186,1200, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 78 VAL HB 80 GLY HN 5.15 (#peak 4004)
&rst
ixpk= 4004, nxpk= 0, iat=1186,1210, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 78 VAL QQG 79 ASP HN 3.58 (#peak 1892)
&rst
ixpk= 1892, nxpk= 0, iat= -1,1198, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1=1188,1189,1190,1192,1193,1194,
&end
#
# 78 VAL QQG 79 ASP HA 6.15 (#peak 1052)
&rst
ixpk= 1052, nxpk= 0, iat= -1,1200, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=1188,1189,1190,1192,1193,1194,
&end
#
# 78 VAL QQG 79 ASP HB2 6.03 (#peak 1333)
&rst
ixpk= 1333, nxpk= 0, iat= -1,1202, r1= 1.30, r2= 1.80, r3= 8.13, r4= 8.63,
igr1=1188,1189,1190,1192,1193,1194,
&end
#
# 78 VAL QQG 79 ASP HB3 5.80 (#peak 1339)
&rst
ixpk= 1339, nxpk= 0, iat= -1,1203, r1= 1.30, r2= 1.80, r3= 7.82, r4= 8.32,
igr1=1188,1189,1190,1192,1193,1194,
&end
#
# 78 VAL QQG 80 GLY HN 4.69 (#peak 4005)
&rst
ixpk= 4005, nxpk= 0, iat= -1,1210, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1=1188,1189,1190,1192,1193,1194,
&end
#
# 78 VAL QQG 81 GLN HN 4.09 (#peak 4006)
&rst
ixpk= 4006, nxpk= 0, iat= -1,1217, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1=1188,1189,1190,1192,1193,1194,
&end
#
# 78 VAL QQG 81 GLN HG3 6.15 (#peak 4616)
&rst
ixpk= 4616, nxpk= 0, iat= -1,1225, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=1188,1189,1190,1192,1193,1194,
&end
#
# 79 ASP HN 79 ASP HB2 4.11 (#peak 1894)
&rst
ixpk= 1894, nxpk= 0, iat=1198,1202, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 79 ASP HN 80 GLY HN 4.35 (#peak 1896)
&rst
ixpk= 1896, nxpk= 0, iat=1198,1210, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 79 ASP HA 81 GLN HN 4.84 (#peak 3468)
&rst
ixpk= 3468, nxpk= 0, iat=1200,1217, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 79 ASP HA 81 GLN HG3 5.88 (#peak 4620)
&rst
ixpk= 4620, nxpk= 0, iat=1200,1225, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 79 ASP HB2 80 GLY HN 4.53 (#peak 2480)
&rst
ixpk= 2480, nxpk= 0, iat=1202,1210, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 79 ASP HB2 81 GLN HN 4.68 (#peak 4002)
&rst
ixpk= 4002, nxpk= 0, iat=1202,1217, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 79 ASP HB3 80 GLY HN 5.22 (#peak 2488)
&rst
ixpk= 2488, nxpk= 0, iat=1203,1210, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 79 ASP HB3 81 GLN HN 4.74 (#peak 4003)
&rst
ixpk= 4003, nxpk= 0, iat=1203,1217, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 80 GLY HN 81 GLN HN 3.64 (#peak 1932)
&rst
ixpk= 1932, nxpk= 0, iat=1210,1217, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 80 GLY HN 81 GLN HA 5.92 (#peak 3544)
&rst
ixpk= 3544, nxpk= 0, iat=1210,1219, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 80 GLY HN 81 GLN HG2 6.15 (#peak 4114)
&rst
ixpk= 4114, nxpk= 0, iat=1210,1224, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 80 GLY HA2 81 GLN HN 3.42 (#peak 1928)
&rst
ixpk= 1928, nxpk= 0, iat=1212,1217, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 80 GLY HA2 81 GLN HG2 6.15 (#peak 4111)
&rst
ixpk= 4111, nxpk= 0, iat=1212,1224, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 81 GLN HN 81 GLN HB3 3.66 (#peak 1918)
&rst
ixpk= 1918, nxpk= 0, iat=1217,1222, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 81 GLN HN 81 GLN HG2 3.44 (#peak 1933)
&rst
ixpk= 1933, nxpk= 0, iat=1217,1224, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 81 GLN HN 81 GLN HG3 3.65 (#peak 1931)
&rst
ixpk= 1931, nxpk= 0, iat=1217,1225, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 81 GLN HN 82 LEU HN 4.53 (#peak 792)
&rst
ixpk= 792, nxpk= 0, iat=1217,1234, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 81 GLN HA 82 LEU HN 3.42 (#peak 794)
&rst
ixpk= 794, nxpk= 0, iat=1219,1234, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 81 GLN HB2 82 LEU HN 4.45 (#peak 791)
&rst
ixpk= 791, nxpk= 0, iat=1221,1234, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 81 GLN HB3 82 LEU HN 4.17 (#peak 786)
&rst
ixpk= 786, nxpk= 0, iat=1222,1234, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 81 GLN HG2 82 LEU HN 5.75 (#peak 797)
&rst
ixpk= 797, nxpk= 0, iat=1224,1234, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 81 GLN HG3 82 LEU HN 5.20 (#peak 796)
&rst
ixpk= 796, nxpk= 0, iat=1225,1234, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 82 LEU HN 82 LEU HB2 3.79 (#peak 795)
&rst
ixpk= 795, nxpk= 0, iat=1234,1238, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 82 LEU HN 82 LEU HB3 3.94 (#peak 788)
&rst
ixpk= 788, nxpk= 0, iat=1234,1239, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 82 LEU HN 82 LEU QD1 3.94 (#peak 790)
&rst
ixpk= 790, nxpk= 0, iat=1234, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=1243,1244,1245,
&end
#
# 82 LEU HN 82 LEU QD2 4.63 (#peak 3232)
&rst
ixpk= 3232, nxpk= 0, iat=1234, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=1247,1248,1249,
&end
#
# 82 LEU HN 83 ILE HN 5.01 (#peak 2669)
&rst
ixpk= 2669, nxpk= 0, iat=1234,1253, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 82 LEU HN 83 ILE QD1 6.15 (#peak 3041)
&rst
ixpk= 3041, nxpk= 0, iat=1234, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1266,1267,1268,
&end
#
# 82 LEU HA 82 LEU QD1 5.95 (#peak 4158)
&rst
ixpk= 4158, nxpk= 0, iat=1236, -1, r1= 1.30, r2= 1.80, r3= 7.15, r4= 7.65,
igr2=1243,1244,1245,
&end
#
# 82 LEU HA 82 LEU QD2 5.22 (#peak 1655)
&rst
ixpk= 1655, nxpk= 0, iat=1236, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=1247,1248,1249,
&end
#
# 82 LEU HB2 83 ILE HN 5.14 (#peak 2677)
&rst
ixpk= 2677, nxpk= 0, iat=1238,1253, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 82 LEU QD1 83 ILE HN 5.06 (#peak 2679)
&rst
ixpk= 2679, nxpk= 0, iat= -1,1253, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1=1243,1244,1245,
&end
#
# 82 LEU QD2 83 ILE HN 6.04 (#peak 1660)
&rst
ixpk= 1660, nxpk= 0, iat= -1,1253, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr1=1247,1248,1249,
&end
#
# 83 ILE HN 83 ILE HB 3.96 (#peak 2675)
&rst
ixpk= 2675, nxpk= 0, iat=1253,1257, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 83 ILE HN 83 ILE HG12 4.14 (#peak 2676)
&rst
ixpk= 2676, nxpk= 0, iat=1253,1263, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 83 ILE HN 83 ILE HG13 3.96 (#peak 2667)
&rst
ixpk= 2667, nxpk= 0, iat=1253,1264, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 83 ILE HN 83 ILE QD1 5.37 (#peak 2674)
&rst
ixpk= 2674, nxpk= 0, iat=1253, -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr2=1266,1267,1268,
&end
#
# 83 ILE HN 83 ILE QG2 4.68 (#peak 2668)
&rst
ixpk= 2668, nxpk= 0, iat=1253, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=1259,1260,1261,
&end
#
# 83 ILE HN 84 THR HN 4.70 (#peak 2666)
&rst
ixpk= 2666, nxpk= 0, iat=1253,1272, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 83 ILE HA 83 ILE QD1 5.66 (#peak 3037)
&rst
ixpk= 3037, nxpk= 0, iat=1255, -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
igr2=1266,1267,1268,
&end
#
# 83 ILE HB 84 THR HN 5.13 (#peak 480)
&rst
ixpk= 480, nxpk= 0, iat=1257,1272, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 83 ILE HG12 109 GLN HE21 5.91 (#peak 4493)
&rst
ixpk= 4493, nxpk= 0, iat=1263,1672, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 83 ILE HG12 84 THR HN 5.40 (#peak 481)
&rst
ixpk= 481, nxpk= 0, iat=1263,1272, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 83 ILE HG13 84 THR HN 5.47 (#peak 476)
&rst
ixpk= 476, nxpk= 0, iat=1264,1272, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 83 ILE QD1 109 GLN HE21 4.29 (#peak 4459)
&rst
ixpk= 4459, nxpk= 0, iat= -1,1672, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr1=1266,1267,1268,
&end
#
# 83 ILE QD1 109 GLN HE22 3.99 (#peak 4129)
&rst
ixpk= 4129, nxpk= 0, iat= -1,1673, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1=1266,1267,1268,
&end
#
# 83 ILE QD1 112 GLU HN 5.99 (#peak 4491)
&rst
ixpk= 4491, nxpk= 0, iat= -1,1700, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
igr1=1266,1267,1268,
&end
#
# 83 ILE QD1 84 THR HN 5.26 (#peak 479)
&rst
ixpk= 479, nxpk= 0, iat= -1,1272, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1=1266,1267,1268,
&end
#
# 83 ILE QG2 109 GLN HE21 3.26 (#peak 4458)
&rst
ixpk= 4458, nxpk= 0, iat= -1,1672, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr1=1259,1260,1261,
&end
#
# 83 ILE QG2 109 GLN HE22 3.27 (#peak 4457)
&rst
ixpk= 4457, nxpk= 0, iat= -1,1673, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1=1259,1260,1261,
&end
#
# 83 ILE QG2 84 THR HN 3.92 (#peak 477)
&rst
ixpk= 477, nxpk= 0, iat= -1,1272, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr1=1259,1260,1261,
&end
#
# 84 THR HN 84 THR HB 3.84 (#peak 475)
&rst
ixpk= 475, nxpk= 0, iat=1272,1276, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 84 THR HN 84 THR QG2 4.19 (#peak 483)
&rst
ixpk= 483, nxpk= 0, iat=1272, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1278,1279,1280,
&end
#
# 84 THR HN 85 LEU HN 5.86 (#peak 3156)
&rst
ixpk= 3156, nxpk= 0, iat=1272,1286, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 84 THR HB 85 LEU HN 6.15 (#peak 338)
&rst
ixpk= 338, nxpk= 0, iat=1276,1286, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 84 THR QG2 85 LEU HN 4.71 (#peak 1883)
&rst
ixpk= 1883, nxpk= 0, iat= -1,1286, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1=1278,1279,1280,
&end
#
# 85 LEU HN 85 LEU QQD 4.13 (#peak 1880)
&rst
ixpk= 1880, nxpk= 0, iat=1286, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=1299,1300,1301,1295,1296,1297,
&end
#
# 85 LEU HN 86 GLU HN 5.04 (#peak 1881)
&rst
ixpk= 1881, nxpk= 0, iat=1286,1305, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 85 LEU HA 109 GLN HN 5.50 (#peak 4109)
&rst
ixpk= 4109, nxpk= 0, iat=1288,1660, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 85 LEU HA 85 LEU QQD 6.13 (#peak 3697)
&rst
ixpk= 3697, nxpk= 0, iat=1288, -1, r1= 1.30, r2= 1.80, r3= 8.26, r4= 8.76,
igr2=1299,1300,1301,1295,1296,1297,
&end
#
# 85 LEU HB2 86 GLU HN 4.33 (#peak 4018)
&rst
ixpk= 4018, nxpk= 0, iat=1290,1305, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 85 LEU HB3 86 GLU HN 5.07 (#peak 4019)
&rst
ixpk= 4019, nxpk= 0, iat=1291,1305, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 85 LEU QQD 109 GLN HG2 6.15 (#peak 4727)
&rst
ixpk= 4727, nxpk= 0, iat= -1,1667, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=1299,1300,1301,1295,1296,1297,
&end
#
# 85 LEU QQD 86 GLU HN 4.52 (#peak 2220)
&rst
ixpk= 2220, nxpk= 0, iat= -1,1305, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1=1299,1300,1301,1295,1296,1297,
&end
#
# 86 GLU HA 109 GLN HN 5.28 (#peak 3375)
&rst
ixpk= 3375, nxpk= 0, iat=1307,1660, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 86 GLU HB2 87 SER HN 4.22 (#peak 1241)
&rst
ixpk= 1241, nxpk= 0, iat=1309,1320, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 86 GLU HB3 87 SER HN 4.89 (#peak 1240)
&rst
ixpk= 1240, nxpk= 0, iat=1310,1320, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 87 SER HN 106 GLU HN 5.95 (#peak 4108)
&rst
ixpk= 4108, nxpk= 0, iat=1320,1609, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 87 SER HN 107 GLN HN 6.15 (#peak 4124)
&rst
ixpk= 4124, nxpk= 0, iat=1320,1624, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 87 SER HN 108 ILE HA 5.07 (#peak 4767)
&rst
ixpk= 4767, nxpk= 0, iat=1320,1643, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 87 SER HN 108 ILE HB 5.37 (#peak 4132)
&rst
ixpk= 4132, nxpk= 0, iat=1320,1645, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 87 SER HN 108 ILE QD1 5.25 (#peak 4650)
&rst
ixpk= 4650, nxpk= 0, iat=1320, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2=1654,1655,1656,
&end
#
# 87 SER HN 108 ILE QG1 4.98 (#peak 4131)
&rst
ixpk= 4131, nxpk= 0, iat=1320, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr2=1651,1652,
&end
#
# 87 SER HN 108 ILE QG2 5.22 (#peak 4455)
&rst
ixpk= 4455, nxpk= 0, iat=1320, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=1647,1648,1649,
&end
#
# 87 SER HN 88 GLY HN 5.00 (#peak 1853)
&rst
ixpk= 1853, nxpk= 0, iat=1320,1331, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 87 SER HB2 88 GLY HN 3.86 (#peak 1854)
&rst
ixpk= 1854, nxpk= 0, iat=1324,1331, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 87 SER HB3 88 GLY HN 3.89 (#peak 1858)
&rst
ixpk= 1858, nxpk= 0, iat=1325,1331, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 88 GLY QA 89 GLU HB2 6.15 (#peak 2826)
&rst
ixpk= 2826, nxpk= 0, iat= -1,1342, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1333,1334,
&end
#
# 89 GLU HN 104 GLN HN 6.15 (#peak 4575)
&rst
ixpk= 4575, nxpk= 0, iat=1338,1578, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 89 GLU HN 104 GLN O 2.40
&rst
ixpk= 4575, nxpk= 0, iat=1338,1593, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 89 GLU HN 105 THR HA 4.71 (#peak 4647)
&rst
ixpk= 4647, nxpk= 0, iat=1338,1597, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 89 GLU HN 89 GLU HB3 4.11 (#peak 498)
&rst
ixpk= 498, nxpk= 0, iat=1338,1343, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 89 GLU HB2 90 PHE HN 4.38 (#peak 3456)
&rst
ixpk= 3456, nxpk= 0, iat=1342,1353, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 89 GLU HB3 90 PHE HN 5.34 (#peak 3455)
&rst
ixpk= 3455, nxpk= 0, iat=1343,1353, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, &end
#
# 89 GLU N 104 GLN O 3.30
&rst
ixpk= 3455, nxpk= 0, iat=1337,1593, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 89 GLU O 104 GLN HN 2.40
&rst
ixpk= 3455, nxpk= 0, iat=1351,1578, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 89 GLU O 104 GLN N 3.30
&rst
ixpk= 3455, nxpk= 0, iat=1351,1577, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 90 PHE HN 91 GLN HN 5.23 (#peak 1237)
&rst
ixpk= 1237, nxpk= 0, iat=1353,1373, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 90 PHE HZ 101 THR HA 5.52 (#peak 12180)
&rst
ixpk= 12180, nxpk= 0, iat=1365,1536, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 90 PHE HZ 101 THR HB 4.97 (#peak 12178)
&rst
ixpk= 12178, nxpk= 0, iat=1365,1538, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 90 PHE HZ 92 VAL QG1 4.75 (#peak 12622)
&rst
ixpk= 12622, nxpk= 0, iat=1365, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1396,1397,1398,
&end
#
# 90 PHE HZ 92 VAL QG2 4.12 (#peak 12621)
&rst
ixpk= 12621, nxpk= 0, iat=1365, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2=1400,1401,1402,
&end
#
# 90 PHE QD 101 THR HB 6.15 (#peak 12174)
&rst
ixpk= 12174, nxpk= 0, iat= -1,1538, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1361,1369,
&end
#
# 90 PHE QD 103 PHE HZ 6.05 (#peak 12010)
&rst
ixpk= 12010, nxpk= 0, iat= -1,1570, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1361,1369,
&end
#
# 90 PHE QD 103 PHE QD 4.40 (#peak 12006)
&rst
ixpk= 12006, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=1361,1369,
igr2=1566,1574,
&end
#
# 90 PHE QD 103 PHE QE 4.13 (#peak 12008)
&rst
ixpk= 12008, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=1361,1369,
igr2=1568,1572,
&end
#
# 90 PHE QD 92 VAL HN 6.04 (#peak 12422)
&rst
ixpk= 12422, nxpk= 0, iat= -1,1390, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr1=1361,1369,
&end
#
# 90 PHE QD 92 VAL QG1 4.41 (#peak 12334)
&rst
ixpk= 12334, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1=1361,1369,
igr2=1396,1397,1398,
&end
#
# 90 PHE QD 92 VAL QG2 5.24 (#peak 12027)
&rst
ixpk= 12027, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr1=1361,1369,
igr2=1400,1401,1402,
&end
#
# 90 PHE QE 101 THR HA 5.38 (#peak 12181)
&rst
ixpk= 12181, nxpk= 0, iat= -1,1536, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1363,1367,
&end
#
# 90 PHE QE 101 THR HB 4.00 (#peak 12172)
&rst
ixpk= 12172, nxpk= 0, iat= -1,1538, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=1363,1367,
&end
#
# 90 PHE QE 101 THR QG2 3.59 (#peak 12608)
&rst
ixpk= 12608, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1=1363,1367,
igr2=1540,1541,1542,
&end
#
# 90 PHE QE 102 ALA HN 4.88 (#peak 12336)
&rst
ixpk= 12336, nxpk= 0, iat= -1,1548, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1=1363,1367,
&end
#
# 90 PHE QE 103 PHE HZ 4.09 (#peak 12009)
&rst
ixpk= 12009, nxpk= 0, iat= -1,1570, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1=1363,1367,
&end
#
# 90 PHE QE 103 PHE QD 3.97 (#peak 12007)
&rst
ixpk= 12007, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1=1363,1367,
igr2=1566,1574,
&end
#
# 90 PHE QE 103 PHE QE 3.43 (#peak 5223)
&rst
ixpk= 5223, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr1=1363,1367,
igr2=1568,1572,
&end
#
# 90 PHE QE 92 VAL QG1 3.90 (#peak 12025)
&rst
ixpk= 12025, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=1363,1367,
igr2=1396,1397,1398,
&end
#
# 90 PHE QE 92 VAL QG2 4.97 (#peak 12022)
&rst
ixpk= 12022, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1=1363,1367,
igr2=1400,1401,1402,
&end
#
# 91 GLN HN 102 ALA HN 5.32 (#peak 3379)
&rst
ixpk= 3379, nxpk= 0, iat=1373,1548, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 91 GLN HN 102 ALA O 2.40
&rst
ixpk= 3379, nxpk= 0, iat=1373,1556, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 91 GLN HN 91 GLN QG 4.22 (#peak 748)
&rst
ixpk= 748, nxpk= 0, iat=1373, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1380,1381,
&end
#
# 91 GLN N 102 ALA O 3.30
&rst
ixpk= 748, nxpk= 0, iat=1372,1556, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 91 GLN QB 91 GLN HE21 3.46 (#peak 2284)
&rst
ixpk= 2284, nxpk= 0, iat= -1,1385, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr1=1377,1378,
&end
#
# 91 GLN QB 91 GLN HE22 3.35 (#peak 1876)
&rst
ixpk= 1876, nxpk= 0, iat= -1,1386, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr1=1377,1378,
&end
#
# 92 VAL HN 92 VAL HB 3.91 (#peak 2530)
&rst
ixpk= 2530, nxpk= 0, iat=1390,1394, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 92 VAL HN 92 VAL QG1 3.89 (#peak 2529)
&rst
ixpk= 2529, nxpk= 0, iat=1390, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2=1396,1397,1398,
&end
#
# 92 VAL HN 92 VAL QG2 4.00 (#peak 4719)
&rst
ixpk= 4719, nxpk= 0, iat=1390, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1400,1401,1402,
&end
#
# 92 VAL HN 93 TYR HN 4.71 (#peak 2531)
&rst
ixpk= 2531, nxpk= 0, iat=1390,1406, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 92 VAL HA 100 LEU HN 5.77 (#peak 4654)
&rst
ixpk= 4654, nxpk= 0, iat=1392,1515, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27, &end
#
# 92 VAL QG1 100 LEU HN 5.23 (#peak 3414)
&rst
ixpk= 3414, nxpk= 0, iat= -1,1515, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1=1396,1397,1398,
&end
#
# 92 VAL QG1 101 THR HB 4.34 (#peak 6168)
&rst
ixpk= 6168, nxpk= 0, iat= -1,1538, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1=1396,1397,1398,
&end
#
# 92 VAL QG1 93 TYR HN 4.72 (#peak 3850)
&rst
ixpk= 3850, nxpk= 0, iat= -1,1406, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1=1396,1397,1398,
&end
#
# 92 VAL QG1 93 TYR HA 6.15 (#peak 2467)
&rst
ixpk= 2467, nxpk= 0, iat= -1,1408, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=1396,1397,1398,
&end
#
# 92 VAL QG1 94 LYS HN 5.74 (#peak 12030)
&rst
ixpk= 12030, nxpk= 0, iat= -1,1427, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr1=1396,1397,1398,
&end
#
# 92 VAL QG2 101 THR HB 4.60 (#peak 12490)
&rst
ixpk= 12490, nxpk= 0, iat= -1,1538, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1=1400,1401,1402,
&end
#
# 92 VAL QG2 93 TYR HN 4.65 (#peak 1404)
&rst
ixpk= 1404, nxpk= 0, iat= -1,1406, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1400,1401,1402,
&end
#
# 93 TYR HN 100 LEU HN 4.97 (#peak 3447)
&rst
ixpk= 3447, nxpk= 0, iat=1406,1515, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 93 TYR HN 100 LEU O 2.40
&rst
ixpk= 3447, nxpk= 0, iat=1406,1532, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 93 TYR HN 101 THR HA 6.15 (#peak 4576)
&rst
ixpk= 4576, nxpk= 0, iat=1406,1536, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 93 TYR N 100 LEU O 3.30
&rst
ixpk= 4576, nxpk= 0, iat=1405,1532, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 93 TYR QB 100 LEU HN 6.13 (#peak 3446)
&rst
ixpk= 3446, nxpk= 0, iat= -1,1515, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr1=1410,1411,
&end
#
# 93 TYR QD 100 LEU QD1 3.64 (#peak 1393)
&rst
ixpk= 1393, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1=1414,1423,
igr2=1524,1525,1526,
&end
#
# 93 TYR QD 100 LEU QD2 3.26 (#peak 8117)
&rst
ixpk= 8117, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1=1414,1423,
igr2=1528,1529,1530,
&end
#
# 93 TYR QD 149 THR HB 4.90 (#peak 12244)
&rst
ixpk= 12244, nxpk= 0, iat= -1,2273, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1414,1423,
&end
#
# 93 TYR QD 149 THR QG2 4.44 (#peak 12243)
&rst
ixpk= 12243, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1414,1423,
igr2=2275,2276,2277,
&end
#
# 93 TYR QD 151 PHE QD 4.73 (#peak 11939)
&rst
ixpk= 11939, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1=1414,1423,
igr2=2301,2309,
&end
#
# 93 TYR QD 151 PHE QE 3.52 (#peak 12231)
&rst
ixpk= 12231, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1=1414,1423,
igr2=2303,2307,
&end
#
# 93 TYR QD 246 ALA QB 3.65 (#peak 4344)
&rst
ixpk= 4344, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=1414,1423,
igr2=3688,3689,3690,
&end
#
# 93 TYR QE 100 LEU QD1 5.12 (#peak 12257)
&rst
ixpk= 12257, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1416,1421,
igr2=1524,1525,1526,
&end
#
# 93 TYR QE 100 LEU QD2 4.39 (#peak 12258)
&rst
ixpk= 12258, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1=1416,1421,
igr2=1528,1529,1530,
&end
#
# 93 TYR QE 149 THR HN 6.15 (#peak 12254)
&rst
ixpk= 12254, nxpk= 0, iat= -1,2269, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1416,1421,
&end
#
# 93 TYR QE 149 THR HB 3.21 (#peak 12251)
&rst
ixpk= 12251, nxpk= 0, iat= -1,2273, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1416,1421,
&end
#
# 93 TYR QE 149 THR QG2 3.30 (#peak 12250)
&rst
ixpk= 12250, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,
igr1=1416,1421,
igr2=2275,2276,2277,
&end
#
# 93 TYR QE 151 PHE QD 5.43 (#peak 12233)
&rst
ixpk= 12233, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
igr1=1416,1421,
igr2=2301,2309,
&end
#
# 93 TYR QE 151 PHE QE 3.96 (#peak 12232)
&rst
ixpk= 12232, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr1=1416,1421,
igr2=2303,2307,
&end
#
# 93 TYR QE 246 ALA QB 3.66 (#peak 12878)
&rst
ixpk= 12878, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=1416,1421,
igr2=3688,3689,3690,
&end
#
# 94 LYS HN 94 LYS QD 5.56 (#peak 4238)
&rst
ixpk= 4238, nxpk= 0, iat=1427, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2=1437,1438,
&end
#
# 94 LYS HN 94 LYS QG 5.08 (#peak 4239)
&rst
ixpk= 4239, nxpk= 0, iat=1427, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1434,1435,
&end
#
# 94 LYS HA 100 LEU HN 5.52 (#peak 3442)
&rst
ixpk= 3442, nxpk= 0, iat=1429,1515, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 94 LYS HA 99 ALA QB 3.52 (#peak 4348)
&rst
ixpk= 4348, nxpk= 0, iat=1429, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2=1509,1510,1511,
&end
#
# 94 LYS QB 99 ALA QB 4.58 (#peak 4356)
&rst
ixpk= 4356, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1431,1432,
igr2=1509,1510,1511,
&end
#
# 94 LYS QD 95 GLN HN 6.15 (#peak 4240)
&rst
ixpk= 4240, nxpk= 0, iat= -1,1449, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1437,1438,
&end
#
# 94 LYS QD 99 ALA QB 3.76 (#peak 4357)
&rst
ixpk= 4357, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1=1437,1438,
igr2=1509,1510,1511,
&end
#
# 94 LYS QG 95 GLN HN 5.52 (#peak 4241)
&rst
ixpk= 4241, nxpk= 0, iat= -1,1449, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=1434,1435,
&end
#
# 94 LYS QG 99 ALA QB 3.83 (#peak 4358)
&rst
ixpk= 4358, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1=1434,1435,
igr2=1509,1510,1511,
&end
#
# 95 GLN HN 96 SER HN 6.03 (#peak 4228)
&rst
ixpk= 4228, nxpk= 0, iat=1449,1466, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 95 GLN HN 98 SER HN 6.15 (#peak 4574)
&rst
ixpk= 4574, nxpk= 0, iat=1449,1494, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 95 GLN HN 99 ALA QB 4.38 (#peak 4657)
&rst
ixpk= 4657, nxpk= 0, iat=1449, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1509,1510,1511,
&end
#
# 95 GLN QB 248 LYS HB2 6.15 (#peak 4689)
&rst
ixpk= 4689, nxpk= 0, iat= -1,3708, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1453,1454,
&end
#
# 95 GLN QB 96 SER HN 5.68 (#peak 4223)
&rst
ixpk= 4223, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1=1453,1454,
&end
#
# 95 GLN QB 96 SER HA 6.15 (#peak 1366)
&rst
ixpk= 1366, nxpk= 0, iat= -1,1468, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1453,1454,
&end
#
# 95 GLN QG 96 SER HN 6.01 (#peak 4222)
&rst
ixpk= 4222, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr1=1456,1457,
&end
#
# 96 SER HN 97 HIS HN 4.91 (#peak 250)
&rst
ixpk= 250, nxpk= 0, iat=1466,1477, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 96 SER HN 98 SER HN 6.15 (#peak 3645)
&rst
ixpk= 3645, nxpk= 0, iat=1466,1494, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 96 SER HA 97 HIS HD2 4.42 (#peak 13012)
&rst
ixpk= 13012, nxpk= 0, iat=1468,1490, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 96 SER HA 97 HIS HE1 6.15 (#peak 13014)
&rst
ixpk= 13014, nxpk= 0, iat=1468,1487, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 96 SER QB 227 GLU QG 4.90 (#peak 13136)
&rst
ixpk= 13136, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1470,1471,
igr2=3413,3414,
&end
#
# 96 SER QB 97 HIS HN 5.45 (#peak 570)
&rst
ixpk= 570, nxpk= 0, iat= -1,1477, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1=1470,1471,
&end
#
# 96 SER QB 97 HIS HD2 3.67 (#peak 13011)
&rst
ixpk= 13011, nxpk= 0, iat= -1,1490, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1=1470,1471,
&end
#
# 96 SER QB 97 HIS HE1 5.84 (#peak 13013)
&rst
ixpk= 13013, nxpk= 0, iat= -1,1487, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1=1470,1471,
&end
#
# 97 HIS HN 226 GLN QB 6.15 (#peak 13185)
&rst
ixpk= 13185, nxpk= 0, iat=1477, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=3393,3394,
&end
#
# 97 HIS HN 98 SER HN 3.92 (#peak 2491)
&rst
ixpk= 2491, nxpk= 0, iat=1477,1494, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 97 HIS HD2 226 GLN HA 6.15 (#peak 13017)
&rst
ixpk= 13017, nxpk= 0, iat=1490,3391, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 97 HIS HD2 226 GLN QB 4.07 (#peak 13016)
&rst
ixpk= 13016, nxpk= 0, iat=1490, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr2=3393,3394,
&end
#
# 97 HIS HD2 226 GLN QG 4.14 (#peak 13015)
&rst
ixpk= 13015, nxpk= 0, iat=1490, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=3396,3397,
&end
#
# 97 HIS HD2 98 SER HN 6.15 (#peak 4187)
&rst
ixpk= 4187, nxpk= 0, iat=1490,1494, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 97 HIS QB 98 SER HN 4.08 (#peak 2493)
&rst
ixpk= 2493, nxpk= 0, iat= -1,1494, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1=1481,1482,
&end
#
# 97 HIS QB 98 SER HA 6.15 (#peak 3765)
&rst
ixpk= 3765, nxpk= 0, iat= -1,1496, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1481,1482,
&end
#
# 97 HIS QB 98 SER HB2 6.15 (#peak 1846)
&rst
ixpk= 1846, nxpk= 0, iat= -1,1498, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1481,1482,
&end
#
# 98 SER HN 99 ALA HN 4.89 (#peak 2567)
&rst
ixpk= 2567, nxpk= 0, iat=1494,1505, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 98 SER HN 99 ALA QB 6.07 (#peak 4434)
&rst
ixpk= 4434, nxpk= 0, iat=1494, -1, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr2=1509,1510,1511,
&end
#
# 98 SER HB2 130 GLY HA3 6.15 (#peak 4711)
&rst
ixpk= 4711, nxpk= 0, iat=1498,1992, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 98 SER HB3 130 GLY HA2 6.15 (#peak 4713)
&rst
ixpk= 4713, nxpk= 0, iat=1499,1991, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 98 SER HB3 130 GLY HA3 6.15 (#peak 4712)
&rst
ixpk= 4712, nxpk= 0, iat=1499,1992, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 98 SER HB3 221 PHE HB2 4.84 (#peak 4709)
&rst
ixpk= 4709, nxpk= 0, iat=1499,3327, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 98 SER HB3 229 ALA QB 6.15 (#peak 4710)
&rst
ixpk= 4710, nxpk= 0, iat=1499, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3441,3442,3443,
&end
#
# 98 SER QB 229 ALA QB 4.62 (#peak 4506)
&rst
ixpk= 4506, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1=1498,1499,
igr2=3441,3442,3443,
&end
#
# 99 ALA HN 100 LEU QB 6.15 (#peak 472)
&rst
ixpk= 472, nxpk= 0, iat=1505, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=1519,1520,
&end
#
# 99 ALA HN 128 ILE QG2 4.99 (#peak 4667)
&rst
ixpk= 4667, nxpk= 0, iat=1505, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1966,1967,1968,
&end
#
# 99 ALA HN 129 ALA HN 5.11 (#peak 3365)
&rst
ixpk= 3365, nxpk= 0, iat=1505,1979, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 99 ALA HN 129 ALA O 2.40
&rst
ixpk= 3365, nxpk= 0, iat=1505,1987, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 99 ALA HN 129 ALA QB 5.58 (#peak 3962)
&rst
ixpk= 3962, nxpk= 0, iat=1505, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr2=1983,1984,1985,
&end
#
# 99 ALA HN 130 GLY HA2 5.25 (#peak 4539)
&rst
ixpk= 4539, nxpk= 0, iat=1505,1991, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 99 ALA HN 130 GLY HA3 4.74 (#peak 4540)
&rst
ixpk= 4540, nxpk= 0, iat=1505,1992, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 99 ALA HN 221 PHE QD 5.51 (#peak 4672)
&rst
ixpk= 4672, nxpk= 0, iat=1505, -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr2=3331,3339,
&end
#
# 99 ALA HN 229 ALA QB 5.20 (#peak 4673)
&rst
ixpk= 4673, nxpk= 0, iat=1505, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2=3441,3442,3443,
&end
#
# 99 ALA N 129 ALA O 3.30
&rst
ixpk= 4673, nxpk= 0, iat=1504,1987, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 99 ALA O 129 ALA HN 2.40
&rst
ixpk= 4673, nxpk= 0, iat=1513,1979, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 99 ALA O 129 ALA N 3.30
&rst
ixpk= 4673, nxpk= 0, iat=1513,1978, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 99 ALA QB 100 LEU HN 4.63 (#peak 1659)
&rst
ixpk= 1659, nxpk= 0, iat= -1,1515, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=1509,1510,1511,
&end
#
# 99 ALA QB 101 THR HN 5.83 (#peak 3438)
&rst
ixpk= 3438, nxpk= 0, iat= -1,1534, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1=1509,1510,1511,
&end
#
# 99 ALA QB 129 ALA HN 5.08 (#peak 3422)
&rst
ixpk= 3422, nxpk= 0, iat= -1,1979, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1=1509,1510,1511,
&end
#
# 100 LEU HN 100 LEU HG 5.01 (#peak 3417)
&rst
ixpk= 3417, nxpk= 0, iat=1515,1522, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 100 LEU HN 100 LEU QD1 4.76 (#peak 3416)
&rst
ixpk= 3416, nxpk= 0, iat=1515, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2=1524,1525,1526,
&end
#
# 100 LEU HN 101 THR HN 4.88 (#peak 3409)
&rst
ixpk= 3409, nxpk= 0, iat=1515,1534, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 100 LEU HA 101 THR HN 3.46 (#peak 1540)
&rst
ixpk= 1540, nxpk= 0, iat=1517,1534, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 100 LEU HA 128 ILE HA 4.97 (#peak 4382)
&rst
ixpk= 4382, nxpk= 0, iat=1517,1962, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 100 LEU HA 129 ALA HN 5.08 (#peak 3353)
&rst
ixpk= 3353, nxpk= 0, iat=1517,1979, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 100 LEU HG 101 THR HN 4.97 (#peak 3419)
&rst
ixpk= 3419, nxpk= 0, iat=1522,1534, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 100 LEU HG 128 ILE QD1 5.29 (#peak 4392)
&rst
ixpk= 4392, nxpk= 0, iat=1522, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=1973,1974,1975,
&end
#
# 100 LEU HG 151 PHE QE 4.31 (#peak 4291)
&rst
ixpk= 4291, nxpk= 0, iat=1522, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=2303,2307,
&end
#
# 100 LEU QB 100 LEU QD1 3.81 (#peak 471)
&rst
ixpk= 471, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1519,1520,
igr2=1524,1525,1526,
&end
#
# 100 LEU QB 101 THR HN 4.02 (#peak 1537)
&rst
ixpk= 1537, nxpk= 0, iat= -1,1534, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr1=1519,1520,
&end
#
# 100 LEU QB 129 ALA HN 5.50 (#peak 4457)
&rst
ixpk= 4457, nxpk= 0, iat= -1,1979, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1519,1520,
&end
#
# 100 LEU QB 151 PHE QE 5.22 (#peak 4290)
&rst
ixpk= 4290, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1=1519,1520,
igr2=2303,2307,
&end
#
# 100 LEU QB 229 ALA QB 4.02 (#peak 4398)
&rst
ixpk= 4398, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1519,1520,
igr2=3441,3442,3443,
&end
#
# 100 LEU QD1 101 THR HN 4.70 (#peak 3418)
&rst
ixpk= 3418, nxpk= 0, iat= -1,1534, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1=1524,1525,1526,
&end
#
# 100 LEU QD1 125 ILE QD1 3.25 (#peak 4395)
&rst
ixpk= 4395, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1=1524,1525,1526,
igr2=1935,1936,1937,
&end
#
# 100 LEU QD1 128 ILE QD1 4.24 (#peak 4393)
&rst
ixpk= 4393, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1=1524,1525,1526,
igr2=1973,1974,1975,
&end
#
# 100 LEU QD1 129 ALA HN 6.01 (#peak 4476)
&rst
ixpk= 4476, nxpk= 0, iat= -1,1979, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
igr1=1524,1525,1526,
&end
#
# 100 LEU QD1 151 PHE QD 4.37 (#peak 13192)
&rst
ixpk= 13192, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr1=1524,1525,1526,
igr2=2301,2309,
&end
#
# 100 LEU QD1 151 PHE QE 3.04 (#peak 12851)
&rst
ixpk= 12851, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr1=1524,1525,1526,
igr2=2303,2307,
&end
#
# 100 LEU QD1 245 LEU HN 4.49 (#peak 12349)
&rst
ixpk= 12349, nxpk= 0, iat= -1,3665, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=1524,1525,1526,
&end
#
# 100 LEU QD2 101 THR HN 5.15 (#peak 3426)
&rst
ixpk= 3426, nxpk= 0, iat= -1,1534, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr1=1528,1529,1530,
&end
#
# 100 LEU QD2 151 PHE QD 4.72 (#peak 13191)
&rst
ixpk= 13191, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1=1528,1529,1530,
igr2=2301,2309,
&end
#
# 100 LEU QD2 151 PHE QE 3.01 (#peak 4294)
&rst
ixpk= 4294, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr1=1528,1529,1530,
igr2=2303,2307,
&end
#
# 100 LEU QD2 245 LEU HN 3.91 (#peak 4297)
&rst
ixpk= 4297, nxpk= 0, iat= -1,3665, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1=1528,1529,1530,
&end
#
# 101 THR HN 101 THR QG2 4.37 (#peak 1542)
&rst
ixpk= 1542, nxpk= 0, iat=1534, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr2=1540,1541,1542,
&end
#
# 101 THR HN 102 ALA HN 4.59 (#peak 2425)
&rst
ixpk= 2425, nxpk= 0, iat=1534,1548, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 101 THR HN 125 ILE QD1 6.15 (#peak 4543)
&rst
ixpk= 4543, nxpk= 0, iat=1534, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1935,1936,1937,
&end
#
# 101 THR HN 127 ASP HN 5.38 (#peak 3367)
&rst
ixpk= 3367, nxpk= 0, iat=1534,1948, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 101 THR HN 127 ASP HB2 6.15 (#peak 3951)
&rst
ixpk= 3951, nxpk= 0, iat=1534,1952, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 101 THR HN 127 ASP HB3 6.15 (#peak 3952)
&rst
ixpk= 3952, nxpk= 0, iat=1534,1953, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 101 THR HN 128 ILE HA 4.82 (#peak 3897)
&rst
ixpk= 3897, nxpk= 0, iat=1534,1962, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 101 THR HA 102 ALA HA 6.15 (#peak 3174)
&rst
ixpk= 3174, nxpk= 0, iat=1536,1550, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 101 THR HB 102 ALA HN 5.49 (#peak 2420)
&rst
ixpk= 2420, nxpk= 0, iat=1538,1548, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 101 THR O 126 GLY HN 2.40
&rst
ixpk= 2420, nxpk= 0, iat=1546,1941, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 101 THR O 126 GLY N 3.30
&rst
ixpk= 2420, nxpk= 0, iat=1546,1940, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 101 THR QG2 102 ALA HN 3.88 (#peak 2424)
&rst
ixpk= 2424, nxpk= 0, iat= -1,1548, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=1540,1541,1542,
&end
#
# 101 THR QG2 103 PHE QE 3.81 (#peak 12606)
&rst
ixpk= 12606, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1540,1541,1542,
igr2=1568,1572,
&end
#
# 101 THR QG2 127 ASP HN 5.71 (#peak 3923)
&rst
ixpk= 3923, nxpk= 0, iat= -1,1948, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr1=1540,1541,1542,
&end
#
# 102 ALA HN 102 ALA QB 4.01 (#peak 2422)
&rst
ixpk= 2422, nxpk= 0, iat=1548, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=1552,1553,1554,
&end
#
# 102 ALA HA 103 PHE QD 3.98 (#peak 12081)
&rst
ixpk= 12081, nxpk= 0, iat=1550, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2=1566,1574,
&end
#
# 102 ALA HA 125 ILE HA 4.33 (#peak 4383)
&rst
ixpk= 4383, nxpk= 0, iat=1550,1924, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 102 ALA HA 125 ILE QD1 6.15 (#peak 4777)
&rst
ixpk= 4777, nxpk= 0, iat=1550, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1935,1936,1937,
&end
#
# 102 ALA HA 126 GLY HN 5.44 (#peak 4416)
&rst
ixpk= 4416, nxpk= 0, iat=1550,1941, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 102 ALA HA 127 ASP HN 6.15 (#peak 3356)
&rst
ixpk= 3356, nxpk= 0, iat=1550,1948, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 102 ALA QB 103 PHE HN 3.70 (#peak 2457)
&rst
ixpk= 2457, nxpk= 0, iat= -1,1558, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1=1552,1553,1554,
&end
#
# 102 ALA QB 123 PHE HA 5.20 (#peak 12365)
&rst
ixpk= 12365, nxpk= 0, iat= -1,1880, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1552,1553,1554,
&end
#
# 102 ALA QB 124 ARG HN 4.93 (#peak 4345)
&rst
ixpk= 4345, nxpk= 0, iat= -1,1898, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1=1552,1553,1554,
&end
#
# 102 ALA QB 151 PHE QE 3.12 (#peak 4329)
&rst
ixpk= 4329, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr1=1552,1553,1554,
igr2=2303,2307,
&end
#
# 103 PHE HN 103 PHE QD 4.49 (#peak 846)
&rst
ixpk= 846, nxpk= 0, iat=1558, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1566,1574,
&end
#
# 103 PHE HN 123 PHE HA 6.15 (#peak 3648)
&rst
ixpk= 3648, nxpk= 0, iat=1558,1880, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 103 PHE HN 124 ARG HN 4.93 (#peak 3358)
&rst
ixpk= 3358, nxpk= 0, iat=1558,1898, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 103 PHE QB 105 THR QG2 4.12 (#peak 4499)
&rst
ixpk= 4499, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr1=1562,1563,
igr2=1601,1602,1603,
&end
#
# 103 PHE QB 124 ARG HN 6.15 (#peak 3940)
&rst
ixpk= 3940, nxpk= 0, iat= -1,1898, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1562,1563,
&end
#
# 103 PHE QD 104 GLN HN 4.45 (#peak 11994)
&rst
ixpk= 11994, nxpk= 0, iat= -1,1578, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr1=1566,1574,
&end
#
# 103 PHE QD 105 THR HA 6.15 (#peak 12412)
&rst
ixpk= 12412, nxpk= 0, iat= -1,1597, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1566,1574,
&end
#
# 103 PHE QD 105 THR HB 4.82 (#peak 12442)
&rst
ixpk= 12442, nxpk= 0, iat= -1,1599, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr1=1566,1574,
&end
#
# 103 PHE QD 124 ARG HN 6.10 (#peak 12368)
&rst
ixpk= 12368, nxpk= 0, iat= -1,1898, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1=1566,1574,
&end
#
# 104 GLN HN 104 GLN QB 4.17 (#peak 29)
&rst
ixpk= 29, nxpk= 0, iat=1578, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=1582,1583,
&end
#
# 104 GLN HN 104 GLN QG 4.78 (#peak 28)
&rst
ixpk= 28, nxpk= 0, iat=1578, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=1585,1586,
&end
#
# 104 GLN HA 105 THR HB 6.15 (#peak 798)
&rst
ixpk= 798, nxpk= 0, iat=1580,1599, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 104 GLN HA 123 PHE HA 3.96 (#peak 12074)
&rst
ixpk= 12074, nxpk= 0, iat=1580,1880, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 104 GLN HA 123 PHE QD 5.01 (#peak 12307)
&rst
ixpk= 12307, nxpk= 0, iat=1580, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=1886,1894,
&end
#
# 104 GLN HA 124 ARG HN 5.80 (#peak 3357)
&rst
ixpk= 3357, nxpk= 0, iat=1580,1898, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 104 GLN QB 104 GLN HE21 4.84 (#peak 2720)
&rst
ixpk= 2720, nxpk= 0, iat= -1,1590, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1=1582,1583,
&end
#
# 104 GLN QB 104 GLN HE22 4.84 (#peak 305)
&rst
ixpk= 305, nxpk= 0, iat= -1,1591, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1=1582,1583,
&end
#
# 104 GLN QB 105 THR HN 5.50 (#peak 4150)
&rst
ixpk= 4150, nxpk= 0, iat= -1,1595, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1582,1583,
&end
#
# 105 THR HN 105 THR QG2 4.36 (#peak 1685)
&rst
ixpk= 1685, nxpk= 0, iat=1595, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1601,1602,1603,
&end
#
# 105 THR HN 106 GLU QB 6.15 (#peak 1938)
&rst
ixpk= 1938, nxpk= 0, iat=1595, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=1613,1614,
&end
#
# 105 THR HN 122 GLN HN 5.69 (#peak 3364)
&rst
ixpk= 3364, nxpk= 0, iat=1595,1861, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 105 THR HN 123 PHE HA 6.15 (#peak 4438)
&rst
ixpk= 4438, nxpk= 0, iat=1595,1880, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 105 THR HA 107 GLN HN 6.15 (#peak 3650)
&rst
ixpk= 3650, nxpk= 0, iat=1597,1624, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 105 THR HA 122 GLN HN 6.15 (#peak 4447)
&rst
ixpk= 4447, nxpk= 0, iat=1597,1861, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 105 THR HB 106 GLU QG 6.15 (#peak 1463)
&rst
ixpk= 1463, nxpk= 0, iat=1599, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=1616,1617,
&end
#
# 105 THR HB 122 GLN HN 5.79 (#peak 4446)
&rst
ixpk= 4446, nxpk= 0, iat=1599,1861, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 105 THR QG2 106 GLU HN 4.99 (#peak 347)
&rst
ixpk= 347, nxpk= 0, iat= -1,1609, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1601,1602,1603,
&end
#
# 105 THR QG2 108 ILE QG2 4.16 (#peak 4503)
&rst
ixpk= 4503, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1601,1602,1603,
igr2=1647,1648,1649,
&end
#
# 105 THR QG2 122 GLN HB2 3.75 (#peak 4500)
&rst
ixpk= 4500, nxpk= 0, iat= -1,1865, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1=1601,1602,1603,
&end
#
# 105 THR QG2 122 GLN HB3 3.64 (#peak 4501)
&rst
ixpk= 4501, nxpk= 0, iat= -1,1866, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1=1601,1602,1603,
&end
#
# 105 THR QG2 122 GLN HE21 4.80 (#peak 4156)
&rst
ixpk= 4156, nxpk= 0, iat= -1,1873, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1601,1602,1603,
&end
#
# 105 THR QG2 122 GLN HE22 5.12 (#peak 4155)
&rst
ixpk= 4155, nxpk= 0, iat= -1,1874, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1601,1602,1603,
&end
#
# 105 THR QG2 122 GLN QG 3.76 (#peak 4504)
&rst
ixpk= 4504, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1=1601,1602,1603,
igr2=1868,1869,
&end
#
# 106 GLU HN 107 GLN HN 4.81 (#peak 2297)
&rst
ixpk= 2297, nxpk= 0, iat=1609,1624, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 106 GLU HA 120 LYS HN 6.15 (#peak 4406)
&rst
ixpk= 4406, nxpk= 0, iat=1611,1815, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 106 GLU HA 122 GLN HN 6.15 (#peak 3363)
&rst
ixpk= 3363, nxpk= 0, iat=1611,1861, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 106 GLU QB 107 GLN HN 5.28 (#peak 3651)
&rst
ixpk= 3651, nxpk= 0, iat= -1,1624, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1=1613,1614,
&end
#
# 107 GLN HN 107 GLN HB2 4.17 (#peak 2300)
&rst
ixpk= 2300, nxpk= 0, iat=1624,1628, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 107 GLN HN 107 GLN HB3 3.83 (#peak 4101)
&rst
ixpk= 4101, nxpk= 0, iat=1624,1629, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 107 GLN HN 108 ILE HN 4.95 (#peak 286)
&rst
ixpk= 286, nxpk= 0, iat=1624,1641, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 107 GLN HA 108 ILE QD1 6.15 (#peak 2880)
&rst
ixpk= 2880, nxpk= 0, iat=1626, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1654,1655,1656,
&end
#
# 107 GLN HA 119 ALA HN 5.89 (#peak 4409)
&rst
ixpk= 4409, nxpk= 0, iat=1626,1805, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 107 GLN HA 120 LYS HN 4.97 (#peak 4405)
&rst
ixpk= 4405, nxpk= 0, iat=1626,1815, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 107 GLN HB2 108 ILE HA 6.15 (#peak 3382)
&rst
ixpk= 3382, nxpk= 0, iat=1628,1643, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 107 GLN HB3 108 ILE HN 4.07 (#peak 281)
&rst
ixpk= 281, nxpk= 0, iat=1629,1641, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 108 ILE HN 108 ILE HB 3.91 (#peak 279)
&rst
ixpk= 279, nxpk= 0, iat=1641,1645, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 108 ILE HN 108 ILE QD1 4.87 (#peak 275)
&rst
ixpk= 275, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=1654,1655,1656,
&end
#
# 108 ILE HN 108 ILE QG1 4.47 (#peak 280)
&rst
ixpk= 280, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2=1651,1652,
&end
#
# 108 ILE HN 108 ILE QG2 3.82 (#peak 282)
&rst
ixpk= 282, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2=1647,1648,1649,
&end
#
# 108 ILE HN 109 GLN HN 4.66 (#peak 276)
&rst
ixpk= 276, nxpk= 0, iat=1641,1660, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 108 ILE HN 117 MET HA 5.88 (#peak 4774)
&rst
ixpk= 4774, nxpk= 0, iat=1641,1774, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 108 ILE HN 117 MET QE 6.15 (#peak 4415)
&rst
ixpk= 4415, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1783,1784,1785,
&end
#
# 108 ILE HN 118 VAL HN 4.85 (#peak 3991)
&rst
ixpk= 3991, nxpk= 0, iat=1641,1789, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 108 ILE HN 119 ALA HA 5.55 (#peak 4773)
&rst
ixpk= 4773, nxpk= 0, iat=1641,1807, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 108 ILE HN 119 ALA QB 6.15 (#peak 4775)
&rst
ixpk= 4775, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1809,1810,1811,
&end
#
# 108 ILE HN 120 LYS HN 5.94 (#peak 3370)
&rst
ixpk= 3370, nxpk= 0, iat=1641,1815, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 108 ILE HB 109 GLN HN 4.19 (#peak 72)
&rst
ixpk= 72, nxpk= 0, iat=1645,1660, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 108 ILE QD1 109 GLN HN 4.16 (#peak 69)
&rst
ixpk= 69, nxpk= 0, iat= -1,1660, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1=1654,1655,1656,
&end
#
# 108 ILE QG1 109 GLN HN 4.37 (#peak 73)
&rst
ixpk= 73, nxpk= 0, iat= -1,1660, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1=1651,1652,
&end
#
# 108 ILE QG2 109 GLN HN 4.45 (#peak 77)
&rst
ixpk= 77, nxpk= 0, iat= -1,1660, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=1647,1648,1649,
&end
#
# 109 GLN HN 109 GLN HB2 4.12 (#peak 76)
&rst
ixpk= 76, nxpk= 0, iat=1660,1664, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 109 GLN HN 109 GLN HE21 5.10 (#peak 3184)
&rst
ixpk= 3184, nxpk= 0, iat=1660,1672, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 109 GLN HN 109 GLN HG2 4.61 (#peak 79)
&rst
ixpk= 79, nxpk= 0, iat=1660,1667, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 109 GLN HN 109 GLN HG3 4.93 (#peak 3235)
&rst
ixpk= 3235, nxpk= 0, iat=1660,1668, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 109 GLN HN 110 ASP HN 5.02 (#peak 696)
&rst
ixpk= 696, nxpk= 0, iat=1660,1677, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 109 GLN HN 117 MET QE 6.15 (#peak 4418)
&rst
ixpk= 4418, nxpk= 0, iat=1660, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1783,1784,1785,
&end
#
# 109 GLN HA 117 MET HN 6.15 (#peak 4732)
&rst
ixpk= 4732, nxpk= 0, iat=1662,1772, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 109 GLN HA 118 VAL HN 4.51 (#peak 4408)
&rst
ixpk= 4408, nxpk= 0, iat=1662,1789, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 109 GLN HB2 109 GLN HE21 4.88 (#peak 3239)
&rst
ixpk= 3239, nxpk= 0, iat=1664,1672, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 109 GLN HB2 109 GLN HE22 5.17 (#peak 3240)
&rst
ixpk= 3240, nxpk= 0, iat=1664,1673, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 109 GLN HB2 110 ASP HN 5.09 (#peak 700)
&rst
ixpk= 700, nxpk= 0, iat=1664,1677, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 109 GLN HB2 117 MET QE 6.13 (#peak 4730)
&rst
ixpk= 4730, nxpk= 0, iat=1664, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr2=1783,1784,1785,
&end
#
# 109 GLN HB3 109 GLN HE21 4.00 (#peak 118)
&rst
ixpk= 118, nxpk= 0, iat=1665,1672, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 109 GLN HB3 109 GLN HE22 4.32 (#peak 1272)
&rst
ixpk= 1272, nxpk= 0, iat=1665,1673, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 109 GLN HB3 110 ASP HN 4.69 (#peak 3234)
&rst
ixpk= 3234, nxpk= 0, iat=1665,1677, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 109 GLN HB3 117 MET QE 6.07 (#peak 4729)
&rst
ixpk= 4729, nxpk= 0, iat=1665, -1, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr2=1783,1784,1785,
&end
#
# 109 GLN HE21 115 GLY HA2 4.96 (#peak 4747)
&rst
ixpk= 4747, nxpk= 0, iat=1672,1745, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 109 GLN HE21 115 GLY HA3 4.74 (#peak 4746)
&rst
ixpk= 4746, nxpk= 0, iat=1672,1746, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 109 GLN HE21 116 LYS HB2 5.72 (#peak 4496)
&rst
ixpk= 4496, nxpk= 0, iat=1672,1754, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 109 GLN HE21 116 LYS HB3 6.15 (#peak 4494)
&rst
ixpk= 4494, nxpk= 0, iat=1672,1755, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 109 GLN HE21 117 MET QE 6.15 (#peak 3796)
&rst
ixpk= 3796, nxpk= 0, iat=1672, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1783,1784,1785,
&end
#
# 109 GLN HE22 115 GLY HA2 4.72 (#peak 4749)
&rst
ixpk= 4749, nxpk= 0, iat=1673,1745, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 109 GLN HE22 117 MET QE 6.06 (#peak 3797)
&rst
ixpk= 3797, nxpk= 0, iat=1673, -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
igr2=1783,1784,1785,
&end
#
# 109 GLN HG2 109 GLN HE21 3.55 (#peak 117)
&rst
ixpk= 117, nxpk= 0, iat=1667,1672, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 109 GLN HG2 109 GLN HE22 3.76 (#peak 1271)
&rst
ixpk= 1271, nxpk= 0, iat=1667,1673, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 109 GLN HG2 110 ASP HN 5.00 (#peak 703)
&rst
ixpk= 703, nxpk= 0, iat=1667,1677, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 109 GLN HG2 116 LYS HN 5.47 (#peak 4507)
&rst
ixpk= 4507, nxpk= 0, iat=1667,1750, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 109 GLN HG2 117 MET QE 6.15 (#peak 4728)
&rst
ixpk= 4728, nxpk= 0, iat=1667, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1783,1784,1785,
&end
#
# 109 GLN HG3 109 GLN HE21 3.99 (#peak 3236)
&rst
ixpk= 3236, nxpk= 0, iat=1668,1672, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 109 GLN HG3 110 ASP HN 4.60 (#peak 3238)
&rst
ixpk= 3238, nxpk= 0, iat=1668,1677, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 109 GLN HG3 116 LYS HN 5.61 (#peak 4508)
&rst
ixpk= 4508, nxpk= 0, iat=1668,1750, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 110 ASP HN 110 ASP HB2 3.94 (#peak 698)
&rst
ixpk= 698, nxpk= 0, iat=1677,1681, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 110 ASP HN 111 SER HN 5.38 (#peak 3124)
&rst
ixpk= 3124, nxpk= 0, iat=1677,1689, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 110 ASP HN 116 LYS HN 5.87 (#peak 3995)
&rst
ixpk= 3995, nxpk= 0, iat=1677,1750, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 110 ASP HN 116 LYS HB2 5.70 (#peak 3436)
&rst
ixpk= 3436, nxpk= 0, iat=1677,1754, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 110 ASP HN 116 LYS HB3 5.57 (#peak 3437)
&rst
ixpk= 3437, nxpk= 0, iat=1677,1755, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 110 ASP HN 117 MET HA 4.13 (#peak 3431)
&rst
ixpk= 3431, nxpk= 0, iat=1677,1774, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 110 ASP HN 117 MET QE 6.15 (#peak 4416)
&rst
ixpk= 4416, nxpk= 0, iat=1677, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1783,1784,1785,
&end
#
# 110 ASP HN 118 VAL HN 5.57 (#peak 3993)
&rst
ixpk= 3993, nxpk= 0, iat=1677,1789, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 110 ASP HN 118 VAL QQG 4.59 (#peak 3433)
&rst
ixpk= 3433, nxpk= 0, iat=1677, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr2=1795,1796,1797,1799,1800,1801,
&end
#
# 110 ASP HA 111 SER HA 6.15 (#peak 2082)
&rst
ixpk= 2082, nxpk= 0, iat=1679,1691, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 110 ASP HA 111 SER QB 6.15 (#peak 4043)
&rst
ixpk= 4043, nxpk= 0, iat=1679, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=1693,1694,
&end
#
# 110 ASP HB2 111 SER HN 4.48 (#peak 1718)
&rst
ixpk= 1718, nxpk= 0, iat=1681,1689, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 110 ASP HB2 111 SER HA 6.15 (#peak 4609)
&rst
ixpk= 4609, nxpk= 0, iat=1681,1691, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 110 ASP HB2 113 HIS HN 5.55 (#peak 4415)
&rst
ixpk= 4415, nxpk= 0, iat=1681,1715, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 110 ASP HB2 116 LYS HN 4.95 (#peak 4001)
&rst
ixpk= 4001, nxpk= 0, iat=1681,1750, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 110 ASP HB2 118 VAL QQG 6.15 (#peak 4433)
&rst
ixpk= 4433, nxpk= 0, iat=1681, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr2=1795,1796,1797,1799,1800,1801,
&end
#
# 110 ASP HB3 116 LYS HN 4.33 (#peak 4000)
&rst
ixpk= 4000, nxpk= 0, iat=1682,1750, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 111 SER HN 112 GLU HN 4.49 (#peak 2007)
&rst
ixpk= 2007, nxpk= 0, iat=1689,1700, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 111 SER HN 114 SER HN 5.85 (#peak 4506)
&rst
ixpk= 4506, nxpk= 0, iat=1689,1732, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 111 SER QB 112 GLU HN 4.72 (#peak 2008)
&rst
ixpk= 2008, nxpk= 0, iat= -1,1700, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1693,1694,
&end
#
# 112 GLU HN 112 GLU HG2 3.45 (#peak 2002)
&rst
ixpk= 2002, nxpk= 0, iat=1700,1707, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 112 GLU HN 112 GLU HG3 3.27 (#peak 2005)
&rst
ixpk= 2005, nxpk= 0, iat=1700,1708, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 112 GLU HN 112 GLU QB 4.07 (#peak 2003)
&rst
ixpk= 2003, nxpk= 0, iat=1700, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr2=1704,1705,
&end
#
# 112 GLU HN 113 HIS HN 3.28 (#peak 2006)
&rst
ixpk= 2006, nxpk= 0, iat=1700,1715, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 112 GLU HN 113 HIS HB2 5.20 (#peak 3921)
&rst
ixpk= 3921, nxpk= 0, iat=1700,1719, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 112 GLU HN 113 HIS HB3 5.63 (#peak 4412)
&rst
ixpk= 4412, nxpk= 0, iat=1700,1720, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 112 GLU HN 114 SER HN 5.91 (#peak 4505)
&rst
ixpk= 4505, nxpk= 0, iat=1700,1732, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 112 GLU HN 114 SER QB 5.66 (#peak 4691)
&rst
ixpk= 4691, nxpk= 0, iat=1700, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=1736,1737,
&end
#
# 112 GLU HG2 113 HIS HN 5.48 (#peak 1489)
&rst
ixpk= 1489, nxpk= 0, iat=1707,1715, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 112 GLU HG3 113 HIS HN 5.15 (#peak 1495)
&rst
ixpk= 1495, nxpk= 0, iat=1708,1715, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 112 GLU QB 113 HIS HN 4.12 (#peak 1492)
&rst
ixpk= 1492, nxpk= 0, iat= -1,1715, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1=1704,1705,
&end
#
# 112 GLU QB 113 HIS HB2 6.15 (#peak 2788)
&rst
ixpk= 2788, nxpk= 0, iat= -1,1719, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1704,1705,
&end
#
# 113 HIS HN 113 HIS HB2 3.58 (#peak 1497)
&rst
ixpk= 1497, nxpk= 0, iat=1715,1719, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 113 HIS HN 113 HIS HB3 4.07 (#peak 1500)
&rst
ixpk= 1500, nxpk= 0, iat=1715,1720, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 113 HIS HN 113 HIS HD2 5.48 (#peak 4082)
&rst
ixpk= 4082, nxpk= 0, iat=1715,1728, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 113 HIS HN 114 SER HN 4.90 (#peak 4413)
&rst
ixpk= 4413, nxpk= 0, iat=1715,1732, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 113 HIS HN 114 SER HA 6.09 (#peak 4411)
&rst
ixpk= 4411, nxpk= 0, iat=1715,1734, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59, &end
#
# 113 HIS HN 114 SER QB 5.92 (#peak 1488)
&rst
ixpk= 1488, nxpk= 0, iat=1715, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2=1736,1737,
&end
#
# 113 HIS HN 115 GLY HN 4.33 (#peak 4501)
&rst
ixpk= 4501, nxpk= 0, iat=1715,1743, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 113 HIS HN 116 LYS HN 6.15 (#peak 4502)
&rst
ixpk= 4502, nxpk= 0, iat=1715,1750, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 113 HIS HA 115 GLY HN 5.61 (#peak 4500)
&rst
ixpk= 4500, nxpk= 0, iat=1717,1743, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 113 HIS HB2 114 SER HN 4.92 (#peak 2355)
&rst
ixpk= 2355, nxpk= 0, iat=1719,1732, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 113 HIS HB2 116 LYS HB3 6.15 (#peak 4431)
&rst
ixpk= 4431, nxpk= 0, iat=1719,1755, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 113 HIS HB2 116 LYS HG2 6.15 (#peak 4430)
&rst
ixpk= 4430, nxpk= 0, iat=1719,1757, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 113 HIS HB2 116 LYS HG3 6.15 (#peak 4429)
&rst
ixpk= 4429, nxpk= 0, iat=1719,1758, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 113 HIS HB3 114 SER HN 5.36 (#peak 3127)
&rst
ixpk= 3127, nxpk= 0, iat=1720,1732, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 114 SER HN 114 SER QB 3.99 (#peak 2350)
&rst
ixpk= 2350, nxpk= 0, iat=1732, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1736,1737,
&end
#
# 114 SER HN 115 GLY HN 4.84 (#peak 1431)
&rst
ixpk= 1431, nxpk= 0, iat=1732,1743, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 114 SER HA 116 LYS HN 4.70 (#peak 4504)
&rst
ixpk= 4504, nxpk= 0, iat=1734,1750, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 114 SER QB 115 GLY HN 4.59 (#peak 1427)
&rst
ixpk= 1427, nxpk= 0, iat= -1,1743, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr1=1736,1737,
&end
#
# 115 GLY HN 116 LYS HN 3.53 (#peak 2411)
&rst
ixpk= 2411, nxpk= 0, iat=1743,1750, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 115 GLY HN 116 LYS HB2 6.15 (#peak 4499)
&rst
ixpk= 4499, nxpk= 0, iat=1743,1754, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 115 GLY HA3 116 LYS HN 3.53 (#peak 2412)
&rst
ixpk= 2412, nxpk= 0, iat=1746,1750, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 116 LYS HN 116 LYS HB2 3.73 (#peak 2415)
&rst
ixpk= 2415, nxpk= 0, iat=1750,1754, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 116 LYS HN 116 LYS HB3 3.80 (#peak 2409)
&rst
ixpk= 2409, nxpk= 0, iat=1750,1755, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 116 LYS HN 116 LYS HG2 3.45 (#peak 2414)
&rst
ixpk= 2414, nxpk= 0, iat=1750,1757, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 116 LYS HN 116 LYS HG3 3.52 (#peak 2407)
&rst
ixpk= 2407, nxpk= 0, iat=1750,1758, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 116 LYS HN 117 MET HN 4.61 (#peak 2410)
&rst
ixpk= 2410, nxpk= 0, iat=1750,1772, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 116 LYS HA 117 MET HN 2.88 (#peak 850)
&rst
ixpk= 850, nxpk= 0, iat=1752,1772, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38, &end
#
# 116 LYS HA 117 MET HA 6.15 (#peak 3631)
&rst
ixpk= 3631, nxpk= 0, iat=1752,1774, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 116 LYS HB2 117 MET HN 3.45 (#peak 844)
&rst
ixpk= 844, nxpk= 0, iat=1754,1772, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 116 LYS HD2 117 MET HN 4.10 (#peak 3794)
&rst
ixpk= 3794, nxpk= 0, iat=1760,1772, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 116 LYS HD3 117 MET HN 4.88 (#peak 3792)
&rst
ixpk= 3792, nxpk= 0, iat=1761,1772, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 116 LYS HG3 117 MET HN 4.72 (#peak 839)
&rst
ixpk= 839, nxpk= 0, iat=1758,1772, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 117 MET HN 117 MET HG2 4.77 (#peak 849)
&rst
ixpk= 849, nxpk= 0, iat=1772,1779, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 117 MET HN 117 MET HG3 4.57 (#peak 843)
&rst
ixpk= 843, nxpk= 0, iat=1772,1780, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 117 MET HN 117 MET QE 4.63 (#peak 3788)
&rst
ixpk= 3788, nxpk= 0, iat=1772, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=1783,1784,1785,
&end
#
# 117 MET HN 118 VAL HN 4.69 (#peak 2174)
&rst
ixpk= 2174, nxpk= 0, iat=1772,1789, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 117 MET HN 118 VAL QQG 4.31 (#peak 838)
&rst
ixpk= 838, nxpk= 0, iat=1772, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2=1795,1796,1797,1799,1800,1801,
&end
#
# 117 MET HA 118 VAL HN 3.53 (#peak 2179)
&rst
ixpk= 2179, nxpk= 0, iat=1774,1789, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 117 MET HA 118 VAL QQG 6.15 (#peak 3622)
&rst
ixpk= 3622, nxpk= 0, iat=1774, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr2=1795,1796,1797,1799,1800,1801,
&end
#
# 117 MET HB3 118 VAL HN 4.72 (#peak 3137)
&rst
ixpk= 3137, nxpk= 0, iat=1777,1789, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 117 MET HB3 118 VAL HA 5.98 (#peak 233)
&rst
ixpk= 233, nxpk= 0, iat=1777,1791, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 117 MET HG2 118 VAL HN 5.48 (#peak 3134)
&rst
ixpk= 3134, nxpk= 0, iat=1779,1789, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 117 MET HG2 118 VAL HA 6.15 (#peak 3878)
&rst
ixpk= 3878, nxpk= 0, iat=1779,1791, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 117 MET HG3 118 VAL HN 4.91 (#peak 2177)
&rst
ixpk= 2177, nxpk= 0, iat=1780,1789, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 117 MET QE 118 VAL HN 4.76 (#peak 3789)
&rst
ixpk= 3789, nxpk= 0, iat= -1,1789, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1783,1784,1785,
&end
#
# 118 VAL HN 118 VAL HB 3.82 (#peak 2175)
&rst
ixpk= 2175, nxpk= 0, iat=1789,1793, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 118 VAL HN 118 VAL QQG 3.70 (#peak 2168)
&rst
ixpk= 2168, nxpk= 0, iat=1789, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr2=1795,1796,1797,1799,1800,1801,
&end
#
# 118 VAL HN 119 ALA HN 4.65 (#peak 2170)
&rst
ixpk= 2170, nxpk= 0, iat=1789,1805, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 118 VAL HA 119 ALA HN 3.30 (#peak 228)
&rst
ixpk= 228, nxpk= 0, iat=1791,1805, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 118 VAL HA 119 ALA QB 5.88 (#peak 3395)
&rst
ixpk= 3395, nxpk= 0, iat=1791, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2=1809,1810,1811,
&end
#
# 118 VAL HB 119 ALA HN 4.20 (#peak 226)
&rst
ixpk= 226, nxpk= 0, iat=1793,1805, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 118 VAL QQG 119 ALA HN 3.77 (#peak 224)
&rst
ixpk= 224, nxpk= 0, iat= -1,1805, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1=1795,1796,1797,1799,1800,1801,
&end
#
# 119 ALA HN 119 ALA QB 2.89 (#peak 230)
&rst
ixpk= 230, nxpk= 0, iat=1805, -1, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
igr2=1809,1810,1811,
&end
#
# 119 ALA HN 120 LYS HN 5.14 (#peak 3138)
&rst
ixpk= 3138, nxpk= 0, iat=1805,1815, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 119 ALA HA 120 LYS HN 3.40 (#peak 2403)
&rst
ixpk= 2403, nxpk= 0, iat=1807,1815, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 119 ALA QB 120 LYS HN 3.79 (#peak 2405)
&rst
ixpk= 2405, nxpk= 0, iat= -1,1815, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1=1809,1810,1811,
&end
#
# 120 LYS HN 120 LYS QD 3.84 (#peak 2406)
&rst
ixpk= 2406, nxpk= 0, iat=1815, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2=1825,1826,
&end
#
# 120 LYS HN 120 LYS QG 4.99 (#peak 3143)
&rst
ixpk= 3143, nxpk= 0, iat=1815, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2=1822,1823,
&end
#
# 120 LYS HN 121 ARG HN 4.51 (#peak 123)
&rst
ixpk= 123, nxpk= 0, iat=1815,1837, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 120 LYS HA 121 ARG HN 3.20 (#peak 119)
&rst
ixpk= 119, nxpk= 0, iat=1817,1837, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 121 ARG HN 121 ARG QB 3.41 (#peak 120)
&rst
ixpk= 120, nxpk= 0, iat=1837, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2=1841,1842,
&end
#
# 121 ARG HN 121 ARG QG 3.97 (#peak 3142)
&rst
ixpk= 3142, nxpk= 0, iat=1837, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2=1844,1845,
&end
#
# 121 ARG HN 122 GLN HN 4.71 (#peak 121)
&rst
ixpk= 121, nxpk= 0, iat=1837,1861, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 121 ARG QB 122 GLN HN 4.32 (#peak 523)
&rst
ixpk= 523, nxpk= 0, iat= -1,1861, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1=1841,1842,
&end
#
# 121 ARG QG 122 GLN HN 4.42 (#peak 526)
&rst
ixpk= 526, nxpk= 0, iat= -1,1861, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1=1844,1845,
&end
#
# 122 GLN HN 122 GLN QG 4.23 (#peak 525)
&rst
ixpk= 525, nxpk= 0, iat=1861, -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr2=1868,1869,
&end
#
# 122 GLN HA 122 GLN HE21 4.07 (#peak 1866)
&rst
ixpk= 1866, nxpk= 0, iat=1863,1873, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 122 GLN HA 123 PHE HN 3.32 (#peak 1789)
&rst
ixpk= 1789, nxpk= 0, iat=1863,1878, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 122 GLN HA 123 PHE HA 5.43 (#peak 12075)
&rst
ixpk= 12075, nxpk= 0, iat=1863,1880, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 122 GLN HB2 122 GLN HE21 4.27 (#peak 1861)
&rst
ixpk= 1861, nxpk= 0, iat=1865,1873, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 122 GLN HB2 123 PHE HN 4.59 (#peak 1786)
&rst
ixpk= 1786, nxpk= 0, iat=1865,1878, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 122 GLN HB3 122 GLN HE21 4.35 (#peak 1865)
&rst
ixpk= 1865, nxpk= 0, iat=1866,1873, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 122 GLN HB3 123 PHE HN 4.73 (#peak 1787)
&rst
ixpk= 1787, nxpk= 0, iat=1866,1878, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 122 GLN HE22 124 ARG QB 6.09 (#peak 4159)
&rst
ixpk= 4159, nxpk= 0, iat=1874, -1, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
igr2=1902,1903,
&end
#
# 122 GLN QG 122 GLN HE21 3.71 (#peak 1860)
&rst
ixpk= 1860, nxpk= 0, iat= -1,1873, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1=1868,1869,
&end
#
# 122 GLN QG 123 PHE HN 3.91 (#peak 1783)
&rst
ixpk= 1783, nxpk= 0, iat= -1,1878, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1=1868,1869,
&end
#
# 123 PHE HN 123 PHE QD 4.39 (#peak 4051)
&rst
ixpk= 4051, nxpk= 0, iat=1878, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr2=1886,1894,
&end
#
# 123 PHE HN 124 ARG HN 4.56 (#peak 517)
&rst
ixpk= 517, nxpk= 0, iat=1878,1898, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 123 PHE HA 123 PHE QD 4.13 (#peak 1045)
&rst
ixpk= 1045, nxpk= 0, iat=1880, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1886,1894,
&end
#
# 123 PHE HA 124 ARG HN 3.38 (#peak 515)
&rst
ixpk= 515, nxpk= 0, iat=1880,1898, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 123 PHE HA 124 ARG QB 6.15 (#peak 1467)
&rst
ixpk= 1467, nxpk= 0, iat=1880, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=1902,1903,
&end
#
# 123 PHE HB2 124 ARG HN 5.66 (#peak 520)
&rst
ixpk= 520, nxpk= 0, iat=1882,1898, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16, &end
#
# 123 PHE HB2 153 SER QB 4.86 (#peak 4441)
&rst
ixpk= 4441, nxpk= 0, iat=1882, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2=2324,2325,
&end
#
# 123 PHE HB3 124 ARG HN 5.25 (#peak 3090)
&rst
ixpk= 3090, nxpk= 0, iat=1883,1898, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 123 PHE QD 124 ARG HN 4.38 (#peak 4052)
&rst
ixpk= 4052, nxpk= 0, iat= -1,1898, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=1886,1894,
&end
#
# 123 PHE QD 153 SER HN 3.42 (#peak 4145)
&rst
ixpk= 4145, nxpk= 0, iat= -1,2320, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1=1886,1894,
&end
#
# 123 PHE QD 153 SER HA 4.41 (#peak 13082)
&rst
ixpk= 13082, nxpk= 0, iat= -1,2322, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1886,1894,
&end
#
# 123 PHE QD 153 SER QB 5.69 (#peak 13081)
&rst
ixpk= 13081, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr1=1886,1894,
igr2=2324,2325,
&end
#
# 123 PHE QE 152 GLY HA2 4.22 (#peak 13021)
&rst
ixpk= 13021, nxpk= 0, iat= -1,2315, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1=1888,1892,
&end
#
# 123 PHE QE 152 GLY HA3 4.61 (#peak 13022)
&rst
ixpk= 13022, nxpk= 0, iat= -1,2316, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1=1888,1892,
&end
#
# 124 ARG HN 124 ARG QD 4.48 (#peak 516)
&rst
ixpk= 516, nxpk= 0, iat=1898, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1908,1909,
&end
#
# 124 ARG HN 125 ILE HN 4.74 (#peak 353)
&rst
ixpk= 353, nxpk= 0, iat=1898,1922, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 124 ARG HN 125 ILE QG2 6.15 (#peak 4158)
&rst
ixpk= 4158, nxpk= 0, iat=1898, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1928,1929,1930,
&end
#
# 124 ARG HA 242 HIS HE1 5.60 (#peak 13025)
&rst
ixpk= 13025, nxpk= 0, iat=1900,3632, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 124 ARG QB 125 ILE HN 3.80 (#peak 355)
&rst
ixpk= 355, nxpk= 0, iat= -1,1922, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr1=1902,1903,
&end
#
# 124 ARG QB 242 HIS HE1 5.29 (#peak 13028)
&rst
ixpk= 13028, nxpk= 0, iat= -1,3632, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1=1902,1903,
&end
#
# 124 ARG QD 125 ILE HN 3.91 (#peak 4160)
&rst
ixpk= 4160, nxpk= 0, iat= -1,1922, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1=1908,1909,
&end
#
# 124 ARG QD 242 HIS HD2 5.15 (#peak 13026)
&rst
ixpk= 13026, nxpk= 0, iat= -1,3635, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1=1908,1909,
&end
#
# 124 ARG QD 242 HIS HE1 5.89 (#peak 13027)
&rst
ixpk= 13027, nxpk= 0, iat= -1,3632, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1908,1909,
&end
#
# 125 ILE HN 125 ILE HB 3.79 (#peak 357)
&rst
ixpk= 357, nxpk= 0, iat=1922,1926, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 125 ILE HN 125 ILE QD1 5.26 (#peak 354)
&rst
ixpk= 354, nxpk= 0, iat=1922, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2=1935,1936,1937,
&end
#
# 125 ILE HN 125 ILE QG2 4.68 (#peak 352)
&rst
ixpk= 352, nxpk= 0, iat=1922, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=1928,1929,1930,
&end
#
# 125 ILE HN 126 GLY HN 4.84 (#peak 358)
&rst
ixpk= 358, nxpk= 0, iat=1922,1941, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 125 ILE HA 125 ILE QD1 6.15 (#peak 2893)
&rst
ixpk= 2893, nxpk= 0, iat=1924, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1935,1936,1937,
&end
#
# 125 ILE HB 242 HIS QB 5.07 (#peak 13116)
&rst
ixpk= 13116, nxpk= 0, iat=1926, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=3626,3627,
&end
#
# 125 ILE QD1 126 GLY HN 5.77 (#peak 2639)
&rst
ixpk= 2639, nxpk= 0, iat= -1,1941, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1=1935,1936,1937,
&end
#
# 125 ILE QD1 151 PHE QD 4.60 (#peak 4454)
&rst
ixpk= 4454, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=1935,1936,1937,
igr2=2301,2309,
&end
#
# 125 ILE QD1 151 PHE QE 3.78 (#peak 4385)
&rst
ixpk= 4385, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1=1935,1936,1937,
igr2=2303,2307,
&end
#
# 125 ILE QD1 230 GLY HN 6.15 (#peak 4302)
&rst
ixpk= 4302, nxpk= 0, iat= -1,3447, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=1935,1936,1937,
&end
#
# 125 ILE QD1 231 SER HA 5.12 (#peak 4421)
&rst
ixpk= 4421, nxpk= 0, iat= -1,3456, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1935,1936,1937,
&end
#
# 125 ILE QD1 231 SER HB2 3.53 (#peak 4422)
&rst
ixpk= 4422, nxpk= 0, iat= -1,3458, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=1935,1936,1937,
&end
#
# 125 ILE QD1 231 SER HB3 6.15 (#peak 4445)
&rst
ixpk= 4445, nxpk= 0, iat= -1,3459, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=1935,1936,1937,
&end
#
# 125 ILE QD1 242 HIS QB 4.65 (#peak 4418)
&rst
ixpk= 4418, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1=1935,1936,1937,
igr2=3626,3627,
&end
#
# 125 ILE QD1 244 GLY HA2 3.46 (#peak 4420)
&rst
ixpk= 4420, nxpk= 0, iat= -1,3660, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1=1935,1936,1937,
&end
#
# 125 ILE QD1 244 GLY HA3 4.08 (#peak 4419)
&rst
ixpk= 4419, nxpk= 0, iat= -1,3661, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1=1935,1936,1937,
&end
#
# 125 ILE QD1 245 LEU HN 5.35 (#peak 4303)
&rst
ixpk= 4303, nxpk= 0, iat= -1,3665, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr1=1935,1936,1937,
&end
#
# 125 ILE QG2 125 ILE QD1 5.30 (#peak 2401)
&rst
ixpk= 2401, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
igr1=1928,1929,1930,
igr2=1935,1936,1937,
&end
#
# 125 ILE QG2 126 GLY HN 4.56 (#peak 2636)
&rst
ixpk= 2636, nxpk= 0, iat= -1,1941, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1=1928,1929,1930,
&end
#
# 126 GLY HN 231 SER HB2 6.15 (#peak 4778)
&rst
ixpk= 4778, nxpk= 0, iat=1941,3458, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 127 ASP HB2 128 ILE HN 4.75 (#peak 2336)
&rst
ixpk= 2336, nxpk= 0, iat=1952,1960, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 127 ASP HB3 128 ILE HN 5.81 (#peak 2339)
&rst
ixpk= 2339, nxpk= 0, iat=1953,1960, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 128 ILE HN 128 ILE QD1 4.63 (#peak 2333)
&rst
ixpk= 2333, nxpk= 0, iat=1960, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=1973,1974,1975,
&end
#
# 128 ILE HN 128 ILE QG1 4.28 (#peak 2337)
&rst
ixpk= 2337, nxpk= 0, iat=1960, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1970,1971,
&end
#
# 128 ILE HN 128 ILE QG2 5.23 (#peak 3430)
&rst
ixpk= 3430, nxpk= 0, iat=1960, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr2=1966,1967,1968,
&end
#
# 128 ILE HN 129 ALA HN 5.14 (#peak 2334)
&rst
ixpk= 2334, nxpk= 0, iat=1960,1979, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 128 ILE HB 129 ALA HN 5.37 (#peak 4456)
&rst
ixpk= 4456, nxpk= 0, iat=1964,1979, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 128 ILE QD1 129 ALA HN 4.91 (#peak 3786)
&rst
ixpk= 3786, nxpk= 0, iat= -1,1979, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1=1973,1974,1975,
&end
#
# 128 ILE QD1 229 ALA QB 3.08 (#peak 4399)
&rst
ixpk= 4399, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1=1973,1974,1975,
igr2=3441,3442,3443,
&end
#
# 128 ILE QD1 230 GLY HA2 3.78 (#peak 4400)
&rst
ixpk= 4400, nxpk= 0, iat= -1,3449, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1=1973,1974,1975,
&end
#
# 128 ILE QD1 230 GLY HA3 3.74 (#peak 4401)
&rst
ixpk= 4401, nxpk= 0, iat= -1,3450, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=1973,1974,1975,
&end
#
# 128 ILE QD1 231 SER HB2 4.18 (#peak 4405)
&rst
ixpk= 4405, nxpk= 0, iat= -1,3458, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=1973,1974,1975,
&end
#
# 128 ILE QD1 231 SER HB3 4.45 (#peak 4406)
&rst
ixpk= 4406, nxpk= 0, iat= -1,3459, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=1973,1974,1975,
&end
#
# 128 ILE QG1 129 ALA HN 4.85 (#peak 4186)
&rst
ixpk= 4186, nxpk= 0, iat= -1,1979, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1=1970,1971,
&end
#
# 128 ILE QG2 129 ALA HN 4.74 (#peak 581)
&rst
ixpk= 581, nxpk= 0, iat= -1,1979, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1=1966,1967,1968,
&end
#
# 128 ILE QG2 221 PHE QE 3.58 (#peak 12825)
&rst
ixpk= 12825, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1=1966,1967,1968,
igr2=3333,3337,
&end
#
# 128 ILE QG2 230 GLY HA2 4.63 (#peak 4403)
&rst
ixpk= 4403, nxpk= 0, iat= -1,3449, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=1966,1967,1968,
&end
#
# 128 ILE QG2 230 GLY HA3 4.56 (#peak 4402)
&rst
ixpk= 4402, nxpk= 0, iat= -1,3450, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1=1966,1967,1968,
&end
#
# 129 ALA HN 129 ALA QB 3.78 (#peak 579)
&rst
ixpk= 579, nxpk= 0, iat=1979, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr2=1983,1984,1985,
&end
#
# 129 ALA HN 130 GLY HN 5.95 (#peak 578)
&rst
ixpk= 578, nxpk= 0, iat=1979,1989, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 129 ALA HN 221 PHE QE 6.03 (#peak 4066)
&rst
ixpk= 4066, nxpk= 0, iat=1979, -1, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr2=3333,3337,
&end
#
# 129 ALA QB 130 GLY HN 3.65 (#peak 1346)
&rst
ixpk= 1346, nxpk= 0, iat= -1,1989, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1=1983,1984,1985,
&end
#
# 130 GLY HN 131 GLU HN 5.32 (#peak 2544)
&rst
ixpk= 2544, nxpk= 0, iat=1989,1996, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 130 GLY HN 131 GLU QG 5.25 (#peak 3171)
&rst
ixpk= 3171, nxpk= 0, iat=1989, -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr2=2003,2004,
&end
#
# 130 GLY HN 221 PHE QD 5.93 (#peak 3973)
&rst
ixpk= 3973, nxpk= 0, iat=1989, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr2=3331,3339,
&end
#
# 130 GLY HN 221 PHE QE 6.15 (#peak 4065)
&rst
ixpk= 4065, nxpk= 0, iat=1989, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=3333,3337,
&end
#
# 130 GLY HA2 131 GLU HB3 6.15 (#peak 2840)
&rst
ixpk= 2840, nxpk= 0, iat=1991,2001, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 131 GLU HN 131 GLU QG 3.68 (#peak 2542)
&rst
ixpk= 2542, nxpk= 0, iat=1996, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2=2003,2004,
&end
#
# 131 GLU HN 132 HIS HN 4.56 (#peak 1402)
&rst
ixpk= 1402, nxpk= 0, iat=1996,2011, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 131 GLU HB2 133 THR HN 6.15 (#peak 3783)
&rst
ixpk= 3783, nxpk= 0, iat=2000,2028, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 132 HIS HN 132 HIS HD2 5.05 (#peak 3778)
&rst
ixpk= 3778, nxpk= 0, iat=2011,2024, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 132 HIS HN 133 THR HN 5.22 (#peak 2252)
&rst
ixpk= 2252, nxpk= 0, iat=2011,2028, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 132 HIS HN 198 ARG QD 6.15 (#peak 4175)
&rst
ixpk= 4175, nxpk= 0, iat=2011, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=2989,2990,
&end
#
# 132 HIS HA 134 SER HN 6.15 (#peak 3764)
&rst
ixpk= 3764, nxpk= 0, iat=2013,2042, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 132 HIS HD2 199 HIS HB2 4.11 (#peak 12684)
&rst
ixpk= 12684, nxpk= 0, iat=2024,3007, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 132 HIS HD2 199 HIS HB3 3.61 (#peak 12683)
&rst
ixpk= 12683, nxpk= 0, iat=2024,3008, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 132 HIS HD2 199 HIS HD2 5.20 (#peak 12688)
&rst
ixpk= 12688, nxpk= 0, iat=2024,3016, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 132 HIS HD2 199 HIS HE1 4.58 (#peak 12686)
&rst
ixpk= 12686, nxpk= 0, iat=2024,3013, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 132 HIS HD2 221 PHE QE 5.39 (#peak 12822)
&rst
ixpk= 12822, nxpk= 0, iat=2024, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=3333,3337,
&end
#
# 132 HIS HE1 199 HIS HD2 6.15 (#peak 12821)
&rst
ixpk= 12821, nxpk= 0, iat=2021,3016, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 132 HIS HE1 199 HIS HE1 5.00 (#peak 12687)
&rst
ixpk= 12687, nxpk= 0, iat=2021,3013, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 132 HIS HE1 221 PHE QD 6.15 (#peak 12819)
&rst
ixpk= 12819, nxpk= 0, iat=2021, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=3331,3339,
&end
#
# 132 HIS HE1 221 PHE QE 3.96 (#peak 12828)
&rst
ixpk= 12828, nxpk= 0, iat=2021, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=3333,3337,
&end
#
# 132 HIS QB 133 THR HN 5.89 (#peak 3761)
&rst
ixpk= 3761, nxpk= 0, iat= -1,2028, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=2015,2016,
&end
#
# 132 HIS QB 199 HIS HD2 4.92 (#peak 12682)
&rst
ixpk= 12682, nxpk= 0, iat= -1,3016, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1=2015,2016,
&end
#
# 132 HIS QB 199 HIS HE1 5.78 (#peak 12681)
&rst
ixpk= 12681, nxpk= 0, iat= -1,3013, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1=2015,2016,
&end
#
# 133 THR HN 134 SER HN 5.16 (#peak 2540)
&rst
ixpk= 2540, nxpk= 0, iat=2028,2042, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 133 THR HA 198 ARG HA 6.15 (#peak 4677)
&rst
ixpk= 4677, nxpk= 0, iat=2030,2981, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 133 THR HB 134 SER HN 5.89 (#peak 2536)
&rst
ixpk= 2536, nxpk= 0, iat=2032,2042, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 133 THR QG2 134 SER HN 4.47 (#peak 2534)
&rst
ixpk= 2534, nxpk= 0, iat= -1,2042, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=2034,2035,2036,
&end
#
# 133 THR QG2 134 SER HA 6.15 (#peak 1590)
&rst
ixpk= 1590, nxpk= 0, iat= -1,2044, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2034,2035,2036,
&end
#
# 134 SER HN 134 SER HB2 3.95 (#peak 2535)
&rst
ixpk= 2535, nxpk= 0, iat=2042,2046, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 134 SER HN 135 PHE HN 4.90 (#peak 2538)
&rst
ixpk= 2538, nxpk= 0, iat=2042,2053, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 134 SER HN 136 ASP HN 6.15 (#peak 2539)
&rst
ixpk= 2539, nxpk= 0, iat=2042,2073, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 134 SER HN 137 LYS HB2 5.92 (#peak 4174)
&rst
ixpk= 4174, nxpk= 0, iat=2042,2089, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 134 SER HN 137 LYS HG2 5.11 (#peak 4778)
&rst
ixpk= 4778, nxpk= 0, iat=2042,2092, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 134 SER HN 137 LYS HG3 5.54 (#peak 4392)
&rst
ixpk= 4392, nxpk= 0, iat=2042,2093, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 134 SER HN 199 HIS HD2 6.15 (#peak 4050)
&rst
ixpk= 4050, nxpk= 0, iat=2042,3016, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 134 SER HA 136 ASP HN 5.40 (#peak 3767)
&rst
ixpk= 3767, nxpk= 0, iat=2044,2073, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 134 SER HA 138 LEU QD1 6.15 (#peak 2282)
&rst
ixpk= 2282, nxpk= 0, iat=2044, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2116,2117,2118,
&end
#
# 134 SER HA 199 HIS HA 6.15 (#peak 13176)
&rst
ixpk= 13176, nxpk= 0, iat=2044,3005, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 134 SER HB2 136 ASP HN 6.15 (#peak 1625)
&rst
ixpk= 1625, nxpk= 0, iat=2046,2073, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 134 SER HB2 137 LYS HN 5.25 (#peak 1476)
&rst
ixpk= 1476, nxpk= 0, iat=2046,2085, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 134 SER HB2 137 LYS HB2 4.85 (#peak 4553)
&rst
ixpk= 4553, nxpk= 0, iat=2046,2089, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 134 SER HB2 137 LYS HB3 4.84 (#peak 4554)
&rst
ixpk= 4554, nxpk= 0, iat=2046,2090, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 134 SER HB2 137 LYS HG2 6.15 (#peak 3534)
&rst
ixpk= 3534, nxpk= 0, iat=2046,2092, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 134 SER HB3 137 LYS HN 5.33 (#peak 1472)
&rst
ixpk= 1472, nxpk= 0, iat=2047,2085, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 134 SER HB3 137 LYS HB2 4.84 (#peak 4552)
&rst
ixpk= 4552, nxpk= 0, iat=2047,2089, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 134 SER HB3 137 LYS HB3 4.89 (#peak 4555)
&rst
ixpk= 4555, nxpk= 0, iat=2047,2090, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 135 PHE HN 135 PHE QD 4.91 (#peak 1844)
&rst
ixpk= 1844, nxpk= 0, iat=2053, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=2061,2069,
&end
#
# 135 PHE HN 136 ASP HN 4.26 (#peak 2212)
&rst
ixpk= 2212, nxpk= 0, iat=2053,2073, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 135 PHE HN 200 ALA HN 6.12 (#peak 3990)
&rst
ixpk= 3990, nxpk= 0, iat=2053,3020, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62, &end
#
# 135 PHE HA 137 LYS HG3 6.15 (#peak 4047)
&rst
ixpk= 4047, nxpk= 0, iat=2055,2093, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 135 PHE HA 138 LEU HN 6.15 (#peak 1065)
&rst
ixpk= 1065, nxpk= 0, iat=2055,2107, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 135 PHE HA 138 LEU HB2 3.74 (#peak 4533)
&rst
ixpk= 4533, nxpk= 0, iat=2055,2111, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 135 PHE HA 138 LEU HB3 4.64 (#peak 492)
&rst
ixpk= 492, nxpk= 0, iat=2055,2112, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 135 PHE HA 138 LEU QD1 6.15 (#peak 2280)
&rst
ixpk= 2280, nxpk= 0, iat=2055, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2116,2117,2118,
&end
#
# 135 PHE HB2 136 ASP HN 4.53 (#peak 2209)
&rst
ixpk= 2209, nxpk= 0, iat=2057,2073, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 135 PHE QD 136 ASP HN 5.55 (#peak 2204)
&rst
ixpk= 2204, nxpk= 0, iat= -1,2073, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1=2061,2069,
&end
#
# 135 PHE QD 137 LYS HN 6.06 (#peak 1473)
&rst
ixpk= 1473, nxpk= 0, iat= -1,2085, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
igr1=2061,2069,
&end
#
# 135 PHE QD 138 LEU HN 6.15 (#peak 4786)
&rst
ixpk= 4786, nxpk= 0, iat= -1,2107, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2061,2069,
&end
#
# 135 PHE QD 200 ALA HN 5.97 (#peak 3275)
&rst
ixpk= 3275, nxpk= 0, iat= -1,3020, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1=2061,2069,
&end
#
# 135 PHE QD 200 ALA QB 3.73 (#peak 13193)
&rst
ixpk= 13193, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=2061,2069,
igr2=3024,3025,3026,
&end
#
# 135 PHE QE 136 ASP HN 5.73 (#peak 2210)
&rst
ixpk= 2210, nxpk= 0, iat= -1,2073, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr1=2063,2067,
&end
#
# 135 PHE QE 200 ALA HN 6.15 (#peak 3278)
&rst
ixpk= 3278, nxpk= 0, iat= -1,3020, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2063,2067,
&end
#
# 135 PHE QE 200 ALA QB 3.32 (#peak 12673)
&rst
ixpk= 12673, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1=2063,2067,
igr2=3024,3025,3026,
&end
#
# 136 ASP HN 136 ASP HB2 3.53 (#peak 2205)
&rst
ixpk= 2205, nxpk= 0, iat=2073,2077, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 136 ASP HN 136 ASP HB3 3.59 (#peak 2215)
&rst
ixpk= 2215, nxpk= 0, iat=2073,2078, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 136 ASP HN 137 LYS HN 3.89 (#peak 2211)
&rst
ixpk= 2211, nxpk= 0, iat=2073,2085, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 136 ASP HN 137 LYS HB2 5.80 (#peak 4824)
&rst
ixpk= 4824, nxpk= 0, iat=2073,2089, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 136 ASP HN 137 LYS HB3 6.15 (#peak 4821)
&rst
ixpk= 4821, nxpk= 0, iat=2073,2090, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 136 ASP HN 137 LYS HD2 6.15 (#peak 4823)
&rst
ixpk= 4823, nxpk= 0, iat=2073,2095, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 136 ASP HN 137 LYS HD3 5.47 (#peak 4822)
&rst
ixpk= 4822, nxpk= 0, iat=2073,2096, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 136 ASP HN 137 LYS HG2 4.69 (#peak 2214)
&rst
ixpk= 2214, nxpk= 0, iat=2073,2092, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 136 ASP HN 137 LYS HG3 6.13 (#peak 2217)
&rst
ixpk= 2217, nxpk= 0, iat=2073,2093, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63, &end
#
# 136 ASP HN 138 LEU HN 5.43 (#peak 2207)
&rst
ixpk= 2207, nxpk= 0, iat=2073,2107, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 136 ASP HA 138 LEU HN 6.15 (#peak 3360)
&rst
ixpk= 3360, nxpk= 0, iat=2075,2107, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 136 ASP HB2 137 LYS HN 4.36 (#peak 1474)
&rst
ixpk= 1474, nxpk= 0, iat=2077,2085, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 136 ASP HB3 137 LYS HN 4.27 (#peak 1483)
&rst
ixpk= 1483, nxpk= 0, iat=2078,2085, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 137 LYS HN 137 LYS HD2 5.92 (#peak 1479)
&rst
ixpk= 1479, nxpk= 0, iat=2085,2095, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 137 LYS HN 137 LYS HG2 3.85 (#peak 1482)
&rst
ixpk= 1482, nxpk= 0, iat=2085,2092, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 137 LYS HN 137 LYS HG3 3.94 (#peak 1486)
&rst
ixpk= 1486, nxpk= 0, iat=2085,2093, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 137 LYS HN 138 LEU HN 3.62 (#peak 1070)
&rst
ixpk= 1070, nxpk= 0, iat=2085,2107, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 137 LYS HN 138 LEU QD1 5.85 (#peak 1478)
&rst
ixpk= 1478, nxpk= 0, iat=2085, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr2=2116,2117,2118,
&end
#
# 137 LYS HB2 138 LEU HN 5.60 (#peak 1064)
&rst
ixpk= 1064, nxpk= 0, iat=2089,2107, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 137 LYS HB3 138 LEU HN 5.25 (#peak 1068)
&rst
ixpk= 1068, nxpk= 0, iat=2090,2107, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 137 LYS HD2 138 LEU HN 5.04 (#peak 1073)
&rst
ixpk= 1073, nxpk= 0, iat=2095,2107, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 137 LYS HD3 138 LEU HN 6.15 (#peak 2571)
&rst
ixpk= 2571, nxpk= 0, iat=2096,2107, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 137 LYS HG2 138 LEU HN 6.06 (#peak 1078)
&rst
ixpk= 1078, nxpk= 0, iat=2092,2107, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56, &end
#
# 137 LYS HG3 138 LEU HN 5.81 (#peak 2783)
&rst
ixpk= 2783, nxpk= 0, iat=2093,2107, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 137 LYS HG3 138 LEU QD1 5.77 (#peak 4050)
&rst
ixpk= 4050, nxpk= 0, iat=2093, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr2=2116,2117,2118,
&end
#
# 137 LYS QE 138 LEU HN 5.74 (#peak 1075)
&rst
ixpk= 1075, nxpk= 0, iat= -1,2107, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1=2098,2099,
&end
#
# 138 LEU HN 138 LEU HG 4.96 (#peak 1069)
&rst
ixpk= 1069, nxpk= 0, iat=2107,2114, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 138 LEU HN 138 LEU QD1 4.07 (#peak 1071)
&rst
ixpk= 1071, nxpk= 0, iat=2107, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=2116,2117,2118,
&end
#
# 138 LEU HN 138 LEU QD2 4.09 (#peak 2784)
&rst
ixpk= 2784, nxpk= 0, iat=2107, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=2120,2121,2122,
&end
#
# 138 LEU HN 139 PRO HD2 4.82 (#peak 1079)
&rst
ixpk= 1079, nxpk= 0, iat=2107,2127, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 138 LEU HN 139 PRO HD3 5.33 (#peak 1067)
&rst
ixpk= 1067, nxpk= 0, iat=2107,2128, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 138 LEU HB2 139 PRO HD2 6.15 (#peak 3854)
&rst
ixpk= 3854, nxpk= 0, iat=2111,2127, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 138 LEU HB2 139 PRO HD3 6.15 (#peak 1450)
&rst
ixpk= 1450, nxpk= 0, iat=2111,2128, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 138 LEU HB2 139 PRO HG2 6.15 (#peak 3891)
&rst
ixpk= 3891, nxpk= 0, iat=2111,2130, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 138 LEU HG 139 PRO HD2 6.15 (#peak 3858)
&rst
ixpk= 3858, nxpk= 0, iat=2114,2127, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 138 LEU HG 225 ALA QB 5.68 (#peak 4692)
&rst
ixpk= 4692, nxpk= 0, iat=2114, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=3383,3384,3385,
&end
#
# 138 LEU QD1 139 PRO HD2 6.15 (#peak 3860)
&rst
ixpk= 3860, nxpk= 0, iat= -1,2127, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2116,2117,2118,
&end
#
# 138 LEU QD1 166 PHE HZ 4.58 (#peak 12757)
&rst
ixpk= 12757, nxpk= 0, iat= -1,2512, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=2116,2117,2118,
&end
#
# 138 LEU QD1 166 PHE QD 6.15 (#peak 12755)
&rst
ixpk= 12755, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=2116,2117,2118,
igr2=2508,2516,
&end
#
# 138 LEU QD1 166 PHE QE 4.06 (#peak 12756)
&rst
ixpk= 12756, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1=2116,2117,2118,
igr2=2510,2514,
&end
#
# 138 LEU QD1 225 ALA QB 6.15 (#peak 2281)
&rst
ixpk= 2281, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=2116,2117,2118,
igr2=3383,3384,3385,
&end
#
# 138 LEU QD2 139 PRO HD2 6.15 (#peak 3853)
&rst
ixpk= 3853, nxpk= 0, iat= -1,2127, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2120,2121,2122,
&end
#
# 138 LEU QD2 225 ALA QB 6.15 (#peak 648)
&rst
ixpk= 648, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=2120,2121,2122,
igr2=3383,3384,3385,
&end
#
# 139 PRO HA 140 GLU HB3 6.15 (#peak 519)
&rst
ixpk= 519, nxpk= 0, iat=2136,2145, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 139 PRO HA 141 GLY HN 4.88 (#peak 415)
&rst
ixpk= 415, nxpk= 0, iat=2136,2155, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 139 PRO HB2 140 GLU HN 3.88 (#peak 2588)
&rst
ixpk= 2588, nxpk= 0, iat=2133,2140, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 139 PRO HB2 141 GLY HN 4.89 (#peak 401)
&rst
ixpk= 401, nxpk= 0, iat=2133,2155, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 139 PRO HB3 140 GLU HN 4.07 (#peak 2591)
&rst
ixpk= 2591, nxpk= 0, iat=2134,2140, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 139 PRO HB3 141 GLY HN 4.73 (#peak 411)
&rst
ixpk= 411, nxpk= 0, iat=2134,2155, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 139 PRO HB3 166 PHE QD 6.15 (#peak 2535)
&rst
ixpk= 2535, nxpk= 0, iat=2134, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=2508,2516,
&end
#
# 139 PRO HD3 166 PHE QD 6.15 (#peak 2748)
&rst
ixpk= 2748, nxpk= 0, iat=2128, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=2508,2516,
&end
#
# 139 PRO HD3 166 PHE QE 6.15 (#peak 8739)
&rst
ixpk= 8739, nxpk= 0, iat=2128, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=2510,2514,
&end
#
# 139 PRO HG2 140 GLU HN 4.40 (#peak 2594)
&rst
ixpk= 2594, nxpk= 0, iat=2130,2140, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 139 PRO HG2 141 GLY HN 5.89 (#peak 3241)
&rst
ixpk= 3241, nxpk= 0, iat=2130,2155, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 139 PRO HG2 166 PHE HB3 6.15 (#peak 3366)
&rst
ixpk= 3366, nxpk= 0, iat=2130,2505, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 139 PRO HG3 140 GLU HN 5.61 (#peak 2589)
&rst
ixpk= 2589, nxpk= 0, iat=2131,2140, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 140 GLU HN 140 GLU HB2 3.38 (#peak 2590)
&rst
ixpk= 2590, nxpk= 0, iat=2140,2144, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 140 GLU HN 140 GLU HB3 4.07 (#peak 2782)
&rst
ixpk= 2782, nxpk= 0, iat=2140,2145, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 140 GLU HN 140 GLU HG2 5.38 (#peak 2592)
&rst
ixpk= 2592, nxpk= 0, iat=2140,2147, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 140 GLU HN 140 GLU HG3 6.15 (#peak 499)
&rst
ixpk= 499, nxpk= 0, iat=2140,2148, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 140 GLU HN 141 GLY HN 3.40 (#peak 418)
&rst
ixpk= 418, nxpk= 0, iat=2140,2155, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 140 GLU HN 166 PHE QD 5.54 (#peak 3773)
&rst
ixpk= 3773, nxpk= 0, iat=2140, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr2=2508,2516,
&end
#
# 140 GLU HN 167 ALA HA 6.04 (#peak 3246)
&rst
ixpk= 3246, nxpk= 0, iat=2140,2522, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54, &end
#
# 140 GLU HA 167 ALA HA 6.15 (#peak 4703)
&rst
ixpk= 4703, nxpk= 0, iat=2142,2522, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 140 GLU HB2 141 GLY HN 4.80 (#peak 408)
&rst
ixpk= 408, nxpk= 0, iat=2144,2155, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 140 GLU HB3 141 GLY HN 4.74 (#peak 400)
&rst
ixpk= 400, nxpk= 0, iat=2145,2155, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 140 GLU HG2 141 GLY HN 5.23 (#peak 412)
&rst
ixpk= 412, nxpk= 0, iat=2147,2155, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 140 GLU HG3 141 GLY HN 5.01 (#peak 399)
&rst
ixpk= 399, nxpk= 0, iat=2148,2155, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 141 GLY HN 142 GLY HN 4.32 (#peak 1835)
&rst
ixpk= 1835, nxpk= 0, iat=2155,2162, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 141 GLY HN 166 PHE HB2 4.49 (#peak 416)
&rst
ixpk= 416, nxpk= 0, iat=2155,2504, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 141 GLY HN 166 PHE QD 5.01 (#peak 3775)
&rst
ixpk= 3775, nxpk= 0, iat=2155, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=2508,2516,
&end
#
# 141 GLY HN 166 PHE QE 6.05 (#peak 3774)
&rst
ixpk= 3774, nxpk= 0, iat=2155, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2510,2514,
&end
#
# 141 GLY HN 167 ALA HN 5.27 (#peak 405)
&rst
ixpk= 405, nxpk= 0, iat=2155,2520, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 141 GLY HN 167 ALA HA 4.73 (#peak 409)
&rst
ixpk= 409, nxpk= 0, iat=2155,2522, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 141 GLY HN 167 ALA QB 4.81 (#peak 407)
&rst
ixpk= 407, nxpk= 0, iat=2155, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=2524,2525,2526,
&end
#
# 141 GLY HA2 167 ALA HA 6.15 (#peak 2321)
&rst
ixpk= 2321, nxpk= 0, iat=2157,2522, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 141 GLY HA2 167 ALA QB 5.68 (#peak 2015)
&rst
ixpk= 2015, nxpk= 0, iat=2157, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=2524,2525,2526,
&end
#
# 141 GLY HA3 167 ALA HA 6.15 (#peak 2860)
&rst
ixpk= 2860, nxpk= 0, iat=2158,2522, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 141 GLY HA3 167 ALA QB 5.68 (#peak 2019)
&rst
ixpk= 2019, nxpk= 0, iat=2158, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=2524,2525,2526,
&end
#
# 142 GLY HN 166 PHE HN 5.10 (#peak 1948)
&rst
ixpk= 1948, nxpk= 0, iat=2162,2500, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 142 GLY HN 166 PHE HB2 4.87 (#peak 1842)
&rst
ixpk= 1842, nxpk= 0, iat=2162,2504, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 142 GLY HN 166 PHE HB3 5.12 (#peak 1836)
&rst
ixpk= 1836, nxpk= 0, iat=2162,2505, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 142 GLY HN 166 PHE QD 5.54 (#peak 3746)
&rst
ixpk= 3746, nxpk= 0, iat=2162, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr2=2508,2516,
&end
#
# 142 GLY HN 167 ALA QB 4.20 (#peak 1839)
&rst
ixpk= 1839, nxpk= 0, iat=2162, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=2524,2525,2526,
&end
#
# 142 GLY HA2 143 ARG HN 3.52 (#peak 1646)
&rst
ixpk= 1646, nxpk= 0, iat=2164,2169, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 142 GLY HA3 143 ARG HN 3.26 (#peak 1640)
&rst
ixpk= 1640, nxpk= 0, iat=2165,2169, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 142 GLY HA3 167 ALA QB 6.15 (#peak 2013)
&rst
ixpk= 2013, nxpk= 0, iat=2165, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2524,2525,2526,
&end
#
# 143 ARG HN 143 ARG HG2 4.78 (#peak 2922)
&rst
ixpk= 2922, nxpk= 0, iat=2169,2176, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 143 ARG HN 143 ARG HG3 4.84 (#peak 2923)
&rst
ixpk= 2923, nxpk= 0, iat=2169,2177, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 143 ARG HN 143 ARG QB 3.42 (#peak 1641)
&rst
ixpk= 1641, nxpk= 0, iat=2169, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=2173,2174,
&end
#
# 143 ARG HN 143 ARG QD 4.65 (#peak 1636)
&rst
ixpk= 1636, nxpk= 0, iat=2169, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=2179,2180,
&end
#
# 143 ARG HN 144 ALA HN 4.75 (#peak 1638)
&rst
ixpk= 1638, nxpk= 0, iat=2169,2193, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 143 ARG HN 165 ASP HA 5.14 (#peak 1647)
&rst
ixpk= 1647, nxpk= 0, iat=2169,2490, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 143 ARG HN 166 PHE QD 6.03 (#peak 1644)
&rst
ixpk= 1644, nxpk= 0, iat=2169, -1, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr2=2508,2516,
&end
#
# 143 ARG HA 143 ARG QD 6.15 (#peak 3430)
&rst
ixpk= 3430, nxpk= 0, iat=2171, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=2179,2180,
&end
#
# 143 ARG HA 144 ALA HN 3.53 (#peak 558)
&rst
ixpk= 558, nxpk= 0, iat=2171,2193, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 143 ARG HA 163 THR QG2 6.15 (#peak 3431)
&rst
ixpk= 3431, nxpk= 0, iat=2171, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2461,2462,2463,
&end
#
# 143 ARG HA 166 PHE HN 5.36 (#peak 2921)
&rst
ixpk= 2921, nxpk= 0, iat=2171,2500, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 143 ARG HA 166 PHE QD 6.15 (#peak 13164)
&rst
ixpk= 13164, nxpk= 0, iat=2171, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=2508,2516,
&end
#
# 143 ARG HA 166 PHE QE 6.15 (#peak 12308)
&rst
ixpk= 12308, nxpk= 0, iat=2171, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=2510,2514,
&end
#
# 143 ARG HG2 144 ALA HN 4.91 (#peak 550)
&rst
ixpk= 550, nxpk= 0, iat=2176,2193, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 143 ARG HG2 144 ALA HA 6.15 (#peak 1220)
&rst
ixpk= 1220, nxpk= 0, iat=2176,2195, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 143 ARG HG3 144 ALA HN 6.15 (#peak 3115)
&rst
ixpk= 3115, nxpk= 0, iat=2177,2193, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 143 ARG QB 144 ALA HN 3.84 (#peak 551)
&rst
ixpk= 551, nxpk= 0, iat= -1,2193, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1=2173,2174,
&end
#
# 143 ARG QB 163 THR QG2 6.15 (#peak 1669)
&rst
ixpk= 1669, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=2173,2174,
igr2=2461,2462,2463,
&end
#
# 143 ARG QB 166 PHE HN 4.60 (#peak 3747)
&rst
ixpk= 3747, nxpk= 0, iat= -1,2500, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1=2173,2174,
&end
#
# 143 ARG QD 144 ALA HN 6.07 (#peak 547)
&rst
ixpk= 547, nxpk= 0, iat= -1,2193, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1=2179,2180,
&end
#
# 143 ARG QD 163 THR QG2 6.15 (#peak 844)
&rst
ixpk= 844, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=2179,2180,
igr2=2461,2462,2463,
&end
#
# 144 ALA HN 144 ALA QB 3.55 (#peak 553)
&rst
ixpk= 553, nxpk= 0, iat=2193, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2=2197,2198,2199,
&end
#
# 144 ALA HN 145 THR HN 4.55 (#peak 1219)
&rst
ixpk= 1219, nxpk= 0, iat=2193,2203, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 144 ALA HN 163 THR QG2 5.23 (#peak 548)
&rst
ixpk= 548, nxpk= 0, iat=2193, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr2=2461,2462,2463,
&end
#
# 144 ALA HN 164 ILE HN 5.16 (#peak 3250)
&rst
ixpk= 3250, nxpk= 0, iat=2193,2469, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 144 ALA HN 164 ILE QG2 6.15 (#peak 556)
&rst
ixpk= 556, nxpk= 0, iat=2193, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2475,2476,2477,
&end
#
# 144 ALA HN 166 PHE QD 5.37 (#peak 3742)
&rst
ixpk= 3742, nxpk= 0, iat=2193, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=2508,2516,
&end
#
# 144 ALA HN 166 PHE QE 5.91 (#peak 3741)
&rst
ixpk= 3741, nxpk= 0, iat=2193, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2=2510,2514,
&end
#
# 144 ALA HA 163 THR HA 6.15 (#peak 3703)
&rst
ixpk= 3703, nxpk= 0, iat=2195,2457, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 144 ALA HA 164 ILE HN 6.15 (#peak 1029)
&rst
ixpk= 1029, nxpk= 0, iat=2195,2469, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 144 ALA QB 145 THR HN 3.38 (#peak 1224)
&rst
ixpk= 1224, nxpk= 0, iat= -1,2203, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr1=2197,2198,2199,
&end
#
# 144 ALA QB 163 THR HA 6.15 (#peak 3707)
&rst
ixpk= 3707, nxpk= 0, iat= -1,2457, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2197,2198,2199,
&end
#
# 144 ALA QB 164 ILE HN 4.51 (#peak 1694)
&rst
ixpk= 1694, nxpk= 0, iat= -1,2469, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=2197,2198,2199,
&end
#
# 144 ALA QB 166 PHE QE 5.98 (#peak 2523)
&rst
ixpk= 2523, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.06, r4= 8.56,
igr1=2197,2198,2199,
igr2=2510,2514,
&end
#
# 145 THR HN 145 THR HB 3.52 (#peak 1217)
&rst
ixpk= 1217, nxpk= 0, iat=2203,2207, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 145 THR HN 145 THR QG2 4.70 (#peak 1223)
&rst
ixpk= 1223, nxpk= 0, iat=2203, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2=2209,2210,2211,
&end
#
# 145 THR HN 146 TYR HN 5.46 (#peak 606)
&rst
ixpk= 606, nxpk= 0, iat=2203,2217, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 145 THR HN 146 TYR QD 6.15 (#peak 1226)
&rst
ixpk= 1226, nxpk= 0, iat=2203, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=2225,2234,
&end
#
# 145 THR HA 163 THR HA 6.15 (#peak 3709)
&rst
ixpk= 3709, nxpk= 0, iat=2205,2457, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 145 THR HA 164 ILE HN 5.93 (#peak 3253)
&rst
ixpk= 3253, nxpk= 0, iat=2205,2469, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 145 THR HB 146 TYR HN 5.64 (#peak 601)
&rst
ixpk= 601, nxpk= 0, iat=2207,2217, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 145 THR HB 250 HIS HN 6.15 (#peak 185)
&rst
ixpk= 185, nxpk= 0, iat=2207,3743, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 145 THR QG2 146 TYR HN 4.88 (#peak 604)
&rst
ixpk= 604, nxpk= 0, iat= -1,2217, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1=2209,2210,2211,
&end
#
# 145 THR QG2 146 TYR QD 6.15 (#peak 1361)
&rst
ixpk= 1361, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=2209,2210,2211,
igr2=2225,2234,
&end
#
# 145 THR QG2 147 ARG QG 6.15 (#peak 1362)
&rst
ixpk= 1362, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=2209,2210,2211,
igr2=2245,2246,
&end
#
# 145 THR QG2 250 HIS HN 6.15 (#peak 1454)
&rst
ixpk= 1454, nxpk= 0, iat= -1,3743, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2209,2210,2211,
&end
#
# 146 TYR HN 146 TYR QD 4.66 (#peak 610)
&rst
ixpk= 610, nxpk= 0, iat=2217, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr2=2225,2234,
&end
#
# 146 TYR HN 147 ARG HN 5.03 (#peak 436)
&rst
ixpk= 436, nxpk= 0, iat=2217,2238, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 146 TYR HN 162 TYR HN 6.15 (#peak 2019)
&rst
ixpk= 2019, nxpk= 0, iat=2217,2434, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 146 TYR HN 163 THR HA 6.15 (#peak 3702)
&rst
ixpk= 3702, nxpk= 0, iat=2217,2457, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 146 TYR HN 163 THR QG2 5.43 (#peak 4164)
&rst
ixpk= 4164, nxpk= 0, iat=2217, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2=2461,2462,2463,
&end
#
# 146 TYR HB2 147 ARG HN 4.53 (#peak 454)
&rst
ixpk= 454, nxpk= 0, iat=2221,2238, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 146 TYR HB2 162 TYR HB3 6.15 (#peak 4091)
&rst
ixpk= 4091, nxpk= 0, iat=2221,2439, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 146 TYR HB3 147 ARG HN 5.22 (#peak 440)
&rst
ixpk= 440, nxpk= 0, iat=2222,2238, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 146 TYR O 162 TYR HN 2.40
&rst
ixpk= 440, nxpk= 0, iat=2236,2434, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 146 TYR O 162 TYR N 3.30
&rst
ixpk= 440, nxpk= 0, iat=2236,2433, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 146 TYR QD 147 ARG HN 4.55 (#peak 449)
&rst
ixpk= 449, nxpk= 0, iat= -1,2238, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr1=2225,2234,
&end
#
# 146 TYR QD 227 GLU HN 6.15 (#peak 3910)
&rst
ixpk= 3910, nxpk= 0, iat= -1,3406, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2225,2234,
&end
#
# 146 TYR QD 227 GLU HA 3.92 (#peak 12765)
&rst
ixpk= 12765, nxpk= 0, iat= -1,3408, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr1=2225,2234,
&end
#
# 146 TYR QD 228 VAL HN 4.80 (#peak 12784)
&rst
ixpk= 12784, nxpk= 0, iat= -1,3421, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=2225,2234,
&end
#
# 146 TYR QD 228 VAL QG1 3.95 (#peak 12795)
&rst
ixpk= 12795, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=2225,2234,
igr2=3427,3428,3429,
&end
#
# 146 TYR QD 228 VAL QG2 4.09 (#peak 1724)
&rst
ixpk= 1724, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1=2225,2234,
igr2=3431,3432,3433,
&end
#
# 146 TYR QD 248 LYS HA 3.76 (#peak 12766)
&rst
ixpk= 12766, nxpk= 0, iat= -1,3706, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr1=2225,2234,
&end
#
# 146 TYR QD 250 HIS HN 4.79 (#peak 1457)
&rst
ixpk= 1457, nxpk= 0, iat= -1,3743, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1=2225,2234,
&end
#
# 146 TYR QE 164 ILE QD1 4.14 (#peak 12808)
&rst
ixpk= 12808, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=2227,2232,
igr2=2482,2483,2484,
&end
#
# 146 TYR QE 164 ILE QG2 3.44 (#peak 12817)
&rst
ixpk= 12817, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1=2227,2232,
igr2=2475,2476,2477,
&end
#
# 146 TYR QE 166 PHE HZ 4.68 (#peak 12722)
&rst
ixpk= 12722, nxpk= 0, iat= -1,2512, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1=2227,2232,
&end
#
# 146 TYR QE 166 PHE QE 4.28 (#peak 12721)
&rst
ixpk= 12721, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=2227,2232,
igr2=2510,2514,
&end
#
# 146 TYR QE 225 ALA QB 4.14 (#peak 13159)
&rst
ixpk= 13159, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=2227,2232,
igr2=3383,3384,3385,
&end
#
# 146 TYR QE 227 GLU HA 3.72 (#peak 12764)
&rst
ixpk= 12764, nxpk= 0, iat= -1,3408, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1=2227,2232,
&end
#
# 146 TYR QE 228 VAL HN 5.09 (#peak 12780)
&rst
ixpk= 12780, nxpk= 0, iat= -1,3421, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
igr1=2227,2232,
&end
#
# 146 TYR QE 228 VAL QG1 4.01 (#peak 12797)
&rst
ixpk= 12797, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr1=2227,2232,
igr2=3427,3428,3429,
&end
#
# 146 TYR QE 228 VAL QG2 4.02 (#peak 12796)
&rst
ixpk= 12796, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=2227,2232,
igr2=3431,3432,3433,
&end
#
# 146 TYR QE 248 LYS HA 4.44 (#peak 12769)
&rst
ixpk= 12769, nxpk= 0, iat= -1,3706, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1=2227,2232,
&end
#
# 147 ARG HN 147 ARG HB3 4.11 (#peak 445)
&rst
ixpk= 445, nxpk= 0, iat=2238,2243, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 147 ARG HN 147 ARG QD 4.59 (#peak 442)
&rst
ixpk= 442, nxpk= 0, iat=2238, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=2248,2249,
&end
#
# 147 ARG HN 147 ARG QG 5.08 (#peak 453)
&rst
ixpk= 453, nxpk= 0, iat=2238, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=2245,2246,
&end
#
# 147 ARG HN 148 GLY HN 4.99 (#peak 2187)
&rst
ixpk= 2187, nxpk= 0, iat=2238,2262, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 147 ARG HN 148 GLY HA3 6.15 (#peak 3984)
&rst
ixpk= 3984, nxpk= 0, iat=2238,2265, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 147 ARG HN 247 ALA QB 5.22 (#peak 441)
&rst
ixpk= 441, nxpk= 0, iat=2238, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=3698,3699,3700,
&end
#
# 147 ARG HN 248 LYS HN 5.90 (#peak 446)
&rst
ixpk= 446, nxpk= 0, iat=2238,3704, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40, &end
#
# 147 ARG HN 249 GLN HA 5.67 (#peak 439)
&rst
ixpk= 439, nxpk= 0, iat=2238,3728, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 147 ARG HN 250 HIS HN 6.09 (#peak 1451)
&rst
ixpk= 1451, nxpk= 0, iat=2238,3743, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59, &end
#
# 147 ARG HA 147 ARG QD 6.15 (#peak 4554)
&rst
ixpk= 4554, nxpk= 0, iat=2240, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=2248,2249,
&end
#
# 147 ARG HA 161 THR HA 6.15 (#peak 1058)
&rst
ixpk= 1058, nxpk= 0, iat=2240,2422, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 147 ARG HA 161 THR QG2 6.15 (#peak 1795)
&rst
ixpk= 1795, nxpk= 0, iat=2240, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2426,2427,2428,
&end
#
# 147 ARG HA 162 TYR HN 4.59 (#peak 2020)
&rst
ixpk= 2020, nxpk= 0, iat=2240,2434, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 147 ARG HB2 148 GLY HN 5.22 (#peak 2188)
&rst
ixpk= 2188, nxpk= 0, iat=2242,2262, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 147 ARG HB2 161 THR QG2 6.15 (#peak 1793)
&rst
ixpk= 1793, nxpk= 0, iat=2242, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2426,2427,2428,
&end
#
# 147 ARG HB3 148 GLY HN 5.36 (#peak 2196)
&rst
ixpk= 2196, nxpk= 0, iat=2243,2262, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 147 ARG QD 148 GLY HN 4.40 (#peak 2195)
&rst
ixpk= 2195, nxpk= 0, iat= -1,2262, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=2248,2249,
&end
#
# 147 ARG QD 161 THR HA 6.15 (#peak 2070)
&rst
ixpk= 2070, nxpk= 0, iat= -1,2422, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2248,2249,
&end
#
# 147 ARG QD 161 THR QG2 6.00 (#peak 2071)
&rst
ixpk= 2071, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1=2248,2249,
igr2=2426,2427,2428,
&end
#
# 147 ARG QG 148 GLY HN 3.90 (#peak 2202)
&rst
ixpk= 2202, nxpk= 0, iat= -1,2262, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1=2245,2246,
&end
#
# 147 ARG QG 161 THR HA 6.15 (#peak 4033)
&rst
ixpk= 4033, nxpk= 0, iat= -1,2422, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2245,2246,
&end
#
# 148 GLY HN 149 THR HN 4.72 (#peak 2199)
&rst
ixpk= 2199, nxpk= 0, iat=2262,2269, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 148 GLY HN 159 LYS HA 6.15 (#peak 1273)
&rst
ixpk= 1273, nxpk= 0, iat=2262,2381, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 148 GLY HN 160 LEU HN 4.72 (#peak 651)
&rst
ixpk= 651, nxpk= 0, iat=2262,2401, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 148 GLY HN 160 LEU HG 6.15 (#peak 3970)
&rst
ixpk= 3970, nxpk= 0, iat=2262,2408, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 148 GLY HN 160 LEU QB 5.31 (#peak 2193)
&rst
ixpk= 2193, nxpk= 0, iat=2262, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=2405,2406,
&end
#
# 148 GLY HN 160 LEU QD2 5.07 (#peak 3466)
&rst
ixpk= 3466, nxpk= 0, iat=2262, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr2=2414,2415,2416,
&end
#
# 148 GLY HN 161 THR HA 4.35 (#peak 2191)
&rst
ixpk= 2191, nxpk= 0, iat=2262,2422, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 148 GLY HN 161 THR QG2 6.15 (#peak 1803)
&rst
ixpk= 1803, nxpk= 0, iat=2262, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2426,2427,2428,
&end
#
# 148 GLY HN 162 TYR HN 5.91 (#peak 2028)
&rst
ixpk= 2028, nxpk= 0, iat=2262,2434, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 148 GLY HN 247 ALA QB 5.46 (#peak 4723)
&rst
ixpk= 4723, nxpk= 0, iat=2262, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr2=3698,3699,3700,
&end
#
# 148 GLY HA3 149 THR HB 6.15 (#peak 3986)
&rst
ixpk= 3986, nxpk= 0, iat=2265,2273, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 148 GLY HA3 246 ALA HN 6.15 (#peak 2796)
&rst
ixpk= 2796, nxpk= 0, iat=2265,3684, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 148 GLY HA3 247 ALA HA 6.15 (#peak 4246)
&rst
ixpk= 4246, nxpk= 0, iat=2265,3696, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 148 GLY HA3 247 ALA QB 6.15 (#peak 3985)
&rst
ixpk= 3985, nxpk= 0, iat=2265, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3698,3699,3700,
&end
#
# 148 GLY HA3 248 LYS HN 6.15 (#peak 3987)
&rst
ixpk= 3987, nxpk= 0, iat=2265,3704, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 149 THR HN 149 THR QG2 4.09 (#peak 2797)
&rst
ixpk= 2797, nxpk= 0, iat=2269, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=2275,2276,2277,
&end
#
# 149 THR HN 150 ALA HN 4.99 (#peak 65)
&rst
ixpk= 65, nxpk= 0, iat=2269,2283, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 149 THR HN 160 LEU QD1 5.33 (#peak 4722)
&rst
ixpk= 4722, nxpk= 0, iat=2269, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2=2410,2411,2412,
&end
#
# 149 THR HN 245 LEU HA 5.67 (#peak 1597)
&rst
ixpk= 1597, nxpk= 0, iat=2269,3667, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 149 THR HN 245 LEU QD1 6.15 (#peak 4721)
&rst
ixpk= 4721, nxpk= 0, iat=2269, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3674,3675,3676,
&end
#
# 149 THR HN 246 ALA HN 4.31 (#peak 259)
&rst
ixpk= 259, nxpk= 0, iat=2269,3684, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 149 THR HN 246 ALA QB 4.56 (#peak 4720)
&rst
ixpk= 4720, nxpk= 0, iat=2269, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2=3688,3689,3690,
&end
#
# 149 THR HN 247 ALA HA 5.19 (#peak 3010)
&rst
ixpk= 3010, nxpk= 0, iat=2269,3696, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 149 THR HN 247 ALA QB 5.74 (#peak 2326)
&rst
ixpk= 2326, nxpk= 0, iat=2269, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr2=3698,3699,3700,
&end
#
# 149 THR HA 159 LYS HA 6.15 (#peak 2930)
&rst
ixpk= 2930, nxpk= 0, iat=2271,2381, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 149 THR HA 160 LEU HN 4.96 (#peak 649)
&rst
ixpk= 649, nxpk= 0, iat=2271,2401, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 149 THR HB 150 ALA HN 4.95 (#peak 61)
&rst
ixpk= 61, nxpk= 0, iat=2273,2283, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 149 THR HB 151 PHE QD 4.36 (#peak 12255)
&rst
ixpk= 12255, nxpk= 0, iat=2273, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=2301,2309,
&end
#
# 149 THR HB 246 ALA HN 4.97 (#peak 257)
&rst
ixpk= 257, nxpk= 0, iat=2273,3684, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 149 THR QG2 150 ALA HN 5.24 (#peak 58)
&rst
ixpk= 58, nxpk= 0, iat= -1,2283, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1=2275,2276,2277,
&end
#
# 149 THR QG2 151 PHE HN 6.15 (#peak 1999)
&rst
ixpk= 1999, nxpk= 0, iat= -1,2293, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2275,2276,2277,
&end
#
# 149 THR QG2 151 PHE HB3 6.15 (#peak 1996)
&rst
ixpk= 1996, nxpk= 0, iat= -1,2298, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2275,2276,2277,
&end
#
# 149 THR QG2 151 PHE QD 3.32 (#peak 10761)
&rst
ixpk= 10761, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1=2275,2276,2277,
igr2=2301,2309,
&end
#
# 149 THR QG2 151 PHE QE 4.31 (#peak 13182)
&rst
ixpk= 13182, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1=2275,2276,2277,
igr2=2303,2307,
&end
#
# 149 THR QG2 159 LYS HG2 6.15 (#peak 3688)
&rst
ixpk= 3688, nxpk= 0, iat= -1,2386, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2275,2276,2277,
&end
#
# 149 THR QG2 159 LYS HG3 6.15 (#peak 1995)
&rst
ixpk= 1995, nxpk= 0, iat= -1,2387, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2275,2276,2277,
&end
#
# 149 THR QG2 159 LYS QB 6.15 (#peak 1998)
&rst
ixpk= 1998, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=2275,2276,2277,
igr2=2383,2384,
&end
#
# 149 THR QG2 159 LYS QD 5.45 (#peak 2634)
&rst
ixpk= 2634, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
igr1=2275,2276,2277,
igr2=2389,2390,
&end
#
# 149 THR QG2 246 ALA HN 5.24 (#peak 2934)
&rst
ixpk= 2934, nxpk= 0, iat= -1,3684, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1=2275,2276,2277,
&end
#
# 150 ALA HN 150 ALA QB 3.79 (#peak 68)
&rst
ixpk= 68, nxpk= 0, iat=2283, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2=2287,2288,2289,
&end
#
# 150 ALA HN 151 PHE HN 4.55 (#peak 1563)
&rst
ixpk= 1563, nxpk= 0, iat=2283,2293, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 150 ALA HN 151 PHE HA 6.15 (#peak 54)
&rst
ixpk= 54, nxpk= 0, iat=2283,2295, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 150 ALA HN 158 GLY HN 4.99 (#peak 891)
&rst
ixpk= 891, nxpk= 0, iat=2283,2372, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 150 ALA HN 158 GLY HA3 6.15 (#peak 2311)
&rst
ixpk= 2311, nxpk= 0, iat=2283,2375, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 150 ALA HN 159 LYS HA 4.13 (#peak 55)
&rst
ixpk= 55, nxpk= 0, iat=2283,2381, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 150 ALA HN 159 LYS HG2 6.11 (#peak 4783)
&rst
ixpk= 4783, nxpk= 0, iat=2283,2386, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61, &end
#
# 150 ALA HN 159 LYS HG3 5.99 (#peak 4784)
&rst
ixpk= 4784, nxpk= 0, iat=2283,2387, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49, &end
#
# 150 ALA HN 159 LYS QB 5.69 (#peak 57)
&rst
ixpk= 57, nxpk= 0, iat=2283, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr2=2383,2384,
&end
#
# 150 ALA HN 159 LYS QD 4.71 (#peak 62)
&rst
ixpk= 62, nxpk= 0, iat=2283, -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr2=2389,2390,
&end
#
# 150 ALA HN 160 LEU HN 5.33 (#peak 53)
&rst
ixpk= 53, nxpk= 0, iat=2283,2401, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 150 ALA HN 243 ILE QG2 4.60 (#peak 4846)
&rst
ixpk= 4846, nxpk= 0, iat=2283, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=3645,3646,3647,
&end
#
# 150 ALA HA 243 ILE QG2 6.04 (#peak 3530)
&rst
ixpk= 3530, nxpk= 0, iat=2285, -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr2=3645,3646,3647,
&end
#
# 150 ALA HA 244 GLY HN 5.66 (#peak 1100)
&rst
ixpk= 1100, nxpk= 0, iat=2285,3658, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16, &end
#
# 150 ALA HA 245 LEU HA 6.15 (#peak 3527)
&rst
ixpk= 3527, nxpk= 0, iat=2285,3667, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 150 ALA HA 245 LEU QD1 6.15 (#peak 3426)
&rst
ixpk= 3426, nxpk= 0, iat=2285, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3674,3675,3676,
&end
#
# 150 ALA HA 245 LEU QD2 6.15 (#peak 3526)
&rst
ixpk= 3526, nxpk= 0, iat=2285, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3678,3679,3680,
&end
#
# 150 ALA HA 246 ALA HN 5.33 (#peak 260)
&rst
ixpk= 260, nxpk= 0, iat=2285,3684, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 150 ALA QB 151 PHE HN 4.70 (#peak 1577)
&rst
ixpk= 1577, nxpk= 0, iat= -1,2293, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1=2287,2288,2289,
&end
#
# 150 ALA QB 151 PHE HA 6.15 (#peak 3948)
&rst
ixpk= 3948, nxpk= 0, iat= -1,2295, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2287,2288,2289,
&end
#
# 150 ALA QB 152 GLY HN 5.26 (#peak 2270)
&rst
ixpk= 2270, nxpk= 0, iat= -1,2313, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1=2287,2288,2289,
&end
#
# 150 ALA QB 156 ALA HN 6.15 (#peak 4490)
&rst
ixpk= 4490, nxpk= 0, iat= -1,2355, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2287,2288,2289,
&end
#
# 150 ALA QB 157 GLY HN 6.15 (#peak 4779)
&rst
ixpk= 4779, nxpk= 0, iat= -1,2365, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2287,2288,2289,
&end
#
# 150 ALA QB 158 GLY HN 5.56 (#peak 903)
&rst
ixpk= 903, nxpk= 0, iat= -1,2372, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr1=2287,2288,2289,
&end
#
# 150 ALA QB 158 GLY HA3 6.15 (#peak 3953)
&rst
ixpk= 3953, nxpk= 0, iat= -1,2375, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2287,2288,2289,
&end
#
# 150 ALA QB 159 LYS HA 6.15 (#peak 3949)
&rst
ixpk= 3949, nxpk= 0, iat= -1,2381, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2287,2288,2289,
&end
#
# 150 ALA QB 159 LYS HG3 6.15 (#peak 3950)
&rst
ixpk= 3950, nxpk= 0, iat= -1,2387, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2287,2288,2289,
&end
#
# 150 ALA QB 159 LYS QD 5.07 (#peak 3955)
&rst
ixpk= 3955, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1=2287,2288,2289,
igr2=2389,2390,
&end
#
# 150 ALA QB 160 LEU HN 5.06 (#peak 655)
&rst
ixpk= 655, nxpk= 0, iat= -1,2401, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1=2287,2288,2289,
&end
#
# 150 ALA QB 243 ILE QG2 4.80 (#peak 3956)
&rst
ixpk= 3956, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
igr1=2287,2288,2289,
igr2=3645,3646,3647,
&end
#
# 150 ALA QB 245 LEU HA 6.15 (#peak 3952)
&rst
ixpk= 3952, nxpk= 0, iat= -1,3667, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2287,2288,2289,
&end
#
# 150 ALA QB 245 LEU QD1 4.60 (#peak 3428)
&rst
ixpk= 3428, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr1=2287,2288,2289,
igr2=3674,3675,3676,
&end
#
# 150 ALA QB 245 LEU QD2 4.94 (#peak 3946)
&rst
ixpk= 3946, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr1=2287,2288,2289,
igr2=3678,3679,3680,
&end
#
# 150 ALA QB 246 ALA HN 5.80 (#peak 3261)
&rst
ixpk= 3261, nxpk= 0, iat= -1,3684, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1=2287,2288,2289,
&end
#
# 151 PHE HN 151 PHE QD 3.76 (#peak 1568)
&rst
ixpk= 1568, nxpk= 0, iat=2293, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=2301,2309,
&end
#
# 151 PHE HN 243 ILE HA 6.15 (#peak 3401)
&rst
ixpk= 3401, nxpk= 0, iat=2293,3641, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 151 PHE HN 243 ILE QD1 4.84 (#peak 2791)
&rst
ixpk= 2791, nxpk= 0, iat=2293, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2=3652,3653,3654,
&end
#
# 151 PHE HN 243 ILE QG2 4.64 (#peak 1572)
&rst
ixpk= 1572, nxpk= 0, iat=2293, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=3645,3646,3647,
&end
#
# 151 PHE HN 244 GLY HN 4.38 (#peak 1569)
&rst
ixpk= 1569, nxpk= 0, iat=2293,3658, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 151 PHE HN 244 GLY HA2 6.15 (#peak 2911)
&rst
ixpk= 2911, nxpk= 0, iat=2293,3660, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 151 PHE HN 244 GLY HA3 4.93 (#peak 1576)
&rst
ixpk= 1576, nxpk= 0, iat=2293,3661, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 151 PHE HN 245 LEU QD2 5.46 (#peak 2792)
&rst
ixpk= 2792, nxpk= 0, iat=2293, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr2=3678,3679,3680,
&end
#
# 151 PHE HA 156 ALA HN 4.96 (#peak 2551)
&rst
ixpk= 2551, nxpk= 0, iat=2295,2355, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 151 PHE HA 156 ALA HA 6.15 (#peak 1118)
&rst
ixpk= 1118, nxpk= 0, iat=2295,2357, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 151 PHE HA 156 ALA QB 6.15 (#peak 1470)
&rst
ixpk= 1470, nxpk= 0, iat=2295, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2359,2360,2361,
&end
#
# 151 PHE HA 158 GLY HN 6.15 (#peak 1120)
&rst
ixpk= 1120, nxpk= 0, iat=2295,2372, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 151 PHE HB2 152 GLY HN 4.63 (#peak 2262)
&rst
ixpk= 2262, nxpk= 0, iat=2297,2313, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 151 PHE HB2 156 ALA HN 6.15 (#peak 2554)
&rst
ixpk= 2554, nxpk= 0, iat=2297,2355, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 151 PHE HB2 156 ALA HA 6.15 (#peak 12)
&rst
ixpk= 12, nxpk= 0, iat=2297,2357, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 151 PHE HB2 156 ALA QB 6.15 (#peak 1473)
&rst
ixpk= 1473, nxpk= 0, iat=2297, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2359,2360,2361,
&end
#
# 151 PHE HB3 152 GLY HN 4.42 (#peak 2261)
&rst
ixpk= 2261, nxpk= 0, iat=2298,2313, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 151 PHE HB3 156 ALA HA 6.15 (#peak 11)
&rst
ixpk= 11, nxpk= 0, iat=2298,2357, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 151 PHE HB3 156 ALA QB 6.15 (#peak 1472)
&rst
ixpk= 1472, nxpk= 0, iat=2298, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2359,2360,2361,
&end
#
# 151 PHE QD 152 GLY HN 5.01 (#peak 2263)
&rst
ixpk= 2263, nxpk= 0, iat= -1,2313, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1=2301,2309,
&end
#
# 151 PHE QD 244 GLY HN 4.88 (#peak 1092)
&rst
ixpk= 1092, nxpk= 0, iat= -1,3658, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1=2301,2309,
&end
#
# 151 PHE QD 246 ALA HN 6.15 (#peak 3919)
&rst
ixpk= 3919, nxpk= 0, iat= -1,3684, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2301,2309,
&end
#
# 151 PHE QE 244 GLY HN 5.45 (#peak 2813)
&rst
ixpk= 2813, nxpk= 0, iat= -1,3658, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1=2303,2307,
&end
#
# 151 PHE QE 246 ALA HN 6.15 (#peak 3914)
&rst
ixpk= 3914, nxpk= 0, iat= -1,3684, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2303,2307,
&end
#
# 151 PHE QE 246 ALA QB 4.32 (#peak 4343)
&rst
ixpk= 4343, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1=2303,2307,
igr2=3688,3689,3690,
&end
#
# 152 GLY HN 153 SER HN 4.77 (#peak 1320)
&rst
ixpk= 1320, nxpk= 0, iat=2313,2320, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 152 GLY HN 155 ASP HA 6.15 (#peak 2265)
&rst
ixpk= 2265, nxpk= 0, iat=2313,2345, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 152 GLY HN 156 ALA HA 5.16 (#peak 2256)
&rst
ixpk= 2256, nxpk= 0, iat=2313,2357, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 152 GLY HN 156 ALA QB 4.58 (#peak 2260)
&rst
ixpk= 2260, nxpk= 0, iat=2313, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=2359,2360,2361,
&end
#
# 152 GLY HN 243 ILE QG2 3.82 (#peak 2266)
&rst
ixpk= 2266, nxpk= 0, iat=2313, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2=3645,3646,3647,
&end
#
# 152 GLY HA2 155 ASP HN 5.73 (#peak 167)
&rst
ixpk= 167, nxpk= 0, iat=2315,2343, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 152 GLY HA2 243 ILE HA 6.15 (#peak 3554)
&rst
ixpk= 3554, nxpk= 0, iat=2315,3641, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 152 GLY HA2 243 ILE QG2 6.15 (#peak 3552)
&rst
ixpk= 3552, nxpk= 0, iat=2315, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3645,3646,3647,
&end
#
# 152 GLY HA3 155 ASP HN 5.51 (#peak 166)
&rst
ixpk= 166, nxpk= 0, iat=2316,2343, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 152 GLY HA3 243 ILE QG2 6.15 (#peak 3471)
&rst
ixpk= 3471, nxpk= 0, iat=2316, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3645,3646,3647,
&end
#
# 152 GLY HA3 244 GLY HN 5.42 (#peak 1099)
&rst
ixpk= 1099, nxpk= 0, iat=2316,3658, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 153 SER HN 154 ASP HN 4.24 (#peak 4551)
&rst
ixpk= 4551, nxpk= 0, iat=2320,2331, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 153 SER HN 241 ARG QD 4.99 (#peak 4553)
&rst
ixpk= 4553, nxpk= 0, iat=2320, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2=3608,3609,
&end
#
# 153 SER HN 243 ILE HA 6.15 (#peak 1321)
&rst
ixpk= 1321, nxpk= 0, iat=2320,3641, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 153 SER HN 243 ILE HG13 6.15 (#peak 1317)
&rst
ixpk= 1317, nxpk= 0, iat=2320,3650, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 153 SER HN 243 ILE QG2 6.14 (#peak 1319)
&rst
ixpk= 1319, nxpk= 0, iat=2320, -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr2=3645,3646,3647,
&end
#
# 153 SER HA 154 ASP HA 6.15 (#peak 3180)
&rst
ixpk= 3180, nxpk= 0, iat=2322,2333, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 153 SER HA 155 ASP HN 4.92 (#peak 159)
&rst
ixpk= 159, nxpk= 0, iat=2322,2343, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 153 SER QB 154 ASP HN 5.15 (#peak 953)
&rst
ixpk= 953, nxpk= 0, iat= -1,2331, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1=2324,2325,
&end
#
# 154 ASP HN 155 ASP HN 3.73 (#peak 161)
&rst
ixpk= 161, nxpk= 0, iat=2331,2343, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 154 ASP HA 155 ASP HN 3.52 (#peak 165)
&rst
ixpk= 165, nxpk= 0, iat=2333,2343, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 154 ASP HB2 155 ASP HN 5.02 (#peak 162)
&rst
ixpk= 162, nxpk= 0, iat=2335,2343, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 154 ASP HB2 156 ALA HN 6.15 (#peak 4554)
&rst
ixpk= 4554, nxpk= 0, iat=2335,2355, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 154 ASP HB3 155 ASP HN 4.70 (#peak 168)
&rst
ixpk= 168, nxpk= 0, iat=2336,2343, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 154 ASP HB3 241 ARG HG2 6.15 (#peak 4623)
&rst
ixpk= 4623, nxpk= 0, iat=2336,3605, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 154 ASP HB3 241 ARG HG3 6.15 (#peak 4622)
&rst
ixpk= 4622, nxpk= 0, iat=2336,3606, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 155 ASP HN 155 ASP HB2 3.93 (#peak 158)
&rst
ixpk= 158, nxpk= 0, iat=2343,2347, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 155 ASP HN 155 ASP HB3 3.34 (#peak 164)
&rst
ixpk= 164, nxpk= 0, iat=2343,2348, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 155 ASP HN 156 ALA HN 4.07 (#peak 169)
&rst
ixpk= 169, nxpk= 0, iat=2343,2355, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 155 ASP HN 156 ALA QB 4.86 (#peak 160)
&rst
ixpk= 160, nxpk= 0, iat=2343, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2=2359,2360,2361,
&end
#
# 155 ASP HN 243 ILE QG2 5.89 (#peak 3311)
&rst
ixpk= 3311, nxpk= 0, iat=2343, -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
igr2=3645,3646,3647,
&end
#
# 155 ASP HA 157 GLY HN 4.86 (#peak 4149)
&rst
ixpk= 4149, nxpk= 0, iat=2345,2365, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 155 ASP HB2 156 ALA HN 4.41 (#peak 2552)
&rst
ixpk= 2552, nxpk= 0, iat=2347,2355, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 155 ASP HB2 157 GLY HN 6.09 (#peak 2608)
&rst
ixpk= 2608, nxpk= 0, iat=2347,2365, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59, &end
#
# 155 ASP HB3 156 ALA HN 5.13 (#peak 2557)
&rst
ixpk= 2557, nxpk= 0, iat=2348,2355, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 156 ALA HN 156 ALA QB 3.36 (#peak 2553)
&rst
ixpk= 2553, nxpk= 0, iat=2355, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2=2359,2360,2361,
&end
#
# 156 ALA HN 157 GLY HN 4.04 (#peak 2613)
&rst
ixpk= 2613, nxpk= 0, iat=2355,2365, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 156 ALA HN 157 GLY HA2 5.58 (#peak 2555)
&rst
ixpk= 2555, nxpk= 0, iat=2355,2367, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 156 ALA HN 157 GLY HA3 5.26 (#peak 2558)
&rst
ixpk= 2558, nxpk= 0, iat=2355,2368, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 156 ALA HN 158 GLY HN 5.57 (#peak 900)
&rst
ixpk= 900, nxpk= 0, iat=2355,2372, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 156 ALA HN 243 ILE QG2 5.49 (#peak 4555)
&rst
ixpk= 4555, nxpk= 0, iat=2355, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr2=3645,3646,3647,
&end
#
# 156 ALA HA 158 GLY HN 6.15 (#peak 9)
&rst
ixpk= 9, nxpk= 0, iat=2357,2372, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 156 ALA QB 157 GLY HN 3.87 (#peak 2607)
&rst
ixpk= 2607, nxpk= 0, iat= -1,2365, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1=2359,2360,2361,
&end
#
# 156 ALA QB 158 GLY HN 6.15 (#peak 1471)
&rst
ixpk= 1471, nxpk= 0, iat= -1,2372, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2359,2360,2361,
&end
#
# 157 GLY HN 158 GLY HN 3.94 (#peak 2606)
&rst
ixpk= 2606, nxpk= 0, iat=2365,2372, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 157 GLY HN 178 LEU QD1 5.85 (#peak 4489)
&rst
ixpk= 4489, nxpk= 0, iat=2365, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr2=2689,2690,2691,
&end
#
# 157 GLY HN 178 LEU QD2 5.57 (#peak 4488)
&rst
ixpk= 4488, nxpk= 0, iat=2365, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr2=2693,2694,2695,
&end
#
# 158 GLY HN 159 LYS HN 4.71 (#peak 2376)
&rst
ixpk= 2376, nxpk= 0, iat=2372,2379, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 158 GLY HN 159 LYS QD 5.60 (#peak 898)
&rst
ixpk= 898, nxpk= 0, iat=2372, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2=2389,2390,
&end
#
# 158 GLY HA2 175 ILE QD1 6.15 (#peak 4145)
&rst
ixpk= 4145, nxpk= 0, iat=2374, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2642,2643,2644,
&end
#
# 158 GLY HA2 176 GLU HN 6.15 (#peak 4150)
&rst
ixpk= 4150, nxpk= 0, iat=2374,2648, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 158 GLY HA2 177 HIS HB2 6.15 (#peak 4146)
&rst
ixpk= 4146, nxpk= 0, iat=2374,2667, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 158 GLY HA2 177 HIS HB3 6.15 (#peak 4151)
&rst
ixpk= 4151, nxpk= 0, iat=2374,2668, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 158 GLY HA2 177 HIS HD2 5.86 (#peak 12856)
&rst
ixpk= 12856, nxpk= 0, iat=2374,2676, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 158 GLY HA2 178 LEU HN 6.15 (#peak 4147)
&rst
ixpk= 4147, nxpk= 0, iat=2374,2680, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 158 GLY HA2 178 LEU QD1 6.15 (#peak 4148)
&rst
ixpk= 4148, nxpk= 0, iat=2374, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2689,2690,2691,
&end
#
# 158 GLY HA3 159 LYS HG3 6.15 (#peak 1297)
&rst
ixpk= 1297, nxpk= 0, iat=2375,2387, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 158 GLY HA3 176 GLU HN 6.15 (#peak 2315)
&rst
ixpk= 2315, nxpk= 0, iat=2375,2648, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 158 GLY HA3 178 LEU QD1 6.15 (#peak 2312)
&rst
ixpk= 2312, nxpk= 0, iat=2375, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2689,2690,2691,
&end
#
# 158 GLY HA3 178 LEU QD2 6.15 (#peak 2552)
&rst
ixpk= 2552, nxpk= 0, iat=2375, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2693,2694,2695,
&end
#
# 159 LYS HN 159 LYS HG2 5.26 (#peak 2385)
&rst
ixpk= 2385, nxpk= 0, iat=2379,2386, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 159 LYS HN 159 LYS HG3 4.96 (#peak 3345)
&rst
ixpk= 3345, nxpk= 0, iat=2379,2387, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 159 LYS HN 159 LYS QB 4.01 (#peak 2378)
&rst
ixpk= 2378, nxpk= 0, iat=2379, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=2383,2384,
&end
#
# 159 LYS HN 159 LYS QD 4.77 (#peak 2383)
&rst
ixpk= 2383, nxpk= 0, iat=2379, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr2=2389,2390,
&end
#
# 159 LYS HN 160 LEU HN 5.12 (#peak 653)
&rst
ixpk= 653, nxpk= 0, iat=2379,2401, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 159 LYS HN 176 GLU HN 5.20 (#peak 2976)
&rst
ixpk= 2976, nxpk= 0, iat=2379,2648, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 159 LYS HN 177 HIS HA 6.15 (#peak 2978)
&rst
ixpk= 2978, nxpk= 0, iat=2379,2665, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 159 LYS HN 177 HIS HB2 4.60 (#peak 2372)
&rst
ixpk= 2372, nxpk= 0, iat=2379,2667, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 159 LYS HN 177 HIS HB3 4.60 (#peak 2381)
&rst
ixpk= 2381, nxpk= 0, iat=2379,2668, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 159 LYS HN 177 HIS HD2 5.35 (#peak 3020)
&rst
ixpk= 3020, nxpk= 0, iat=2379,2676, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 159 LYS HN 178 LEU QD1 6.15 (#peak 3342)
&rst
ixpk= 3342, nxpk= 0, iat=2379, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2689,2690,2691,
&end
#
# 159 LYS HN 178 LEU QD2 5.84 (#peak 3343)
&rst
ixpk= 3343, nxpk= 0, iat=2379, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr2=2693,2694,2695,
&end
#
# 159 LYS HA 159 LYS QD 6.15 (#peak 2630)
&rst
ixpk= 2630, nxpk= 0, iat=2381, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=2389,2390,
&end
#
# 159 LYS HG2 159 LYS QD 2.88 (#peak 2637)
&rst
ixpk= 2637, nxpk= 0, iat=2386, -1, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
igr2=2389,2390,
&end
#
# 159 LYS HG2 160 LEU HN 6.05 (#peak 654)
&rst
ixpk= 654, nxpk= 0, iat=2386,2401, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 159 LYS HG2 177 HIS HD2 4.33 (#peak 4565)
&rst
ixpk= 4565, nxpk= 0, iat=2386,2676, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 159 LYS HG3 160 LEU HN 5.88 (#peak 645)
&rst
ixpk= 645, nxpk= 0, iat=2387,2401, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 159 LYS HG3 177 HIS HD2 5.22 (#peak 4566)
&rst
ixpk= 4566, nxpk= 0, iat=2387,2676, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 159 LYS HG3 177 HIS HE1 5.83 (#peak 12860)
&rst
ixpk= 12860, nxpk= 0, iat=2387,2673, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 159 LYS QB 159 LYS QD 4.21 (#peak 2633)
&rst
ixpk= 2633, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=2383,2384,
igr2=2389,2390,
&end
#
# 159 LYS QB 160 LEU HN 4.53 (#peak 646)
&rst
ixpk= 646, nxpk= 0, iat= -1,2401, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1=2383,2384,
&end
#
# 159 LYS QB 177 HIS HB3 6.15 (#peak 1779)
&rst
ixpk= 1779, nxpk= 0, iat= -1,2668, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2383,2384,
&end
#
# 159 LYS QB 177 HIS HD2 6.15 (#peak 1788)
&rst
ixpk= 1788, nxpk= 0, iat= -1,2676, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2383,2384,
&end
#
# 159 LYS QD 160 LEU HN 5.71 (#peak 648)
&rst
ixpk= 648, nxpk= 0, iat= -1,2401, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr1=2389,2390,
&end
#
# 159 LYS QD 177 HIS HD2 5.70 (#peak 2634)
&rst
ixpk= 2634, nxpk= 0, iat= -1,2676, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=2389,2390,
&end
#
# 159 LYS QD 177 HIS HE1 5.10 (#peak 12855)
&rst
ixpk= 12855, nxpk= 0, iat= -1,2673, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=2389,2390,
&end
#
# 160 LEU HN 160 LEU HG 4.53 (#peak 656)
&rst
ixpk= 656, nxpk= 0, iat=2401,2408, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 160 LEU HN 160 LEU QD1 5.53 (#peak 2799)
&rst
ixpk= 2799, nxpk= 0, iat=2401, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2=2410,2411,2412,
&end
#
# 160 LEU HN 160 LEU QD2 5.17 (#peak 652)
&rst
ixpk= 652, nxpk= 0, iat=2401, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=2414,2415,2416,
&end
#
# 160 LEU HN 161 THR HN 4.74 (#peak 1290)
&rst
ixpk= 1290, nxpk= 0, iat=2401,2420, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 160 LEU HA 175 ILE HA 6.15 (#peak 3239)
&rst
ixpk= 3239, nxpk= 0, iat=2403,2631, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 160 LEU HA 176 GLU HN 4.57 (#peak 3021)
&rst
ixpk= 3021, nxpk= 0, iat=2403,2648, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 160 LEU HG 161 THR HN 5.32 (#peak 1305)
&rst
ixpk= 1305, nxpk= 0, iat=2408,2420, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 160 LEU QB 161 THR HN 4.08 (#peak 1306)
&rst
ixpk= 1306, nxpk= 0, iat= -1,2420, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1=2405,2406,
&end
#
# 160 LEU QD1 161 THR HN 4.74 (#peak 1298)
&rst
ixpk= 1298, nxpk= 0, iat= -1,2420, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1=2410,2411,2412,
&end
#
# 160 LEU QD2 161 THR HN 3.47 (#peak 1303)
&rst
ixpk= 1303, nxpk= 0, iat= -1,2420, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr1=2414,2415,2416,
&end
#
# 160 LEU QD2 162 TYR HN 4.95 (#peak 2029)
&rst
ixpk= 2029, nxpk= 0, iat= -1,2434, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1=2414,2415,2416,
&end
#
# 160 LEU QD2 163 THR HN 6.15 (#peak 3463)
&rst
ixpk= 3463, nxpk= 0, iat= -1,2455, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2414,2415,2416,
&end
#
# 160 LEU QD2 173 GLY HA2 5.75 (#peak 3459)
&rst
ixpk= 3459, nxpk= 0, iat= -1,2602, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr1=2414,2415,2416,
&end
#
# 160 LEU QD2 174 LYS HN 5.31 (#peak 1915)
&rst
ixpk= 1915, nxpk= 0, iat= -1,2607, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1=2414,2415,2416,
&end
#
# 161 THR HN 162 TYR HN 5.12 (#peak 2024)
&rst
ixpk= 2024, nxpk= 0, iat=2420,2434, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 161 THR HN 173 GLY HA2 6.15 (#peak 3019)
&rst
ixpk= 3019, nxpk= 0, iat=2420,2602, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 161 THR HN 173 GLY HA3 4.98 (#peak 1292)
&rst
ixpk= 1292, nxpk= 0, iat=2420,2603, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 161 THR HN 174 LYS HN 4.00 (#peak 1908)
&rst
ixpk= 1908, nxpk= 0, iat=2420,2607, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 161 THR HN 174 LYS HB2 5.14 (#peak 1293)
&rst
ixpk= 1293, nxpk= 0, iat=2420,2611, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 161 THR HN 174 LYS HB3 5.14 (#peak 1301)
&rst
ixpk= 1301, nxpk= 0, iat=2420,2612, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 161 THR HN 174 LYS HG2 4.89 (#peak 1294)
&rst
ixpk= 1294, nxpk= 0, iat=2420,2614, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 161 THR HN 174 LYS HG3 3.91 (#peak 1297)
&rst
ixpk= 1297, nxpk= 0, iat=2420,2615, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 161 THR HN 174 LYS QE 4.95 (#peak 1304)
&rst
ixpk= 1304, nxpk= 0, iat=2420, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=2620,2621,
&end
#
# 161 THR HN 175 ILE HA 5.17 (#peak 3017)
&rst
ixpk= 3017, nxpk= 0, iat=2420,2631, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 161 THR HB 162 TYR HN 4.49 (#peak 2025)
&rst
ixpk= 2025, nxpk= 0, iat=2424,2434, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 161 THR HB 174 LYS HN 4.51 (#peak 1910)
&rst
ixpk= 1910, nxpk= 0, iat=2424,2607, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 161 THR HB 174 LYS HB2 6.15 (#peak 2326)
&rst
ixpk= 2326, nxpk= 0, iat=2424,2611, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 161 THR HB 174 LYS HB3 6.15 (#peak 3142)
&rst
ixpk= 3142, nxpk= 0, iat=2424,2612, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 161 THR HB 174 LYS HG2 6.15 (#peak 2327)
&rst
ixpk= 2327, nxpk= 0, iat=2424,2614, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 161 THR HB 174 LYS QE 6.15 (#peak 2332)
&rst
ixpk= 2332, nxpk= 0, iat=2424, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=2620,2621,
&end
#
# 161 THR QG2 162 TYR HN 3.57 (#peak 2023)
&rst
ixpk= 2023, nxpk= 0, iat= -1,2434, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1=2426,2427,2428,
&end
#
# 161 THR QG2 163 THR HN 5.01 (#peak 2992)
&rst
ixpk= 2992, nxpk= 0, iat= -1,2455, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1=2426,2427,2428,
&end
#
# 161 THR QG2 174 LYS HN 5.65 (#peak 1906)
&rst
ixpk= 1906, nxpk= 0, iat= -1,2607, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=2426,2427,2428,
&end
#
# 161 THR QG2 174 LYS HB3 5.86 (#peak 1802)
&rst
ixpk= 1802, nxpk= 0, iat= -1,2612, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr1=2426,2427,2428,
&end
#
# 162 TYR HN 163 THR HN 4.62 (#peak 1830)
&rst
ixpk= 1830, nxpk= 0, iat=2434,2455, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 162 TYR HA 172 ASN HN 6.15 (#peak 1370)
&rst
ixpk= 1370, nxpk= 0, iat=2436,2586, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 162 TYR HA 173 GLY HA2 6.15 (#peak 1698)
&rst
ixpk= 1698, nxpk= 0, iat=2436,2602, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 162 TYR HA 173 GLY HA3 6.15 (#peak 1071)
&rst
ixpk= 1071, nxpk= 0, iat=2436,2603, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 162 TYR HA 174 LYS HN 5.15 (#peak 2961)
&rst
ixpk= 2961, nxpk= 0, iat=2436,2607, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 162 TYR HB2 163 THR HN 5.22 (#peak 1827)
&rst
ixpk= 1827, nxpk= 0, iat=2438,2455, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 162 TYR HB2 228 VAL QG2 6.15 (#peak 4304)
&rst
ixpk= 4304, nxpk= 0, iat=2438, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3431,3432,3433,
&end
#
# 162 TYR HB3 163 THR HN 5.11 (#peak 1819)
&rst
ixpk= 1819, nxpk= 0, iat=2439,2455, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 162 TYR HB3 228 VAL QG2 6.15 (#peak 4305)
&rst
ixpk= 4305, nxpk= 0, iat=2439, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3431,3432,3433,
&end
#
# 162 TYR QD 163 THR HN 5.40 (#peak 1828)
&rst
ixpk= 1828, nxpk= 0, iat= -1,2455, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=2442,2451,
&end
#
# 162 TYR QD 216 TYR QD 5.78 (#peak 12741)
&rst
ixpk= 12741, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
igr1=2442,2451,
igr2=3254,3263,
&end
#
# 162 TYR QD 216 TYR QE 5.50 (#peak 12742)
&rst
ixpk= 12742, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1=2442,2451,
igr2=3256,3261,
&end
#
# 162 TYR QD 228 VAL QG1 4.43 (#peak 4265)
&rst
ixpk= 4265, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=2442,2451,
igr2=3427,3428,3429,
&end
#
# 162 TYR QE 187 LEU QD1 4.34 (#peak 12736)
&rst
ixpk= 12736, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=2444,2449,
igr2=2831,2832,2833,
&end
#
# 162 TYR QE 187 LEU QD2 3.87 (#peak 12814)
&rst
ixpk= 12814, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1=2444,2449,
igr2=2835,2836,2837,
&end
#
# 162 TYR QE 216 TYR HH 6.07 (#peak 12809)
&rst
ixpk= 12809, nxpk= 0, iat= -1,3259, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1=2444,2449,
&end
#
# 162 TYR QE 216 TYR QD 4.96 (#peak 12739)
&rst
ixpk= 12739, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1=2444,2449,
igr2=3254,3263,
&end
#
# 162 TYR QE 216 TYR QE 4.84 (#peak 12740)
&rst
ixpk= 12740, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1=2444,2449,
igr2=3256,3261,
&end
#
# 163 THR HN 163 THR HB 3.69 (#peak 1822)
&rst
ixpk= 1822, nxpk= 0, iat=2455,2459, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 163 THR HN 163 THR QG2 4.82 (#peak 1820)
&rst
ixpk= 1820, nxpk= 0, iat=2455, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=2461,2462,2463,
&end
#
# 163 THR HN 164 ILE HN 4.58 (#peak 1826)
&rst
ixpk= 1826, nxpk= 0, iat=2455,2469, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 163 THR HN 172 ASN HN 5.21 (#peak 1363)
&rst
ixpk= 1363, nxpk= 0, iat=2455,2586, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 163 THR HN 172 ASN HB2 6.15 (#peak 3004)
&rst
ixpk= 3004, nxpk= 0, iat=2455,2590, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 163 THR HN 173 GLY HA2 4.30 (#peak 1823)
&rst
ixpk= 1823, nxpk= 0, iat=2455,2602, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 163 THR HN 173 GLY HA3 5.67 (#peak 1821)
&rst
ixpk= 1821, nxpk= 0, iat=2455,2603, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 163 THR HA 164 ILE QG2 4.54 (#peak 12121)
&rst
ixpk= 12121, nxpk= 0, iat=2457, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2=2475,2476,2477,
&end
#
# 163 THR HA 172 ASN HN 5.83 (#peak 1369)
&rst
ixpk= 1369, nxpk= 0, iat=2457,2586, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 163 THR HB 164 ILE HN 4.54 (#peak 1692)
&rst
ixpk= 1692, nxpk= 0, iat=2459,2469, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 163 THR HB 172 ASN HN 5.96 (#peak 1355)
&rst
ixpk= 1355, nxpk= 0, iat=2459,2586, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 163 THR QG2 164 ILE HN 3.72 (#peak 1689)
&rst
ixpk= 1689, nxpk= 0, iat= -1,2469, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1=2461,2462,2463,
&end
#
# 163 THR QG2 165 ASP HN 5.22 (#peak 1504)
&rst
ixpk= 1504, nxpk= 0, iat= -1,2488, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1=2461,2462,2463,
&end
#
# 163 THR QG2 172 ASN HN 5.07 (#peak 1352)
&rst
ixpk= 1352, nxpk= 0, iat= -1,2586, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1=2461,2462,2463,
&end
#
# 163 THR QG2 172 ASN HD21 5.85 (#peak 4486)
&rst
ixpk= 4486, nxpk= 0, iat= -1,2595, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr1=2461,2462,2463,
&end
#
# 163 THR QG2 172 ASN HD22 5.81 (#peak 4487)
&rst
ixpk= 4487, nxpk= 0, iat= -1,2596, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr1=2461,2462,2463,
&end
#
# 164 ILE HN 164 ILE QG2 5.71 (#peak 2916)
&rst
ixpk= 2916, nxpk= 0, iat=2469, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr2=2475,2476,2477,
&end
#
# 164 ILE HN 165 ASP HN 4.89 (#peak 1693)
&rst
ixpk= 1693, nxpk= 0, iat=2469,2488, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 164 ILE HA 164 ILE QD1 6.15 (#peak 607)
&rst
ixpk= 607, nxpk= 0, iat=2471, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2482,2483,2484,
&end
#
# 164 ILE HA 170 GLN HN 6.10 (#peak 925)
&rst
ixpk= 925, nxpk= 0, iat=2471,2562, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60, &end
#
# 164 ILE HA 171 GLY HN 5.69 (#peak 2653)
&rst
ixpk= 2653, nxpk= 0, iat=2471,2579, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 164 ILE HA 171 GLY HA2 6.15 (#peak 1973)
&rst
ixpk= 1973, nxpk= 0, iat=2471,2581, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 164 ILE HA 171 GLY HA3 6.15 (#peak 2545)
&rst
ixpk= 2545, nxpk= 0, iat=2471,2582, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 164 ILE HA 172 ASN HN 4.89 (#peak 2972)
&rst
ixpk= 2972, nxpk= 0, iat=2471,2586, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 164 ILE HB 165 ASP HN 4.33 (#peak 1516)
&rst
ixpk= 1516, nxpk= 0, iat=2473,2488, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 164 ILE HB 172 ASN HN 5.63 (#peak 1361)
&rst
ixpk= 1361, nxpk= 0, iat=2473,2586, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 164 ILE QD1 165 ASP HN 5.62 (#peak 2918)
&rst
ixpk= 2918, nxpk= 0, iat= -1,2488, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr1=2482,2483,2484,
&end
#
# 164 ILE QD1 166 PHE HN 5.55 (#peak 2925)
&rst
ixpk= 2925, nxpk= 0, iat= -1,2500, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1=2482,2483,2484,
&end
#
# 164 ILE QD1 166 PHE HZ 5.84 (#peak 12806)
&rst
ixpk= 12806, nxpk= 0, iat= -1,2512, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1=2482,2483,2484,
&end
#
# 164 ILE QD1 166 PHE QD 6.15 (#peak 4311)
&rst
ixpk= 4311, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=2482,2483,2484,
igr2=2508,2516,
&end
#
# 164 ILE QD1 166 PHE QE 3.75 (#peak 12807)
&rst
ixpk= 12807, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1=2482,2483,2484,
igr2=2510,2514,
&end
#
# 164 ILE QD1 169 LYS QD 6.15 (#peak 4179)
&rst
ixpk= 4179, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=2482,2483,2484,
igr2=2550,2551,
&end
#
# 164 ILE QD1 170 GLN HN 4.85 (#peak 2911)
&rst
ixpk= 2911, nxpk= 0, iat= -1,2562, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1=2482,2483,2484,
&end
#
# 164 ILE QD1 171 GLY HN 6.15 (#peak 4323)
&rst
ixpk= 4323, nxpk= 0, iat= -1,2579, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2482,2483,2484,
&end
#
# 164 ILE QD1 171 GLY HA3 6.15 (#peak 2544)
&rst
ixpk= 2544, nxpk= 0, iat= -1,2582, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2482,2483,2484,
&end
#
# 164 ILE QD1 172 ASN HN 6.13 (#peak 4613)
&rst
ixpk= 4613, nxpk= 0, iat= -1,2586, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr1=2482,2483,2484,
&end
#
# 164 ILE QG1 165 ASP HN 4.17 (#peak 1503)
&rst
ixpk= 1503, nxpk= 0, iat= -1,2488, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1=2479,2480,
&end
#
# 164 ILE QG1 166 PHE HN 5.77 (#peak 2926)
&rst
ixpk= 2926, nxpk= 0, iat= -1,2500, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1=2479,2480,
&end
#
# 164 ILE QG1 169 LYS HN 5.07 (#peak 2909)
&rst
ixpk= 2909, nxpk= 0, iat= -1,2540, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1=2479,2480,
&end
#
# 164 ILE QG1 169 LYS QD 6.15 (#peak 4180)
&rst
ixpk= 4180, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.75, r4= 8.25,
igr1=2479,2480,
igr2=2550,2551,
&end
#
# 164 ILE QG1 170 GLN HN 4.42 (#peak 2906)
&rst
ixpk= 2906, nxpk= 0, iat= -1,2562, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1=2479,2480,
&end
#
# 164 ILE QG1 170 GLN HA 6.15 (#peak 256)
&rst
ixpk= 256, nxpk= 0, iat= -1,2564, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2479,2480,
&end
#
# 164 ILE QG1 171 GLY HA2 6.15 (#peak 1974)
&rst
ixpk= 1974, nxpk= 0, iat= -1,2581, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2479,2480,
&end
#
# 164 ILE QG1 172 ASN HN 5.03 (#peak 1351)
&rst
ixpk= 1351, nxpk= 0, iat= -1,2586, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1=2479,2480,
&end
#
# 164 ILE QG2 165 ASP HN 5.28 (#peak 1511)
&rst
ixpk= 1511, nxpk= 0, iat= -1,2488, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1=2475,2476,2477,
&end
#
# 164 ILE QG2 166 PHE HN 4.66 (#peak 1949)
&rst
ixpk= 1949, nxpk= 0, iat= -1,2500, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1=2475,2476,2477,
&end
#
# 164 ILE QG2 166 PHE HA 4.67 (#peak 12122)
&rst
ixpk= 12122, nxpk= 0, iat= -1,2502, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=2475,2476,2477,
&end
#
# 164 ILE QG2 166 PHE HZ 5.04 (#peak 12116)
&rst
ixpk= 12116, nxpk= 0, iat= -1,2512, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1=2475,2476,2477,
&end
#
# 164 ILE QG2 166 PHE QD 3.64 (#peak 12117)
&rst
ixpk= 12117, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1=2475,2476,2477,
igr2=2508,2516,
&end
#
# 164 ILE QG2 166 PHE QE 5.81 (#peak 13172)
&rst
ixpk= 13172, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.83, r4= 8.33,
igr1=2475,2476,2477,
igr2=2510,2514,
&end
#
# 164 ILE QG2 169 LYS HA 6.14 (#peak 12123)
&rst
ixpk= 12123, nxpk= 0, iat= -1,2542, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr1=2475,2476,2477,
&end
#
# 164 ILE QG2 170 GLN HN 6.12 (#peak 935)
&rst
ixpk= 935, nxpk= 0, iat= -1,2562, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
igr1=2475,2476,2477,
&end
#
# 164 ILE QG2 172 ASN HN 5.79 (#peak 1366)
&rst
ixpk= 1366, nxpk= 0, iat= -1,2586, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr1=2475,2476,2477,
&end
#
# 165 ASP HN 170 GLN HN 4.57 (#peak 933)
&rst
ixpk= 933, nxpk= 0, iat=2488,2562, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 165 ASP HN 171 GLY HA2 4.53 (#peak 1507)
&rst
ixpk= 1507, nxpk= 0, iat=2488,2581, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 165 ASP HN 172 ASN HN 5.57 (#peak 1360)
&rst
ixpk= 1360, nxpk= 0, iat=2488,2586, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 165 ASP HA 167 ALA HN 4.84 (#peak 996)
&rst
ixpk= 996, nxpk= 0, iat=2490,2520, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 165 ASP HA 168 ALA HN 6.15 (#peak 472)
&rst
ixpk= 472, nxpk= 0, iat=2490,2530, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 165 ASP HB2 166 PHE HN 5.08 (#peak 1951)
&rst
ixpk= 1951, nxpk= 0, iat=2492,2500, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 165 ASP HB2 167 ALA HN 5.41 (#peak 4610)
&rst
ixpk= 4610, nxpk= 0, iat=2492,2520, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 165 ASP HB2 168 ALA HN 5.20 (#peak 469)
&rst
ixpk= 469, nxpk= 0, iat=2492,2530, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 165 ASP HB2 168 ALA QB 6.03 (#peak 3982)
&rst
ixpk= 3982, nxpk= 0, iat=2492, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr2=2534,2535,2536,
&end
#
# 165 ASP HB2 169 LYS HN 5.23 (#peak 2920)
&rst
ixpk= 2920, nxpk= 0, iat=2492,2540, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 165 ASP HB2 170 GLN HN 4.37 (#peak 937)
&rst
ixpk= 937, nxpk= 0, iat=2492,2562, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 165 ASP HB3 167 ALA HN 4.83 (#peak 4611)
&rst
ixpk= 4611, nxpk= 0, iat=2493,2520, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 165 ASP HB3 168 ALA HN 4.35 (#peak 457)
&rst
ixpk= 457, nxpk= 0, iat=2493,2530, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 165 ASP HB3 168 ALA QB 5.97 (#peak 3977)
&rst
ixpk= 3977, nxpk= 0, iat=2493, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr2=2534,2535,2536,
&end
#
# 165 ASP HB3 169 LYS HN 5.76 (#peak 2431)
&rst
ixpk= 2431, nxpk= 0, iat=2493,2540, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 165 ASP HB3 170 GLN HN 4.31 (#peak 929)
&rst
ixpk= 929, nxpk= 0, iat=2493,2562, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 165 ASP HB3 170 GLN HB2 6.15 (#peak 2468)
&rst
ixpk= 2468, nxpk= 0, iat=2493,2566, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 166 PHE HN 166 PHE HB3 4.00 (#peak 1942)
&rst
ixpk= 1942, nxpk= 0, iat=2500,2505, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 166 PHE HN 166 PHE QD 3.90 (#peak 1947)
&rst
ixpk= 1947, nxpk= 0, iat=2500, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=2508,2516,
&end
#
# 166 PHE HN 167 ALA HN 3.73 (#peak 992)
&rst
ixpk= 992, nxpk= 0, iat=2500,2520, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 166 PHE HN 167 ALA HA 6.10 (#peak 2931)
&rst
ixpk= 2931, nxpk= 0, iat=2500,2522, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60, &end
#
# 166 PHE HN 167 ALA QB 6.15 (#peak 2020)
&rst
ixpk= 2020, nxpk= 0, iat=2500, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2524,2525,2526,
&end
#
# 166 PHE HN 168 ALA HN 4.96 (#peak 467)
&rst
ixpk= 467, nxpk= 0, iat=2500,2530, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 166 PHE HA 166 PHE QD 6.15 (#peak 4767)
&rst
ixpk= 4767, nxpk= 0, iat=2502, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=2508,2516,
&end
#
# 166 PHE HA 166 PHE QE 6.15 (#peak 4768)
&rst
ixpk= 4768, nxpk= 0, iat=2502, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=2510,2514,
&end
#
# 166 PHE HA 168 ALA HN 6.15 (#peak 460)
&rst
ixpk= 460, nxpk= 0, iat=2502,2530, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 166 PHE HA 169 LYS HN 4.20 (#peak 2434)
&rst
ixpk= 2434, nxpk= 0, iat=2502,2540, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 166 PHE HA 170 GLN HN 6.01 (#peak 931)
&rst
ixpk= 931, nxpk= 0, iat=2502,2562, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 166 PHE HB2 167 ALA HN 4.34 (#peak 994)
&rst
ixpk= 994, nxpk= 0, iat=2504,2520, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 166 PHE HB2 167 ALA QB 6.15 (#peak 3153)
&rst
ixpk= 3153, nxpk= 0, iat=2504, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2524,2525,2526,
&end
#
# 166 PHE HB3 167 ALA HN 4.26 (#peak 985)
&rst
ixpk= 985, nxpk= 0, iat=2505,2520, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 166 PHE HZ 220 ILE QG2 4.23 (#peak 12754)
&rst
ixpk= 12754, nxpk= 0, iat=2512, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=3310,3311,3312,
&end
#
# 166 PHE HZ 224 LYS HA 6.15 (#peak 12758)
&rst
ixpk= 12758, nxpk= 0, iat=2512,3359, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 166 PHE HZ 225 ALA QB 3.20 (#peak 12746)
&rst
ixpk= 12746, nxpk= 0, iat=2512, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=3383,3384,3385,
&end
#
# 166 PHE QD 167 ALA HN 5.27 (#peak 991)
&rst
ixpk= 991, nxpk= 0, iat= -1,2520, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1=2508,2516,
&end
#
# 166 PHE QD 169 LYS HN 5.99 (#peak 2439)
&rst
ixpk= 2439, nxpk= 0, iat= -1,2540, r1= 1.30, r2= 1.80, r3= 6.72, r4= 7.22,
igr1=2508,2516,
&end
#
# 166 PHE QD 169 LYS HA 6.15 (#peak 13166)
&rst
ixpk= 13166, nxpk= 0, iat= -1,2542, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2508,2516,
&end
#
# 166 PHE QD 225 ALA QB 6.15 (#peak 12748)
&rst
ixpk= 12748, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=2508,2516,
igr2=3383,3384,3385,
&end
#
# 166 PHE QE 220 ILE QD1 3.53 (#peak 12677)
&rst
ixpk= 12677, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=2510,2514,
igr2=3317,3318,3319,
&end
#
# 166 PHE QE 220 ILE QG2 4.19 (#peak 12676)
&rst
ixpk= 12676, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1=2510,2514,
igr2=3310,3311,3312,
&end
#
# 166 PHE QE 225 ALA QB 3.28 (#peak 12747)
&rst
ixpk= 12747, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr1=2510,2514,
igr2=3383,3384,3385,
&end
#
# 167 ALA HN 167 ALA QB 2.96 (#peak 989)
&rst
ixpk= 989, nxpk= 0, iat=2520, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2=2524,2525,2526,
&end
#
# 167 ALA HN 168 ALA HN 3.42 (#peak 459)
&rst
ixpk= 459, nxpk= 0, iat=2520,2530, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 167 ALA HN 169 LYS HN 4.07 (#peak 995)
&rst
ixpk= 995, nxpk= 0, iat=2520,2540, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 167 ALA HN 170 GLN HN 5.74 (#peak 2995)
&rst
ixpk= 2995, nxpk= 0, iat=2520,2562, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 167 ALA HA 169 LYS HN 6.07 (#peak 2437)
&rst
ixpk= 2437, nxpk= 0, iat=2522,2540, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57, &end
#
# 167 ALA QB 168 ALA HN 3.09 (#peak 462)
&rst
ixpk= 462, nxpk= 0, iat= -1,2530, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,
igr1=2524,2525,2526,
&end
#
# 167 ALA QB 168 ALA QB 5.50 (#peak 3980)
&rst
ixpk= 3980, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
igr1=2524,2525,2526,
igr2=2534,2535,2536,
&end
#
# 167 ALA QB 169 LYS HN 4.52 (#peak 2435)
&rst
ixpk= 2435, nxpk= 0, iat= -1,2540, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1=2524,2525,2526,
&end
#
# 168 ALA HN 168 ALA QB 3.07 (#peak 471)
&rst
ixpk= 471, nxpk= 0, iat=2530, -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr2=2534,2535,2536,
&end
#
# 168 ALA HN 169 LYS HN 3.72 (#peak 470)
&rst
ixpk= 470, nxpk= 0, iat=2530,2540, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 168 ALA HN 169 LYS HA 5.01 (#peak 466)
&rst
ixpk= 466, nxpk= 0, iat=2530,2542, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 168 ALA HN 170 GLN HN 4.25 (#peak 926)
&rst
ixpk= 926, nxpk= 0, iat=2530,2562, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 168 ALA HN 170 GLN QG 5.86 (#peak 461)
&rst
ixpk= 461, nxpk= 0, iat=2530, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2=2569,2570,
&end
#
# 168 ALA HA 170 GLN HN 5.75 (#peak 927)
&rst
ixpk= 927, nxpk= 0, iat=2532,2562, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 168 ALA QB 169 LYS HN 3.53 (#peak 2444)
&rst
ixpk= 2444, nxpk= 0, iat= -1,2540, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=2534,2535,2536,
&end
#
# 168 ALA QB 169 LYS HA 6.15 (#peak 3981)
&rst
ixpk= 3981, nxpk= 0, iat= -1,2542, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2534,2535,2536,
&end
#
# 168 ALA QB 170 GLN HN 4.53 (#peak 939)
&rst
ixpk= 939, nxpk= 0, iat= -1,2562, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1=2534,2535,2536,
&end
#
# 168 ALA QB 170 GLN QG 5.71 (#peak 3979)
&rst
ixpk= 3979, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,
igr1=2534,2535,2536,
igr2=2569,2570,
&end
#
# 169 LYS HN 169 LYS HB2 4.19 (#peak 2436)
&rst
ixpk= 2436, nxpk= 0, iat=2540,2544, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 169 LYS HN 170 GLN HN 3.60 (#peak 938)
&rst
ixpk= 938, nxpk= 0, iat=2540,2562, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 169 LYS HA 192 ILE QD1 6.15 (#peak 4272)
&rst
ixpk= 4272, nxpk= 0, iat=2542, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2896,2897,2898,
&end
#
# 169 LYS HB2 192 ILE HG12 6.15 (#peak 2832)
&rst
ixpk= 2832, nxpk= 0, iat=2544,2893, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 169 LYS HB2 192 ILE QD1 6.15 (#peak 2223)
&rst
ixpk= 2223, nxpk= 0, iat=2544, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2896,2897,2898,
&end
#
# 169 LYS HB3 170 GLN HN 5.24 (#peak 940)
&rst
ixpk= 940, nxpk= 0, iat=2545,2562, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 169 LYS QG 170 GLN HN 4.80 (#peak 923)
&rst
ixpk= 923, nxpk= 0, iat= -1,2562, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=2547,2548,
&end
#
# 170 GLN HN 170 GLN QG 3.72 (#peak 932)
&rst
ixpk= 932, nxpk= 0, iat=2562, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr2=2569,2570,
&end
#
# 170 GLN HN 171 GLY HN 4.46 (#peak 941)
&rst
ixpk= 941, nxpk= 0, iat=2562,2579, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 170 GLN HN 191 ASP HA 6.15 (#peak 933)
&rst
ixpk= 933, nxpk= 0, iat=2562,2873, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 170 GLN HA 170 GLN HE21 4.40 (#peak 1791)
&rst
ixpk= 1791, nxpk= 0, iat=2564,2574, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 170 GLN HA 190 ALA HN 6.15 (#peak 4618)
&rst
ixpk= 4618, nxpk= 0, iat=2564,2861, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 170 GLN HA 191 ASP HN 5.01 (#peak 258)
&rst
ixpk= 258, nxpk= 0, iat=2564,2871, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 170 GLN HA 191 ASP HA 6.15 (#peak 931)
&rst
ixpk= 931, nxpk= 0, iat=2564,2873, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 170 GLN HA 192 ILE HN 4.52 (#peak 2692)
&rst
ixpk= 2692, nxpk= 0, iat=2564,2883, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 170 GLN HB2 170 GLN HE21 5.42 (#peak 1796)
&rst
ixpk= 1796, nxpk= 0, iat=2566,2574, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 170 GLN HB2 170 GLN HE22 5.16 (#peak 208)
&rst
ixpk= 208, nxpk= 0, iat=2566,2575, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 170 GLN HB2 171 GLY HN 4.48 (#peak 2659)
&rst
ixpk= 2659, nxpk= 0, iat=2566,2579, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 170 GLN HB3 170 GLN HE21 4.35 (#peak 1790)
&rst
ixpk= 1790, nxpk= 0, iat=2567,2574, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 170 GLN HB3 170 GLN HE22 6.15 (#peak 146)
&rst
ixpk= 146, nxpk= 0, iat=2567,2575, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 170 GLN HB3 171 GLY HN 4.60 (#peak 2651)
&rst
ixpk= 2651, nxpk= 0, iat=2567,2579, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 170 GLN HE21 189 ALA QB 5.99 (#peak 3102)
&rst
ixpk= 3102, nxpk= 0, iat=2574, -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
igr2=2855,2856,2857,
&end
#
# 170 GLN HE21 190 ALA HA 4.55 (#peak 1799)
&rst
ixpk= 1799, nxpk= 0, iat=2574,2863, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 170 GLN HE21 190 ALA QB 6.15 (#peak 2512)
&rst
ixpk= 2512, nxpk= 0, iat=2574, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2865,2866,2867,
&end
#
# 170 GLN HE21 191 ASP HA 4.24 (#peak 1793)
&rst
ixpk= 1793, nxpk= 0, iat=2574,2873, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 170 GLN HE21 191 ASP HB3 5.14 (#peak 1795)
&rst
ixpk= 1795, nxpk= 0, iat=2574,2876, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 170 GLN HE22 190 ALA HA 6.01 (#peak 211)
&rst
ixpk= 211, nxpk= 0, iat=2575,2863, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 170 GLN HE22 191 ASP HB3 4.85 (#peak 207)
&rst
ixpk= 207, nxpk= 0, iat=2575,2876, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 170 GLN QG 170 GLN HE21 3.17 (#peak 1794)
&rst
ixpk= 1794, nxpk= 0, iat= -1,2574, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
igr1=2569,2570,
&end
#
# 170 GLN QG 170 GLN HE22 3.79 (#peak 206)
&rst
ixpk= 206, nxpk= 0, iat= -1,2575, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr1=2569,2570,
&end
#
# 170 GLN QG 171 GLY HN 4.00 (#peak 2656)
&rst
ixpk= 2656, nxpk= 0, iat= -1,2579, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=2569,2570,
&end
#
# 170 GLN QG 189 ALA QB 6.15 (#peak 3098)
&rst
ixpk= 3098, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=2569,2570,
igr2=2855,2856,2857,
&end
#
# 170 GLN QG 190 ALA HN 5.31 (#peak 961)
&rst
ixpk= 961, nxpk= 0, iat= -1,2861, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1=2569,2570,
&end
#
# 170 GLN QG 191 ASP HN 6.15 (#peak 1883)
&rst
ixpk= 1883, nxpk= 0, iat= -1,2871, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2569,2570,
&end
#
# 170 GLN QG 191 ASP HA 6.15 (#peak 1882)
&rst
ixpk= 1882, nxpk= 0, iat= -1,2873, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2569,2570,
&end
#
# 170 GLN QG 192 ILE HN 5.61 (#peak 2697)
&rst
ixpk= 2697, nxpk= 0, iat= -1,2883, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1=2569,2570,
&end
#
# 171 GLY HN 172 ASN HN 4.66 (#peak 1372)
&rst
ixpk= 1372, nxpk= 0, iat=2579,2586, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 171 GLY HN 189 ALA HA 5.33 (#peak 2891)
&rst
ixpk= 2891, nxpk= 0, iat=2579,2853, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 171 GLY HN 189 ALA QB 5.04 (#peak 2663)
&rst
ixpk= 2663, nxpk= 0, iat=2579, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=2855,2856,2857,
&end
#
# 171 GLY HN 190 ALA QB 4.50 (#peak 2660)
&rst
ixpk= 2660, nxpk= 0, iat=2579, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=2865,2866,2867,
&end
#
# 171 GLY HN 191 ASP HN 6.12 (#peak 4635)
&rst
ixpk= 4635, nxpk= 0, iat=2579,2871, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62, &end
#
# 171 GLY HN 191 ASP HA 5.33 (#peak 2654)
&rst
ixpk= 2654, nxpk= 0, iat=2579,2873, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 171 GLY HN 202 ILE QD1 4.77 (#peak 3350)
&rst
ixpk= 3350, nxpk= 0, iat=2579, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr2=3059,3060,3061,
&end
#
# 171 GLY HN 202 ILE QG2 4.84 (#peak 2658)
&rst
ixpk= 2658, nxpk= 0, iat=2579, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2=3052,3053,3054,
&end
#
# 171 GLY HA3 202 ILE QD1 6.15 (#peak 4099)
&rst
ixpk= 4099, nxpk= 0, iat=2582, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3059,3060,3061,
&end
#
# 171 GLY HA3 202 ILE QG2 6.15 (#peak 2150)
&rst
ixpk= 2150, nxpk= 0, iat=2582, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3052,3053,3054,
&end
#
# 172 ASN HN 172 ASN HB3 3.93 (#peak 2900)
&rst
ixpk= 2900, nxpk= 0, iat=2586,2591, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 172 ASN HN 172 ASN HD21 5.49 (#peak 1411)
&rst
ixpk= 1411, nxpk= 0, iat=2586,2595, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 172 ASN HN 173 GLY HN 4.66 (#peak 1054)
&rst
ixpk= 1054, nxpk= 0, iat=2586,2600, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 172 ASN HA 172 ASN HD21 4.04 (#peak 1418)
&rst
ixpk= 1418, nxpk= 0, iat=2588,2595, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 172 ASN HA 172 ASN HD22 4.39 (#peak 2349)
&rst
ixpk= 2349, nxpk= 0, iat=2588,2596, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 172 ASN HA 190 ALA HN 5.11 (#peak 971)
&rst
ixpk= 971, nxpk= 0, iat=2588,2861, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 172 ASN HA 190 ALA QB 6.15 (#peak 2515)
&rst
ixpk= 2515, nxpk= 0, iat=2588, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2865,2866,2867,
&end
#
# 172 ASN HB2 172 ASN HD21 3.85 (#peak 1414)
&rst
ixpk= 1414, nxpk= 0, iat=2590,2595, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 172 ASN HB2 173 GLY HN 4.00 (#peak 2897)
&rst
ixpk= 2897, nxpk= 0, iat=2590,2600, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 172 ASN HB2 189 ALA HN 6.15 (#peak 2996)
&rst
ixpk= 2996, nxpk= 0, iat=2590,2851, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 172 ASN HB2 189 ALA QB 6.15 (#peak 3104)
&rst
ixpk= 3104, nxpk= 0, iat=2590, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2855,2856,2857,
&end
#
# 172 ASN HB2 190 ALA HN 5.30 (#peak 968)
&rst
ixpk= 968, nxpk= 0, iat=2590,2861, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 172 ASN HB3 173 GLY HN 4.20 (#peak 2902)
&rst
ixpk= 2902, nxpk= 0, iat=2591,2600, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 172 ASN HB3 190 ALA HN 5.40 (#peak 2975)
&rst
ixpk= 2975, nxpk= 0, iat=2591,2861, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 172 ASN HD21 173 GLY HN 4.48 (#peak 1410)
&rst
ixpk= 1410, nxpk= 0, iat=2595,2600, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 172 ASN HD21 188 ALA HN 5.34 (#peak 4634)
&rst
ixpk= 4634, nxpk= 0, iat=2595,2841, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, &end
#
# 172 ASN HD21 188 ALA HA 5.04 (#peak 1413)
&rst
ixpk= 1413, nxpk= 0, iat=2595,2843, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 172 ASN HD21 188 ALA QB 5.69 (#peak 4627)
&rst
ixpk= 4627, nxpk= 0, iat=2595, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr2=2845,2846,2847,
&end
#
# 172 ASN HD21 189 ALA QB 5.05 (#peak 1415)
&rst
ixpk= 1415, nxpk= 0, iat=2595, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=2855,2856,2857,
&end
#
# 172 ASN HD21 190 ALA HN 6.08 (#peak 1409)
&rst
ixpk= 1409, nxpk= 0, iat=2595,2861, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58, &end
#
# 172 ASN HD22 173 GLY HN 4.38 (#peak 2342)
&rst
ixpk= 2342, nxpk= 0, iat=2596,2600, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 172 ASN HD22 187 LEU QD2 6.15 (#peak 2677)
&rst
ixpk= 2677, nxpk= 0, iat=2596, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2835,2836,2837,
&end
#
# 172 ASN HD22 188 ALA HA 5.67 (#peak 2345)
&rst
ixpk= 2345, nxpk= 0, iat=2596,2843, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 172 ASN HD22 189 ALA QB 5.33 (#peak 2347)
&rst
ixpk= 2347, nxpk= 0, iat=2596, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2=2855,2856,2857,
&end
#
# 173 GLY HN 174 LYS HN 4.92 (#peak 1904)
&rst
ixpk= 1904, nxpk= 0, iat=2600,2607, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 173 GLY HN 186 ASP HA 6.15 (#peak 1052)
&rst
ixpk= 1052, nxpk= 0, iat=2600,2812, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 173 GLY HN 187 LEU HN 4.70 (#peak 1053)
&rst
ixpk= 1053, nxpk= 0, iat=2600,2822, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 173 GLY HN 187 LEU HB2 4.24 (#peak 1051)
&rst
ixpk= 1051, nxpk= 0, iat=2600,2826, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 173 GLY HN 187 LEU QD1 4.60 (#peak 1048)
&rst
ixpk= 1048, nxpk= 0, iat=2600, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=2831,2832,2833,
&end
#
# 173 GLY HN 187 LEU QD2 4.40 (#peak 1056)
&rst
ixpk= 1056, nxpk= 0, iat=2600, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=2835,2836,2837,
&end
#
# 173 GLY HN 188 ALA HA 6.01 (#peak 4616)
&rst
ixpk= 4616, nxpk= 0, iat=2600,2843, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 174 LYS HN 174 LYS HG2 4.22 (#peak 1903)
&rst
ixpk= 1903, nxpk= 0, iat=2607,2614, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 174 LYS HN 174 LYS HG3 4.54 (#peak 1911)
&rst
ixpk= 1911, nxpk= 0, iat=2607,2615, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 174 LYS HN 174 LYS QD 5.77 (#peak 1898)
&rst
ixpk= 1898, nxpk= 0, iat=2607, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr2=2617,2618,
&end
#
# 174 LYS HN 174 LYS QE 5.61 (#peak 1916)
&rst
ixpk= 1916, nxpk= 0, iat=2607, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2=2620,2621,
&end
#
# 174 LYS HN 175 ILE QD1 5.89 (#peak 4826)
&rst
ixpk= 4826, nxpk= 0, iat=2607, -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
igr2=2642,2643,2644,
&end
#
# 174 LYS HN 186 ASP HA 6.15 (#peak 1928)
&rst
ixpk= 1928, nxpk= 0, iat=2607,2812, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 174 LYS HN 187 LEU QD1 4.32 (#peak 1899)
&rst
ixpk= 1899, nxpk= 0, iat=2607, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=2831,2832,2833,
&end
#
# 174 LYS HN 187 LEU QD2 4.77 (#peak 1912)
&rst
ixpk= 1912, nxpk= 0, iat=2607, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr2=2835,2836,2837,
&end
#
# 174 LYS HA 186 ASP HN 6.15 (#peak 1502)
&rst
ixpk= 1502, nxpk= 0, iat=2609,2810, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 174 LYS HA 187 LEU HN 5.16 (#peak 1310)
&rst
ixpk= 1310, nxpk= 0, iat=2609,2822, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 174 LYS HA 187 LEU QD2 6.15 (#peak 2670)
&rst
ixpk= 2670, nxpk= 0, iat=2609, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2835,2836,2837,
&end
#
# 174 LYS HB2 174 LYS QE 5.78 (#peak 3478)
&rst
ixpk= 3478, nxpk= 0, iat=2611, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr2=2620,2621,
&end
#
# 174 LYS HB2 175 ILE HN 4.83 (#peak 3032)
&rst
ixpk= 3032, nxpk= 0, iat=2611,2629, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 174 LYS HB2 186 ASP HA 6.15 (#peak 1924)
&rst
ixpk= 1924, nxpk= 0, iat=2611,2812, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 174 LYS HB3 174 LYS QE 6.15 (#peak 3147)
&rst
ixpk= 3147, nxpk= 0, iat=2612, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=2620,2621,
&end
#
# 174 LYS HB3 175 ILE HN 4.29 (#peak 3033)
&rst
ixpk= 3033, nxpk= 0, iat=2612,2629, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 174 LYS HB3 186 ASP HA 5.91 (#peak 1930)
&rst
ixpk= 1930, nxpk= 0, iat=2612,2812, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 174 LYS HG2 175 ILE HN 5.02 (#peak 3034)
&rst
ixpk= 3034, nxpk= 0, iat=2614,2629, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 174 LYS HG3 175 ILE HN 5.03 (#peak 3035)
&rst
ixpk= 3035, nxpk= 0, iat=2615,2629, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 174 LYS QD 175 ILE HN 5.16 (#peak 3036)
&rst
ixpk= 3036, nxpk= 0, iat= -1,2629, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1=2617,2618,
&end
#
# 175 ILE HN 175 ILE QD1 4.35 (#peak 3031)
&rst
ixpk= 3031, nxpk= 0, iat=2629, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=2642,2643,2644,
&end
#
# 175 ILE HN 175 ILE QG2 4.08 (#peak 3030)
&rst
ixpk= 3030, nxpk= 0, iat=2629, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr2=2635,2636,2637,
&end
#
# 175 ILE HN 185 VAL HN 4.52 (#peak 12713)
&rst
ixpk= 12713, nxpk= 0, iat=2629,2794, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 175 ILE HN 185 VAL QG2 4.90 (#peak 3038)
&rst
ixpk= 3038, nxpk= 0, iat=2629, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2=2804,2805,2806,
&end
#
# 175 ILE HN 186 ASP HA 4.15 (#peak 3037)
&rst
ixpk= 3037, nxpk= 0, iat=2629,2812, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 175 ILE HA 175 ILE QD1 6.15 (#peak 3235)
&rst
ixpk= 3235, nxpk= 0, iat=2631, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2642,2643,2644,
&end
#
# 175 ILE HB 185 VAL HN 4.52 (#peak 2448)
&rst
ixpk= 2448, nxpk= 0, iat=2633,2794, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 175 ILE HB 185 VAL QG2 6.15 (#peak 4650)
&rst
ixpk= 4650, nxpk= 0, iat=2633, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2804,2805,2806,
&end
#
# 175 ILE QD1 176 GLU HN 4.06 (#peak 1129)
&rst
ixpk= 1129, nxpk= 0, iat= -1,2648, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1=2642,2643,2644,
&end
#
# 175 ILE QD1 185 VAL HN 6.15 (#peak 322)
&rst
ixpk= 322, nxpk= 0, iat= -1,2794, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2642,2643,2644,
&end
#
# 175 ILE QD1 187 LEU QD2 5.26 (#peak 2664)
&rst
ixpk= 2664, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.59, r4= 8.09,
igr1=2642,2643,2644,
igr2=2835,2836,2837,
&end
#
# 175 ILE QG2 175 ILE QD1 4.36 (#peak 3993)
&rst
ixpk= 3993, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1=2635,2636,2637,
igr2=2642,2643,2644,
&end
#
# 175 ILE QG2 176 GLU HN 3.67 (#peak 1137)
&rst
ixpk= 1137, nxpk= 0, iat= -1,2648, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1=2635,2636,2637,
&end
#
# 175 ILE QG2 176 GLU QB 5.29 (#peak 3996)
&rst
ixpk= 3996, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1=2635,2636,2637,
igr2=2652,2653,
&end
#
# 175 ILE QG2 178 LEU QD1 5.00 (#peak 795)
&rst
ixpk= 795, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1=2635,2636,2637,
igr2=2689,2690,2691,
&end
#
# 175 ILE QG2 184 ASN HD22 6.15 (#peak 3998)
&rst
ixpk= 3998, nxpk= 0, iat= -1,2790, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2635,2636,2637,
&end
#
# 175 ILE QG2 185 VAL HN 4.13 (#peak 2454)
&rst
ixpk= 2454, nxpk= 0, iat= -1,2794, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1=2635,2636,2637,
&end
#
# 175 ILE QG2 185 VAL QG2 6.15 (#peak 4651)
&rst
ixpk= 4651, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=2635,2636,2637,
igr2=2804,2805,2806,
&end
#
# 176 GLU HN 176 GLU HG2 5.23 (#peak 3338)
&rst
ixpk= 3338, nxpk= 0, iat=2648,2655, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 176 GLU HN 176 GLU HG3 4.76 (#peak 3340)
&rst
ixpk= 3340, nxpk= 0, iat=2648,2656, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 176 GLU HN 176 GLU QB 3.96 (#peak 3339)
&rst
ixpk= 3339, nxpk= 0, iat=2648, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=2652,2653,
&end
#
# 176 GLU HN 177 HIS HB2 4.81 (#peak 1130)
&rst
ixpk= 1130, nxpk= 0, iat=2648,2667, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 176 GLU HN 178 LEU HN 6.15 (#peak 1131)
&rst
ixpk= 1131, nxpk= 0, iat=2648,2680, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 176 GLU HN 184 ASN HB2 6.15 (#peak 2421)
&rst
ixpk= 2421, nxpk= 0, iat=2648,2784, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 176 GLU HA 184 ASN HB2 6.15 (#peak 3442)
&rst
ixpk= 3442, nxpk= 0, iat=2650,2784, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 176 GLU HA 184 ASN HB3 6.15 (#peak 633)
&rst
ixpk= 633, nxpk= 0, iat=2650,2785, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 176 GLU HA 185 VAL HN 5.52 (#peak 2979)
&rst
ixpk= 2979, nxpk= 0, iat=2650,2794, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 176 GLU HG2 177 HIS HN 4.40 (#peak 2243)
&rst
ixpk= 2243, nxpk= 0, iat=2655,2663, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 176 GLU HG2 184 ASN HB2 6.15 (#peak 2231)
&rst
ixpk= 2231, nxpk= 0, iat=2655,2784, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 176 GLU HG2 184 ASN HB3 6.15 (#peak 2230)
&rst
ixpk= 2230, nxpk= 0, iat=2655,2785, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 176 GLU HG2 184 ASN HD22 4.28 (#peak 2158)
&rst
ixpk= 2158, nxpk= 0, iat=2655,2790, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 176 GLU HG3 177 HIS HN 5.38 (#peak 2251)
&rst
ixpk= 2251, nxpk= 0, iat=2656,2663, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 176 GLU HG3 184 ASN HN 6.15 (#peak 2321)
&rst
ixpk= 2321, nxpk= 0, iat=2656,2780, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 176 GLU HG3 184 ASN HB2 6.15 (#peak 4182)
&rst
ixpk= 4182, nxpk= 0, iat=2656,2784, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 176 GLU HG3 184 ASN HB3 6.15 (#peak 4181)
&rst
ixpk= 4181, nxpk= 0, iat=2656,2785, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 176 GLU QB 177 HIS HN 4.11 (#peak 2245)
&rst
ixpk= 2245, nxpk= 0, iat= -1,2663, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1=2652,2653,
&end
#
# 176 GLU QB 177 HIS HB2 6.15 (#peak 577)
&rst
ixpk= 577, nxpk= 0, iat= -1,2667, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2652,2653,
&end
#
# 176 GLU QB 184 ASN HB2 6.15 (#peak 2864)
&rst
ixpk= 2864, nxpk= 0, iat= -1,2784, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2652,2653,
&end
#
# 177 HIS HN 177 HIS HB2 3.82 (#peak 2238)
&rst
ixpk= 2238, nxpk= 0, iat=2663,2667, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 177 HIS HN 177 HIS HD2 5.95 (#peak 2249)
&rst
ixpk= 2249, nxpk= 0, iat=2663,2676, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 177 HIS HN 178 LEU HN 4.27 (#peak 2239)
&rst
ixpk= 2239, nxpk= 0, iat=2663,2680, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 177 HIS HN 178 LEU QD1 6.15 (#peak 2240)
&rst
ixpk= 2240, nxpk= 0, iat=2663, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2689,2690,2691,
&end
#
# 177 HIS HN 178 LEU QD2 5.20 (#peak 2244)
&rst
ixpk= 2244, nxpk= 0, iat=2663, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2=2693,2694,2695,
&end
#
# 177 HIS HN 184 ASN HA 5.67 (#peak 2250)
&rst
ixpk= 2250, nxpk= 0, iat=2663,2782, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 177 HIS HN 184 ASN HB2 5.78 (#peak 4839)
&rst
ixpk= 4839, nxpk= 0, iat=2663,2784, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 177 HIS HN 184 ASN HB3 6.15 (#peak 4838)
&rst
ixpk= 4838, nxpk= 0, iat=2663,2785, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 177 HIS HA 178 LEU QD1 6.15 (#peak 1037)
&rst
ixpk= 1037, nxpk= 0, iat=2665, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2689,2690,2691,
&end
#
# 177 HIS HB2 178 LEU HN 4.97 (#peak 420)
&rst
ixpk= 420, nxpk= 0, iat=2667,2680, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 177 HIS HB3 178 LEU HN 4.97 (#peak 425)
&rst
ixpk= 425, nxpk= 0, iat=2668,2680, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 177 HIS HB3 178 LEU QD1 6.15 (#peak 2274)
&rst
ixpk= 2274, nxpk= 0, iat=2668, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2689,2690,2691,
&end
#
# 178 LEU HN 178 LEU HG 4.52 (#peak 429)
&rst
ixpk= 429, nxpk= 0, iat=2680,2687, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 178 LEU HN 178 LEU QD1 5.17 (#peak 422)
&rst
ixpk= 422, nxpk= 0, iat=2680, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=2689,2690,2691,
&end
#
# 178 LEU HN 178 LEU QD2 3.75 (#peak 4313)
&rst
ixpk= 4313, nxpk= 0, iat=2680, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=2693,2694,2695,
&end
#
# 178 LEU HN 179 LYS HN 4.97 (#peak 426)
&rst
ixpk= 426, nxpk= 0, iat=2680,2699, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 178 LEU HN 180 SER HN 5.08 (#peak 421)
&rst
ixpk= 421, nxpk= 0, iat=2680,2721, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 178 LEU HN 183 LEU QB 5.74 (#peak 419)
&rst
ixpk= 419, nxpk= 0, iat=2680, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr2=2765,2766,
&end
#
# 178 LEU HN 184 ASN HB2 6.15 (#peak 4836)
&rst
ixpk= 4836, nxpk= 0, iat=2680,2784, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 178 LEU HN 184 ASN HB3 5.96 (#peak 4837)
&rst
ixpk= 4837, nxpk= 0, iat=2680,2785, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 178 LEU HN 184 ASN HD22 4.21 (#peak 430)
&rst
ixpk= 430, nxpk= 0, iat=2680,2790, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 178 LEU HA 178 LEU QD1 6.15 (#peak 2923)
&rst
ixpk= 2923, nxpk= 0, iat=2682, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2689,2690,2691,
&end
#
# 178 LEU HA 180 SER HN 6.15 (#peak 2922)
&rst
ixpk= 2922, nxpk= 0, iat=2682,2721, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 178 LEU HB2 179 LYS HN 3.82 (#peak 1620)
&rst
ixpk= 1620, nxpk= 0, iat=2684,2699, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 178 LEU HB2 184 ASN HN 5.83 (#peak 4682)
&rst
ixpk= 4682, nxpk= 0, iat=2684,2780, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 178 LEU HB3 179 LYS HN 6.15 (#peak 3659)
&rst
ixpk= 3659, nxpk= 0, iat=2685,2699, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 178 LEU HB3 183 LEU HN 6.15 (#peak 4681)
&rst
ixpk= 4681, nxpk= 0, iat=2685,2761, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 178 LEU HG 179 LYS HN 4.85 (#peak 1619)
&rst
ixpk= 1619, nxpk= 0, iat=2687,2699, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 178 LEU HG 180 SER HN 4.96 (#peak 324)
&rst
ixpk= 324, nxpk= 0, iat=2687,2721, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 178 LEU QD1 179 LYS HN 4.63 (#peak 1615)
&rst
ixpk= 1615, nxpk= 0, iat= -1,2699, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=2689,2690,2691,
&end
#
# 178 LEU QD1 180 SER HN 4.89 (#peak 3401)
&rst
ixpk= 3401, nxpk= 0, iat= -1,2721, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1=2689,2690,2691,
&end
#
# 178 LEU QD1 184 ASN HN 5.33 (#peak 4679)
&rst
ixpk= 4679, nxpk= 0, iat= -1,2780, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=2689,2690,2691,
&end
#
# 178 LEU QD2 179 LYS HN 4.63 (#peak 1616)
&rst
ixpk= 1616, nxpk= 0, iat= -1,2699, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=2693,2694,2695,
&end
#
# 178 LEU QD2 180 SER HN 5.14 (#peak 318)
&rst
ixpk= 318, nxpk= 0, iat= -1,2721, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=2693,2694,2695,
&end
#
# 178 LEU QD2 184 ASN HN 5.37 (#peak 4680)
&rst
ixpk= 4680, nxpk= 0, iat= -1,2780, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr1=2693,2694,2695,
&end
#
# 178 LEU QD2 184 ASN HB2 5.05 (#peak 12592)
&rst
ixpk= 12592, nxpk= 0, iat= -1,2784, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=2693,2694,2695,
&end
#
# 178 LEU QD2 184 ASN HB3 4.08 (#peak 12590)
&rst
ixpk= 12590, nxpk= 0, iat= -1,2785, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1=2693,2694,2695,
&end
#
# 179 LYS HN 179 LYS HG2 6.15 (#peak 2877)
&rst
ixpk= 2877, nxpk= 0, iat=2699,2706, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 179 LYS HN 179 LYS HG3 5.63 (#peak 1612)
&rst
ixpk= 1612, nxpk= 0, iat=2699,2707, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 179 LYS HN 180 SER HN 3.93 (#peak 317)
&rst
ixpk= 317, nxpk= 0, iat=2699,2721, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 179 LYS HB2 180 SER HN 4.10 (#peak 323)
&rst
ixpk= 323, nxpk= 0, iat=2703,2721, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 179 LYS HB3 180 SER HN 6.15 (#peak 1461)
&rst
ixpk= 1461, nxpk= 0, iat=2704,2721, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 179 LYS HD2 180 SER HN 5.06 (#peak 325)
&rst
ixpk= 325, nxpk= 0, iat=2709,2721, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 179 LYS HD3 180 SER HN 4.51 (#peak 312)
&rst
ixpk= 312, nxpk= 0, iat=2710,2721, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 179 LYS HG2 180 SER HN 6.15 (#peak 2876)
&rst
ixpk= 2876, nxpk= 0, iat=2706,2721, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 179 LYS HG3 180 SER HN 4.38 (#peak 307)
&rst
ixpk= 307, nxpk= 0, iat=2707,2721, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 180 SER HN 180 SER HB3 3.45 (#peak 316)
&rst
ixpk= 316, nxpk= 0, iat=2721,2726, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 180 SER HN 181 PRO HA 5.29 (#peak 2980)
&rst
ixpk= 2980, nxpk= 0, iat=2721,2742, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 180 SER HN 181 PRO HD2 4.82 (#peak 328)
&rst
ixpk= 328, nxpk= 0, iat=2721,2733, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 180 SER HN 183 LEU QD1 5.75 (#peak 327)
&rst
ixpk= 327, nxpk= 0, iat=2721, -1, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr2=2770,2771,2772,
&end
#
# 180 SER HN 183 LEU QD2 4.41 (#peak 313)
&rst
ixpk= 313, nxpk= 0, iat=2721, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=2774,2775,2776,
&end
#
# 180 SER HA 183 LEU QD1 6.15 (#peak 4121)
&rst
ixpk= 4121, nxpk= 0, iat=2723, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2770,2771,2772,
&end
#
# 180 SER HB2 183 LEU HN 4.31 (#peak 1376)
&rst
ixpk= 1376, nxpk= 0, iat=2725,2761, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 180 SER HB2 183 LEU HG 6.11 (#peak 623)
&rst
ixpk= 623, nxpk= 0, iat=2725,2768, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61, &end
#
# 180 SER HB2 183 LEU QD1 6.15 (#peak 4123)
&rst
ixpk= 4123, nxpk= 0, iat=2725, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2770,2771,2772,
&end
#
# 180 SER HB2 183 LEU QD2 5.08 (#peak 1188)
&rst
ixpk= 1188, nxpk= 0, iat=2725, -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr2=2774,2775,2776,
&end
#
# 181 PRO HA 184 ASN HB3 6.15 (#peak 629)
&rst
ixpk= 629, nxpk= 0, iat=2742,2785, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 181 PRO HA 184 ASN HD22 4.12 (#peak 2156)
&rst
ixpk= 2156, nxpk= 0, iat=2742,2790, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 181 PRO HB2 182 GLU HN 4.14 (#peak 1726)
&rst
ixpk= 1726, nxpk= 0, iat=2739,2746, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 181 PRO HB2 183 LEU HN 5.06 (#peak 1378)
&rst
ixpk= 1378, nxpk= 0, iat=2739,2761, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 181 PRO HB2 184 ASN HN 6.15 (#peak 1459)
&rst
ixpk= 1459, nxpk= 0, iat=2739,2780, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 181 PRO HD2 182 GLU HN 4.37 (#peak 1735)
&rst
ixpk= 1735, nxpk= 0, iat=2733,2746, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 181 PRO HD3 182 GLU HN 4.42 (#peak 1730)
&rst
ixpk= 1730, nxpk= 0, iat=2734,2746, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 181 PRO HG2 182 GLU HN 5.10 (#peak 1724)
&rst
ixpk= 1724, nxpk= 0, iat=2736,2746, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 181 PRO HG3 182 GLU HN 5.63 (#peak 1729)
&rst
ixpk= 1729, nxpk= 0, iat=2737,2746, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 182 GLU HN 182 GLU HB2 4.07 (#peak 3299)
&rst
ixpk= 3299, nxpk= 0, iat=2746,2750, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 182 GLU HN 182 GLU HB3 3.68 (#peak 1728)
&rst
ixpk= 1728, nxpk= 0, iat=2746,2751, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 182 GLU HN 182 GLU HG2 6.15 (#peak 4156)
&rst
ixpk= 4156, nxpk= 0, iat=2746,2753, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 182 GLU HN 183 LEU HN 3.97 (#peak 1727)
&rst
ixpk= 1727, nxpk= 0, iat=2746,2761, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 182 GLU HN 183 LEU HG 5.85 (#peak 1731)
&rst
ixpk= 1731, nxpk= 0, iat=2746,2768, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 182 GLU HN 183 LEU QD1 6.15 (#peak 4125)
&rst
ixpk= 4125, nxpk= 0, iat=2746, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2770,2771,2772,
&end
#
# 182 GLU HN 183 LEU QD2 4.91 (#peak 1725)
&rst
ixpk= 1725, nxpk= 0, iat=2746, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=2774,2775,2776,
&end
#
# 182 GLU HN 184 ASN HN 4.49 (#peak 1733)
&rst
ixpk= 1733, nxpk= 0, iat=2746,2780, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 182 GLU HA 183 LEU HA 6.15 (#peak 38)
&rst
ixpk= 38, nxpk= 0, iat=2748,2763, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 182 GLU HA 183 LEU QD2 6.15 (#peak 33)
&rst
ixpk= 33, nxpk= 0, iat=2748, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2774,2775,2776,
&end
#
# 182 GLU HA 184 ASN HN 4.38 (#peak 2302)
&rst
ixpk= 2302, nxpk= 0, iat=2748,2780, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 182 GLU HB2 183 LEU HN 4.83 (#peak 1375)
&rst
ixpk= 1375, nxpk= 0, iat=2750,2761, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 182 GLU HG2 183 LEU HN 5.32 (#peak 1384)
&rst
ixpk= 1384, nxpk= 0, iat=2753,2761, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 183 LEU HN 183 LEU HG 5.01 (#peak 1381)
&rst
ixpk= 1381, nxpk= 0, iat=2761,2768, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 183 LEU HN 183 LEU QD1 4.37 (#peak 1383)
&rst
ixpk= 1383, nxpk= 0, iat=2761, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr2=2770,2771,2772,
&end
#
# 183 LEU HN 183 LEU QD2 4.35 (#peak 1377)
&rst
ixpk= 1377, nxpk= 0, iat=2761, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=2774,2775,2776,
&end
#
# 183 LEU HN 184 ASN HN 3.88 (#peak 1382)
&rst
ixpk= 1382, nxpk= 0, iat=2761,2780, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 183 LEU HA 183 LEU QD1 5.73 (#peak 4126)
&rst
ixpk= 4126, nxpk= 0, iat=2763, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr2=2770,2771,2772,
&end
#
# 183 LEU HA 209 ASN HN 6.15 (#peak 2851)
&rst
ixpk= 2851, nxpk= 0, iat=2763,3150, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 183 LEU HG 184 ASN HN 5.17 (#peak 2315)
&rst
ixpk= 2315, nxpk= 0, iat=2768,2780, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 183 LEU QB 184 ASN HN 4.07 (#peak 2303)
&rst
ixpk= 2303, nxpk= 0, iat= -1,2780, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1=2765,2766,
&end
#
# 183 LEU QD1 184 ASN HN 5.58 (#peak 2320)
&rst
ixpk= 2320, nxpk= 0, iat= -1,2780, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1=2770,2771,2772,
&end
#
# 183 LEU QD2 184 ASN HN 5.05 (#peak 2307)
&rst
ixpk= 2307, nxpk= 0, iat= -1,2780, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=2774,2775,2776,
&end
#
# 184 ASN HN 184 ASN HB2 3.72 (#peak 2311)
&rst
ixpk= 2311, nxpk= 0, iat=2780,2784, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 184 ASN HN 184 ASN HB3 3.72 (#peak 2305)
&rst
ixpk= 2305, nxpk= 0, iat=2780,2785, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 184 ASN HN 185 VAL HN 4.95 (#peak 2452)
&rst
ixpk= 2452, nxpk= 0, iat=2780,2794, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 184 ASN HA 185 VAL QG1 6.15 (#peak 3847)
&rst
ixpk= 3847, nxpk= 0, iat=2782, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2800,2801,2802,
&end
#
# 184 ASN HB2 185 VAL HN 4.11 (#peak 2450)
&rst
ixpk= 2450, nxpk= 0, iat=2784,2794, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 185 VAL HN 185 VAL QG1 3.78 (#peak 3400)
&rst
ixpk= 3400, nxpk= 0, iat=2794, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr2=2800,2801,2802,
&end
#
# 185 VAL HN 185 VAL QG2 4.06 (#peak 2451)
&rst
ixpk= 2451, nxpk= 0, iat=2794, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=2804,2805,2806,
&end
#
# 185 VAL HN 186 ASP HN 5.10 (#peak 2445)
&rst
ixpk= 2445, nxpk= 0, iat=2794,2810, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 185 VAL HB 186 ASP HN 4.41 (#peak 40)
&rst
ixpk= 40, nxpk= 0, iat=2798,2810, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 185 VAL HB 207 LEU HN 5.27 (#peak 2074)
&rst
ixpk= 2074, nxpk= 0, iat=2798,3110, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 185 VAL HB 207 LEU QD2 4.96 (#peak 2763)
&rst
ixpk= 2763, nxpk= 0, iat=2798, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=3123,3124,3125,
&end
#
# 185 VAL QG1 186 ASP HN 4.15 (#peak 31)
&rst
ixpk= 31, nxpk= 0, iat= -1,2810, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1=2800,2801,2802,
&end
#
# 185 VAL QG1 208 TYR QD 3.64 (#peak 13126)
&rst
ixpk= 13126, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1=2800,2801,2802,
igr2=3137,3146,
&end
#
# 185 VAL QG2 186 ASP HN 4.19 (#peak 37)
&rst
ixpk= 37, nxpk= 0, iat= -1,2810, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=2804,2805,2806,
&end
#
# 185 VAL QG2 187 LEU HN 6.15 (#peak 2497)
&rst
ixpk= 2497, nxpk= 0, iat= -1,2822, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2804,2805,2806,
&end
#
# 185 VAL QG2 187 LEU HB3 6.15 (#peak 4649)
&rst
ixpk= 4649, nxpk= 0, iat= -1,2827, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2804,2805,2806,
&end
#
# 185 VAL QG2 187 LEU QD1 6.15 (#peak 4647)
&rst
ixpk= 4647, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=2804,2805,2806,
igr2=2831,2832,2833,
&end
#
# 185 VAL QG2 187 LEU QD2 6.15 (#peak 4648)
&rst
ixpk= 4648, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=2804,2805,2806,
igr2=2835,2836,2837,
&end
#
# 185 VAL QG2 206 VAL QG2 5.95 (#peak 2495)
&rst
ixpk= 2495, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
igr1=2804,2805,2806,
igr2=3104,3105,3106,
&end
#
# 185 VAL QG2 208 TYR QD 4.10 (#peak 13125)
&rst
ixpk= 13125, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr1=2804,2805,2806,
igr2=3137,3146,
&end
#
# 186 ASP HN 186 ASP QB 3.94 (#peak 41)
&rst
ixpk= 41, nxpk= 0, iat=2810, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2=2814,2815,
&end
#
# 186 ASP HN 187 LEU HN 4.59 (#peak 1308)
&rst
ixpk= 1308, nxpk= 0, iat=2810,2822, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 186 ASP HN 207 LEU HN 5.51 (#peak 39)
&rst
ixpk= 39, nxpk= 0, iat=2810,3110, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 186 ASP HN 207 LEU HB2 5.52 (#peak 36)
&rst
ixpk= 36, nxpk= 0, iat=2810,3114, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 186 ASP HN 207 LEU HB3 5.01 (#peak 30)
&rst
ixpk= 30, nxpk= 0, iat=2810,3115, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 186 ASP HA 187 LEU HN 3.26 (#peak 1312)
&rst
ixpk= 1312, nxpk= 0, iat=2812,2822, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 186 ASP HA 187 LEU QD1 6.15 (#peak 329)
&rst
ixpk= 329, nxpk= 0, iat=2812, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2831,2832,2833,
&end
#
# 186 ASP HA 187 LEU QD2 6.15 (#peak 2672)
&rst
ixpk= 2672, nxpk= 0, iat=2812, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2835,2836,2837,
&end
#
# 186 ASP QB 187 LEU HN 4.00 (#peak 4166)
&rst
ixpk= 4166, nxpk= 0, iat= -1,2822, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=2814,2815,
&end
#
# 186 ASP QB 187 LEU QD1 6.15 (#peak 334)
&rst
ixpk= 334, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=2814,2815,
igr2=2831,2832,2833,
&end
#
# 186 ASP QB 207 LEU QD2 5.38 (#peak 2759)
&rst
ixpk= 2759, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr1=2814,2815,
igr2=3123,3124,3125,
&end
#
# 187 LEU HN 187 LEU QD1 4.17 (#peak 1309)
&rst
ixpk= 1309, nxpk= 0, iat=2822, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2=2831,2832,2833,
&end
#
# 187 LEU HN 187 LEU QD2 4.70 (#peak 1315)
&rst
ixpk= 1315, nxpk= 0, iat=2822, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2=2835,2836,2837,
&end
#
# 187 LEU HA 187 LEU QD1 6.15 (#peak 331)
&rst
ixpk= 331, nxpk= 0, iat=2824, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2831,2832,2833,
&end
#
# 187 LEU HA 187 LEU QD2 6.10 (#peak 2674)
&rst
ixpk= 2674, nxpk= 0, iat=2824, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2=2835,2836,2837,
&end
#
# 187 LEU HA 205 SER HN 6.15 (#peak 2350)
&rst
ixpk= 2350, nxpk= 0, iat=2824,3083, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 187 LEU HA 206 VAL HA 4.70 (#peak 643)
&rst
ixpk= 643, nxpk= 0, iat=2824,3096, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 187 LEU HA 207 LEU HN 6.02 (#peak 2069)
&rst
ixpk= 2069, nxpk= 0, iat=2824,3110, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 187 LEU HB3 188 ALA HN 4.05 (#peak 541)
&rst
ixpk= 541, nxpk= 0, iat=2827,2841, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 187 LEU HB3 188 ALA HA 6.15 (#peak 3729)
&rst
ixpk= 3729, nxpk= 0, iat=2827,2843, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 187 LEU HB3 188 ALA QB 6.15 (#peak 2064)
&rst
ixpk= 2064, nxpk= 0, iat=2827, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2845,2846,2847,
&end
#
# 187 LEU HB3 206 VAL HA 6.15 (#peak 28)
&rst
ixpk= 28, nxpk= 0, iat=2827,3096, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 187 LEU HB3 216 TYR HH 5.10 (#peak 12108)
&rst
ixpk= 12108, nxpk= 0, iat=2827,3259, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 187 LEU QD1 206 VAL QG1 3.27 (#peak 4477)
&rst
ixpk= 4477, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr1=2831,2832,2833,
igr2=3100,3101,3102,
&end
#
# 187 LEU QD1 206 VAL QG2 3.35 (#peak 4475)
&rst
ixpk= 4475, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1=2831,2832,2833,
igr2=3104,3105,3106,
&end
#
# 187 LEU QD1 216 TYR HH 5.16 (#peak 12110)
&rst
ixpk= 12110, nxpk= 0, iat= -1,3259, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=2831,2832,2833,
&end
#
# 187 LEU QD1 216 TYR QD 5.94 (#peak 12813)
&rst
ixpk= 12813, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.01, r4= 8.51,
igr1=2831,2832,2833,
igr2=3254,3263,
&end
#
# 187 LEU QD1 216 TYR QE 5.22 (#peak 12107)
&rst
ixpk= 12107, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr1=2831,2832,2833,
igr2=3256,3261,
&end
#
# 187 LEU QD2 206 VAL HA 6.15 (#peak 2662)
&rst
ixpk= 2662, nxpk= 0, iat= -1,3096, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2835,2836,2837,
&end
#
# 187 LEU QD2 206 VAL QG2 5.13 (#peak 2666)
&rst
ixpk= 2666, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
igr1=2835,2836,2837,
igr2=3104,3105,3106,
&end
#
# 187 LEU QD2 207 LEU HN 6.03 (#peak 2071)
&rst
ixpk= 2071, nxpk= 0, iat= -1,3110, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr1=2835,2836,2837,
&end
#
# 187 LEU QD2 216 TYR HN 6.15 (#peak 2669)
&rst
ixpk= 2669, nxpk= 0, iat= -1,3246, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2835,2836,2837,
&end
#
# 187 LEU QD2 216 TYR HB2 6.15 (#peak 2667)
&rst
ixpk= 2667, nxpk= 0, iat= -1,3250, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2835,2836,2837,
&end
#
# 187 LEU QD2 216 TYR HH 5.01 (#peak 12109)
&rst
ixpk= 12109, nxpk= 0, iat= -1,3259, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1=2835,2836,2837,
&end
#
# 187 LEU QD2 216 TYR QE 4.25 (#peak 12106)
&rst
ixpk= 12106, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1=2835,2836,2837,
igr2=3256,3261,
&end
#
# 188 ALA HN 188 ALA QB 3.58 (#peak 535)
&rst
ixpk= 535, nxpk= 0, iat=2841, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2=2845,2846,2847,
&end
#
# 188 ALA HN 205 SER HN 4.74 (#peak 681)
&rst
ixpk= 681, nxpk= 0, iat=2841,3083, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 188 ALA HN 205 SER O 2.40
&rst
ixpk= 681, nxpk= 0, iat=2841,3092, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 188 ALA HN 206 VAL HA 4.40 (#peak 531)
&rst
ixpk= 531, nxpk= 0, iat=2841,3096, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 188 ALA HN 206 VAL QG1 5.74 (#peak 3824)
&rst
ixpk= 3824, nxpk= 0, iat=2841, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr2=3100,3101,3102,
&end
#
# 188 ALA HN 206 VAL QG2 5.78 (#peak 3050)
&rst
ixpk= 3050, nxpk= 0, iat=2841, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2=3104,3105,3106,
&end
#
# 188 ALA HN 207 LEU HN 4.90 (#peak 2067)
&rst
ixpk= 2067, nxpk= 0, iat=2841,3110, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 188 ALA HA 189 ALA HN 3.03 (#peak 344)
&rst
ixpk= 344, nxpk= 0, iat=2843,2851, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53, &end
#
# 188 ALA HA 189 ALA QB 5.34 (#peak 2974)
&rst
ixpk= 2974, nxpk= 0, iat=2843, -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr2=2855,2856,2857,
&end
#
# 188 ALA N 205 SER O 3.30
&rst
ixpk= 2974, nxpk= 0, iat=2840,3092, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 188 ALA QB 189 ALA HN 3.79 (#peak 342)
&rst
ixpk= 342, nxpk= 0, iat= -1,2851, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1=2845,2846,2847,
&end
#
# 188 ALA QB 189 ALA QB 5.85 (#peak 2063)
&rst
ixpk= 2063, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.44, r4= 8.94,
igr1=2845,2846,2847,
igr2=2855,2856,2857,
&end
#
# 188 ALA QB 205 SER HN 4.40 (#peak 684)
&rst
ixpk= 684, nxpk= 0, iat= -1,3083, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1=2845,2846,2847,
&end
#
# 188 ALA QB 205 SER HA 6.15 (#peak 2306)
&rst
ixpk= 2306, nxpk= 0, iat= -1,3085, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2845,2846,2847,
&end
#
# 188 ALA QB 205 SER HB2 6.15 (#peak 2090)
&rst
ixpk= 2090, nxpk= 0, iat= -1,3087, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2845,2846,2847,
&end
#
# 188 ALA QB 205 SER HB3 6.15 (#peak 4052)
&rst
ixpk= 4052, nxpk= 0, iat= -1,3088, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2845,2846,2847,
&end
#
# 189 ALA HN 189 ALA QB 2.91 (#peak 346)
&rst
ixpk= 346, nxpk= 0, iat=2851, -1, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
igr2=2855,2856,2857,
&end
#
# 189 ALA HN 190 ALA HN 4.74 (#peak 341)
&rst
ixpk= 341, nxpk= 0, iat=2851,2861, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 189 ALA HA 205 SER HN 6.04 (#peak 682)
&rst
ixpk= 682, nxpk= 0, iat=2853,3083, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54, &end
#
# 189 ALA QB 190 ALA HN 3.61 (#peak 969)
&rst
ixpk= 969, nxpk= 0, iat= -1,2861, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1=2855,2856,2857,
&end
#
# 190 ALA HN 190 ALA QB 3.90 (#peak 966)
&rst
ixpk= 966, nxpk= 0, iat=2861, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=2865,2866,2867,
&end
#
# 190 ALA HN 191 ASP HN 4.80 (#peak 563)
&rst
ixpk= 563, nxpk= 0, iat=2861,2871, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 190 ALA HN 191 ASP HA 6.05 (#peak 4619)
&rst
ixpk= 4619, nxpk= 0, iat=2861,2873, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 190 ALA HN 202 ILE QG2 5.23 (#peak 964)
&rst
ixpk= 964, nxpk= 0, iat=2861, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr2=3052,3053,3054,
&end
#
# 190 ALA HA 191 ASP HN 2.98 (#peak 568)
&rst
ixpk= 568, nxpk= 0, iat=2863,2871, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48, &end
#
# 190 ALA HA 204 GLY HA2 6.15 (#peak 4705)
&rst
ixpk= 4705, nxpk= 0, iat=2863,3078, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 190 ALA HA 204 GLY HA3 6.15 (#peak 4704)
&rst
ixpk= 4704, nxpk= 0, iat=2863,3079, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 190 ALA HA 205 SER HN 6.15 (#peak 4636)
&rst
ixpk= 4636, nxpk= 0, iat=2863,3083, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 190 ALA QB 191 ASP HN 4.42 (#peak 567)
&rst
ixpk= 567, nxpk= 0, iat= -1,2871, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1=2865,2866,2867,
&end
#
# 190 ALA QB 202 ILE QG2 4.69 (#peak 2510)
&rst
ixpk= 2510, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1=2865,2866,2867,
igr2=3052,3053,3054,
&end
#
# 190 ALA QB 203 SER HN 3.72 (#peak 1187)
&rst
ixpk= 1187, nxpk= 0, iat= -1,3065, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1=2865,2866,2867,
&end
#
# 190 ALA QB 204 GLY HN 3.71 (#peak 1996)
&rst
ixpk= 1996, nxpk= 0, iat= -1,3076, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1=2865,2866,2867,
&end
#
# 190 ALA QB 204 GLY HA2 5.54 (#peak 2511)
&rst
ixpk= 2511, nxpk= 0, iat= -1,3078, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr1=2865,2866,2867,
&end
#
# 190 ALA QB 204 GLY HA3 6.15 (#peak 2502)
&rst
ixpk= 2502, nxpk= 0, iat= -1,3079, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2865,2866,2867,
&end
#
# 190 ALA QB 205 SER HN 3.74 (#peak 688)
&rst
ixpk= 688, nxpk= 0, iat= -1,3083, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=2865,2866,2867,
&end
#
# 191 ASP HN 191 ASP HB3 4.10 (#peak 565)
&rst
ixpk= 565, nxpk= 0, iat=2871,2876, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 191 ASP HN 192 ILE HN 4.82 (#peak 2696)
&rst
ixpk= 2696, nxpk= 0, iat=2871,2883, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 191 ASP HN 202 ILE QG2 4.56 (#peak 566)
&rst
ixpk= 566, nxpk= 0, iat=2871, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2=3052,3053,3054,
&end
#
# 191 ASP HN 203 SER HN 5.38 (#peak 4694)
&rst
ixpk= 4694, nxpk= 0, iat=2871,3065, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 191 ASP HA 202 ILE QG2 6.15 (#peak 2141)
&rst
ixpk= 2141, nxpk= 0, iat=2873, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3052,3053,3054,
&end
#
# 191 ASP HA 203 SER HN 6.15 (#peak 1191)
&rst
ixpk= 1191, nxpk= 0, iat=2873,3065, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 191 ASP HB2 192 ILE HN 4.51 (#peak 2691)
&rst
ixpk= 2691, nxpk= 0, iat=2875,2883, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 191 ASP HB3 192 ILE HN 4.51 (#peak 2698)
&rst
ixpk= 2698, nxpk= 0, iat=2876,2883, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 192 ILE HN 192 ILE HB 4.21 (#peak 2702)
&rst
ixpk= 2702, nxpk= 0, iat=2883,2887, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 192 ILE HN 192 ILE HG12 6.15 (#peak 2835)
&rst
ixpk= 2835, nxpk= 0, iat=2883,2893, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 192 ILE HN 192 ILE QD1 4.44 (#peak 2699)
&rst
ixpk= 2699, nxpk= 0, iat=2883, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=2896,2897,2898,
&end
#
# 192 ILE HN 192 ILE QG2 4.61 (#peak 2693)
&rst
ixpk= 2693, nxpk= 0, iat=2883, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2=2889,2890,2891,
&end
#
# 192 ILE HN 193 LYS HN 5.01 (#peak 2704)
&rst
ixpk= 2704, nxpk= 0, iat=2883,2902, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 192 ILE HN 202 ILE HA 6.00 (#peak 2690)
&rst
ixpk= 2690, nxpk= 0, iat=2883,3048, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 192 ILE HN 202 ILE HG12 6.15 (#peak 2810)
&rst
ixpk= 2810, nxpk= 0, iat=2883,3056, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 192 ILE HN 202 ILE QD1 4.42 (#peak 2703)
&rst
ixpk= 2703, nxpk= 0, iat=2883, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=3059,3060,3061,
&end
#
# 192 ILE HA 192 ILE QD1 6.15 (#peak 2199)
&rst
ixpk= 2199, nxpk= 0, iat=2885, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=2896,2897,2898,
&end
#
# 192 ILE HA 200 ALA QB 6.15 (#peak 4790)
&rst
ixpk= 4790, nxpk= 0, iat=2885, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3024,3025,3026,
&end
#
# 192 ILE HA 202 ILE QD1 5.22 (#peak 664)
&rst
ixpk= 664, nxpk= 0, iat=2885, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=3059,3060,3061,
&end
#
# 192 ILE HA 203 SER HN 5.92 (#peak 653)
&rst
ixpk= 653, nxpk= 0, iat=2885,3065, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 192 ILE HB 193 LYS HN 4.20 (#peak 2649)
&rst
ixpk= 2649, nxpk= 0, iat=2887,2902, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 192 ILE HB 200 ALA QB 6.15 (#peak 4794)
&rst
ixpk= 4794, nxpk= 0, iat=2887, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3024,3025,3026,
&end
#
# 192 ILE HG12 193 LYS HN 5.61 (#peak 2647)
&rst
ixpk= 2647, nxpk= 0, iat=2893,2902, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 192 ILE HG12 200 ALA QB 6.15 (#peak 4793)
&rst
ixpk= 4793, nxpk= 0, iat=2893, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3024,3025,3026,
&end
#
# 192 ILE QD1 193 LYS HN 4.53 (#peak 2646)
&rst
ixpk= 2646, nxpk= 0, iat= -1,2902, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1=2896,2897,2898,
&end
#
# 192 ILE QD1 193 LYS HA 6.15 (#peak 2200)
&rst
ixpk= 2200, nxpk= 0, iat= -1,2904, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2896,2897,2898,
&end
#
# 192 ILE QD1 200 ALA QB 6.15 (#peak 4796)
&rst
ixpk= 4796, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=2896,2897,2898,
igr2=3024,3025,3026,
&end
#
# 192 ILE QD1 201 VAL HN 4.42 (#peak 2889)
&rst
ixpk= 2889, nxpk= 0, iat= -1,3030, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1=2896,2897,2898,
&end
#
# 192 ILE QD1 220 ILE HN 6.15 (#peak 3286)
&rst
ixpk= 3286, nxpk= 0, iat= -1,3304, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=2896,2897,2898,
&end
#
# 192 ILE QG2 193 LYS HN 4.90 (#peak 2643)
&rst
ixpk= 2643, nxpk= 0, iat= -1,2902, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1=2889,2890,2891,
&end
#
# 192 ILE QG2 200 ALA QB 6.15 (#peak 4795)
&rst
ixpk= 4795, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=2889,2890,2891,
igr2=3024,3025,3026,
&end
#
# 192 ILE QG2 201 VAL HN 5.33 (#peak 330)
&rst
ixpk= 330, nxpk= 0, iat= -1,3030, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=2889,2890,2891,
&end
#
# 192 ILE QG2 202 ILE HG12 5.31 (#peak 486)
&rst
ixpk= 486, nxpk= 0, iat= -1,3056, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1=2889,2890,2891,
&end
#
# 192 ILE QG2 202 ILE QG2 6.15 (#peak 4318)
&rst
ixpk= 4318, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=2889,2890,2891,
igr2=3052,3053,3054,
&end
#
# 193 LYS HN 193 LYS QE 6.15 (#peak 1146)
&rst
ixpk= 1146, nxpk= 0, iat=2902, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=2915,2916,
&end
#
# 193 LYS HN 193 LYS QG 3.79 (#peak 2648)
&rst
ixpk= 2648, nxpk= 0, iat=2902, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr2=2909,2910,
&end
#
# 193 LYS HN 201 VAL QG1 5.01 (#peak 4699)
&rst
ixpk= 4699, nxpk= 0, iat=2902, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2=3036,3037,3038,
&end
#
# 193 LYS HN 201 VAL QG2 4.49 (#peak 2887)
&rst
ixpk= 2887, nxpk= 0, iat=2902, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=3040,3041,3042,
&end
#
# 193 LYS HN 202 ILE QD1 6.04 (#peak 4239)
&rst
ixpk= 4239, nxpk= 0, iat=2902, -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr2=3059,3060,3061,
&end
#
# 195 ASP HN 195 ASP HB2 4.14 (#peak 4834)
&rst
ixpk= 4834, nxpk= 0, iat=2938,2942, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 195 ASP HA 201 VAL QG2 6.15 (#peak 1902)
&rst
ixpk= 1902, nxpk= 0, iat=2940, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3040,3041,3042,
&end
#
# 195 ASP HB2 200 ALA QB 6.15 (#peak 3081)
&rst
ixpk= 3081, nxpk= 0, iat=2942, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3024,3025,3026,
&end
#
# 195 ASP HB2 201 VAL QG2 6.15 (#peak 3815)
&rst
ixpk= 3815, nxpk= 0, iat=2942, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3040,3041,3042,
&end
#
# 195 ASP HB3 197 LYS HN 6.15 (#peak 1149)
&rst
ixpk= 1149, nxpk= 0, iat=2943,2957, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 195 ASP HB3 201 VAL QG2 6.15 (#peak 3806)
&rst
ixpk= 3806, nxpk= 0, iat=2943, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3040,3041,3042,
&end
#
# 196 GLY HA2 198 ARG HN 6.15 (#peak 741)
&rst
ixpk= 741, nxpk= 0, iat=2952,2979, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 196 GLY HA2 199 HIS HN 5.32 (#peak 2778)
&rst
ixpk= 2778, nxpk= 0, iat=2952,3003, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 196 GLY HA3 199 HIS HN 5.06 (#peak 4832)
&rst
ixpk= 4832, nxpk= 0, iat=2953,3003, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 197 LYS HN 197 LYS HD2 6.15 (#peak 1393)
&rst
ixpk= 1393, nxpk= 0, iat=2957,2967, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 197 LYS HN 197 LYS HD3 4.05 (#peak 1155)
&rst
ixpk= 1155, nxpk= 0, iat=2957,2968, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 197 LYS HN 197 LYS HG2 4.55 (#peak 1153)
&rst
ixpk= 1153, nxpk= 0, iat=2957,2964, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 197 LYS HN 197 LYS HG3 4.75 (#peak 3660)
&rst
ixpk= 3660, nxpk= 0, iat=2957,2965, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 197 LYS HN 198 ARG HN 4.08 (#peak 1551)
&rst
ixpk= 1551, nxpk= 0, iat=2957,2979, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 197 LYS HN 198 ARG QG 5.55 (#peak 4390)
&rst
ixpk= 4390, nxpk= 0, iat=2957, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=2986,2987,
&end
#
# 197 LYS HN 199 HIS HN 4.70 (#peak 1158)
&rst
ixpk= 1158, nxpk= 0, iat=2957,3003, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 197 LYS HA 197 LYS HD2 6.15 (#peak 4074)
&rst
ixpk= 4074, nxpk= 0, iat=2959,2967, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 197 LYS HA 199 HIS HN 6.15 (#peak 4079)
&rst
ixpk= 4079, nxpk= 0, iat=2959,3003, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 197 LYS HB2 198 ARG HN 4.85 (#peak 1553)
&rst
ixpk= 1553, nxpk= 0, iat=2961,2979, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 197 LYS HB2 198 ARG HA 6.15 (#peak 3694)
&rst
ixpk= 3694, nxpk= 0, iat=2961,2981, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 197 LYS HB2 198 ARG HB2 6.15 (#peak 1869)
&rst
ixpk= 1869, nxpk= 0, iat=2961,2983, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 197 LYS HB2 199 HIS HN 5.81 (#peak 2275)
&rst
ixpk= 2275, nxpk= 0, iat=2961,3003, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 197 LYS HB3 198 ARG HN 4.29 (#peak 1560)
&rst
ixpk= 1560, nxpk= 0, iat=2962,2979, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 197 LYS HB3 199 HIS HN 5.86 (#peak 4827)
&rst
ixpk= 4827, nxpk= 0, iat=2962,3003, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 197 LYS HD2 198 ARG HN 6.15 (#peak 1394)
&rst
ixpk= 1394, nxpk= 0, iat=2967,2979, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 197 LYS HG2 198 ARG HN 6.15 (#peak 2464)
&rst
ixpk= 2464, nxpk= 0, iat=2964,2979, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 197 LYS HG2 199 HIS HN 4.90 (#peak 4828)
&rst
ixpk= 4828, nxpk= 0, iat=2964,3003, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 197 LYS HG3 198 ARG HN 5.40 (#peak 1546)
&rst
ixpk= 1546, nxpk= 0, iat=2965,2979, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 197 LYS HG3 199 HIS HN 5.88 (#peak 4829)
&rst
ixpk= 4829, nxpk= 0, iat=2965,3003, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 198 ARG HN 198 ARG QD 4.75 (#peak 1547)
&rst
ixpk= 1547, nxpk= 0, iat=2979, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=2989,2990,
&end
#
# 198 ARG HN 198 ARG QG 4.34 (#peak 1562)
&rst
ixpk= 1562, nxpk= 0, iat=2979, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr2=2986,2987,
&end
#
# 198 ARG HN 199 HIS HN 3.92 (#peak 2276)
&rst
ixpk= 2276, nxpk= 0, iat=2979,3003, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 198 ARG HB2 199 HIS HN 4.81 (#peak 2271)
&rst
ixpk= 2271, nxpk= 0, iat=2983,3003, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 198 ARG HB3 199 HIS HN 4.78 (#peak 2277)
&rst
ixpk= 2277, nxpk= 0, iat=2984,3003, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 198 ARG QD 199 HIS HN 6.15 (#peak 247)
&rst
ixpk= 247, nxpk= 0, iat= -1,3003, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2989,2990,
&end
#
# 198 ARG QG 199 HIS HN 5.12 (#peak 2282)
&rst
ixpk= 2282, nxpk= 0, iat= -1,3003, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1=2986,2987,
&end
#
# 199 HIS HN 199 HIS HB2 4.08 (#peak 2273)
&rst
ixpk= 2273, nxpk= 0, iat=3003,3007, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 199 HIS HN 199 HIS HB3 3.85 (#peak 2279)
&rst
ixpk= 2279, nxpk= 0, iat=3003,3008, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 199 HIS HB2 200 ALA HN 4.79 (#peak 1195)
&rst
ixpk= 1195, nxpk= 0, iat=3007,3020, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 199 HIS HB2 200 ALA QB 6.15 (#peak 4605)
&rst
ixpk= 4605, nxpk= 0, iat=3007, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3024,3025,3026,
&end
#
# 199 HIS HB3 200 ALA HN 4.80 (#peak 1197)
&rst
ixpk= 1197, nxpk= 0, iat=3008,3020, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 199 HIS HD2 200 ALA HN 5.54 (#peak 3271)
&rst
ixpk= 3271, nxpk= 0, iat=3016,3020, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 200 ALA HN 200 ALA QB 3.82 (#peak 1196)
&rst
ixpk= 1196, nxpk= 0, iat=3020, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2=3024,3025,3026,
&end
#
# 200 ALA HN 201 VAL HN 4.69 (#peak 1194)
&rst
ixpk= 1194, nxpk= 0, iat=3020,3030, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 200 ALA HA 201 VAL QG1 6.15 (#peak 1877)
&rst
ixpk= 1877, nxpk= 0, iat=3022, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3036,3037,3038,
&end
#
# 200 ALA QB 201 VAL HN 3.86 (#peak 335)
&rst
ixpk= 335, nxpk= 0, iat= -1,3030, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1=3024,3025,3026,
&end
#
# 200 ALA QB 202 ILE QD1 6.15 (#peak 4100)
&rst
ixpk= 4100, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=3024,3025,3026,
igr2=3059,3060,3061,
&end
#
# 200 ALA QB 220 ILE HN 6.15 (#peak 3027)
&rst
ixpk= 3027, nxpk= 0, iat= -1,3304, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3024,3025,3026,
&end
#
# 201 VAL HN 201 VAL QG1 4.25 (#peak 2818)
&rst
ixpk= 2818, nxpk= 0, iat=3030, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=3036,3037,3038,
&end
#
# 201 VAL HN 201 VAL QG2 4.13 (#peak 337)
&rst
ixpk= 337, nxpk= 0, iat=3030, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2=3040,3041,3042,
&end
#
# 201 VAL HN 202 ILE HN 4.79 (#peak 814)
&rst
ixpk= 814, nxpk= 0, iat=3030,3046, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 201 VAL HA 219 GLY HA2 6.15 (#peak 2382)
&rst
ixpk= 2382, nxpk= 0, iat=3032,3299, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 201 VAL HA 220 ILE HN 5.07 (#peak 2739)
&rst
ixpk= 2739, nxpk= 0, iat=3032,3304, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 201 VAL HB 202 ILE HN 4.24 (#peak 812)
&rst
ixpk= 812, nxpk= 0, iat=3034,3046, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 201 VAL HB 218 LEU HN 6.15 (#peak 142)
&rst
ixpk= 142, nxpk= 0, iat=3034,3278, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 201 VAL QG1 202 ILE HN 5.22 (#peak 817)
&rst
ixpk= 817, nxpk= 0, iat= -1,3046, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1=3036,3037,3038,
&end
#
# 201 VAL QG1 218 LEU HN 4.53 (#peak 1277)
&rst
ixpk= 1277, nxpk= 0, iat= -1,3278, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1=3036,3037,3038,
&end
#
# 201 VAL QG1 219 GLY HN 4.79 (#peak 2819)
&rst
ixpk= 2819, nxpk= 0, iat= -1,3297, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1=3036,3037,3038,
&end
#
# 201 VAL QG1 219 GLY HA2 6.02 (#peak 1876)
&rst
ixpk= 1876, nxpk= 0, iat= -1,3299, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr1=3036,3037,3038,
&end
#
# 201 VAL QG2 202 ILE HN 4.87 (#peak 823)
&rst
ixpk= 823, nxpk= 0, iat= -1,3046, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=3040,3041,3042,
&end
#
# 201 VAL QG2 219 GLY HA2 6.15 (#peak 3807)
&rst
ixpk= 3807, nxpk= 0, iat= -1,3299, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3040,3041,3042,
&end
#
# 201 VAL QG2 219 GLY HA3 6.15 (#peak 1819)
&rst
ixpk= 1819, nxpk= 0, iat= -1,3300, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3040,3041,3042,
&end
#
# 202 ILE HN 202 ILE HB 3.98 (#peak 821)
&rst
ixpk= 821, nxpk= 0, iat=3046,3050, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 202 ILE HN 202 ILE HG12 4.72 (#peak 820)
&rst
ixpk= 820, nxpk= 0, iat=3046,3056, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 202 ILE HN 202 ILE QD1 4.33 (#peak 825)
&rst
ixpk= 825, nxpk= 0, iat=3046, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=3059,3060,3061,
&end
#
# 202 ILE HN 202 ILE QG2 4.28 (#peak 2823)
&rst
ixpk= 2823, nxpk= 0, iat=3046, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2=3052,3053,3054,
&end
#
# 202 ILE HN 203 SER HN 4.88 (#peak 1184)
&rst
ixpk= 1184, nxpk= 0, iat=3046,3065, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 202 ILE HN 217 SER HA 6.06 (#peak 824)
&rst
ixpk= 824, nxpk= 0, iat=3046,3269, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56, &end
#
# 202 ILE HN 218 LEU HN 4.46 (#peak 818)
&rst
ixpk= 818, nxpk= 0, iat=3046,3278, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 202 ILE HN 218 LEU QD1 4.94 (#peak 822)
&rst
ixpk= 822, nxpk= 0, iat=3046, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=3287,3288,3289,
&end
#
# 202 ILE HN 219 GLY HA2 4.81 (#peak 813)
&rst
ixpk= 813, nxpk= 0, iat=3046,3299, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 202 ILE HN 219 GLY HA3 6.15 (#peak 1816)
&rst
ixpk= 1816, nxpk= 0, iat=3046,3300, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 202 ILE HN 220 ILE HN 5.86 (#peak 2737)
&rst
ixpk= 2737, nxpk= 0, iat=3046,3304, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 202 ILE HB 204 GLY HN 6.15 (#peak 2746)
&rst
ixpk= 2746, nxpk= 0, iat=3050,3076, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 202 ILE HB 218 LEU HN 4.31 (#peak 1286)
&rst
ixpk= 1286, nxpk= 0, iat=3050,3278, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 202 ILE HB 218 LEU QD1 6.15 (#peak 3510)
&rst
ixpk= 3510, nxpk= 0, iat=3050, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3287,3288,3289,
&end
#
# 202 ILE HG12 218 LEU HN 5.59 (#peak 2743)
&rst
ixpk= 2743, nxpk= 0, iat=3056,3278, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 202 ILE HG13 218 LEU QD2 6.15 (#peak 444)
&rst
ixpk= 444, nxpk= 0, iat=3057, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3291,3292,3293,
&end
#
# 202 ILE QD1 203 SER HN 3.99 (#peak 1192)
&rst
ixpk= 1192, nxpk= 0, iat= -1,3065, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1=3059,3060,3061,
&end
#
# 202 ILE QD1 218 LEU QD1 6.15 (#peak 4101)
&rst
ixpk= 4101, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=3059,3060,3061,
igr2=3287,3288,3289,
&end
#
# 202 ILE QG2 203 SER HA 6.15 (#peak 2140)
&rst
ixpk= 2140, nxpk= 0, iat= -1,3067, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3052,3053,3054,
&end
#
# 202 ILE QG2 203 SER HB3 6.15 (#peak 2143)
&rst
ixpk= 2143, nxpk= 0, iat= -1,3070, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3052,3053,3054,
&end
#
# 202 ILE QG2 204 GLY HN 4.86 (#peak 1994)
&rst
ixpk= 1994, nxpk= 0, iat= -1,3076, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1=3052,3053,3054,
&end
#
# 202 ILE QG2 216 TYR QD 4.87 (#peak 1578)
&rst
ixpk= 1578, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1=3052,3053,3054,
igr2=3254,3263,
&end
#
# 202 ILE QG2 216 TYR QE 6.15 (#peak 2146)
&rst
ixpk= 2146, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=3052,3053,3054,
igr2=3256,3261,
&end
#
# 202 ILE QG2 217 SER HA 6.15 (#peak 3933)
&rst
ixpk= 3933, nxpk= 0, iat= -1,3269, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3052,3053,3054,
&end
#
# 202 ILE QG2 218 LEU HN 4.52 (#peak 1283)
&rst
ixpk= 1283, nxpk= 0, iat= -1,3278, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1=3052,3053,3054,
&end
#
# 202 ILE QG2 218 LEU QD1 6.15 (#peak 3503)
&rst
ixpk= 3503, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=3052,3053,3054,
igr2=3287,3288,3289,
&end
#
# 202 ILE QG2 218 LEU QD2 6.15 (#peak 2144)
&rst
ixpk= 2144, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=3052,3053,3054,
igr2=3291,3292,3293,
&end
#
# 203 SER HN 203 SER HB2 3.67 (#peak 1189)
&rst
ixpk= 1189, nxpk= 0, iat=3065,3069, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 203 SER HN 203 SER HB3 3.67 (#peak 1183)
&rst
ixpk= 1183, nxpk= 0, iat=3065,3070, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 203 SER HN 204 GLY HN 4.44 (#peak 1188)
&rst
ixpk= 1188, nxpk= 0, iat=3065,3076, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 203 SER HA 204 GLY HN 3.22 (#peak 1987)
&rst
ixpk= 1987, nxpk= 0, iat=3067,3076, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 203 SER HA 217 SER HA 3.62 (#peak 12274)
&rst
ixpk= 12274, nxpk= 0, iat=3067,3269, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 203 SER HA 217 SER HB2 6.15 (#peak 427)
&rst
ixpk= 427, nxpk= 0, iat=3067,3271, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 203 SER HA 218 LEU HN 4.91 (#peak 1274)
&rst
ixpk= 1274, nxpk= 0, iat=3067,3278, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 203 SER HB2 204 GLY HN 4.54 (#peak 1998)
&rst
ixpk= 1998, nxpk= 0, iat=3069,3076, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 203 SER HB3 204 GLY HN 4.69 (#peak 2748)
&rst
ixpk= 2748, nxpk= 0, iat=3070,3076, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 203 SER HB3 217 SER HA 6.15 (#peak 3928)
&rst
ixpk= 3928, nxpk= 0, iat=3070,3269, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 204 GLY HN 205 SER HN 4.53 (#peak 1990)
&rst
ixpk= 1990, nxpk= 0, iat=3076,3083, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 204 GLY HN 215 SER HA 6.15 (#peak 1988)
&rst
ixpk= 1988, nxpk= 0, iat=3076,3237, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 204 GLY HN 215 SER HB2 6.15 (#peak 1389)
&rst
ixpk= 1389, nxpk= 0, iat=3076,3239, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 204 GLY HN 216 TYR HN 4.24 (#peak 863)
&rst
ixpk= 863, nxpk= 0, iat=3076,3246, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 204 GLY HN 216 TYR O 2.40
&rst
ixpk= 863, nxpk= 0, iat=3076,3265, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 204 GLY HN 216 TYR QD 4.53 (#peak 2000)
&rst
ixpk= 2000, nxpk= 0, iat=3076, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=3254,3263,
&end
#
# 204 GLY HN 217 SER HA 4.39 (#peak 1999)
&rst
ixpk= 1999, nxpk= 0, iat=3076,3269, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 204 GLY HN 218 LEU HN 6.10 (#peak 4678)
&rst
ixpk= 4678, nxpk= 0, iat=3076,3278, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60, &end
#
# 204 GLY HA2 205 SER HN 3.56 (#peak 690)
&rst
ixpk= 690, nxpk= 0, iat=3078,3083, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 204 GLY HA2 216 TYR HN 6.15 (#peak 2744)
&rst
ixpk= 2744, nxpk= 0, iat=3078,3246, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 204 GLY HA3 216 TYR HN 5.27 (#peak 852)
&rst
ixpk= 852, nxpk= 0, iat=3079,3246, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 204 GLY N 216 TYR O 3.30
&rst
ixpk= 852, nxpk= 0, iat=3075,3265, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 205 SER HN 205 SER HB2 3.83 (#peak 685)
&rst
ixpk= 685, nxpk= 0, iat=3083,3087, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 205 SER HN 205 SER HB3 3.80 (#peak 693)
&rst
ixpk= 693, nxpk= 0, iat=3083,3088, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 205 SER HN 206 VAL HN 4.61 (#peak 689)
&rst
ixpk= 689, nxpk= 0, iat=3083,3094, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 205 SER HN 206 VAL QG1 6.15 (#peak 2990)
&rst
ixpk= 2990, nxpk= 0, iat=3083, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3100,3101,3102,
&end
#
# 205 SER HN 216 TYR HN 5.77 (#peak 683)
&rst
ixpk= 683, nxpk= 0, iat=3083,3246, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27, &end
#
# 205 SER HN 216 TYR QD 4.77 (#peak 694)
&rst
ixpk= 694, nxpk= 0, iat=3083, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr2=3254,3263,
&end
#
# 205 SER HA 214 GLY HN 5.94 (#peak 760)
&rst
ixpk= 760, nxpk= 0, iat=3085,3228, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 205 SER HA 215 SER HA 6.15 (#peak 2302)
&rst
ixpk= 2302, nxpk= 0, iat=3085,3237, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 205 SER HA 215 SER HB3 6.15 (#peak 3314)
&rst
ixpk= 3314, nxpk= 0, iat=3085,3240, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 205 SER HA 216 TYR HN 4.03 (#peak 859)
&rst
ixpk= 859, nxpk= 0, iat=3085,3246, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 205 SER HB2 206 VAL HN 3.66 (#peak 1709)
&rst
ixpk= 1709, nxpk= 0, iat=3087,3094, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 205 SER HB2 207 LEU QD2 6.15 (#peak 4653)
&rst
ixpk= 4653, nxpk= 0, iat=3087, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3123,3124,3125,
&end
#
# 205 SER HB3 206 VAL HN 3.98 (#peak 1717)
&rst
ixpk= 1717, nxpk= 0, iat=3088,3094, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 206 VAL HN 206 VAL QG1 4.09 (#peak 1701)
&rst
ixpk= 1701, nxpk= 0, iat=3094, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=3100,3101,3102,
&end
#
# 206 VAL HN 206 VAL QG2 4.55 (#peak 3663)
&rst
ixpk= 3663, nxpk= 0, iat=3094, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2=3104,3105,3106,
&end
#
# 206 VAL HN 207 LEU HN 4.67 (#peak 1714)
&rst
ixpk= 1714, nxpk= 0, iat=3094,3110, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 206 VAL HN 214 GLY HN 4.44 (#peak 763)
&rst
ixpk= 763, nxpk= 0, iat=3094,3228, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 206 VAL HN 214 GLY HA3 6.15 (#peak 3390)
&rst
ixpk= 3390, nxpk= 0, iat=3094,3231, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 206 VAL HN 215 SER HA 4.56 (#peak 1712)
&rst
ixpk= 1712, nxpk= 0, iat=3094,3237, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 206 VAL HN 215 SER HB2 6.15 (#peak 1388)
&rst
ixpk= 1388, nxpk= 0, iat=3094,3239, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 206 VAL HN 215 SER HB3 6.15 (#peak 3315)
&rst
ixpk= 3315, nxpk= 0, iat=3094,3240, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 206 VAL HB 207 LEU HN 6.15 (#peak 1622)
&rst
ixpk= 1622, nxpk= 0, iat=3098,3110, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 206 VAL HB 214 GLY HN 4.87 (#peak 4599)
&rst
ixpk= 4599, nxpk= 0, iat=3098,3228, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 206 VAL HB 214 GLY HA2 6.15 (#peak 2609)
&rst
ixpk= 2609, nxpk= 0, iat=3098,3230, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 206 VAL QG1 207 LEU HN 5.35 (#peak 3825)
&rst
ixpk= 3825, nxpk= 0, iat= -1,3110, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr1=3100,3101,3102,
&end
#
# 206 VAL QG1 214 GLY HN 4.80 (#peak 4210)
&rst
ixpk= 4210, nxpk= 0, iat= -1,3228, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=3100,3101,3102,
&end
#
# 206 VAL QG1 216 TYR HN 5.55 (#peak 864)
&rst
ixpk= 864, nxpk= 0, iat= -1,3246, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1=3100,3101,3102,
&end
#
# 206 VAL QG1 216 TYR HB2 6.15 (#peak 2989)
&rst
ixpk= 2989, nxpk= 0, iat= -1,3250, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3100,3101,3102,
&end
#
# 206 VAL QG1 216 TYR QD 6.15 (#peak 2994)
&rst
ixpk= 2994, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=3100,3101,3102,
igr2=3254,3263,
&end
#
# 206 VAL QG2 207 LEU HN 4.74 (#peak 704)
&rst
ixpk= 704, nxpk= 0, iat= -1,3110, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1=3104,3105,3106,
&end
#
# 206 VAL QG2 207 LEU HA 6.15 (#peak 695)
&rst
ixpk= 695, nxpk= 0, iat= -1,3112, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3104,3105,3106,
&end
#
# 206 VAL QG2 214 GLY HN 4.52 (#peak 4209)
&rst
ixpk= 4209, nxpk= 0, iat= -1,3228, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1=3104,3105,3106,
&end
#
# 206 VAL QG2 214 GLY HA2 6.15 (#peak 2607)
&rst
ixpk= 2607, nxpk= 0, iat= -1,3230, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3104,3105,3106,
&end
#
# 206 VAL QG2 214 GLY HA3 6.15 (#peak 3385)
&rst
ixpk= 3385, nxpk= 0, iat= -1,3231, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3104,3105,3106,
&end
#
# 206 VAL QG2 215 SER HA 6.15 (#peak 689)
&rst
ixpk= 689, nxpk= 0, iat= -1,3237, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3104,3105,3106,
&end
#
# 206 VAL QG2 215 SER HB3 6.15 (#peak 3311)
&rst
ixpk= 3311, nxpk= 0, iat= -1,3240, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3104,3105,3106,
&end
#
# 206 VAL QG2 216 TYR HN 4.36 (#peak 853)
&rst
ixpk= 853, nxpk= 0, iat= -1,3246, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=3104,3105,3106,
&end
#
# 207 LEU HN 207 LEU HG 4.89 (#peak 2877)
&rst
ixpk= 2877, nxpk= 0, iat=3110,3117, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 207 LEU HN 208 TYR HN 5.12 (#peak 1969)
&rst
ixpk= 1969, nxpk= 0, iat=3110,3129, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 207 LEU HA 207 LEU QD2 6.15 (#peak 2759)
&rst
ixpk= 2759, nxpk= 0, iat=3112, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3123,3124,3125,
&end
#
# 207 LEU HA 210 GLN HN 6.15 (#peak 1761)
&rst
ixpk= 1761, nxpk= 0, iat=3112,3164, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 207 LEU HA 211 ALA HN 5.22 (#peak 2137)
&rst
ixpk= 2137, nxpk= 0, iat=3112,3181, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 207 LEU HA 212 GLU HN 6.15 (#peak 1769)
&rst
ixpk= 1769, nxpk= 0, iat=3112,3191, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 207 LEU HA 214 GLY HN 5.12 (#peak 3055)
&rst
ixpk= 3055, nxpk= 0, iat=3112,3228, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 207 LEU HB2 207 LEU QD2 3.16 (#peak 4523)
&rst
ixpk= 4523, nxpk= 0, iat=3114, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr2=3123,3124,3125,
&end
#
# 207 LEU HB2 208 TYR HN 4.37 (#peak 1966)
&rst
ixpk= 1966, nxpk= 0, iat=3114,3129, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 207 LEU HB2 210 GLN HN 5.77 (#peak 4259)
&rst
ixpk= 4259, nxpk= 0, iat=3114,3164, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27, &end
#
# 207 LEU HB2 211 ALA HN 6.15 (#peak 4631)
&rst
ixpk= 4631, nxpk= 0, iat=3114,3181, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 207 LEU HB3 207 LEU QD2 3.56 (#peak 4524)
&rst
ixpk= 4524, nxpk= 0, iat=3115, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=3123,3124,3125,
&end
#
# 207 LEU HB3 208 TYR HN 5.33 (#peak 1955)
&rst
ixpk= 1955, nxpk= 0, iat=3115,3129, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 207 LEU HB3 210 GLN HN 5.40 (#peak 4261)
&rst
ixpk= 4261, nxpk= 0, iat=3115,3164, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 207 LEU HB3 211 ALA HN 5.16 (#peak 3330)
&rst
ixpk= 3330, nxpk= 0, iat=3115,3181, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 207 LEU HG 208 TYR HN 4.90 (#peak 1972)
&rst
ixpk= 1972, nxpk= 0, iat=3117,3129, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 207 LEU HG 210 GLN HN 6.15 (#peak 3294)
&rst
ixpk= 3294, nxpk= 0, iat=3117,3164, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 207 LEU HG 211 ALA HN 5.12 (#peak 4630)
&rst
ixpk= 4630, nxpk= 0, iat=3117,3181, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 207 LEU QD1 208 TYR HN 5.12 (#peak 4582)
&rst
ixpk= 4582, nxpk= 0, iat= -1,3129, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=3119,3120,3121,
&end
#
# 207 LEU QD1 210 GLN HN 4.94 (#peak 383)
&rst
ixpk= 383, nxpk= 0, iat= -1,3164, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1=3119,3120,3121,
&end
#
# 207 LEU QD1 210 GLN HA 5.68 (#peak 912)
&rst
ixpk= 912, nxpk= 0, iat= -1,3166, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1=3119,3120,3121,
&end
#
# 207 LEU QD1 211 ALA HN 5.23 (#peak 2133)
&rst
ixpk= 2133, nxpk= 0, iat= -1,3181, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1=3119,3120,3121,
&end
#
# 207 LEU QD1 212 GLU HN 5.53 (#peak 4583)
&rst
ixpk= 4583, nxpk= 0, iat= -1,3191, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1=3119,3120,3121,
&end
#
# 207 LEU QD2 208 TYR HN 4.75 (#peak 1967)
&rst
ixpk= 1967, nxpk= 0, iat= -1,3129, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=3123,3124,3125,
&end
#
# 207 LEU QD2 210 GLN HN 5.68 (#peak 393)
&rst
ixpk= 393, nxpk= 0, iat= -1,3164, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1=3123,3124,3125,
&end
#
# 207 LEU QD2 210 GLN HA 6.15 (#peak 3679)
&rst
ixpk= 3679, nxpk= 0, iat= -1,3166, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3123,3124,3125,
&end
#
# 207 LEU QD2 211 ALA HN 4.85 (#peak 2142)
&rst
ixpk= 2142, nxpk= 0, iat= -1,3181, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1=3123,3124,3125,
&end
#
# 207 LEU QD2 211 ALA QB 5.57 (#peak 2108)
&rst
ixpk= 2108, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.03, r4= 8.53,
igr1=3123,3124,3125,
igr2=3185,3186,3187,
&end
#
# 207 LEU QD2 212 GLU HN 5.35 (#peak 4584)
&rst
ixpk= 4584, nxpk= 0, iat= -1,3191, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr1=3123,3124,3125,
&end
#
# 207 LEU QD2 213 LYS HN 5.72 (#peak 4596)
&rst
ixpk= 4596, nxpk= 0, iat= -1,3206, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1=3123,3124,3125,
&end
#
# 207 LEU QD2 213 LYS HB3 6.15 (#peak 3558)
&rst
ixpk= 3558, nxpk= 0, iat= -1,3211, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3123,3124,3125,
&end
#
# 207 LEU QD2 213 LYS HG2 6.15 (#peak 4644)
&rst
ixpk= 4644, nxpk= 0, iat= -1,3213, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3123,3124,3125,
&end
#
# 207 LEU QD2 214 GLY HN 6.01 (#peak 4825)
&rst
ixpk= 4825, nxpk= 0, iat= -1,3228, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
igr1=3123,3124,3125,
&end
#
# 208 TYR HN 208 TYR HB2 4.15 (#peak 1956)
&rst
ixpk= 1956, nxpk= 0, iat=3129,3133, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 208 TYR HN 208 TYR QD 4.30 (#peak 1957)
&rst
ixpk= 1957, nxpk= 0, iat=3129, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2=3137,3146,
&end
#
# 208 TYR HN 210 GLN HN 4.54 (#peak 394)
&rst
ixpk= 394, nxpk= 0, iat=3129,3164, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 208 TYR HN 210 GLN HA 6.15 (#peak 2852)
&rst
ixpk= 2852, nxpk= 0, iat=3129,3166, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 208 TYR HN 211 ALA HN 3.47 (#peak 2143)
&rst
ixpk= 2143, nxpk= 0, iat=3129,3181, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 208 TYR HN 211 ALA HA 6.15 (#peak 1281)
&rst
ixpk= 1281, nxpk= 0, iat=3129,3183, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 208 TYR HN 211 ALA QB 5.05 (#peak 1965)
&rst
ixpk= 1965, nxpk= 0, iat=3129, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=3185,3186,3187,
&end
#
# 208 TYR HN 212 GLU HN 5.71 (#peak 4587)
&rst
ixpk= 4587, nxpk= 0, iat=3129,3191, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 208 TYR HN 212 GLU HB3 4.73 (#peak 1964)
&rst
ixpk= 1964, nxpk= 0, iat=3129,3196, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 208 TYR HN 212 GLU HG2 6.15 (#peak 1960)
&rst
ixpk= 1960, nxpk= 0, iat=3129,3198, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 208 TYR HN 212 GLU HG3 5.70 (#peak 1968)
&rst
ixpk= 1968, nxpk= 0, iat=3129,3199, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 208 TYR HA 209 ASN HA 6.15 (#peak 1402)
&rst
ixpk= 1402, nxpk= 0, iat=3131,3152, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 208 TYR HA 210 GLN HN 5.14 (#peak 390)
&rst
ixpk= 390, nxpk= 0, iat=3131,3164, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 208 TYR HB2 209 ASN HN 4.77 (#peak 44)
&rst
ixpk= 44, nxpk= 0, iat=3133,3150, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 208 TYR HB2 211 ALA HN 4.91 (#peak 4641)
&rst
ixpk= 4641, nxpk= 0, iat=3133,3181, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 208 TYR HB2 212 GLU HG2 6.15 (#peak 4681)
&rst
ixpk= 4681, nxpk= 0, iat=3133,3198, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 208 TYR HB2 234 VAL HB 5.59 (#peak 13130)
&rst
ixpk= 13130, nxpk= 0, iat=3133,3494, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 208 TYR HB2 234 VAL QG2 4.31 (#peak 13131)
&rst
ixpk= 13131, nxpk= 0, iat=3133, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2=3500,3501,3502,
&end
#
# 208 TYR HB3 211 ALA HN 4.57 (#peak 4640)
&rst
ixpk= 4640, nxpk= 0, iat=3134,3181, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 208 TYR HB3 212 GLU HB2 6.15 (#peak 4682)
&rst
ixpk= 4682, nxpk= 0, iat=3134,3195, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 208 TYR HB3 212 GLU HG2 6.15 (#peak 4680)
&rst
ixpk= 4680, nxpk= 0, iat=3134,3198, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 208 TYR HB3 234 VAL QG2 4.03 (#peak 13132)
&rst
ixpk= 13132, nxpk= 0, iat=3134, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=3500,3501,3502,
&end
#
# 208 TYR QD 209 ASN HN 4.48 (#peak 45)
&rst
ixpk= 45, nxpk= 0, iat= -1,3150, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=3137,3146,
&end
#
# 208 TYR QD 210 GLN HN 6.15 (#peak 381)
&rst
ixpk= 381, nxpk= 0, iat= -1,3164, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=3137,3146,
&end
#
# 208 TYR QD 211 ALA HN 6.15 (#peak 2131)
&rst
ixpk= 2131, nxpk= 0, iat= -1,3181, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=3137,3146,
&end
#
# 208 TYR QD 234 VAL HB 3.95 (#peak 13133)
&rst
ixpk= 13133, nxpk= 0, iat= -1,3494, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1=3137,3146,
&end
#
# 208 TYR QD 234 VAL QG2 3.49 (#peak 13127)
&rst
ixpk= 13127, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1=3137,3146,
igr2=3500,3501,3502,
&end
#
# 208 TYR QE 234 VAL HB 4.04 (#peak 13134)
&rst
ixpk= 13134, nxpk= 0, iat= -1,3494, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=3139,3144,
&end
#
# 208 TYR QE 234 VAL QG2 4.46 (#peak 13128)
&rst
ixpk= 13128, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1=3139,3144,
igr2=3500,3501,3502,
&end
#
# 209 ASN HN 210 GLN HN 4.20 (#peak 380)
&rst
ixpk= 380, nxpk= 0, iat=3150,3164, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 209 ASN HN 211 ALA HN 4.71 (#peak 2130)
&rst
ixpk= 2130, nxpk= 0, iat=3150,3181, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 209 ASN HA 209 ASN HD21 5.10 (#peak 2462)
&rst
ixpk= 2462, nxpk= 0, iat=3152,3159, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 209 ASN HA 209 ASN HD22 4.27 (#peak 2165)
&rst
ixpk= 2165, nxpk= 0, iat=3152,3160, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 209 ASN HA 210 GLN HN 3.57 (#peak 386)
&rst
ixpk= 386, nxpk= 0, iat=3152,3164, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 209 ASN HA 210 GLN HA 6.15 (#peak 3678)
&rst
ixpk= 3678, nxpk= 0, iat=3152,3166, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 209 ASN HA 210 GLN HE22 6.15 (#peak 1400)
&rst
ixpk= 1400, nxpk= 0, iat=3152,3177, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 209 ASN HA 211 ALA HN 5.15 (#peak 2136)
&rst
ixpk= 2136, nxpk= 0, iat=3152,3181, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 209 ASN HB2 209 ASN HD21 3.09 (#peak 2461)
&rst
ixpk= 2461, nxpk= 0, iat=3154,3159, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, &end
#
# 209 ASN HB2 209 ASN HD22 3.96 (#peak 2164)
&rst
ixpk= 2164, nxpk= 0, iat=3154,3160, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 209 ASN HB3 209 ASN HD21 3.27 (#peak 2463)
&rst
ixpk= 2463, nxpk= 0, iat=3155,3159, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 209 ASN HB3 210 GLN HN 4.72 (#peak 388)
&rst
ixpk= 388, nxpk= 0, iat=3155,3164, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 209 ASN HB3 211 ALA HN 4.86 (#peak 2138)
&rst
ixpk= 2138, nxpk= 0, iat=3155,3181, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 209 ASN HB3 211 ALA QB 5.70 (#peak 2099)
&rst
ixpk= 2099, nxpk= 0, iat=3155, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr2=3185,3186,3187,
&end
#
# 210 GLN HN 210 GLN HB2 3.76 (#peak 2870)
&rst
ixpk= 2870, nxpk= 0, iat=3164,3168, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 210 GLN HN 210 GLN HE21 4.49 (#peak 835)
&rst
ixpk= 835, nxpk= 0, iat=3164,3176, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 210 GLN HN 210 GLN HE22 4.56 (#peak 542)
&rst
ixpk= 542, nxpk= 0, iat=3164,3177, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 210 GLN HN 210 GLN QG 3.24 (#peak 395)
&rst
ixpk= 395, nxpk= 0, iat=3164, -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
igr2=3171,3172,
&end
#
# 210 GLN HN 211 ALA HN 3.54 (#peak 2132)
&rst
ixpk= 2132, nxpk= 0, iat=3164,3181, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 210 GLN HN 211 ALA QB 4.80 (#peak 4260)
&rst
ixpk= 4260, nxpk= 0, iat=3164, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=3185,3186,3187,
&end
#
# 210 GLN HA 210 GLN HE22 4.15 (#peak 546)
&rst
ixpk= 546, nxpk= 0, iat=3166,3177, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 210 GLN HA 211 ALA HN 3.43 (#peak 2146)
&rst
ixpk= 2146, nxpk= 0, iat=3166,3181, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 210 GLN HB2 210 GLN HE22 4.97 (#peak 2956)
&rst
ixpk= 2956, nxpk= 0, iat=3168,3177, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 210 GLN HB2 211 ALA HN 4.63 (#peak 2147)
&rst
ixpk= 2147, nxpk= 0, iat=3168,3181, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 210 GLN HB3 210 GLN HE22 4.03 (#peak 2957)
&rst
ixpk= 2957, nxpk= 0, iat=3169,3177, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 210 GLN HB3 211 ALA HN 4.55 (#peak 2135)
&rst
ixpk= 2135, nxpk= 0, iat=3169,3181, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 210 GLN HB3 211 ALA QB 6.15 (#peak 2098)
&rst
ixpk= 2098, nxpk= 0, iat=3169, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3185,3186,3187,
&end
#
# 210 GLN QG 210 GLN HE21 3.59 (#peak 837)
&rst
ixpk= 837, nxpk= 0, iat= -1,3176, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=3171,3172,
&end
#
# 210 GLN QG 210 GLN HE22 3.58 (#peak 545)
&rst
ixpk= 545, nxpk= 0, iat= -1,3177, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr1=3171,3172,
&end
#
# 210 GLN QG 211 ALA HN 4.68 (#peak 2144)
&rst
ixpk= 2144, nxpk= 0, iat= -1,3181, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1=3171,3172,
&end
#
# 211 ALA HN 211 ALA QB 3.09 (#peak 4643)
&rst
ixpk= 4643, nxpk= 0, iat=3181, -1, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,
igr2=3185,3186,3187,
&end
#
# 211 ALA HN 212 GLU HN 4.44 (#peak 2293)
&rst
ixpk= 2293, nxpk= 0, iat=3181,3191, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 211 ALA QB 212 GLU HN 4.22 (#peak 2290)
&rst
ixpk= 2290, nxpk= 0, iat= -1,3191, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1=3185,3186,3187,
&end
#
# 212 GLU HN 212 GLU HB2 3.79 (#peak 2285)
&rst
ixpk= 2285, nxpk= 0, iat=3191,3195, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 212 GLU HN 212 GLU HB3 4.09 (#peak 2291)
&rst
ixpk= 2291, nxpk= 0, iat=3191,3196, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 212 GLU HN 212 GLU HG2 5.04 (#peak 2286)
&rst
ixpk= 2286, nxpk= 0, iat=3191,3198, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 212 GLU HN 212 GLU HG3 4.60 (#peak 2755)
&rst
ixpk= 2755, nxpk= 0, iat=3191,3199, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 212 GLU HN 213 LYS HN 5.06 (#peak 2289)
&rst
ixpk= 2289, nxpk= 0, iat=3191,3206, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 212 GLU HB2 213 LYS HN 5.44 (#peak 1385)
&rst
ixpk= 1385, nxpk= 0, iat=3195,3206, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 212 GLU HB2 214 GLY HN 5.73 (#peak 751)
&rst
ixpk= 751, nxpk= 0, iat=3195,3228, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 212 GLU HB2 234 VAL QG2 4.97 (#peak 435)
&rst
ixpk= 435, nxpk= 0, iat=3195, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=3500,3501,3502,
&end
#
# 212 GLU HB3 213 LYS HN 5.54 (#peak 1393)
&rst
ixpk= 1393, nxpk= 0, iat=3196,3206, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 212 GLU HB3 214 GLY HN 5.36 (#peak 759)
&rst
ixpk= 759, nxpk= 0, iat=3196,3228, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 212 GLU HB3 234 VAL QG2 5.33 (#peak 2141)
&rst
ixpk= 2141, nxpk= 0, iat=3196, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2=3500,3501,3502,
&end
#
# 212 GLU HG2 213 LYS HN 6.15 (#peak 1388)
&rst
ixpk= 1388, nxpk= 0, iat=3198,3206, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 212 GLU HG2 214 GLY HN 6.01 (#peak 755)
&rst
ixpk= 755, nxpk= 0, iat=3198,3228, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 212 GLU HG3 213 LYS HN 4.76 (#peak 1395)
&rst
ixpk= 1395, nxpk= 0, iat=3199,3206, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 212 GLU HG3 214 GLY HN 6.15 (#peak 2800)
&rst
ixpk= 2800, nxpk= 0, iat=3199,3228, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 212 GLU HG3 234 VAL QG2 5.17 (#peak 2800)
&rst
ixpk= 2800, nxpk= 0, iat=3199, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=3500,3501,3502,
&end
#
# 213 LYS HN 213 LYS HG2 5.03 (#peak 4592)
&rst
ixpk= 4592, nxpk= 0, iat=3206,3213, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 213 LYS HN 213 LYS QE 6.15 (#peak 1398)
&rst
ixpk= 1398, nxpk= 0, iat=3206, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=3219,3220,
&end
#
# 213 LYS HN 214 GLY HN 3.68 (#peak 758)
&rst
ixpk= 758, nxpk= 0, iat=3206,3228, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 213 LYS HN 234 VAL HA 6.15 (#peak 4595)
&rst
ixpk= 4595, nxpk= 0, iat=3206,3492, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 213 LYS HN 234 VAL QG2 5.03 (#peak 1386)
&rst
ixpk= 1386, nxpk= 0, iat=3206, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2=3500,3501,3502,
&end
#
# 213 LYS HN 235 LYS HN 4.91 (#peak 4603)
&rst
ixpk= 4603, nxpk= 0, iat=3206,3506, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 213 LYS HN 235 LYS QG 6.15 (#peak 1256)
&rst
ixpk= 1256, nxpk= 0, iat=3206, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=3513,3514,
&end
#
# 213 LYS HA 214 GLY HN 3.57 (#peak 754)
&rst
ixpk= 754, nxpk= 0, iat=3208,3228, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 213 LYS HB2 235 LYS HN 6.15 (#peak 4480)
&rst
ixpk= 4480, nxpk= 0, iat=3210,3506, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 213 LYS HB2 235 LYS QG 6.15 (#peak 1632)
&rst
ixpk= 1632, nxpk= 0, iat=3210, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=3513,3514,
&end
#
# 213 LYS HB3 213 LYS QE 4.74 (#peak 3788)
&rst
ixpk= 3788, nxpk= 0, iat=3211, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2=3219,3220,
&end
#
# 213 LYS HB3 214 GLY HN 4.97 (#peak 769)
&rst
ixpk= 769, nxpk= 0, iat=3211,3228, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 213 LYS HB3 235 LYS QG 4.43 (#peak 1261)
&rst
ixpk= 1261, nxpk= 0, iat=3211, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2=3513,3514,
&end
#
# 213 LYS HG2 214 GLY HN 4.74 (#peak 761)
&rst
ixpk= 761, nxpk= 0, iat=3213,3228, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 213 LYS HG2 235 LYS QG 6.15 (#peak 2452)
&rst
ixpk= 2452, nxpk= 0, iat=3213, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=3513,3514,
&end
#
# 213 LYS HG3 213 LYS QE 3.63 (#peak 3781)
&rst
ixpk= 3781, nxpk= 0, iat=3214, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2=3219,3220,
&end
#
# 213 LYS HG3 214 GLY HN 5.13 (#peak 750)
&rst
ixpk= 750, nxpk= 0, iat=3214,3228, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 213 LYS QD 214 GLY HN 5.68 (#peak 753)
&rst
ixpk= 753, nxpk= 0, iat= -1,3228, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1=3216,3217,
&end
#
# 213 LYS QE 214 GLY HN 6.15 (#peak 3782)
&rst
ixpk= 3782, nxpk= 0, iat= -1,3228, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=3219,3220,
&end
#
# 214 GLY HN 215 SER HN 4.61 (#peak 757)
&rst
ixpk= 757, nxpk= 0, iat=3228,3235, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 214 GLY HN 234 VAL HA 5.62 (#peak 767)
&rst
ixpk= 767, nxpk= 0, iat=3228,3492, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 214 GLY HN 235 LYS HN 4.96 (#peak 1802)
&rst
ixpk= 1802, nxpk= 0, iat=3228,3506, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 214 GLY HN 235 LYS QG 6.15 (#peak 1253)
&rst
ixpk= 1253, nxpk= 0, iat=3228, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=3513,3514,
&end
#
# 214 GLY HA2 215 SER HN 3.40 (#peak 1336)
&rst
ixpk= 1336, nxpk= 0, iat=3230,3235, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 214 GLY HA2 234 VAL HA 6.15 (#peak 3278)
&rst
ixpk= 3278, nxpk= 0, iat=3230,3492, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 214 GLY HA2 234 VAL QG2 6.15 (#peak 2606)
&rst
ixpk= 2606, nxpk= 0, iat=3230, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3500,3501,3502,
&end
#
# 214 GLY HA2 235 LYS HN 4.63 (#peak 1804)
&rst
ixpk= 1804, nxpk= 0, iat=3230,3506, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 214 GLY HA3 234 VAL HA 6.15 (#peak 3392)
&rst
ixpk= 3392, nxpk= 0, iat=3231,3492, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 214 GLY HA3 235 LYS HN 5.16 (#peak 1807)
&rst
ixpk= 1807, nxpk= 0, iat=3231,3506, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 215 SER HN 215 SER HB2 4.10 (#peak 1333)
&rst
ixpk= 1333, nxpk= 0, iat=3235,3239, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 215 SER HN 216 TYR HN 4.61 (#peak 1334)
&rst
ixpk= 1334, nxpk= 0, iat=3235,3246, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 215 SER HN 233 GLU HN 4.49 (#peak 2152)
&rst
ixpk= 2152, nxpk= 0, iat=3235,3475, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 215 SER HN 233 GLU QB 4.72 (#peak 1331)
&rst
ixpk= 1331, nxpk= 0, iat=3235, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=3479,3480,
&end
#
# 215 SER HN 234 VAL HA 4.42 (#peak 1340)
&rst
ixpk= 1340, nxpk= 0, iat=3235,3492, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 215 SER HN 234 VAL HB 4.77 (#peak 1342)
&rst
ixpk= 1342, nxpk= 0, iat=3235,3494, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 215 SER HN 234 VAL QG2 6.11 (#peak 564)
&rst
ixpk= 564, nxpk= 0, iat=3235, -1, r1= 1.30, r2= 1.80, r3= 7.34, r4= 7.84,
igr2=3500,3501,3502,
&end
#
# 215 SER HN 235 LYS HN 5.33 (#peak 2885)
&rst
ixpk= 2885, nxpk= 0, iat=3235,3506, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 215 SER HB2 216 TYR HN 3.88 (#peak 857)
&rst
ixpk= 857, nxpk= 0, iat=3239,3246, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 215 SER HB3 216 TYR HN 4.29 (#peak 867)
&rst
ixpk= 867, nxpk= 0, iat=3240,3246, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 216 TYR HN 216 TYR QD 4.16 (#peak 869)
&rst
ixpk= 869, nxpk= 0, iat=3246, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2=3254,3263,
&end
#
# 216 TYR HN 217 SER HN 4.59 (#peak 2042)
&rst
ixpk= 2042, nxpk= 0, iat=3246,3267, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 216 TYR HN 232 ALA HA 5.35 (#peak 868)
&rst
ixpk= 868, nxpk= 0, iat=3246,3467, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 216 TYR HN 232 ALA QB 5.81 (#peak 3268)
&rst
ixpk= 3268, nxpk= 0, iat=3246, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr2=3469,3470,3471,
&end
#
# 216 TYR HA 232 ALA HA 6.15 (#peak 3748)
&rst
ixpk= 3748, nxpk= 0, iat=3248,3467, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 216 TYR HA 232 ALA QB 6.09 (#peak 3269)
&rst
ixpk= 3269, nxpk= 0, iat=3248, -1, r1= 1.30, r2= 1.80, r3= 7.31, r4= 7.81,
igr2=3469,3470,3471,
&end
#
# 216 TYR HA 233 GLU HN 4.08 (#peak 2151)
&rst
ixpk= 2151, nxpk= 0, iat=3248,3475, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 216 TYR HB2 217 SER HN 4.31 (#peak 2039)
&rst
ixpk= 2039, nxpk= 0, iat=3250,3267, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 216 TYR HB2 218 LEU QD2 6.15 (#peak 924)
&rst
ixpk= 924, nxpk= 0, iat=3250, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3291,3292,3293,
&end
#
# 216 TYR HB2 231 SER HN 6.15 (#peak 2573)
&rst
ixpk= 2573, nxpk= 0, iat=3250,3454, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 216 TYR HB2 232 ALA HA 6.15 (#peak 3745)
&rst
ixpk= 3745, nxpk= 0, iat=3250,3467, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 216 TYR HB2 233 GLU HN 6.15 (#peak 4213)
&rst
ixpk= 4213, nxpk= 0, iat=3250,3475, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 216 TYR HB3 217 SER HN 4.35 (#peak 2047)
&rst
ixpk= 2047, nxpk= 0, iat=3251,3267, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 216 TYR HB3 232 ALA HA 6.15 (#peak 3749)
&rst
ixpk= 3749, nxpk= 0, iat=3251,3467, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 216 TYR HB3 232 ALA QB 6.15 (#peak 3271)
&rst
ixpk= 3271, nxpk= 0, iat=3251, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3469,3470,3471,
&end
#
# 216 TYR HB3 233 GLU HN 6.15 (#peak 4214)
&rst
ixpk= 4214, nxpk= 0, iat=3251,3475, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 216 TYR HH 218 LEU QD2 4.29 (#peak 12100)
&rst
ixpk= 12100, nxpk= 0, iat=3259, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=3291,3292,3293,
&end
#
# 216 TYR QD 216 TYR HH 4.67 (#peak 12112)
&rst
ixpk= 12112, nxpk= 0, iat= -1,3259, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=3254,3263,
&end
#
# 216 TYR QD 217 SER HN 4.89 (#peak 2054)
&rst
ixpk= 2054, nxpk= 0, iat= -1,3267, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1=3254,3263,
&end
#
# 216 TYR QD 218 LEU HN 5.58 (#peak 1289)
&rst
ixpk= 1289, nxpk= 0, iat= -1,3278, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1=3254,3263,
&end
#
# 216 TYR QD 218 LEU QD2 3.92 (#peak 12105)
&rst
ixpk= 12105, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1=3254,3263,
igr2=3291,3292,3293,
&end
#
# 216 TYR QD 245 LEU QD2 3.87 (#peak 12617)
&rst
ixpk= 12617, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1=3254,3263,
igr2=3678,3679,3680,
&end
#
# 216 TYR QE 216 TYR HH 3.23 (#peak 12111)
&rst
ixpk= 12111, nxpk= 0, iat= -1,3259, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr1=3256,3261,
&end
#
# 216 TYR QE 218 LEU HN 5.87 (#peak 1281)
&rst
ixpk= 1281, nxpk= 0, iat= -1,3278, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=3256,3261,
&end
#
# 216 TYR QE 218 LEU QD1 6.15 (#peak 3500)
&rst
ixpk= 3500, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=3256,3261,
igr2=3287,3288,3289,
&end
#
# 217 SER HN 217 SER HB3 3.73 (#peak 2046)
&rst
ixpk= 2046, nxpk= 0, iat=3267,3272, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 217 SER HN 218 LEU HN 4.46 (#peak 2045)
&rst
ixpk= 2045, nxpk= 0, iat=3267,3278, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 217 SER HN 218 LEU QD1 6.15 (#peak 3509)
&rst
ixpk= 3509, nxpk= 0, iat=3267, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3287,3288,3289,
&end
#
# 217 SER HN 218 LEU QD2 6.15 (#peak 1098)
&rst
ixpk= 1098, nxpk= 0, iat=3267, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3291,3292,3293,
&end
#
# 217 SER HN 231 SER HN 4.33 (#peak 2584)
&rst
ixpk= 2584, nxpk= 0, iat=3267,3454, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 217 SER HN 231 SER HB2 5.73 (#peak 4674)
&rst
ixpk= 4674, nxpk= 0, iat=3267,3458, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 217 SER HN 231 SER HB3 5.56 (#peak 4675)
&rst
ixpk= 4675, nxpk= 0, iat=3267,3459, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06, &end
#
# 217 SER HN 232 ALA HA 6.15 (#peak 3750)
&rst
ixpk= 3750, nxpk= 0, iat=3267,3467, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 217 SER HN 232 ALA QB 4.00 (#peak 2048)
&rst
ixpk= 2048, nxpk= 0, iat=3267, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=3469,3470,3471,
&end
#
# 217 SER HN 233 GLU HN 4.83 (#peak 2153)
&rst
ixpk= 2153, nxpk= 0, iat=3267,3475, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 217 SER HN 245 LEU QD2 5.91 (#peak 2040)
&rst
ixpk= 2040, nxpk= 0, iat=3267, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr2=3678,3679,3680,
&end
#
# 217 SER HA 218 LEU QD1 4.96 (#peak 12104)
&rst
ixpk= 12104, nxpk= 0, iat=3269, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=3287,3288,3289,
&end
#
# 217 SER HB2 218 LEU HN 5.40 (#peak 1276)
&rst
ixpk= 1276, nxpk= 0, iat=3271,3278, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 217 SER HB2 231 SER HN 5.58 (#peak 2571)
&rst
ixpk= 2571, nxpk= 0, iat=3271,3454, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 217 SER HB3 218 LEU HN 5.08 (#peak 1282)
&rst
ixpk= 1282, nxpk= 0, iat=3272,3278, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 217 SER HB3 231 SER HN 5.44 (#peak 2581)
&rst
ixpk= 2581, nxpk= 0, iat=3272,3454, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 218 LEU HN 218 LEU HG 4.63 (#peak 1280)
&rst
ixpk= 1280, nxpk= 0, iat=3278,3285, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 218 LEU HN 218 LEU QD1 5.51 (#peak 1287)
&rst
ixpk= 1287, nxpk= 0, iat=3278, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr2=3287,3288,3289,
&end
#
# 218 LEU HN 218 LEU QD2 4.67 (#peak 1278)
&rst
ixpk= 1278, nxpk= 0, iat=3278, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=3291,3292,3293,
&end
#
# 218 LEU HN 219 GLY HN 4.88 (#peak 1593)
&rst
ixpk= 1593, nxpk= 0, iat=3278,3297, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 218 LEU HA 218 LEU QD1 6.15 (#peak 3508)
&rst
ixpk= 3508, nxpk= 0, iat=3280, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3287,3288,3289,
&end
#
# 218 LEU HA 218 LEU QD2 4.98 (#peak 2885)
&rst
ixpk= 2885, nxpk= 0, iat=3280, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=3291,3292,3293,
&end
#
# 218 LEU HA 229 ALA HN 6.15 (#peak 3080)
&rst
ixpk= 3080, nxpk= 0, iat=3280,3437, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 218 LEU HA 230 GLY HN 5.78 (#peak 1024)
&rst
ixpk= 1024, nxpk= 0, iat=3280,3447, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 218 LEU HA 230 GLY HA3 6.15 (#peak 4277)
&rst
ixpk= 4277, nxpk= 0, iat=3280,3450, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 218 LEU HA 231 SER HN 4.06 (#peak 2583)
&rst
ixpk= 2583, nxpk= 0, iat=3280,3454, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 218 LEU HB2 219 GLY HN 4.35 (#peak 1601)
&rst
ixpk= 1601, nxpk= 0, iat=3282,3297, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 218 LEU HB3 218 LEU QD1 3.66 (#peak 3507)
&rst
ixpk= 3507, nxpk= 0, iat=3283, -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr2=3287,3288,3289,
&end
#
# 218 LEU HB3 219 GLY HN 4.58 (#peak 1597)
&rst
ixpk= 1597, nxpk= 0, iat=3283,3297, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 218 LEU HB3 231 SER HN 5.35 (#peak 2582)
&rst
ixpk= 2582, nxpk= 0, iat=3283,3454, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 218 LEU HB3 245 LEU QD1 5.29 (#peak 3421)
&rst
ixpk= 3421, nxpk= 0, iat=3283, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=3674,3675,3676,
&end
#
# 218 LEU HG 219 GLY HN 5.54 (#peak 1590)
&rst
ixpk= 1590, nxpk= 0, iat=3285,3297, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 218 LEU HG 228 VAL QG1 6.15 (#peak 4301)
&rst
ixpk= 4301, nxpk= 0, iat=3285, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3427,3428,3429,
&end
#
# 218 LEU HG 228 VAL QG2 6.15 (#peak 4302)
&rst
ixpk= 4302, nxpk= 0, iat=3285, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3431,3432,3433,
&end
#
# 218 LEU HG 231 SER HN 5.33 (#peak 2577)
&rst
ixpk= 2577, nxpk= 0, iat=3285,3454, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 218 LEU HG 245 LEU QD1 5.75 (#peak 3417)
&rst
ixpk= 3417, nxpk= 0, iat=3285, -1, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr2=3674,3675,3676,
&end
#
# 218 LEU QD1 219 GLY HN 5.49 (#peak 1599)
&rst
ixpk= 1599, nxpk= 0, iat= -1,3297, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=3287,3288,3289,
&end
#
# 218 LEU QD1 228 VAL HB 6.15 (#peak 3493)
&rst
ixpk= 3493, nxpk= 0, iat= -1,3425, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3287,3288,3289,
&end
#
# 218 LEU QD1 228 VAL QG1 5.91 (#peak 3501)
&rst
ixpk= 3501, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.52, r4= 9.02,
igr1=3287,3288,3289,
igr2=3427,3428,3429,
&end
#
# 218 LEU QD1 228 VAL QG2 6.11 (#peak 3512)
&rst
ixpk= 3512, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.81, r4= 9.31,
igr1=3287,3288,3289,
igr2=3431,3432,3433,
&end
#
# 218 LEU QD1 229 ALA HN 5.16 (#peak 1471)
&rst
ixpk= 1471, nxpk= 0, iat= -1,3437, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=3287,3288,3289,
&end
#
# 218 LEU QD1 231 SER HN 6.15 (#peak 2586)
&rst
ixpk= 2586, nxpk= 0, iat= -1,3454, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3287,3288,3289,
&end
#
# 218 LEU QD1 245 LEU QD1 6.15 (#peak 3425)
&rst
ixpk= 3425, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=3287,3288,3289,
igr2=3674,3675,3676,
&end
#
# 218 LEU QD1 245 LEU QD2 6.15 (#peak 1015)
&rst
ixpk= 1015, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=3287,3288,3289,
igr2=3678,3679,3680,
&end
#
# 218 LEU QD2 219 GLY HN 4.85 (#peak 1589)
&rst
ixpk= 1589, nxpk= 0, iat= -1,3297, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1=3291,3292,3293,
&end
#
# 218 LEU QD2 230 GLY HN 5.23 (#peak 1018)
&rst
ixpk= 1018, nxpk= 0, iat= -1,3447, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1=3291,3292,3293,
&end
#
# 218 LEU QD2 230 GLY HA2 6.15 (#peak 1089)
&rst
ixpk= 1089, nxpk= 0, iat= -1,3449, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3291,3292,3293,
&end
#
# 218 LEU QD2 230 GLY HA3 6.15 (#peak 1826)
&rst
ixpk= 1826, nxpk= 0, iat= -1,3450, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3291,3292,3293,
&end
#
# 218 LEU QD2 231 SER HN 4.78 (#peak 2575)
&rst
ixpk= 2575, nxpk= 0, iat= -1,3454, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1=3291,3292,3293,
&end
#
# 218 LEU QD2 245 LEU HN 6.15 (#peak 1092)
&rst
ixpk= 1092, nxpk= 0, iat= -1,3665, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3291,3292,3293,
&end
#
# 218 LEU QD2 245 LEU QD1 5.06 (#peak 3415)
&rst
ixpk= 3415, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr1=3291,3292,3293,
igr2=3674,3675,3676,
&end
#
# 219 GLY HN 220 ILE HN 4.92 (#peak 1602)
&rst
ixpk= 1602, nxpk= 0, iat=3297,3304, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 219 GLY HN 229 ALA HN 4.80 (#peak 1468)
&rst
ixpk= 1468, nxpk= 0, iat=3297,3437, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 219 GLY HN 229 ALA QB 5.35 (#peak 1596)
&rst
ixpk= 1596, nxpk= 0, iat=3297, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2=3441,3442,3443,
&end
#
# 219 GLY HN 230 GLY HA2 4.79 (#peak 1587)
&rst
ixpk= 1587, nxpk= 0, iat=3297,3449, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 219 GLY HN 230 GLY HA3 5.14 (#peak 1592)
&rst
ixpk= 1592, nxpk= 0, iat=3297,3450, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 219 GLY HN 231 SER HN 6.05 (#peak 2830)
&rst
ixpk= 2830, nxpk= 0, iat=3297,3454, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 219 GLY HA2 220 ILE QD1 5.43 (#peak 539)
&rst
ixpk= 539, nxpk= 0, iat=3299, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2=3317,3318,3319,
&end
#
# 219 GLY HA3 220 ILE HA 6.15 (#peak 1817)
&rst
ixpk= 1817, nxpk= 0, iat=3300,3306, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 220 ILE HN 220 ILE HB 3.92 (#peak 2762)
&rst
ixpk= 2762, nxpk= 0, iat=3304,3308, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 220 ILE HN 220 ILE QD1 5.11 (#peak 2764)
&rst
ixpk= 2764, nxpk= 0, iat=3304, -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr2=3317,3318,3319,
&end
#
# 220 ILE HN 220 ILE QG2 4.28 (#peak 2763)
&rst
ixpk= 2763, nxpk= 0, iat=3304, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2=3310,3311,3312,
&end
#
# 220 ILE HA 227 GLU HN 6.15 (#peak 1761)
&rst
ixpk= 1761, nxpk= 0, iat=3306,3406, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 220 ILE HA 228 VAL HA 6.15 (#peak 2258)
&rst
ixpk= 2258, nxpk= 0, iat=3306,3423, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 220 ILE HA 228 VAL QG1 6.15 (#peak 2256)
&rst
ixpk= 2256, nxpk= 0, iat=3306, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3427,3428,3429,
&end
#
# 220 ILE HA 228 VAL QG2 6.15 (#peak 3660)
&rst
ixpk= 3660, nxpk= 0, iat=3306, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3431,3432,3433,
&end
#
# 220 ILE HA 229 ALA HN 5.21 (#peak 1467)
&rst
ixpk= 1467, nxpk= 0, iat=3306,3437, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 220 ILE HB 221 PHE HN 5.00 (#peak 247)
&rst
ixpk= 247, nxpk= 0, iat=3308,3323, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 220 ILE QD1 221 PHE HN 4.75 (#peak 243)
&rst
ixpk= 243, nxpk= 0, iat= -1,3323, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=3317,3318,3319,
&end
#
# 220 ILE QD1 225 ALA HN 6.15 (#peak 20)
&rst
ixpk= 20, nxpk= 0, iat= -1,3379, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3317,3318,3319,
&end
#
# 220 ILE QD1 225 ALA QB 5.26 (#peak 2700)
&rst
ixpk= 2700, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.59, r4= 8.09,
igr1=3317,3318,3319,
igr2=3383,3384,3385,
&end
#
# 220 ILE QD1 227 GLU HN 6.15 (#peak 2705)
&rst
ixpk= 2705, nxpk= 0, iat= -1,3406, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3317,3318,3319,
&end
#
# 220 ILE QD1 228 VAL QG1 6.15 (#peak 2703)
&rst
ixpk= 2703, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=3317,3318,3319,
igr2=3427,3428,3429,
&end
#
# 220 ILE QG1 221 PHE HN 6.15 (#peak 3221)
&rst
ixpk= 3221, nxpk= 0, iat= -1,3323, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=3314,3315,
&end
#
# 220 ILE QG2 221 PHE HN 4.71 (#peak 3223)
&rst
ixpk= 3223, nxpk= 0, iat= -1,3323, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1=3310,3311,3312,
&end
#
# 220 ILE QG2 222 GLY HA2 6.15 (#peak 1609)
&rst
ixpk= 1609, nxpk= 0, iat= -1,3345, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3310,3311,3312,
&end
#
# 220 ILE QG2 225 ALA HN 4.68 (#peak 18)
&rst
ixpk= 18, nxpk= 0, iat= -1,3379, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1=3310,3311,3312,
&end
#
# 220 ILE QG2 225 ALA HA 6.15 (#peak 1719)
&rst
ixpk= 1719, nxpk= 0, iat= -1,3381, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3310,3311,3312,
&end
#
# 220 ILE QG2 225 ALA QB 6.06 (#peak 1611)
&rst
ixpk= 1611, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.74, r4= 9.24,
igr1=3310,3311,3312,
igr2=3383,3384,3385,
&end
#
# 220 ILE QG2 227 GLU HN 5.11 (#peak 1756)
&rst
ixpk= 1756, nxpk= 0, iat= -1,3406, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1=3310,3311,3312,
&end
#
# 220 ILE QG2 228 VAL QG1 6.05 (#peak 1736)
&rst
ixpk= 1736, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
igr1=3310,3311,3312,
igr2=3427,3428,3429,
&end
#
# 221 PHE HN 221 PHE QD 4.45 (#peak 246)
&rst
ixpk= 246, nxpk= 0, iat=3323, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr2=3331,3339,
&end
#
# 221 PHE HN 222 GLY HN 4.99 (#peak 1812)
&rst
ixpk= 1812, nxpk= 0, iat=3323,3343, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 221 PHE HN 225 ALA QB 6.15 (#peak 647)
&rst
ixpk= 647, nxpk= 0, iat=3323, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3383,3384,3385,
&end
#
# 221 PHE HN 227 GLU HN 5.05 (#peak 244)
&rst
ixpk= 244, nxpk= 0, iat=3323,3406, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 221 PHE HN 228 VAL HA 5.42 (#peak 240)
&rst
ixpk= 240, nxpk= 0, iat=3323,3423, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 221 PHE HN 228 VAL QG1 6.15 (#peak 1734)
&rst
ixpk= 1734, nxpk= 0, iat=3323, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3427,3428,3429,
&end
#
# 221 PHE HB2 222 GLY HN 5.60 (#peak 1811)
&rst
ixpk= 1811, nxpk= 0, iat=3327,3343, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 221 PHE HB2 227 GLU HN 6.15 (#peak 355)
&rst
ixpk= 355, nxpk= 0, iat=3327,3406, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 221 PHE HB2 228 VAL HA 6.15 (#peak 1952)
&rst
ixpk= 1952, nxpk= 0, iat=3327,3423, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 221 PHE HB3 222 GLY HN 4.94 (#peak 1815)
&rst
ixpk= 1815, nxpk= 0, iat=3328,3343, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 221 PHE HB3 227 GLU HN 4.59 (#peak 1758)
&rst
ixpk= 1758, nxpk= 0, iat=3328,3406, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 221 PHE QD 222 GLY HN 5.36 (#peak 1818)
&rst
ixpk= 1818, nxpk= 0, iat= -1,3343, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1=3331,3339,
&end
#
# 221 PHE QD 227 GLU HN 5.49 (#peak 4112)
&rst
ixpk= 4112, nxpk= 0, iat= -1,3406, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr1=3331,3339,
&end
#
# 221 PHE QD 227 GLU QG 6.15 (#peak 2916)
&rst
ixpk= 2916, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.75, r4= 8.25,
igr1=3331,3339,
igr2=3413,3414,
&end
#
# 221 PHE QD 228 VAL HN 5.72 (#peak 3908)
&rst
ixpk= 3908, nxpk= 0, iat= -1,3421, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr1=3331,3339,
&end
#
# 221 PHE QD 229 ALA HN 4.71 (#peak 11288)
&rst
ixpk= 11288, nxpk= 0, iat= -1,3437, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr1=3331,3339,
&end
#
# 221 PHE QD 229 ALA QB 4.31 (#peak 4338)
&rst
ixpk= 4338, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1=3331,3339,
igr2=3441,3442,3443,
&end
#
# 221 PHE QE 229 ALA HN 5.35 (#peak 4115)
&rst
ixpk= 4115, nxpk= 0, iat= -1,3437, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1=3333,3337,
&end
#
# 221 PHE QE 229 ALA QB 3.97 (#peak 12802)
&rst
ixpk= 12802, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1=3333,3337,
igr2=3441,3442,3443,
&end
#
# 222 GLY HA2 224 LYS HN 5.00 (#peak 3394)
&rst
ixpk= 3394, nxpk= 0, iat=3345,3357, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 222 GLY HA2 227 GLU HN 6.15 (#peak 3220)
&rst
ixpk= 3220, nxpk= 0, iat=3345,3406, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 222 GLY HA3 227 GLU HN 5.81 (#peak 3224)
&rst
ixpk= 3224, nxpk= 0, iat=3346,3406, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 224 LYS HN 224 LYS HB3 3.59 (#peak 189)
&rst
ixpk= 189, nxpk= 0, iat=3357,3362, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 224 LYS HN 225 ALA HN 3.67 (#peak 188)
&rst
ixpk= 188, nxpk= 0, iat=3357,3379, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 224 LYS HN 225 ALA HA 6.15 (#peak 1715)
&rst
ixpk= 1715, nxpk= 0, iat=3357,3381, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 224 LYS HN 226 GLN HN 4.81 (#peak 973)
&rst
ixpk= 973, nxpk= 0, iat=3357,3389, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 224 LYS HA 225 ALA QB 6.15 (#peak 4607)
&rst
ixpk= 4607, nxpk= 0, iat=3359, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3383,3384,3385,
&end
#
# 224 LYS HA 226 GLN HN 5.89 (#peak 983)
&rst
ixpk= 983, nxpk= 0, iat=3359,3389, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 224 LYS HB2 225 ALA HN 4.28 (#peak 16)
&rst
ixpk= 16, nxpk= 0, iat=3361,3379, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 224 LYS HB3 225 ALA HN 4.52 (#peak 15)
&rst
ixpk= 15, nxpk= 0, iat=3362,3379, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 224 LYS HB3 226 GLN HN 5.95 (#peak 976)
&rst
ixpk= 976, nxpk= 0, iat=3362,3389, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 225 ALA HN 225 ALA QB 3.72 (#peak 14)
&rst
ixpk= 14, nxpk= 0, iat=3379, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2=3383,3384,3385,
&end
#
# 225 ALA HN 226 GLN HN 4.35 (#peak 17)
&rst
ixpk= 17, nxpk= 0, iat=3379,3389, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 225 ALA HN 227 GLU HN 6.15 (#peak 1748)
&rst
ixpk= 1748, nxpk= 0, iat=3379,3406, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 225 ALA HA 227 GLU HN 5.63 (#peak 1757)
&rst
ixpk= 1757, nxpk= 0, iat=3381,3406, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 225 ALA QB 226 GLN HN 4.46 (#peak 975)
&rst
ixpk= 975, nxpk= 0, iat= -1,3389, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr1=3383,3384,3385,
&end
#
# 225 ALA QB 226 GLN HA 6.15 (#peak 3632)
&rst
ixpk= 3632, nxpk= 0, iat= -1,3391, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3383,3384,3385,
&end
#
# 225 ALA QB 227 GLU HN 5.22 (#peak 1752)
&rst
ixpk= 1752, nxpk= 0, iat= -1,3406, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1=3383,3384,3385,
&end
#
# 226 GLN HN 226 GLN QG 4.06 (#peak 979)
&rst
ixpk= 979, nxpk= 0, iat=3389, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=3396,3397,
&end
#
# 226 GLN HN 227 GLU HN 4.32 (#peak 1755)
&rst
ixpk= 1755, nxpk= 0, iat=3389,3406, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 226 GLN QB 227 GLU HN 3.74 (#peak 1750)
&rst
ixpk= 1750, nxpk= 0, iat= -1,3406, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1=3393,3394,
&end
#
# 226 GLN QG 227 GLU HN 4.14 (#peak 1759)
&rst
ixpk= 1759, nxpk= 0, iat= -1,3406, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1=3396,3397,
&end
#
# 227 GLU HN 227 GLU QG 5.51 (#peak 1763)
&rst
ixpk= 1763, nxpk= 0, iat=3406, -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr2=3413,3414,
&end
#
# 227 GLU HN 228 VAL HN 4.74 (#peak 1753)
&rst
ixpk= 1753, nxpk= 0, iat=3406,3421, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 227 GLU HN 228 VAL QG2 6.15 (#peak 3662)
&rst
ixpk= 3662, nxpk= 0, iat=3406, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3431,3432,3433,
&end
#
# 227 GLU HA 248 LYS HA 3.83 (#peak 12266)
&rst
ixpk= 12266, nxpk= 0, iat=3408,3706, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 227 GLU QB 228 VAL HN 6.15 (#peak 3263)
&rst
ixpk= 3263, nxpk= 0, iat= -1,3421, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=3410,3411,
&end
#
# 227 GLU QG 228 VAL HN 5.46 (#peak 3262)
&rst
ixpk= 3262, nxpk= 0, iat= -1,3421, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1=3413,3414,
&end
#
# 227 GLU QG 229 ALA HN 6.15 (#peak 1470)
&rst
ixpk= 1470, nxpk= 0, iat= -1,3437, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=3413,3414,
&end
#
# 227 GLU QG 229 ALA QB 6.15 (#peak 2914)
&rst
ixpk= 2914, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=3413,3414,
igr2=3441,3442,3443,
&end
#
# 228 VAL HN 228 VAL QG1 5.42 (#peak 722)
&rst
ixpk= 722, nxpk= 0, iat=3421, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr2=3427,3428,3429,
&end
#
# 228 VAL HN 228 VAL QG2 6.14 (#peak 726)
&rst
ixpk= 726, nxpk= 0, iat=3421, -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr2=3431,3432,3433,
&end
#
# 228 VAL HN 229 ALA QB 6.15 (#peak 2370)
&rst
ixpk= 2370, nxpk= 0, iat=3421, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3441,3442,3443,
&end
#
# 228 VAL HN 247 ALA HN 4.74 (#peak 720)
&rst
ixpk= 720, nxpk= 0, iat=3421,3694, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 228 VAL HN 247 ALA QB 5.09 (#peak 723)
&rst
ixpk= 723, nxpk= 0, iat=3421, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2=3698,3699,3700,
&end
#
# 228 VAL HN 248 LYS HA 5.05 (#peak 727)
&rst
ixpk= 727, nxpk= 0, iat=3421,3706, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 228 VAL HN 248 LYS HB2 5.09 (#peak 4226)
&rst
ixpk= 4226, nxpk= 0, iat=3421,3708, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 228 VAL HN 248 LYS HB3 5.89 (#peak 4225)
&rst
ixpk= 4225, nxpk= 0, iat=3421,3709, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 228 VAL HB 229 ALA HN 4.53 (#peak 1463)
&rst
ixpk= 1463, nxpk= 0, iat=3425,3437, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 228 VAL HB 247 ALA QB 5.05 (#peak 1892)
&rst
ixpk= 1892, nxpk= 0, iat=3425, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=3698,3699,3700,
&end
#
# 228 VAL QG1 229 ALA HN 5.17 (#peak 4114)
&rst
ixpk= 4114, nxpk= 0, iat= -1,3437, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1=3427,3428,3429,
&end
#
# 228 VAL QG1 247 ALA QB 6.15 (#peak 4300)
&rst
ixpk= 4300, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1=3427,3428,3429,
igr2=3698,3699,3700,
&end
#
# 228 VAL QG2 229 ALA HN 5.83 (#peak 2832)
&rst
ixpk= 2832, nxpk= 0, iat= -1,3437, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1=3431,3432,3433,
&end
#
# 228 VAL QG2 247 ALA HN 4.33 (#peak 591)
&rst
ixpk= 591, nxpk= 0, iat= -1,3694, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=3431,3432,3433,
&end
#
# 228 VAL QG2 247 ALA QB 5.65 (#peak 3658)
&rst
ixpk= 3658, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.15, r4= 8.65,
igr1=3431,3432,3433,
igr2=3698,3699,3700,
&end
#
# 228 VAL QG2 249 GLN HN 5.16 (#peak 234)
&rst
ixpk= 234, nxpk= 0, iat= -1,3726, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=3431,3432,3433,
&end
#
# 229 ALA HN 230 GLY HN 5.10 (#peak 1464)
&rst
ixpk= 1464, nxpk= 0, iat=3437,3447, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 229 ALA HA 246 ALA HA 6.15 (#peak 4263)
&rst
ixpk= 4263, nxpk= 0, iat=3439,3686, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 229 ALA HA 246 ALA QB 6.15 (#peak 809)
&rst
ixpk= 809, nxpk= 0, iat=3439, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3688,3689,3690,
&end
#
# 229 ALA HA 247 ALA HN 4.61 (#peak 585)
&rst
ixpk= 585, nxpk= 0, iat=3439,3694, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 229 ALA QB 230 GLY HN 3.66 (#peak 1022)
&rst
ixpk= 1022, nxpk= 0, iat= -1,3447, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr1=3441,3442,3443,
&end
#
# 230 GLY HN 231 SER HN 4.31 (#peak 2578)
&rst
ixpk= 2578, nxpk= 0, iat=3447,3454, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 230 GLY HN 245 LEU HN 4.48 (#peak 710)
&rst
ixpk= 710, nxpk= 0, iat=3447,3665, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 230 GLY HN 245 LEU HB2 3.91 (#peak 1014)
&rst
ixpk= 1014, nxpk= 0, iat=3447,3669, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 230 GLY HN 245 LEU QD1 5.50 (#peak 1025)
&rst
ixpk= 1025, nxpk= 0, iat=3447, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=3674,3675,3676,
&end
#
# 230 GLY HN 246 ALA HA 5.68 (#peak 1013)
&rst
ixpk= 1013, nxpk= 0, iat=3447,3686, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 230 GLY HN 246 ALA QB 6.15 (#peak 2481)
&rst
ixpk= 2481, nxpk= 0, iat=3447, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3688,3689,3690,
&end
#
# 230 GLY HN 247 ALA HN 5.94 (#peak 1016)
&rst
ixpk= 1016, nxpk= 0, iat=3447,3694, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 230 GLY HA2 245 LEU HB2 6.15 (#peak 59)
&rst
ixpk= 59, nxpk= 0, iat=3449,3669, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 230 GLY HA3 245 LEU HB2 6.15 (#peak 1825)
&rst
ixpk= 1825, nxpk= 0, iat=3450,3669, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 231 SER HN 232 ALA HN 5.37 (#peak 148)
&rst
ixpk= 148, nxpk= 0, iat=3454,3465, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 231 SER HN 245 LEU HN 5.29 (#peak 2576)
&rst
ixpk= 2576, nxpk= 0, iat=3454,3665, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 231 SER HN 245 LEU HB2 4.39 (#peak 2572)
&rst
ixpk= 2572, nxpk= 0, iat=3454,3669, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 231 SER HN 245 LEU QD1 5.27 (#peak 2585)
&rst
ixpk= 2585, nxpk= 0, iat=3454, -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr2=3674,3675,3676,
&end
#
# 231 SER HN 245 LEU QD2 4.42 (#peak 3327)
&rst
ixpk= 3327, nxpk= 0, iat=3454, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=3678,3679,3680,
&end
#
# 231 SER HA 245 LEU HN 4.89 (#peak 712)
&rst
ixpk= 712, nxpk= 0, iat=3456,3665, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 231 SER HA 245 LEU QD2 6.15 (#peak 1834)
&rst
ixpk= 1834, nxpk= 0, iat=3456, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3678,3679,3680,
&end
#
# 231 SER HB2 232 ALA HN 4.28 (#peak 146)
&rst
ixpk= 146, nxpk= 0, iat=3458,3465, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 231 SER HB3 232 ALA HN 6.15 (#peak 1348)
&rst
ixpk= 1348, nxpk= 0, iat=3459,3465, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 231 SER HB3 245 LEU HN 5.02 (#peak 709)
&rst
ixpk= 709, nxpk= 0, iat=3459,3665, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 232 ALA HN 243 ILE HN 4.47 (#peak 170)
&rst
ixpk= 170, nxpk= 0, iat=3465,3639, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 232 ALA HN 243 ILE HB 4.31 (#peak 139)
&rst
ixpk= 139, nxpk= 0, iat=3465,3643, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 232 ALA HN 243 ILE HG12 6.15 (#peak 3571)
&rst
ixpk= 3571, nxpk= 0, iat=3465,3649, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 232 ALA HN 243 ILE HG13 5.65 (#peak 136)
&rst
ixpk= 136, nxpk= 0, iat=3465,3650, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 232 ALA HN 243 ILE QD1 6.15 (#peak 2578)
&rst
ixpk= 2578, nxpk= 0, iat=3465, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3652,3653,3654,
&end
#
# 232 ALA HN 244 GLY HA2 4.58 (#peak 141)
&rst
ixpk= 141, nxpk= 0, iat=3465,3660, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 232 ALA HN 245 LEU HN 5.27 (#peak 135)
&rst
ixpk= 135, nxpk= 0, iat=3465,3665, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 232 ALA HN 245 LEU QD1 5.27 (#peak 143)
&rst
ixpk= 143, nxpk= 0, iat=3465, -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr2=3674,3675,3676,
&end
#
# 232 ALA HN 245 LEU QD2 4.14 (#peak 134)
&rst
ixpk= 134, nxpk= 0, iat=3465, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2=3678,3679,3680,
&end
#
# 232 ALA HA 233 GLU QB 6.15 (#peak 3744)
&rst
ixpk= 3744, nxpk= 0, iat=3467, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=3479,3480,
&end
#
# 232 ALA HA 245 LEU QD1 6.15 (#peak 3753)
&rst
ixpk= 3753, nxpk= 0, iat=3467, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3674,3675,3676,
&end
#
# 232 ALA QB 233 GLU HN 3.83 (#peak 2154)
&rst
ixpk= 2154, nxpk= 0, iat= -1,3475, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1=3469,3470,3471,
&end
#
# 232 ALA QB 243 ILE HN 4.34 (#peak 178)
&rst
ixpk= 178, nxpk= 0, iat= -1,3639, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1=3469,3470,3471,
&end
#
# 232 ALA QB 245 LEU QD1 4.77 (#peak 3274)
&rst
ixpk= 3274, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr1=3469,3470,3471,
igr2=3674,3675,3676,
&end
#
# 233 GLU HN 233 GLU QB 3.61 (#peak 2148)
&rst
ixpk= 2148, nxpk= 0, iat=3475, -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr2=3479,3480,
&end
#
# 233 GLU HN 234 VAL HN 4.57 (#peak 877)
&rst
ixpk= 877, nxpk= 0, iat=3475,3490, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 233 GLU HA 234 VAL HN 3.57 (#peak 873)
&rst
ixpk= 873, nxpk= 0, iat=3477,3490, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 233 GLU HA 243 ILE HN 5.01 (#peak 173)
&rst
ixpk= 173, nxpk= 0, iat=3477,3639, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 233 GLU HG3 234 VAL HN 5.51 (#peak 876)
&rst
ixpk= 876, nxpk= 0, iat=3483,3490, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 233 GLU HG3 242 HIS HD2 5.65 (#peak 12654)
&rst
ixpk= 12654, nxpk= 0, iat=3483,3635, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 233 GLU HG3 242 HIS HE1 4.54 (#peak 12651)
&rst
ixpk= 12651, nxpk= 0, iat=3483,3632, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 233 GLU QB 234 VAL HN 4.32 (#peak 871)
&rst
ixpk= 871, nxpk= 0, iat= -1,3490, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1=3479,3480,
&end
#
# 233 GLU QB 242 HIS HA 6.15 (#peak 3882)
&rst
ixpk= 3882, nxpk= 0, iat= -1,3624, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=3479,3480,
&end
#
# 233 GLU QB 242 HIS HD2 4.43 (#peak 12653)
&rst
ixpk= 12653, nxpk= 0, iat= -1,3635, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1=3479,3480,
&end
#
# 233 GLU QB 242 HIS HE1 4.30 (#peak 12652)
&rst
ixpk= 12652, nxpk= 0, iat= -1,3632, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1=3479,3480,
&end
#
# 233 GLU QB 242 HIS QB 6.15 (#peak 874)
&rst
ixpk= 874, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.75, r4= 8.25,
igr1=3479,3480,
igr2=3626,3627,
&end
#
# 234 VAL HN 234 VAL QG2 4.09 (#peak 870)
&rst
ixpk= 870, nxpk= 0, iat=3490, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=3500,3501,3502,
&end
#
# 234 VAL HN 240 ILE QD1 4.58 (#peak 4202)
&rst
ixpk= 4202, nxpk= 0, iat=3490, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=3592,3593,3594,
&end
#
# 234 VAL HN 240 ILE QG2 5.45 (#peak 878)
&rst
ixpk= 878, nxpk= 0, iat=3490, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr2=3585,3586,3587,
&end
#
# 234 VAL HN 241 ARG HN 5.52 (#peak 874)
&rst
ixpk= 874, nxpk= 0, iat=3490,3598, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 234 VAL HN 241 ARG QB 5.95 (#peak 4176)
&rst
ixpk= 4176, nxpk= 0, iat=3490, -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr2=3602,3603,
&end
#
# 234 VAL HN 242 HIS HA 4.17 (#peak 4212)
&rst
ixpk= 4212, nxpk= 0, iat=3490,3624, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 234 VAL HN 242 HIS HD2 6.15 (#peak 4478)
&rst
ixpk= 4478, nxpk= 0, iat=3490,3635, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 234 VAL HA 235 LYS HA 6.15 (#peak 3276)
&rst
ixpk= 3276, nxpk= 0, iat=3492,3508, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 234 VAL HA 235 LYS HB2 6.15 (#peak 3650)
&rst
ixpk= 3650, nxpk= 0, iat=3492,3510, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 234 VAL HB 235 LYS HN 5.61 (#peak 1810)
&rst
ixpk= 1810, nxpk= 0, iat=3494,3506, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 234 VAL QG2 235 LYS HN 3.61 (#peak 1800)
&rst
ixpk= 1800, nxpk= 0, iat= -1,3506, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1=3500,3501,3502,
&end
#
# 234 VAL QG2 235 LYS HA 6.01 (#peak 563)
&rst
ixpk= 563, nxpk= 0, iat= -1,3508, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
igr1=3500,3501,3502,
&end
#
# 234 VAL QG2 235 LYS HB2 6.15 (#peak 3645)
&rst
ixpk= 3645, nxpk= 0, iat= -1,3510, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3500,3501,3502,
&end
#
# 234 VAL QG2 236 THR HN 4.65 (#peak 1769)
&rst
ixpk= 1769, nxpk= 0, iat= -1,3528, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=3500,3501,3502,
&end
#
# 235 LYS HN 235 LYS QG 4.09 (#peak 1803)
&rst
ixpk= 1803, nxpk= 0, iat=3506, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2=3513,3514,
&end
#
# 235 LYS HN 236 THR HN 4.49 (#peak 1778)
&rst
ixpk= 1778, nxpk= 0, iat=3506,3528, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 235 LYS HN 240 ILE QD1 4.05 (#peak 4732)
&rst
ixpk= 4732, nxpk= 0, iat=3506, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2=3592,3593,3594,
&end
#
# 235 LYS HA 235 LYS QE 6.15 (#peak 2215)
&rst
ixpk= 2215, nxpk= 0, iat=3508, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=3519,3520,
&end
#
# 235 LYS HA 236 THR HN 3.54 (#peak 1770)
&rst
ixpk= 1770, nxpk= 0, iat=3508,3528, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 235 LYS HA 239 GLY HN 6.15 (#peak 880)
&rst
ixpk= 880, nxpk= 0, iat=3508,3572, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 235 LYS HA 240 ILE HA 6.15 (#peak 1942)
&rst
ixpk= 1942, nxpk= 0, iat=3508,3581, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 235 LYS HA 240 ILE QD1 6.15 (#peak 998)
&rst
ixpk= 998, nxpk= 0, iat=3508, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3592,3593,3594,
&end
#
# 235 LYS HA 240 ILE QG2 6.15 (#peak 3406)
&rst
ixpk= 3406, nxpk= 0, iat=3508, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3585,3586,3587,
&end
#
# 235 LYS HA 241 ARG HN 5.96 (#peak 1003)
&rst
ixpk= 1003, nxpk= 0, iat=3508,3598, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 235 LYS HB2 236 THR HN 5.37 (#peak 1781)
&rst
ixpk= 1781, nxpk= 0, iat=3510,3528, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 235 LYS HB2 239 GLY HN 6.15 (#peak 274)
&rst
ixpk= 274, nxpk= 0, iat=3510,3572, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 235 LYS HB3 236 THR HN 5.65 (#peak 1774)
&rst
ixpk= 1774, nxpk= 0, iat=3511,3528, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 235 LYS HB3 239 GLY HN 6.15 (#peak 265)
&rst
ixpk= 265, nxpk= 0, iat=3511,3572, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 235 LYS HB3 239 GLY HA3 6.15 (#peak 3188)
&rst
ixpk= 3188, nxpk= 0, iat=3511,3575, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 235 LYS QE 240 ILE QD1 3.61 (#peak 4412)
&rst
ixpk= 4412, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1=3519,3520,
igr2=3592,3593,3594,
&end
#
# 235 LYS QE 240 ILE QG2 6.11 (#peak 2216)
&rst
ixpk= 2216, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.24, r4= 8.74,
igr1=3519,3520,
igr2=3585,3586,3587,
&end
#
# 235 LYS QG 236 THR HN 4.66 (#peak 1772)
&rst
ixpk= 1772, nxpk= 0, iat= -1,3528, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr1=3513,3514,
&end
#
# 236 THR HN 238 ASN HN 4.59 (#peak 2114)
&rst
ixpk= 2114, nxpk= 0, iat=3528,3558, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 236 THR HN 239 GLY HN 3.93 (#peak 2809)
&rst
ixpk= 2809, nxpk= 0, iat=3528,3572, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 236 THR HN 240 ILE HN 5.27 (#peak 1671)
&rst
ixpk= 1671, nxpk= 0, iat=3528,3579, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 236 THR HN 240 ILE HA 6.15 (#peak 1946)
&rst
ixpk= 1946, nxpk= 0, iat=3528,3581, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 236 THR HN 240 ILE HG13 5.80 (#peak 1773)
&rst
ixpk= 1773, nxpk= 0, iat=3528,3590, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 236 THR HN 240 ILE QD1 5.11 (#peak 1771)
&rst
ixpk= 1771, nxpk= 0, iat=3528, -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr2=3592,3593,3594,
&end
#
# 236 THR HN 240 ILE QG2 5.59 (#peak 1780)
&rst
ixpk= 1780, nxpk= 0, iat=3528, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2=3585,3586,3587,
&end
#
# 236 THR HN 241 ARG HN 6.15 (#peak 2828)
&rst
ixpk= 2828, nxpk= 0, iat=3528,3598, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 236 THR HA 238 ASN HN 6.15 (#peak 2085)
&rst
ixpk= 2085, nxpk= 0, iat=3530,3558, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 236 THR HB 237 VAL HA 6.15 (#peak 672)
&rst
ixpk= 672, nxpk= 0, iat=3532,3544, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 236 THR HB 238 ASN HN 5.54 (#peak 2115)
&rst
ixpk= 2115, nxpk= 0, iat=3532,3558, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 236 THR HB 239 GLY HN 5.73 (#peak 4698)
&rst
ixpk= 4698, nxpk= 0, iat=3532,3572, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 236 THR QG2 239 GLY HN 4.57 (#peak 2807)
&rst
ixpk= 2807, nxpk= 0, iat= -1,3572, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1=3534,3535,3536,
&end
#
# 237 VAL HN 238 ASN HN 4.91 (#peak 2109)
&rst
ixpk= 2109, nxpk= 0, iat=3542,3558, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 237 VAL HA 239 GLY HN 4.70 (#peak 4727)
&rst
ixpk= 4727, nxpk= 0, iat=3544,3572, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 237 VAL HB 238 ASN HN 4.52 (#peak 2112)
&rst
ixpk= 2112, nxpk= 0, iat=3546,3558, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 237 VAL HB 238 ASN HD22 6.15 (#peak 2394)
&rst
ixpk= 2394, nxpk= 0, iat=3546,3568, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 237 VAL HB 239 GLY HN 5.90 (#peak 268)
&rst
ixpk= 268, nxpk= 0, iat=3546,3572, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40, &end
#
# 237 VAL QQG 238 ASN HN 3.72 (#peak 2102)
&rst
ixpk= 2102, nxpk= 0, iat= -1,3558, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=3548,3549,3550,3552,3553,3554,
&end
#
# 237 VAL QQG 238 ASN HA 6.15 (#peak 2560)
&rst
ixpk= 2560, nxpk= 0, iat= -1,3560, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=3548,3549,3550,3552,3553,3554,
&end
#
# 237 VAL QQG 238 ASN HB2 6.15 (#peak 2902)
&rst
ixpk= 2902, nxpk= 0, iat= -1,3562, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=3548,3549,3550,3552,3553,3554,
&end
#
# 237 VAL QQG 238 ASN HB3 6.15 (#peak 550)
&rst
ixpk= 550, nxpk= 0, iat= -1,3563, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1=3548,3549,3550,3552,3553,3554,
&end
#
# 237 VAL QQG 238 ASN HD21 3.42 (#peak 2032)
&rst
ixpk= 2032, nxpk= 0, iat= -1,3567, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1=3548,3549,3550,3552,3553,3554,
&end
#
# 237 VAL QQG 238 ASN HD22 4.77 (#peak 916)
&rst
ixpk= 916, nxpk= 0, iat= -1,3568, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr1=3548,3549,3550,3552,3553,3554,
&end
#
# 237 VAL QQG 239 GLY HN 4.58 (#peak 261)
&rst
ixpk= 261, nxpk= 0, iat= -1,3572, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=3548,3549,3550,3552,3553,3554,
&end
#
# 238 ASN HN 238 ASN HB2 3.91 (#peak 2116)
&rst
ixpk= 2116, nxpk= 0, iat=3558,3562, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 238 ASN HN 238 ASN HB3 3.84 (#peak 2105)
&rst
ixpk= 2105, nxpk= 0, iat=3558,3563, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 238 ASN HN 238 ASN HD21 3.49 (#peak 2037)
&rst
ixpk= 2037, nxpk= 0, iat=3558,3567, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 238 ASN HN 239 GLY HN 3.43 (#peak 273)
&rst
ixpk= 273, nxpk= 0, iat=3558,3572, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 238 ASN HA 238 ASN HD21 3.84 (#peak 2035)
&rst
ixpk= 2035, nxpk= 0, iat=3560,3567, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 238 ASN HA 238 ASN HD22 3.92 (#peak 919)
&rst
ixpk= 919, nxpk= 0, iat=3560,3568, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 238 ASN HB2 238 ASN HD21 3.64 (#peak 2036)
&rst
ixpk= 2036, nxpk= 0, iat=3562,3567, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 238 ASN HB2 238 ASN HD22 3.65 (#peak 920)
&rst
ixpk= 920, nxpk= 0, iat=3562,3568, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 238 ASN HB2 239 GLY HN 5.02 (#peak 271)
&rst
ixpk= 271, nxpk= 0, iat=3562,3572, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 238 ASN HB3 238 ASN HD21 3.73 (#peak 2033)
&rst
ixpk= 2033, nxpk= 0, iat=3563,3567, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 238 ASN HB3 238 ASN HD22 4.06 (#peak 917)
&rst
ixpk= 917, nxpk= 0, iat=3563,3568, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 238 ASN HB3 239 GLY HN 4.89 (#peak 263)
&rst
ixpk= 263, nxpk= 0, iat=3563,3572, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 239 GLY HN 240 ILE HN 5.19 (#peak 270)
&rst
ixpk= 270, nxpk= 0, iat=3572,3579, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 239 GLY HN 240 ILE QG2 6.14 (#peak 4481)
&rst
ixpk= 4481, nxpk= 0, iat=3572, -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr2=3585,3586,3587,
&end
#
# 239 GLY HA3 240 ILE HB 6.15 (#peak 3187)
&rst
ixpk= 3187, nxpk= 0, iat=3575,3583, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 240 ILE HN 240 ILE HG12 5.49 (#peak 2741)
&rst
ixpk= 2741, nxpk= 0, iat=3579,3589, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 240 ILE HN 240 ILE HG13 5.27 (#peak 2810)
&rst
ixpk= 2810, nxpk= 0, iat=3579,3590, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 240 ILE HN 240 ILE QD1 4.56 (#peak 3390)
&rst
ixpk= 3390, nxpk= 0, iat=3579, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2=3592,3593,3594,
&end
#
# 240 ILE HN 240 ILE QG2 4.00 (#peak 1673)
&rst
ixpk= 1673, nxpk= 0, iat=3579, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=3585,3586,3587,
&end
#
# 240 ILE HN 241 ARG HN 5.18 (#peak 1670)
&rst
ixpk= 1670, nxpk= 0, iat=3579,3598, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 240 ILE HA 240 ILE QD1 5.28 (#peak 1943)
&rst
ixpk= 1943, nxpk= 0, iat=3581, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2=3592,3593,3594,
&end
#
# 240 ILE HB 241 ARG HN 4.18 (#peak 1002)
&rst
ixpk= 1002, nxpk= 0, iat=3583,3598, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 240 ILE HG12 241 ARG HN 5.08 (#peak 1011)
&rst
ixpk= 1011, nxpk= 0, iat=3589,3598, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 240 ILE HG12 242 HIS HD2 4.53 (#peak 12844)
&rst
ixpk= 12844, nxpk= 0, iat=3589,3635, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 240 ILE HG13 241 ARG HN 4.96 (#peak 1006)
&rst
ixpk= 1006, nxpk= 0, iat=3590,3598, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 240 ILE QD1 241 ARG HN 5.40 (#peak 1004)
&rst
ixpk= 1004, nxpk= 0, iat= -1,3598, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1=3592,3593,3594,
&end
#
# 240 ILE QD1 242 HIS HD2 5.22 (#peak 12696)
&rst
ixpk= 12696, nxpk= 0, iat= -1,3635, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1=3592,3593,3594,
&end
#
# 240 ILE QG2 241 ARG HN 3.95 (#peak 1010)
&rst
ixpk= 1010, nxpk= 0, iat= -1,3598, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1=3585,3586,3587,
&end
#
# 240 ILE QG2 242 HIS HN 6.15 (#peak 3410)
&rst
ixpk= 3410, nxpk= 0, iat= -1,3622, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3585,3586,3587,
&end
#
# 240 ILE QG2 242 HIS HA 6.15 (#peak 3888)
&rst
ixpk= 3888, nxpk= 0, iat= -1,3624, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3585,3586,3587,
&end
#
# 240 ILE QG2 242 HIS HD2 3.55 (#peak 12697)
&rst
ixpk= 12697, nxpk= 0, iat= -1,3635, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr1=3585,3586,3587,
&end
#
# 241 ARG HN 241 ARG QD 5.21 (#peak 1012)
&rst
ixpk= 1012, nxpk= 0, iat=3598, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=3608,3609,
&end
#
# 241 ARG HN 242 HIS HN 5.11 (#peak 1519)
&rst
ixpk= 1519, nxpk= 0, iat=3598,3622, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 241 ARG HA 241 ARG QD 6.15 (#peak 4176)
&rst
ixpk= 4176, nxpk= 0, iat=3600, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=3608,3609,
&end
#
# 241 ARG QB 242 HIS HN 4.49 (#peak 3205)
&rst
ixpk= 3205, nxpk= 0, iat= -1,3622, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=3602,3603,
&end
#
# 241 ARG QD 242 HIS HN 4.87 (#peak 1524)
&rst
ixpk= 1524, nxpk= 0, iat= -1,3622, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1=3608,3609,
&end
#
# 241 ARG QG 242 HIS HN 4.75 (#peak 3206)
&rst
ixpk= 3206, nxpk= 0, iat= -1,3622, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1=3605,3606,
&end
#
# 242 HIS HN 242 HIS HD2 6.15 (#peak 4048)
&rst
ixpk= 4048, nxpk= 0, iat=3622,3635, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 242 HIS HN 243 ILE HN 4.95 (#peak 1517)
&rst
ixpk= 1517, nxpk= 0, iat=3622,3639, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 242 HIS HN 243 ILE HG12 6.15 (#peak 3575)
&rst
ixpk= 3575, nxpk= 0, iat=3622,3649, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 242 HIS HN 243 ILE HG13 6.15 (#peak 1178)
&rst
ixpk= 1178, nxpk= 0, iat=3622,3650, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 242 HIS HA 243 ILE HB 6.15 (#peak 3885)
&rst
ixpk= 3885, nxpk= 0, iat=3624,3643, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 242 HIS HA 243 ILE HG13 6.15 (#peak 3883)
&rst
ixpk= 3883, nxpk= 0, iat=3624,3650, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 242 HIS HA 243 ILE QD1 6.15 (#peak 3887)
&rst
ixpk= 3887, nxpk= 0, iat=3624, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3652,3653,3654,
&end
#
# 242 HIS HD2 243 ILE HN 6.15 (#peak 182)
&rst
ixpk= 182, nxpk= 0, iat=3635,3639, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 242 HIS QB 243 ILE HN 4.25 (#peak 171)
&rst
ixpk= 171, nxpk= 0, iat= -1,3639, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1=3626,3627,
&end
#
# 243 ILE HN 243 ILE HB 4.09 (#peak 175)
&rst
ixpk= 175, nxpk= 0, iat=3639,3643, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 243 ILE HN 243 ILE HG12 4.48 (#peak 180)
&rst
ixpk= 180, nxpk= 0, iat=3639,3649, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 243 ILE HN 243 ILE HG13 4.22 (#peak 172)
&rst
ixpk= 172, nxpk= 0, iat=3639,3650, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 243 ILE HN 243 ILE QD1 4.33 (#peak 177)
&rst
ixpk= 177, nxpk= 0, iat=3639, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=3652,3653,3654,
&end
#
# 243 ILE HN 243 ILE QG2 5.00 (#peak 3285)
&rst
ixpk= 3285, nxpk= 0, iat=3639, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=3645,3646,3647,
&end
#
# 243 ILE HN 244 GLY HN 5.06 (#peak 174)
&rst
ixpk= 174, nxpk= 0, iat=3639,3658, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 243 ILE HA 243 ILE QD1 6.15 (#peak 3402)
&rst
ixpk= 3402, nxpk= 0, iat=3641, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=3652,3653,3654,
&end
#
# 243 ILE HB 244 GLY HN 4.84 (#peak 1093)
&rst
ixpk= 1093, nxpk= 0, iat=3643,3658, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 243 ILE HG12 244 GLY HN 6.15 (#peak 3574)
&rst
ixpk= 3574, nxpk= 0, iat=3649,3658, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 243 ILE HG13 244 GLY HN 5.24 (#peak 1091)
&rst
ixpk= 1091, nxpk= 0, iat=3650,3658, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 243 ILE QD1 244 GLY HN 4.85 (#peak 1095)
&rst
ixpk= 1095, nxpk= 0, iat= -1,3658, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1=3652,3653,3654,
&end
#
# 243 ILE QG2 244 GLY HN 4.91 (#peak 1097)
&rst
ixpk= 1097, nxpk= 0, iat= -1,3658, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1=3645,3646,3647,
&end
#
# 243 ILE QG2 245 LEU HN 6.15 (#peak 3052)
&rst
ixpk= 3052, nxpk= 0, iat= -1,3665, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=3645,3646,3647,
&end
#
# 244 GLY HN 245 LEU HN 4.74 (#peak 1090)
&rst
ixpk= 1090, nxpk= 0, iat=3658,3665, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 244 GLY HN 245 LEU QD2 5.02 (#peak 1089)
&rst
ixpk= 1089, nxpk= 0, iat=3658, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=3678,3679,3680,
&end
#
# 245 LEU HN 245 LEU HB2 4.02 (#peak 706)
&rst
ixpk= 706, nxpk= 0, iat=3665,3669, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 245 LEU HN 245 LEU QD1 4.88 (#peak 715)
&rst
ixpk= 715, nxpk= 0, iat=3665, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=3674,3675,3676,
&end
#
# 245 LEU HN 245 LEU QD2 4.27 (#peak 3300)
&rst
ixpk= 3300, nxpk= 0, iat=3665, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=3678,3679,3680,
&end
#
# 245 LEU HB2 246 ALA HN 4.44 (#peak 2794)
&rst
ixpk= 2794, nxpk= 0, iat=3669,3684, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 245 LEU QD1 246 ALA HN 4.56 (#peak 258)
&rst
ixpk= 258, nxpk= 0, iat= -1,3684, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1=3674,3675,3676,
&end
#
# 245 LEU QD2 246 ALA HN 4.69 (#peak 2932)
&rst
ixpk= 2932, nxpk= 0, iat= -1,3684, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=3678,3679,3680,
&end
#
# 246 ALA HN 247 ALA HN 5.08 (#peak 254)
&rst
ixpk= 254, nxpk= 0, iat=3684,3694, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 246 ALA QB 247 ALA HN 4.84 (#peak 589)
&rst
ixpk= 589, nxpk= 0, iat= -1,3694, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1=3688,3689,3690,
&end
#
# 247 ALA HN 247 ALA QB 3.80 (#peak 588)
&rst
ixpk= 588, nxpk= 0, iat=3694, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=3698,3699,3700,
&end
#
# 247 ALA HN 248 LYS HN 4.66 (#peak 1885)
&rst
ixpk= 1885, nxpk= 0, iat=3694,3704, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 247 ALA QB 248 LYS HN 3.84 (#peak 1887)
&rst
ixpk= 1887, nxpk= 0, iat= -1,3704, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1=3698,3699,3700,
&end
#
# 248 LYS HN 248 LYS QG 4.20 (#peak 1888)
&rst
ixpk= 1888, nxpk= 0, iat=3704, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=3711,3712,
&end
#
# 248 LYS HA 249 GLN HB2 6.15 (#peak 3893)
&rst
ixpk= 3893, nxpk= 0, iat=3706,3730, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 248 LYS HB3 249 GLN HN 4.85 (#peak 231)
&rst
ixpk= 231, nxpk= 0, iat=3709,3726, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 248 LYS HB3 249 GLN HA 6.15 (#peak 1132)
&rst
ixpk= 1132, nxpk= 0, iat=3709,3728, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 249 GLN HN 249 GLN HB3 3.89 (#peak 233)
&rst
ixpk= 233, nxpk= 0, iat=3726,3731, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 249 GLN HB2 250 HIS HN 3.92 (#peak 1452)
&rst
ixpk= 1452, nxpk= 0, iat=3730,3743, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 249 GLN HB3 250 HIS HN 4.96 (#peak 1456)
&rst
ixpk= 1456, nxpk= 0, iat=3731,3743, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
Contact the webmaster for help, if required. Friday, April 19, 2024 2:44:23 PM GMT (wattos1)