NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
1418 |
1ak8   |
cing | 1-original | 1 | DYANA/DIANA | distance | NOE | simple |
# upper distance limits
1 ALA
HA 1 ALA QB 3.20 # 2M 46500.0 Ce1n100g2374
HA 2 ASP- HN 3.90 # 2 15930.0 290K_n102558
2 ASP-
HN 2 ASP- HA 3.80 # 2 21580.0 Ce1n100g 147
HN 2 ASP- HB2 3.30 # 2 48440.0 Ce1n100g 126
HN 2 ASP- HB3 3.70 # 2 24460.0 Ce1n100g1868
HA 2 ASP- HB2 3.20 # 2 53150.0 Ce1n100g 983
HA 2 ASP- HB3 3.30 # 2 46160.0 Ce1n100g 237
HA 3 GLN HN 3.00 # 2 79060.0 Ce1n100g1112
HB2 3 GLN HN 4.30 # 2 9099.0 290K_n101116
3 GLN
HN 3 GLN HA 3.40 # 2 38760.0 Ce1n100g 186
HN 3 GLN HB2 4.00 ># 2 14670.0 290K_n10 188
HN 3 GLN HB3 3.40 <# 2 38940.0 Ce1n100g 189
HN 3 GLN QG 4.80 # m 1 9369.0*2 290K_n10 187
HA 3 GLN HB2 2.90 <# 2 95100.0 Ce1n100g 194
HA 3 GLN HB3 3.70 ># 2 23940.0 290K_n10 195
HA 3 GLN QG 4.20 # i 1 12030.0*2 Ce1n100g 193
HA 4 LEU HN 2.60 # 2 197300.0 Ce1n100g1108
HA 4 LEU HG 4.10 # 5 10732.5 ! 290K_n102839
HB2 3 GLN QG 3.20 <# m 1 82500.0*2 Ce1n100g 196
HB2 4 LEU HN 4.50 # 2 7596.0 290K_n101110
HB3 3 GLN QG 4.10 ># m 1 21895.0*2 Ce1n100g 197
HB3 4 LEU HN 4.10 # 2 11686.5 290K_n101167
QG 4 LEU HN 6.00 # m 5 3451.5*2 290K_n101111
4 LEU
HN 4 LEU HA 3.40 # 2 40300.0 Ce1n100g 206
HN 4 LEU HB2 3.60 ># 2 29488.5 290K_n10 209
HN 4 LEU HB3 2.90 <# 2 107200.0 Ce1n100g 208
HN 4 LEU HG 2.50 # 1 53290.0 Ce1n100g2515
HN 4 LEU QQD 6.80 # q 1M 18770.0*2 Ce1n100g 210
HA 4 LEU HB2 3.30 # 2 47150.0 Ce1n100g 219
HA 4 LEU HB3 3.20 # 2 58600.0 Ce1n100g 218
HA 4 LEU QQD 5.10 # s 1M 88050.0*2 Ce1n100g 220
HA 5 THR HN 2.70 # 2 154300.0 ! Ce1n100g1105
HB2 4 LEU QQD 4.90 ># 1M 76700.0*2 Ce1n100g 226
HB2 5 THR HN 3.70 # 2 21930.0 Ce1n100g2497
HB2 8 GLN HB2 3.70 # 5 21055.5 290K_n102441
HB3 4 LEU QQD 4.50 <# 1M 179400.0*2 Ce1n100g 223
HB3 5 THR HN 3.50 # 2 30910.0 Ce1n100g1107
HG 4 LEU QQD 4.90 # 1M 84850.0*2 Ce1n100g2516
HG 5 THR HN 4.00 # 5 12568.5 290K_n102521
QQD 5 THR HN 6.70 # 5M 12271.5*2 290K_n102353
5 THR
HN 5 THR HA 3.40 # 2 38970.0 Ce1n100g 67
HN 5 THR HB 4.40 # 2 8575.0 Ce1n100g 66
HN 5 THR QG2 3.20 # 1M 127500.0 ! Ce1n100g 70
HN 8 GLN HN 4.30 # 3 10363.5 290K_n102795
HN 8 GLN HB2 3.40 # 3 43220.0 Ce1n100g2271
HA 5 THR QG2 3.30 # 1M 121800.0 Ce1n100g 72
HA 6 GLU- HN 2.80 # 2 138100.0 Ce1n100g1097
HB 5 THR QG2 3.00 # s 1M 234600.0 Ce1n100g 71
HB 6 GLU- HN 2.90 # 2 95820.0 Ce1n100g1100
QG2 6 GLU- HN 4.40 # 5M 25620.0 ! Ce1n100g1103
6 GLU-
HN 6 GLU- HA 3.20 # 2 57580.0 Ce1n100g 31
HN 6 GLU- QB 3.70 # i 2 66700.0*2 Ce1n100g 35
HN 6 GLU- HG2 3.20 # 1 19070.0 Ce1n100g 33
HN 6 GLU- HG3 3.30 # 1 16398.0 290K_n10 34
HN 7 GLU- HN 3.30 # 2 47810.0 Ce1n100g1098
HN 9 ILE QD1 7.00 # w 5M 2965.0 Ce1n100g1906
HA 6 GLU- QB 3.80 # m 2 137200.0*2 Ce1n100g 49
HA 6 GLU- HG2 2.90 # 1 27250.0 Ce1n100g 48
HA 6 GLU- HG3 3.10 # 1 20990.0 Ce1n100g 47
HA 7 GLU- HN 3.90 # 2 16190.0 Ce1n100g1131
HA 9 ILE HN 4.20 # 3 12030.0 Ce1n100g1178
HA 9 ILE QG2 5.00 # 5M 15600.0 Ce1n100g2370
HA 9 ILE QD1 5.00 # 5M 15007.5 ! 290K_n102782
HA 10 ALA HN 5.00 # 3 4477.0 Ce1n100g2498
QB 6 GLU- HG2 3.20 <# m 1 82500.0*2 Ce1n100g 53
QB 6 GLU- HG3 3.70 ># m 1 40000.0*2 Ce1n100g 232
QB 7 GLU- HN 4.70 # m 2 24547.5*2 290K_n101132
7 GLU-
HN 7 GLU- HA 3.20 # 2 60230.0 Ce1n100g 98
HN 7 GLU- HB2 2.90 <# 2 111800.0 Ce1n100g 101
HN 7 GLU- HB3 3.50 ># 2 31729.5 290K_n10 102
HN 7 GLU- HG2 2.80 # 1 31600.0 Ce1n100g 100
HN 7 GLU- HG3 3.00 # 1 23110.0 Ce1n100g 99
HN 8 GLN HN 3.00 # 2 80090.0 Ce1n100g1134
HA 7 GLU- HB2 3.30 # 2 50175.0 290K_n102641
HA 7 GLU- HB3 3.10 # 2 64390.0 Ce1n100g 106
HA 7 GLU- HG2 2.90 <# 1 26599.5 290K_n10 112
HA 7 GLU- HG3 3.80 ># 1 9756.0 290K_n10 115
HA 8 GLN HN 3.70 # 2 23110.0 Ce1n100g1137
HA 10 ALA HN 4.20 # 3 12960.0 Ce1n100g1181
HA 10 ALA QB 3.40 # 3M 31410.0 Ce1n100g2381
HB2 7 GLU- HG2 3.00 # 1 23200.0 Ce1n100g 123
HB2 7 GLU- HG3 2.50 # 1 50300.0 Ce1n100g 119
HB2 8 GLN HN 3.50 # 2 31810.0 Ce1n100g1136
HB3 7 GLU- HG2 3.10 # 1 20310.0 Ce1n100g 121
HB3 7 GLU- HG3 3.70 # 1 10900.0 Ce1n100g 120
HB3 8 GLN HN 3.80 # 2 19417.5 290K_n101135
8 GLN
HN 8 GLN HA 3.30 # 2 47350.0 Ce1n100g 472
HN 8 GLN HB2 3.10 # 2 63000.0 Ce1n100g 473
HN 8 GLN HB3 3.50 # 2 34950.0 Ce1n100g 474
HN 8 GLN QG 4.30 # m 1 16325.0*2 Ce1n100g2502
HN 9 ILE HN 3.10 # 2 70400.0 Ce1n100g1170
HA 8 GLN HB2 3.20 # 2 56320.0 Ce1n100g 482
HA 8 GLN HB3 3.00 # 2 80000.0 Ce1n100g 481
HA 8 GLN QG 4.00 # i 1 14163.8*2 290K_n102751
HA 9 ILE HN 6.00 # w 2 1126.0 Ce1n100g1169
HA 11 GLU- HN 4.00 # 3 17793.0 290K_n101186
HB2 9 ILE HN 3.50 # 2 32710.0 Ce1n100g1172
HB2 12 PHE CZ 6.70 # r 5 4809.0*2 Ce1n100g2199
HB3 12 PHE CZ 6.20 # r 5 9616.5*2 290K_n102319
QG 8 GLN HE21 5.30 ># m 1 5785.0*2 Ce1n100g1538
QG 8 GLN HE22 4.10 <# m 1 21415.0*2 Ce1n100g2314
9 ILE
HN 9 ILE HA 3.30 # 2 44240.0 Ce1n100g 162
HN 9 ILE HB 3.10 # 2 65800.0 Ce1n100g 163
HN 9 ILE QG2 3.90 # 1M 41283.0 290K_n10 164
HN 9 ILE HG12 5.10 ># 1 2840.4 290K_n102554
HN 9 ILE HG13 4.10 <# 1 7070.0 Ce1n100g2509
HN 9 ILE QD1 4.30 # 1M 21590.0 Ce1n100g 169
HN 10 ALA HN 3.20 # 2 53110.0 Ce1n100g1174
HA 9 ILE HB 3.40 # 2 37089.0 290K_n10 170
HA 9 ILE QG2 3.80 # 1M 48195.0 290K_n10 171
HA 9 ILE HG12 3.40 # 1 14656.5 290K_n102166
HA 9 ILE HG13 3.10 # 1 22090.5 290K_n102706
HA 9 ILE QD1 4.00 # 1M 34452.0 290K_n10 172
HA 10 ALA HN 4.30 # 2 8815.0 Ce1n100g1173
HA 11 GLU- HB2 4.70 # 3 6224.0 Ce1n100g2457
HA 12 PHE HN 3.80 # 3 22310.0 Ce1n100g1189
HA 12 PHE HB2 4.20 # 3 12090.0 Ce1n100g2168
HA 12 PHE HB3 4.00 # 3 16740.0 Ce1n100g2419
HA 12 PHE CG 5.70 # r 5 22675.0*2 Ce1n100g1827
HA 13 LYS+ HN 5.10 # 3 4105.0 Ce1n100g1196
HA 65 PHE CZ 7.50 # r 5 2026.5*2 Ce1n100g1820
HA 65 PHE HZ 4.30 # 5 8557.0 Ce1n100g1819
HA 69 LEU QD2 4.50 # 5M 22990.0 Ce1n100g2215
HB 9 ILE QG2 3.00 # s 1M 202400.0 Ce1n100g 176
HB 9 ILE QD1 3.40 # 1M 100800.0 Ce1n100g 179
HB 10 ALA HN 3.70 # 2 21991.5 290K_n101177
QG2 9 ILE QD1 4.40 # m 1M 90270.0 290K_n10 180
QG2 10 ALA HN 5.10 # 5M 14000.0 Ce1n100g2548
QG2 13 LYS+ HN 7.00 # w 5M 3546.0 Ce1n100g1763
QG2 13 LYS+ QE 6.20 # m 5M 12945.0*2 Ce1n100g2371
QG2 65 PHE CZ 6.40 # r 5M 25905.0*2 Ce1n100g1514
QG2 65 PHE HZ 3.50 # 5M 65740.0 Ce1n100g2041
QG2 69 LEU QD1 5.90 # m 5M 16950.0 Ce1n100g2490
QG2 69 LEU QD2 5.80 # m 5M 18166.5 290K_n102177
HG12 9 ILE QD1 3.00 # s 1M 244200.0 Ce1n100g2505
HG13 9 ILE QD1 3.20 # 1M 137655.0 290K_n102517
HG13 10 ALA HN 4.60 # 5 5366.0 Ce1n100g2546
HG13 10 ALA HA 5.10 # 5 3198.0 Ce1n100g2522
HG13 13 LYS+ HN 4.90 # 5 4038.8 290K_n102898
HG13 69 LEU QD2 5.60 # 5M 10000.0 Ce1n100g2543
QD1 12 PHE CG 6.50 # r 5M 24495.0*2 Ce1n100g1836
QD1 65 PHE CZ 8.80 # r 5M 4325.5*2 Ce1n100g1513
QD1 65 PHE HZ 6.10 # 5M 7091.0 Ce1n100g1521
QD1 69 LEU QD2 4.10 # m 5M 107730.0 290K_n102165
10 ALA
HN 10 ALA HA 3.10 # 2 66620.0 Ce1n100g 322
HN 10 ALA QB 3.00 # s 2M 181100.0 Ce1n100g 326
HN 11 GLU- HN 3.20 # 2 61110.0 290K_n101184
HA 10 ALA QB 3.00 # s 2M 219500.0 Ce1n100g 324
HA 11 GLU- HN 3.70 # 2 23990.0 Ce1n100g1185
HA 13 LYS+ HN 3.70 # 3 28380.0 Ce1n100g1070
HA 13 LYS+ QB 4.60 # m 3 30105.0*2 Ce1n100g2383
QB 11 GLU- HN 3.30 # 2M 43000.0 ! Ce1n100g2499
QB 13 LYS+ HN 5.50 # 3M 1810.8 290K_n102071
11 GLU-
HN 11 GLU- HA 3.20 # 2 60900.0 Ce1n100g 426
HN 11 GLU- HB2 3.30 # 2 49940.0 Ce1n100g 430
HN 11 GLU- HB3 3.60 # 2 26707.5 290K_n10 429
HN 11 GLU- HG2 3.40 ># 1 14750.0 Ce1n100g 428
HN 11 GLU- HG3 2.60 <# 1 43140.0 Ce1n100g 427
HN 12 PHE HN 3.00 # 2 80420.0 Ce1n100g1188
HN 13 LYS+ HN 4.30 # 3 10930.0 Ce1n100g2285
HA 11 GLU- HB2 3.40 # 2 39500.0 Ce1n100g 443
HA 11 GLU- HB3 3.40 # 2 42500.0 Ce1n100g 442
HA 11 GLU- HG2 2.70 # 1 38430.0 Ce1n100g 441
HA 11 GLU- HG3 3.00 # 1 24727.5 290K_n10 436
HA 12 PHE HN 3.80 # 2 19310.0 Ce1n100g1192
HA 15 ALA HN 5.50 # 3 2578.0 Ce1n100g1231
HB2 11 GLU- HG2 3.10 # 1 20140.0 Ce1n100g 451
HB2 11 GLU- HG3 3.40 # 1 13968.0 290K_n10 446
HB2 12 PHE HN 3.20 <# 2 55170.0 Ce1n100g1190
HB3 11 GLU- HG2 2.60 # 1 46530.0 290K_n10 450
HB3 11 GLU- HG3 3.20 # 1 19242.0 290K_n10 445
HB3 12 PHE HN 3.80 ># 2 18450.0 Ce1n100g1191
HG2 12 PHE HN 5.00 # 5 3485.0 Ce1n100g1203
12 PHE
HN 12 PHE HA 3.30 # 2 47310.0 Ce1n100g 148
HN 12 PHE HB2 3.10 # 2 64120.0 Ce1n100g1822
HN 12 PHE HB3 3.50 # 2 35370.0 Ce1n100g 150
HN 12 PHE CG 6.00 # r 1 7915.0*2 Ce1n100g1504
HN 13 LYS+ HN 3.20 # 2 61730.0 Ce1n100g1194
HN 65 PHE HZ 5.00 # 5 3316.0 290K_n101812
HA 12 PHE HB2 3.60 # 2 29570.0 Ce1n100g1840
HA 12 PHE HB3 3.30 # 2 45030.0 Ce1n100g 154
HA 12 PHE CG 3.50 # m 1 53900.0*2 Ce1n100g1275
HA 12 PHE CZ 5.30 # i 1 4033.0*2 Ce1n100g1814
HA 13 LYS+ HN 4.20 # 2 10940.0 Ce1n100g1193
HA 15 ALA HN 3.70 # 3 28670.0 Ce1n100g1236
HA 15 ALA QB 3.00 # s 3M 74920.0 ! Ce1n100g1813
HA 16 PHE HN 5.70 # 3 1900.0 Ce1n100g1246
HA 68 PHE CZ 6.40 # r 5 7085.0*2 Ce1n100g1764
HB2 12 PHE CG 5.10 # r 1 20410.0*2 Ce1n100g1824
HB2 13 LYS+ HN 4.00 # 2 14780.0 Ce1n100g2207
HB2 65 PHE CZ 6.90 ># r 5 3915.0*2 290K_n101825
HB2 65 PHE HZ 3.60 # 5 26580.0 Ce1n100g1823
HB2 69 LEU QD2 4.80 # 5M 17630.0 Ce1n100g2209
HB3 12 PHE CG 5.10 # r 1 22680.0*2 Ce1n100g1818
HB3 13 LYS+ HN 3.80 # 2 19290.0 Ce1n100g1204
HB3 65 PHE CZ 6.20 <# r 5 10260.0*2 290K_n101821
HB3 65 PHE HZ 3.50 # 5 31720.0 Ce1n100g1499
HB3 68 PHE CG 7.00 # r 5 3479.0*2 Ce1n100g1546
HB3 68 PHE CZ 5.80 # r 5 18050.0*2 Ce1n100g1826
HB3 69 LEU QD2 3.80 # 5M 48350.0 Ce1n100g2205
CG 12 PHE CZ 6.40 # rr 1 65375.0*2*2 Ce1n100g1556
CG 13 LYS+ HN 8.00 # r w 5 1069.5*2 Ce1n100g1207
CG 15 ALA QB 7.20 # r 5M 13285.0*2 Ce1n100g1837
CG 68 PHE CZ 8.20 # rr 5 9305.0*2*2 Ce1n100g1828
CG 69 LEU QD1 9.00 ># r w 5M 1824.0*2 Ce1n100g1831
CG 69 LEU QD2 6.50 <# r 5M 23010.0*2 Ce1n100g1829
CG 72 MET HG2 6.80 ># r 5 4678.5*2 Ce1n100g2354
CG 72 MET HG3 6.20 <# r 5 10030.0*2 Ce1n100g1834
CZ 69 LEU QD2 8.30 # r 5M 6160.0*2 Ce1n100g1830
CZ 72 MET HG2 6.60 ># r 5 5590.0*2 Ce1n100g1832
CZ 72 MET HG3 5.80 <# r 5 17510.0*2 Ce1n100g1833
CZ 72 MET QE 9.00 # r w 5M 2845.0*2 Ce1n100g2320
CZ 73 ALA HA 6.50 # r 5 6450.0*2 Ce1n100g1453
13 LYS+
HN 13 LYS+ HA 3.30 # 2 43270.0 Ce1n100g 5
HN 13 LYS+ QB 3.70 # i 2 63250.0*2 Ce1n100g 13
HN 13 LYS+ HG2 3.00 <# 1 24633.0 290K_n10 14
HN 13 LYS+ HG3 4.10 ># 1 7155.0 290K_n10 20
HN 14 GLU- HN 3.20 # 2 57260.0 Ce1n100g1198
HN 15 ALA HN 5.40 # 3 2904.0 Ce1n100g1232
HN 65 PHE CZ 6.20 # r 5 9360.0*2 Ce1n100g1496
HN 65 PHE HZ 3.70 # 5 20043.0 290K_n101497
HA 13 LYS+ QB 4.30 # m 2 47710.0*2 Ce1n100g 18
HA 13 LYS+ HG2 2.20 <# 1 80000.0 Ce1n100g 23
HA 13 LYS+ HG3 3.10 ># 1 20605.5 290K_n10 22
HA 13 LYS+ QD 4.50 # m 1 13505.0*2 Ce1n100g 945
HA 14 GLU- HN 3.90 # 2 16040.0 Ce1n100g1209
HA 16 PHE HN 3.60 # 3 33270.0 Ce1n100g1247
HA 16 PHE HB2 3.90 ># 3 21010.0 Ce1n100g2333
HA 16 PHE HB3 3.40 <# 3 42480.0 Ce1n100g2086
HA 16 PHE CG 6.50 # r 5 6875.0*2 Ce1n100g1920
HA 65 PHE CG 6.20 # r 5 9395.0*2 Ce1n100g1234
HA 65 PHE CZ 5.30 # r 5 44790.0*2 Ce1n100g1485
HA 65 PHE HZ 3.80 # 5 17760.0 Ce1n100g1233
QB 13 LYS+ HG2 3.60 # m 1 43150.0*2 Ce1n100g 25
QB 13 LYS+ HG3 3.40 # m 1 59400.0*2 290K_n10 26
QB 13 LYS+ QD 5.10 # mm 1 22750.0*2*2 Ce1n100g 943
QB 13 LYS+ QE 7.70 # mm 1 1762.9*2*2 290K_n10 935
QB 14 GLU- HN 4.70 # m 2 24727.5*2 290K_n101235
QB 65 PHE CZ 8.10 # mr 5 3155.0*2*2 Ce1n100g1503
QB 65 PHE HZ 5.10 # m 5 12215.0*2 Ce1n100g1762
HG2 13 LYS+ QD 3.20 <# m 1 83900.0*2 Ce1n100g 942
HG2 13 LYS+ QE 3.90 <# m 1 28597.5*2 290K_n10 947
HG2 14 GLU- HN 5.20 # 5 2592.0 Ce1n100g1228
HG2 65 PHE CZ 6.90 # r 5 3699.5*2 Ce1n100g1515
HG2 65 PHE HZ 3.50 <# 5 30620.0 Ce1n100g2042
HG3 13 LYS+ QD 5.10 ># m 1 6995.0*2 Ce1n100g 941
HG3 13 LYS+ QE 5.00 ># m 1 7393.5*2 290K_n10 938
HG3 65 PHE HZ 4.00 ># 5 14040.0 Ce1n100g2473
QD 13 LYS+ QE 5.90 # mm 1 8240.0*2*2 Ce1n100g 944
QE 65 PHE CZ 8.00 # mr 5 3387.5*2*2 Ce1n100g1761
14 GLU-
HN 14 GLU- HA 3.10 # 2 76000.0 Ce1n100g 463
HN 14 GLU- HB2 3.10 <# 2 63170.0 Ce1n100g 465
HN 14 GLU- HB3 3.60 ># 2 29700.0 290K_n10 469
HN 14 GLU- HG2 2.80 # 1 32121.0 290K_n10 471
HN 14 GLU- HG3 2.50 # 1 53360.0 Ce1n100g 470
HN 15 ALA HN 3.40 # 2 39631.5 290K_n101229
HA 14 GLU- HB2 3.10 # 2 70000.0 Ce1n100g1226
HA 14 GLU- HB3 2.80 # 2 129800.0 Ce1n100g1220
HA 14 GLU- HG2 2.80 <# 1 31500.0 Ce1n100g1213
HA 14 GLU- HG3 3.60 ># 1 11380.0 Ce1n100g1215
HA 15 ALA HN 4.30 # 2 9815.0 Ce1n100g1237
HA 17 SER HN 3.60 # 3 32427.0 290K_n101254
HB2 14 GLU- HG2 3.00 # 1 24500.0 Ce1n100g1218
HB2 14 GLU- HG3 3.80 # 1 9269.0 Ce1n100g1224
HB2 15 ALA HN 3.70 # 2 23600.0 Ce1n100g1244
HB3 14 GLU- HG2 2.70 # 1 37820.0 Ce1n100g1217
HB3 14 GLU- HG3 4.50 # 1 4715.0 Ce1n100g1223
HB3 15 ALA HN 3.70 # 2 25150.0 Ce1n100g1243
15 ALA
HN 15 ALA HA 3.20 # 2 58530.0 Ce1n100g 378
HN 15 ALA QB 3.00 # s 2M 135600.0 Ce1n100g 379
HN 16 PHE HN 3.20 # 2 51810.0 Ce1n100g1238
HA 15 ALA QB 3.00 # s 2M 92500.0 Ce1n100g 383
HA 16 PHE HN 4.40 # 2 8640.0 290K_n101245
HA 18 LEU HN 4.20 # 3 12970.0 Ce1n100g1258
HA 18 LEU QB 5.20 # m 3 13405.0*2 Ce1n100g2373
HA 18 LEU QD1 3.60 # 5M 58230.0 290K_n102366
HA 19 PHE CG 7.70 # r 5 1587.5*2 Ce1n100g1166
HA 19 PHE CZ 7.50 # r 5 1936.5*2 Ce1n100g1165
QB 16 PHE HN 3.10 # 2M 61170.0 Ce1n100g1248
QB 19 PHE CG 9.00 # r w 5M 2802.0*2 Ce1n100g1881
QB 19 PHE CZ 8.10 # r 5M 6885.0*2 Ce1n100g1882
QB 68 PHE CZ 6.00 # r 5M 37075.0*2 Ce1n100g1547
QB 68 PHE HZ 3.50 # 5M 66070.0 Ce1n100g2028
16 PHE
HN 16 PHE HA 3.50 # 2 34627.5 290K_n10 235
HN 16 PHE HB2 3.30 # 2 48440.0 Ce1n100g 986
HN 16 PHE HB3 3.00 # 2 78790.0 Ce1n100g1118
HN 16 PHE CG 5.90 # r 1 8450.0*2 Ce1n100g1122
HN 17 SER HN 3.30 # 2 44110.0 Ce1n100g1255
HN 65 PHE CG 7.90 # r 5 1230.0*2 Ce1n100g1766
HN 65 PHE CZ 7.10 # r 5 2974.5*2 290K_n101127
HN 68 PHE CG 7.20 # r 5 2639.0*2 Ce1n100g1123
HN 68 PHE CZ 6.20 # r 5 9750.0*2 Ce1n100g1124
HN 68 PHE HZ 5.30 # 5 2391.0 Ce1n100g1765
HA 16 PHE HB2 2.60 <# 2 186000.0 Ce1n100g 987
HA 16 PHE HB3 3.00 ># 2 85000.0 Ce1n100g1774
HA 16 PHE CG 3.60 # m 1 43565.0*2 Ce1n100g2080
HA 17 SER HN 4.30 # 2 9050.0 Ce1n100g1252
HA 18 LEU HN 5.60 # 3 2259.9 290K_n101775
HA 19 PHE HN 4.60 # 3 7555.0 Ce1n100g1776
HA 19 PHE HB2 3.50 # 3 41270.0 Ce1n100g1784
HA 19 PHE CG 5.80 # r 5 18860.0*2 Ce1n100g1782
HA 27 ILE QD1 4.50 # 5M 23650.0 Ce1n100g1955
HA 65 PHE CG 7.10 # r 5 3198.5*2 Ce1n100g1778
HA 65 PHE CZ 8.00 # r w 5 820.5*2 Ce1n100g1777
HA 68 PHE CG 6.90 # r 5 3777.5*2 Ce1n100g1783
HA 68 PHE CZ 6.30 # r 5 9185.0*2 Ce1n100g1781
HA 68 PHE HZ 4.10 # 5 10930.0 Ce1n100g1780
HB2 16 PHE CG 4.60 # r 1 46240.0*2 Ce1n100g2079
HB2 17 SER HN 3.80 ># 2 18800.0 Ce1n100g1251
HB2 65 PHE CG 5.60 <# r 5 26375.0*2 Ce1n100g2339
HB2 65 PHE CZ 5.90 <# r 5 14900.0*2 Ce1n100g1512
HB2 68 PHE CG 6.60 # r 5 5705.0*2 Ce1n100g1791
HB2 68 PHE CZ 6.70 # r 5 4970.0*2 Ce1n100g1789
HB3 16 PHE CG 4.60 # r 1 44080.0*2 Ce1n100g2078
HB3 17 SER HN 3.30 <# 2 50630.0 Ce1n100g1253
HB3 65 PHE CG 6.20 ># r 5 9875.2*2 290K_n101788
HB3 65 PHE CZ 6.60 ># r 5 5865.0*2 Ce1n100g1786
HB3 68 PHE CZ 6.70 # r 5 5064.8*2 290K_n101790
CG 16 PHE CZ 6.70 # rr 1 40300.0*2*2 Ce1n100g 898
CG 16 PHE HZ 6.50 # r 1 4509.0*2 290K_n10 894
CG 17 SER HN 6.60 # r 5 5925.0*2 Ce1n100g1767
CG 17 SER HA 6.30 # r 5 8315.0*2 Ce1n100g2147
CG 27 ILE QD1 6.50 # r 5M 22830.0*2 Ce1n100g1965
CG 65 PHE HA 6.50 # r 5 6670.0*2 Ce1n100g1608
CG 65 PHE CG 7.90 # rr 5 15245.0*2*2 Ce1n100g1795
CG 65 PHE CZ 9.20 # rr 5 2670.0*2*2 Ce1n100g1769
CG 68 PHE HN 7.80 # r 5 1411.5*2 Ce1n100g1809
CG 68 PHE HA 6.90 # r 5 3775.5*2 290K_n102430
CG 68 PHE QB 7.50 # rm 5 6255.0*2*2 Ce1n100g2428
CZ 16 PHE HZ 4.20 # r 1 86000.0*2 Ce1n100g 896
CZ 25 GLY HA1 6.40 # r 5 6975.0*2 Ce1n100g2048
CZ 27 ILE HG13 6.60 # r 5 5675.0*2 Ce1n100g1935 folded
CZ 27 ILE QD1 6.30 # r 5M 27190.0*2 Ce1n100g1362
CZ 63 ILE QG2 7.80 # r 5M 8380.0*2 Ce1n100g1918
CZ 64 ASP- HA 6.20 # r 5 9870.8*2 290K_n102778
CZ 65 PHE HN 6.30 # r 5 8226.0*2 290K_n101805
CZ 65 PHE HA 5.80 # r 5 18035.0*2 Ce1n100g1915
CZ 68 PHE HN 8.00 # r 5 1105.9*2 290K_n101808
CZ 68 PHE QB 7.20 # rm 5 9582.5*2*2 Ce1n100g2341
CZ 68 PHE CG 8.80 # rr 5 4687.5*2*2 Ce1n100g2049
HZ 26 THR HA 3.30 # 5 41940.0 Ce1n100g2305
HZ 27 ILE QD1 7.00 # 5M 3921.8 290K_n102733
HZ 64 ASP- HA 3.50 # 5 32380.0 Ce1n100g1507
HZ 65 PHE HN 4.30 # 5 8221.0 Ce1n100g1754
17 SER
HN 17 SER HA 3.30 # 2 47080.0 Ce1n100g 495
HN 17 SER QB 3.80 # i 2 54050.0*2 Ce1n100g 494
HN 18 LEU HN 3.30 # 2 45930.0 Ce1n100g1256
HA 17 SER QB 4.30 # m 2 44662.5*2 290K_n10 497
HA 18 LEU HN 4.70 # 2 5143.0 Ce1n100g1160
HA 19 PHE HN 6.00 # w 3 1345.9 290K_n102589
HA 20 ASP- HN 3.90 # 3 21267.0 290K_n101139
HA 20 ASP- HB3 3.70 # 3 28548.0 290K_n102221
QB 18 LEU HN 5.10 # m 2 12065.0*2 Ce1n100g1257
18 LEU
HN 18 LEU HA 3.30 # 2 45800.0 Ce1n100g 744
HN 18 LEU QB 3.60 # i 2 77850.0*2 Ce1n100g 745
HN 18 LEU HG 3.60 # 1 11655.0 ! 290K_n10 746
HN 18 LEU QD1 4.90 # 1M 10940.0 Ce1n100g 747
HN 18 LEU QD2 5.30 # 1M 6237.0 290K_n10 773
HN 19 PHE HN 3.10 # 2 73630.0 Ce1n100g1259
HA 18 LEU QB 4.20 # m 2 61800.0*2 Ce1n100g 754
HA 18 LEU HG 2.70 # 1 35406.0 290K_n10 751
HA 18 LEU QD1 3.60 <# 1M 62960.0 Ce1n100g 767
HA 18 LEU QD2 4.30 ># 1M 24358.5 290K_n10 772
HA 19 PHE HN 4.00 # 2 13890.0 Ce1n100g1148
QB 18 LEU HG 3.90 # m 1 29947.5*2 290K_n10 756
QB 18 LEU QD1 4.90 # m 1M 40845.0*2 Ce1n100g 757
QB 18 LEU QD2 4.80 # m 1M 52150.0*2 Ce1n100g 771
QB 19 PHE HN 4.80 # m 2 19536.8*2 290K_n101261
QB 19 PHE CG 7.80 # mr 5 4467.5*2*2 Ce1n100g2531
HG 18 LEU QD1 3.30 # 1M 111735.0 290K_n10 762
HG 18 LEU QD2 3.60 # 1M 63360.0 290K_n10 770
HG 35 VAL QG2 4.50 # 5M 23360.0 Ce1n100g2179
QD1 19 PHE CG 9.00 ># r w 5M 1773.0*2 Ce1n100g1884
QD1 19 PHE CZ 9.00 # r w 5M 2747.2*2 290K_n101885
QD2 19 PHE CG 7.30 <# r 5M 11710.0*2 Ce1n100g1896
QD2 35 VAL QG1 4.80 # m 5M 47205.0 290K_n102474
19 PHE
HN 19 PHE HA 3.60 # 2 29520.0 Ce1n100g 860
HN 19 PHE HB2 3.10 <# 2 63610.0 Ce1n100g 864
HN 19 PHE HB3 3.60 ># 2 29350.0 Ce1n100g 862
HN 19 PHE CG 4.90 # r 1 29745.0*2 Ce1n100g2075
HN 20 ASP- HN 2.90 # 2 99190.0 Ce1n100g1264
HN 35 VAL QG2 7.00 # w 5M 3528.0 Ce1n100g2222
HA 19 PHE HB2 3.00 # 2 81180.0 Ce1n100g 866
HA 19 PHE HB3 3.20 # 2 58660.0 Ce1n100g 867
HA 19 PHE CG 4.60 # m 1 11150.0*2 Ce1n100g2083
HA 20 ASP- HN 3.70 # 2 24730.0 Ce1n100g1506
HA 27 ILE QG2 7.00 # w 5M 1143.0 290K_n102607
HA 27 ILE QD1 5.90 # 5M 7632.0 290K_n102907
HA 35 VAL QG1 6.80 ># 5M 4518.0 290K_n102619
HA 35 VAL QG2 3.10 <# 5M 110700.0 Ce1n100g2024
HB2 19 PHE CG 4.90 # r 1 29610.0*2 Ce1n100g1262
HB2 20 ASP- HN 3.20 <# 2 53030.0 Ce1n100g2145
HB2 27 ILE QG2 5.90 ># 5M 8079.0 Ce1n100g1980
HB2 27 ILE QD1 3.60 # 5M 55970.0 Ce1n100g1956
HB2 35 VAL QG2 6.00 # 5M 7429.0 Ce1n100g2169
HB3 19 PHE CG 4.80 # r 1 34615.0*2 Ce1n100g2081
HB3 20 ASP- HN 3.80 ># 2 19327.5 290K_n101505
HB3 27 ILE QG2 4.60 <# 5M 20790.0 Ce1n100g1982
HB3 27 ILE HG13 4.90 # 5 3822.8 290K_n102746
HB3 27 ILE QD1 3.90 # 5M 43360.0 Ce1n100g1957
HB3 32 LEU HA 4.30 # 5 8302.5 290K_n102812
HB3 68 PHE CZ 7.30 # r 5 2531.2*2 290K_n102482
CG 19 PHE CZ 6.20 # rr 1 88150.0*2*2 Ce1n100g1367
CG 20 ASP- HN 7.40 # r 5 2155.3*2 290K_n102584
CG 27 ILE QG2 7.80 # r 5M 8561.2*2 290K_n101895
CG 27 ILE QD1 7.40 # r 5M 11209.5*2 290K_n101798
CG 32 LEU HA 5.30 # r 5 42415.0*2 Ce1n100g1283
CG 32 LEU QD1 7.70 <# r 5M 8860.0*2 Ce1n100g1889
CG 32 LEU QD2 9.00 ># r w 5M 2994.8*2 290K_n102228
CG 35 VAL HB 6.00 # r 5 14005.0*2 Ce1n100g1873
CG 35 VAL QG1 9.00 ># r 5M 3884.0*2 Ce1n100g1893
CG 35 VAL QG2 6.80 <# r 5M 18560.0*2 Ce1n100g1877
CZ 32 LEU HA 5.80 # r 5 17615.2*2 290K_n101871
CZ 32 LEU QD1 6.80 <# r 5M 18351.0*2 290K_n101890
CZ 32 LEU QD2 9.00 ># r w 5M 3557.2*2 290K_n101891
CZ 35 VAL HB 5.70 # r 5 22405.0*2 Ce1n100g1883
CZ 35 VAL QG1 6.60 <# r 5M 21900.0*2 Ce1n100g2231
CZ 35 VAL QG2 7.90 ># r 5M 7659.0*2 290K_n101888
CZ 68 PHE CZ 8.20 # rr 5 9680.6*2*2 290K_n101870
CZ 68 PHE HZ 5.80 # r 5 18870.8*2 290K_n101869
CZ 72 MET QE 8.90 # r 5M 4107.0*2 Ce1n100g2487
20 ASP-
HN 20 ASP- HB2 3.70 ># 2 25290.0 Ce1n30h21677
HN 20 ASP- HB3 3.00 <# 2 85815.0 290K_n101679
HA 20 ASP- HB2 3.60 # 2 25782.0 Ce1n30h21673
HA 21 LYS+ HN 3.70 # 2 24804.0 Ce1n30h21648
22 ASP-
HN 23 GLY HN 3.90 # 2 15867.0 Ce1n30h21710
24 ASP-
HN 25 GLY HN 3.50 # 2 31680.0 Ce1n30h21691
HA 24 ASP- HB2 3.10 # 2 75375.0 290K_n101494
HA 24 ASP- HB3 2.90 # 2 93510.0 Ce1n100g1493
25 GLY
HN 25 GLY HA1 3.20 <# 2 55440.0 Ce1n30h21690
HN 25 GLY HA2 3.80 ># 2 20949.0 Ce1n30h21689
HN 26 THR HN 4.00 # 2 14151.0 Ce1n30h21702
26 THR
HN 26 THR HA 3.60 # 2 29829.0 Ce1n30h21715
HA 27 ILE HN 3.20 # 2 55360.0 Ce1n100g2022
HA 64 ASP- HA 2.50 # 4 16371.0 290K_n102279
27 ILE
HN 27 ILE HA 4.30 # 2 9204.0 Ce1n30h21622
HN 27 ILE HB 3.40 # 2 38500.0 Ce1n100g1180
HN 27 ILE HG13 3.30 # 1 17241.0 Ce1n30h21629
HN 27 ILE QD1 5.40 # 1M 5575.5 290K_n102546
HN 63 ILE HN 2.30 # 4 22090.0 Ce1n100g2023
HN 63 ILE HB 4.10 # 5 11580.0 Ce1n100g1733
HA 27 ILE HG12 3.00 # 1 25095.0 Ce1n30h21942
HA 28 THR HN 3.10 # 2 71550.0 Ce1n30h21950
HB 27 ILE QG2 3.60 # 1M 69120.0 290K_n101908
HB 27 ILE HG12 5.80 ># 1 1712.4 Ce1n30h22252
HB 27 ILE HG13 3.00 <# 1 22972.5 290K_n101996 folded
HB 27 ILE QD1 3.80 # 1M 48910.0 Ce1n100g1938
HB 63 ILE HN 4.00 # 5 14067.0 290K_n101929
HB 63 ILE HB 2.80 # 5 119900.0 Ce1n100g1928
HB 63 ILE HG13 5.00 # 5 3563.1 290K_n102786
QG2 27 ILE HG12 4.20 <# 1M 25300.0 Ce1n100g1992 folded
QG2 27 ILE HG13 4.90 ># 1M 10125.0 Ce1n30h21947
QG2 27 ILE QD1 4.20 # m 1M 140500.0 Ce1n100g2085
QG2 29 THR HA 6.60 # 5M 5014.0 Ce1n100g1993
QG2 31 GLU- HN 6.80 # 5M 4500.0 290K_n101924
QG2 31 GLU- HB2 4.20 # 5M 31374.0 290K_n101933
QG2 31 GLU- HB3 4.50 # 5M 22945.5 290K_n101934
QG2 32 LEU HN 4.40 # 5M 26590.0 Ce1n100g1341
QG2 32 LEU HA 4.90 # 5M 16770.0 Ce1n100g1973
QG2 32 LEU HB2 4.50 <# 5M 24570.0 Ce1n100g1979
QG2 32 LEU HB3 6.80 ># 5M 4433.9 290K_n101976
QG2 32 LEU HG 5.50 # 5M 10656.0 290K_n101978
QG2 32 LEU QD1 5.50 # m 5M 23242.5 290K_n101990
QG2 32 LEU QD2 5.80 # m 5M 17980.0 Ce1n100g1986
QG2 52 ILE QD1 7.10 # m 5M 6667.0 Ce1n100g1951
QG2 63 ILE HB 4.50 # 5M 23242.5 290K_n101989
HG12 27 ILE QD1 3.70 # 1M 59900.0 Ce1n100g1960 folded
HG13 27 ILE QD1 3.70 # 1M 61750.0 Ce1n100g1936 folded
QD1 63 ILE HB 4.60 # 5M 20700.0 ! 290K_n101959
QD1 63 ILE QG2 5.30 # m 5M 28008.0 290K_n102094
QD1 68 PHE QB 7.10 # m 5M 7008.8*2 290K_n101954
QD1 68 PHE CG 6.30 # r 5M 27675.0*2 290K_n101799
QD1 68 PHE CZ 7.40 # r 5M 11375.0*2 Ce1n100g1797
28 THR
HA 28 THR QG2 4.00 # 1M 33180.0 Ce1n100g1397
HA 29 THR HN 3.10 # 2 73940.0 Ce1n100g2274
HA 52 ILE QD1 5.80 # 5M 8676.0 290K_n102622
QG2 29 THR HN 3.00 # s 5M 115100.0 ! Ce1n100g 978
QG2 30 LYS+ HN 4.00 # 5M 38410.0 Ce1n100g 980
29 THR
HN 29 THR HA 3.40 # 2 40930.0 Ce1n100g 60
HN 29 THR HB 3.90 # 2 16220.0 Ce1n100g1391
HN 29 THR QG2 3.60 # 1M 66170.0 Ce1n100g 64
HN 30 LYS+ HN 3.50 # 2 32390.0 Ce1n100g1385
HN 52 ILE QD1 4.50 # 5M 22550.0 ! Ce1n100g1392
HA 29 THR HB 3.00 # 2 87040.0 Ce1n100g1401
HA 29 THR QG2 3.40 # 1M 88810.0 Ce1n100g 63
HA 30 LYS+ HN 4.30 # 2 9585.0 Ce1n100g1386
HA 32 LEU HN 4.20 # 3 11907.0 290K_n101389
HA 32 LEU HB2 3.70 # 3 28420.0 Ce1n100g2401
HA 32 LEU HB3 3.60 # 3 33590.0 Ce1n100g2329
HA 32 LEU QD1 5.20 # 5M 13041.0 290K_n102204
HA 32 LEU QD2 5.70 # 5M 9117.0 290K_n102203
HA 33 GLY HN 6.00 # 3 1431.0 290K_n101390
HA 48 LEU HG 5.40 # 5 2122.0 ! Ce1n100g2406
HA 48 LEU QD1 5.00 <# 5M 15232.5 290K_n102405
HA 48 LEU QD2 6.20 ># 5M 6531.0 Ce1n100g2403
HA 52 ILE HG13 4.60 # 5 5616.0 290K_n102685
HA 52 ILE QD1 3.60 # 5M 58940.0 Ce1n100g1994
HB 29 THR QG2 3.00 # s 1M 187500.0 Ce1n100g1402
HB 30 LYS+ HN 3.80 # 2 19320.0 Ce1n100g1153
HB 48 LEU HB2 4.30 # 5 8127.0 290K_n102758
HB 52 ILE QD1 5.90 # 5M 8109.0 290K_n102613
QG2 30 LYS+ HN 5.70 # 5M 8865.0 290K_n101387
QG2 49 GLN HA 3.60 # 5M 54920.0 Ce1n100g1904
QG2 49 GLN QG 5.10 # m 5M 35150.0*2 Ce1n100g2149
QG2 49 GLN HE21 7.00 ># w 5M 2528.6 290K_n102054
QG2 49 GLN HE22 6.10 <# 5M 7091.0 Ce1n100g2055
QG2 52 ILE QG2 5.60 # m 5M 20713.5 ! 290K_n102130
QG2 52 ILE HG12 5.90 ># 5M 7662.0 Ce1n100g2256
QG2 52 ILE HG13 4.60 <# 5M 22113.0 290K_n102716
QG2 52 ILE QD1 4.30 # m 5M 79245.0 290K_n102162
30 LYS+
HN 30 LYS+ HA 3.30 # 2 48750.0 Ce1n100g 396
HN 30 LYS+ HB2 3.20 # 2 59250.0 Ce1n100g 399
HN 30 LYS+ HB3 3.40 # 2 38480.0 Ce1n100g 423
HN 30 LYS+ QG 4.20 # m 1 19523.2*2 290K_n10 402
HN 30 LYS+ HD3 4.10 # 1 7092.0 290K_n10 970
HN 31 GLU- HN 3.50 # 2 33480.0 Ce1n100g1383
HA 30 LYS+ HB2 3.00 # 2 76740.0 Ce1n100g 419
HA 30 LYS+ HB3 3.30 # 2 45100.0 Ce1n100g 418
HA 30 LYS+ QG 3.80 # i 1 17952.8*2 290K_n102659
HA 31 GLU- HN 3.70 # 2 24430.0 Ce1n100g1382
HA 32 LEU HN 5.40 # 3 2885.0 Ce1n100g1412
HA 33 GLY HN 4.30 # 3 11260.0 Ce1n100g1197
HA 48 LEU QD1 6.80 # 5M 4455.9 290K_n102629
HB2 30 LYS+ QG 4.00 # m 1 24825.0*2 Ce1n100g 410
HB2 30 LYS+ HD3 3.00 # 1 23640.0 Ce1n100g 962
HB2 31 GLU- HN 4.10 # 2 11910.0 Ce1n100g1380
HB3 30 LYS+ QG 4.50 # m 1 13705.0*2 Ce1n100g 409
HB3 31 GLU- HN 3.90 # 2 17710.0 Ce1n100g1381
QG 30 LYS+ HD2 3.20 <# m 1 84750.0*2 Ce1n100g 974
QG 30 LYS+ HD3 3.90 ># m 1 28730.0*2 Ce1n100g 977
QG 30 LYS+ QE 7.10 # mm 1 2733.8*2*2 290K_n10 404
HD2 30 LYS+ QE 4.20 # m 1 19465.0*2 Ce1n100g 954
HD3 30 LYS+ QE 4.40 # m 1 14505.8*2 290K_n10 957
31 GLU-
HN 31 GLU- HA 3.30 # 2 43460.0 Ce1n100g 55
HN 31 GLU- HB2 3.50 <# 2 32740.0 Ce1n100g 58
HN 31 GLU- HB3 4.30 ># 2 9409.5 290K_n10 982
HN 32 LEU HN 3.40 # 2 38100.0 Ce1n100g1372
HA 31 GLU- HB2 4.10 # 2 12100.0 Ce1n100g 56
HA 31 GLU- HB3 3.70 # 2 22603.5 290K_n10 981
HA 32 LEU HN 4.40 # 2 8260.0 Ce1n100g1371
HA 34 THR HN 3.90 # 3 18890.0 Ce1n100g 979
HB2 32 LEU HN 4.40 # 2 8075.0 Ce1n100g1373
32 LEU
HN 32 LEU HA 3.50 # 2 31790.0 Ce1n100g 280
HN 32 LEU HB2 3.10 # 2 66000.0 Ce1n100g 318
HN 32 LEU HB3 3.40 # 2 41035.5 290K_n10 311
HN 32 LEU HG 4.60 # 1 4129.6 290K_n10 312
HN 32 LEU QD1 5.70 # 1M 4220.1 290K_n10 319
HN 32 LEU QD2 5.30 # 1M 6642.0 290K_n10 315
HN 33 GLY HN 3.30 # 2 48400.0 Ce1n100g1378
HA 32 LEU HB2 3.40 # 2 40910.0 Ce1n100g 285
HA 32 LEU HB3 3.80 # 2 20940.0 Ce1n100g 282
HA 32 LEU HG 3.90 # 1 8433.0 290K_n10 310
HA 32 LEU QD1 3.60 <# 1M 70900.0 Ce1n100g 298
HA 32 LEU QD2 4.50 ># 1M 17370.0 290K_n10 301
HA 35 VAL HN 4.60 # 3 7293.0 Ce1n100g1268
HA 35 VAL HB 4.00 # 3 17830.0 ! Ce1n100g1408
HA 35 VAL QG2 5.70 # 5M 9351.0 290K_n102621
HB2 32 LEU QD1 4.00 # 1M 34947.0 290K_n10 294
HB2 32 LEU QD2 3.90 # 1M 39771.0 290K_n10 292
HB2 33 GLY HN 3.90 # 2 18153.0 290K_n101416
HB2 52 ILE QD1 5.60 ># 5M 9603.0 290K_n102159
HB3 32 LEU HG 2.70 # 1 39636.0 290K_n10 304
HB3 32 LEU QD1 4.30 # 1M 21460.0 Ce1n100g 297
HB3 32 LEU QD2 3.80 # 1M 45610.0 Ce1n100g 296
HB3 33 GLY HN 3.50 # 2 35869.5 290K_n101415
HB3 48 LEU QD2 4.90 # 5M 16660.0 Ce1n100g2491
HB3 52 ILE QD1 4.50 <# 5M 23584.5 290K_n102161
HG 32 LEU QD1 3.50 # 1M 79335.0 290K_n10 286
HG 32 LEU QD2 3.50 # 1M 79390.0 Ce1n100g 287
HG 33 GLY HN 4.90 # 5 4074.0 Ce1n100g1418
QD1 36 MET HG2 7.00 # w 5M 3794.0 Ce1n100g2197
QD1 36 MET HG3 7.00 # w 5M 3650.8 290K_n102198
QD1 48 LEU QD2 5.50 # m 5M 23274.0 290K_n102152
QD1 52 ILE QD1 5.60 # m 5M 20710.0 Ce1n100g2034
QD1 63 ILE QD1 5.80 # m 5M 17850.0 Ce1n100g2108
QD2 33 GLY HN 7.00 # w 5M 1827.0 290K_n102550
QD2 48 LEU HA 5.60 # 5M 9454.5 290K_n102210
QD2 48 LEU HB2 6.60 # 5M 4977.0 290K_n102699
QD2 48 LEU QD2 5.00 # m 5M 39340.0 Ce1n100g2151
QD2 51 MET HB3 4.30 # 5M 27850.0 Ce1n100g2182
QD2 51 MET HG3 7.00 # w 5M 2559.6 290K_n102904
QD2 52 ILE HN 6.80 # 5M 4376.0 Ce1n100g2234
QD2 52 ILE HG12 4.90 # 5M 16410.0 Ce1n100g2109
QD2 52 ILE HG13 5.60 # 5M 9877.5 290K_n102903
QD2 52 ILE QD1 5.10 # m 5M 35260.0 Ce1n100g2035
33 GLY
HN 33 GLY HA1 3.10 # 2 64120.0 Ce1n100g1202
HN 33 GLY HA2 2.90 # 2 106000.0 Ce1n100g 149
HN 34 THR HN 3.50 # 2 31460.0 Ce1n100g1413
HN 48 LEU QD1 4.40 # 5M 24710.0 Ce1n100g2030
HN 48 LEU QD2 4.50 # 5M 23550.0 Ce1n100g1417
HA1 34 THR HN 3.80 # 2 20560.0 Ce1n100g1421
HA1 36 MET HN 4.30 # 3 11400.0 Ce1n100g1444
HA1 36 MET HB2 3.50 # 3 38560.5 290K_n102455
HA1 48 LEU QD1 3.90 # 5M 41840.0 Ce1n100g2363
HA1 48 LEU QD2 3.70 # 5M 50210.0 Ce1n100g2362
HA2 34 THR HN 4.10 # 2 12748.5 290K_n101420
HA2 48 LEU QD1 3.80 # 5M 47115.0 290K_n102364
HA2 48 LEU QD2 4.30 # 5M 27880.0 Ce1n100g2359
34 THR
HN 34 THR HA 3.50 # 2 35300.0 Ce1n100g1422
HN 34 THR HB 2.90 # 2 103700.0 Ce1n100g 252
HN 34 THR QG2 4.10 # 1M 29820.0 ! Ce1n100g 251
HN 35 VAL HN 3.40 # 2 37250.0 Ce1n100g1425
HN 35 VAL QG2 6.90 # 5M 4244.0 Ce1n100g2259
HA 34 THR HB 4.10 # 2 13070.0 Ce1n100g1005
HA 34 THR QG2 3.40 # 1M 89330.0 Ce1n100g1423
HA 35 VAL HN 4.40 # 2 8196.0 Ce1n100g1152
HA 37 ARG+ HN 4.20 # 3 12690.0 Ce1n100g1897
HA 37 ARG+ QB 4.70 # m 3 27135.0*2 Ce1n100g2388
HA 37 ARG+ HE 4.60 # 5 6057.0 Ce1n100g2057
HB 34 THR QG2 3.30 # 1M 112200.0 Ce1n100g 260
HB 35 VAL HN 3.40 # 2 41380.0 Ce1n100g1368
HB 35 VAL QG2 5.90 # 5M 7978.0 Ce1n100g2216
35 VAL
HN 35 VAL HA 3.20 # 2 54010.0 Ce1n100g 723
HN 35 VAL HB 2.90 # 2 106600.0 Ce1n100g 724
HN 35 VAL QG1 4.20 ># 1M 24670.0 Ce1n100g 726
HN 35 VAL QG2 3.50 <# 1M 82000.0 Ce1n100g 725
HN 36 MET HN 3.30 # 2 44401.5 290K_n101438
HA 35 VAL HB 3.20 # 2 58840.0 Ce1n100g 733
HA 35 VAL QG1 3.60 # 1M 66690.0 290K_n10 730
HA 35 VAL QG2 3.40 # 1M 95130.0 Ce1n100g 736
HA 36 MET HN 4.20 # 2 11400.0 Ce1n100g1433
HA 37 ARG+ HN 4.40 # 3 9322.0 Ce1n100g2058
HA 38 SER HN 3.90 # 3 18560.0 Ce1n100g1409
HB 35 VAL QG1 3.00 # s 1M 213000.0 Ce1n100g 731
HB 35 VAL QG2 3.10 # 1M 156700.0 Ce1n100g 732
HB 36 MET HN 3.20 # 2 57530.0 Ce1n100g1434
QG1 36 MET HN 5.20 # 5M 13620.0 Ce1n100g1435
QG1 36 MET HA 5.30 # 5M 11722.5 290K_n102617
QG1 39 LEU QQD 6.70 # q 5M 27382.5*2 290K_n101731
QG2 36 MET HN 5.20 # 5M 12627.0 290K_n101436
36 MET
HN 36 MET HA 3.40 # 2 42780.0 Ce1n100g 268
HN 36 MET HB2 3.20 <# 2 61240.0 Ce1n100g 270
HN 36 MET HB3 3.80 ># 2 18500.0 Ce1n100g2269
HN 36 MET HG2 3.20 # 1 18648.0 290K_n101427
HN 36 MET HG3 2.80 # 1 32314.5 290K_n10 269
HN 37 ARG+ HN 3.20 # 2 53890.0 Ce1n100g1439
HA 36 MET HB2 3.00 # 2 80000.0 Ce1n100g 275
HA 36 MET HB3 3.00 # 2 82215.0 290K_n102759
HA 36 MET HG2 2.70 <# 1 34816.5 290K_n101430
HA 36 MET HG3 3.60 ># 1 11560.0 Ce1n100g 274
HA 37 ARG+ HN 4.30 # 2 9789.0 Ce1n100g1898
HA 39 LEU HB2 3.00 # 3 102200.0 Ce1n100g2389
HA 39 LEU QQD 6.30 # 5M 17313.8*2 290K_n102467
HA 41 GLN HE21 4.10 # 5 11900.0 Ce1n100g2312
HB2 36 MET HG2 2.90 # 1 28210.5 290K_n101432
HB2 36 MET HG3 2.60 # 1 47025.0 290K_n10 278
HB2 37 ARG+ HN 2.90 <# 2 107900.0 Ce1n100g1462
HB2 41 GLN HB2 3.80 # 5 18130.0 Ce1n100g2442
HB2 42 ASN HA 3.40 # 5 36490.0 Ce1n100g1574
HB3 36 MET HG2 3.10 # 1 22621.5 290K_n102506
HB3 36 MET HG3 3.10 # 1 21766.5 290K_n102507
HB3 37 ARG+ HN 4.80 ># 2 4698.0 290K_n102797
37 ARG+
HN 37 ARG+ HA 4.00 # 2 15260.0 Ce1n100g 156
HN 37 ARG+ QB 3.60 # i 2 83400.0*2 Ce1n100g 157
HN 37 ARG+ QG 4.10 # m 1 22185.0*2 Ce1n100g2062
HN 37 ARG+ HD2 4.40 # 1 5062.0 Ce1n100g2059
HN 37 ARG+ HD3 4.60 # 1 4450.0 Ce1n100g2060
HN 37 ARG+ HE 3.60 # 1 11484.0 290K_n102283
HN 38 SER HN 3.20 # 2 56140.0 Ce1n100g1450
HA 37 ARG+ QB 4.00 # i 2 40330.0*2 Ce1n100g 158
HA 37 ARG+ QG 3.90 # i 1 16460.0*2 Ce1n100g2065
QB 37 ARG+ HD2 3.50 ># m 1 49850.0*2 Ce1n100g 553
QB 37 ARG+ HD3 3.00 <# m 1 142450.0*2 Ce1n100g 552
QB 37 ARG+ HE 4.40 # m 1 14285.0*2 Ce1n100g 545
QB 38 SER HN 5.10 # m 2 12860.0*2 Ce1n100g2317
QG 37 ARG+ HD2 4.70 # m 1 10940.0*2 Ce1n100g2066
QG 37 ARG+ HE 4.70 # m 1 10020.0*2 Ce1n100g2061
HD2 37 ARG+ HE 2.90 # 1 27370.0 Ce1n100g 543
HD3 37 ARG+ HE 2.60 # 1 41080.0 Ce1n100g 544
38 SER
HN 38 SER HA 3.20 # 2 60760.0 Ce1n100g 456
HN 38 SER QB 4.00 # i 2 41580.0*2 Ce1n100g 457
HN 39 LEU HN 3.20 # 2 58420.0 Ce1n100g1442
HA 38 SER QB 4.50 # m 2 32625.0*2 290K_n10 460
HA 39 LEU HN 3.60 # 2 25750.0 Ce1n100g1460
QB 39 LEU HN 6.20 # m 2 3027.0*2 Ce1n100g1461
39 LEU
HN 39 LEU HA 3.60 # 2 25750.0 Ce1n100g 708
HN 39 LEU HB2 3.10 # 2 69470.0 Ce1n100g 712
HN 39 LEU HB3 3.20 # 2 54810.0 290K_n10 713
HN 39 LEU QQD 6.90 # q 1M 16765.0*2 Ce1n100g 718
HN 40 GLY HN 3.30 # 2 44410.0 Ce1n100g1443
HN 41 GLN HN 3.70 # 3 27040.5 290K_n101845
HA 39 LEU HB2 3.00 # 2 91370.0 Ce1n100g 709
HA 39 LEU HB3 3.10 # 2 68570.0 Ce1n100g 710
HA 39 LEU HG 2.40 # 1 57660.0 Ce1n100g2501
HA 39 LEU QQD 5.60 # s 1M 44257.5*2 290K_n102817
HA 40 GLY HN 3.50 # 2 31240.0 ! Ce1n100g1456
HB2 39 LEU QQD 5.20 # 1M 50500.0*2 Ce1n100g 722
HB2 41 GLN HN 4.70 # 3 6138.0 290K_n101459
HB2 41 GLN HE22 4.70 # 5 4797.0 290K_n102806
HB3 40 GLY HN 4.10 # 2 13221.0 290K_n101458
HG 39 LEU QQD 4.70 # 1M 111172.5*2 290K_n10 719
QQD 41 GLN HN 7.90 # 5M 5274.0*2 290K_n102541
40 GLY
HN 40 GLY HA1 2.80 <# 2 118900.0 Ce1n100g 501
HN 40 GLY HA2 3.20 ># 2 57440.0 Ce1n100g 508
HA1 41 GLN HN 3.30 # 2 44068.5 290K_n101843
HA2 41 GLN HN 3.50 # 2 33900.0 Ce1n100g1844
41 GLN
HN 41 GLN HA 3.30 # 2 44850.0 Ce1n100g 484
HN 41 GLN HB2 3.10 <# 2 70240.0 Ce1n100g 486
HN 41 GLN HB3 3.60 ># 2 29980.0 Ce1n100g 485
HN 41 GLN QG 4.10 # m 1 20659.5*2 290K_n101847
HN 42 ASN HN 4.40 # 2 7767.0 ! Ce1n100g1617
HA 41 GLN HB2 3.50 ># 2 35118.0 290K_n101042
HA 41 GLN HB3 2.90 <# 2 106300.0 Ce1n100g 487
HA 41 GLN QG 3.90 # i 1 16215.8*2 290K_n101850
HA 42 ASN HN 2.90 # 2 96530.0 Ce1n100g1128
HB2 41 GLN QG 3.20 # m 1 81950.0*2 Ce1n100g1849
HB2 42 ASN HN 3.70 ># 2 22122.0 290K_n101130
HB2 43 PRO HD3 3.80 # 5 16950.0 Ce1n100g2328
HB3 42 ASN HN 3.30 <# 2 45000.0 Ce1n100g1616
QG 41 GLN HE21 4.40 <# m 1 14490.0*2 Ce1n100g1530
QG 41 GLN HE22 6.50 ># m 1 2156.8*2 290K_n102313
QG 42 ASN HN 5.20 # m 5 10250.0*2 Ce1n100g1856
42 ASN
HN 42 ASN HA 3.40 # 2 39850.0 Ce1n100g 124
HN 42 ASN HB2 3.70 # 2 23470.0 Ce1n100g1853
HN 42 ASN HB3 3.60 # 2 29180.0 Ce1n100g1852
HN 42 ASN HD21 6.00 # w 1 1388.7 290K_n102762
HN 43 PRO HD2 4.00 ># 5 12510.0 Ce1n100g1120
HN 43 PRO HD3 3.60 <# 5 26630.0 Ce1n100g1119
HA 42 ASN HB2 3.20 # 2 52450.0 Ce1n100g 136
HA 42 ASN HB3 3.10 # 2 70990.0 Ce1n100g 137
HA 43 PRO QG 4.90 # m 5 15250.0*2 Ce1n100g2069
HA 43 PRO HD2 2.90 # 5 102700.0 Ce1n100g1575
HA 43 PRO HD3 3.10 # 5 63360.0 Ce1n100g1573
HB2 42 ASN HD21 2.70 # 1 35586.0 290K_n101543
HB2 42 ASN HD22 3.50 # 1 13460.0 Ce1n100g1864
HB2 43 PRO HD3 4.70 # 5 4932.0 290K_n102423
HB3 42 ASN HD21 3.20 # 1 19768.5 290K_n101544
HB3 42 ASN HD22 4.00 # 1 7372.0 Ce1n100g1535
43 PRO
HA 43 PRO HB3 2.60 # 2 183100.0 Ce1n100g1858
HA 43 PRO QG 3.50 # i 1 28600.0*2 Ce1n100g1861
HA 44 THR HN 2.90 # 2 113100.0 Ce1n100g1857
HA 47 GLU- QB 5.10 # m 3 14120.0*2 Ce1n100g2459
HB2 44 THR HN 3.20 # 2 56830.0 Ce1n100g1863
HB2 47 GLU- QB 4.60 # m 5 25220.0*2 Ce1n100g2472
HB2 48 LEU QD1 4.60 # 5M 21510.0 Ce1n100g2447
HB3 43 PRO HD2 2.30 # 1 69660.0 Ce1n100g1901
HB3 43 PRO HD3 2.70 # 1 39150.0 290K_n101900
HB3 48 LEU QD2 5.00 # 5M 15080.0 Ce1n100g2446
QG 43 PRO HD2 3.30 # m 1 76800.0*2 Ce1n100g1862
QG 43 PRO HD3 3.50 # m 1 53000.0*2 Ce1n100g1860
QG 48 LEU QD1 5.40 ># m 5M 26032.5*2 290K_n102477
QG 48 LEU QD2 4.50 <# m 5M 63100.0*2 Ce1n100g2443
44 THR
HN 44 THR HA 3.10 # 2 74950.0 Ce1n100g 92
HN 44 THR HB 3.50 # 2 30480.0 ! Ce1n100g1239
HN 44 THR QG2 3.30 # 1M 112600.0 Ce1n100g 93
HN 47 GLU- HN 4.30 # 3 10640.0 Ce1n100g1156
HN 47 GLU- QB 4.40 # m 3 45195.0*2 Ce1n100g1356
HA 44 THR HB 3.90 # 2 17770.5 290K_n101351
HA 44 THR QG2 3.30 # 1M 116400.0 Ce1n100g 96
HA 45 GLU- HN 2.70 # 2 144500.0 Ce1n100g1168
HA 46 ALA HN 4.20 # 3 13050.0 Ce1n100g1410
HA 47 GLU- HN 5.70 # 3 1959.0 Ce1n100g1355
HA 47 GLU- QB 5.60 # m 3 7820.0*2 Ce1n100g1357
HB 44 THR QG2 3.10 # 1M 181700.0 Ce1n100g1352
HB 45 GLU- HN 2.80 # 2 117300.0 Ce1n100g1353
HB 47 GLU- HN 4.50 # 3 7948.0 Ce1n100g2308
QG2 45 GLU- HN 4.90 # 5M 16254.0 290K_n101354
QG2 47 GLU- QB 5.50 # m 5M 24360.0*2 Ce1n100g2435
45 GLU-
HN 45 GLU- HA 3.30 # 2 50230.0 Ce1n100g 75
HN 45 GLU- QB 3.70 # i 2 70250.0*2 Ce1n100g 79
HN 45 GLU- QG 4.00 # m 1 25180.0*2 Ce1n100g 77
HN 46 ALA HN 3.20 # 2 51710.0 Ce1n100g1349
HN 48 LEU QD1 6.30 # 5M 6196.0 Ce1n100g2031
HA 45 GLU- QB 4.20 # m 2 59782.5*2 290K_n10 83
HA 45 GLU- QG 3.30 # i 1 35325.0*2 290K_n10 81
HA 46 ALA HN 4.20 # 2 11210.0 Ce1n100g1348
HA 48 LEU HN 4.20 # 3 12980.0 Ce1n100g1344
HA 48 LEU HB2 3.60 <# 3 33060.0 Ce1n100g2378
HA 48 LEU HB3 4.60 ># 3 7326.0 290K_n102376
HA 48 LEU QD1 3.50 # 5M 68625.0 290K_n102327
HA 49 GLN HN 4.70 # 3 6755.0 Ce1n100g1345
QB 45 GLU- QG 5.10 # mm 1 22500.0*2*2 Ce1n100g 86
QB 46 ALA HN 4.50 # m 2 35190.0*2 Ce1n100g1301
QG 46 ALA HN 6.00 # m 5 3548.0*2 Ce1n100g1350
46 ALA
HN 46 ALA HA 3.00 # 2 80970.0 Ce1n100g 246
HN 46 ALA QB 3.00 # s 2M 173700.0 Ce1n100g 250
HN 47 GLU- HN 3.20 # 2 53070.0 Ce1n100g1149
HN 47 GLU- QB 5.70 # m 2 5540.0*2 Ce1n100g1151
HN 48 LEU QD1 7.00 # 5M 4010.8 290K_n102260
HN 49 GLN HN 4.90 # 3 5309.0 Ce1n100g1155
HA 46 ALA QB 3.00 # s 2M 153090.0 290K_n10 248
HA 47 GLU- HN 4.30 # 2 9432.0 290K_n101346
HA 49 GLN HN 3.90 # 3 18780.0 Ce1n100g1154
HA 49 GLN QB 4.40 # m 3 49612.5*2 290K_n102390
QB 47 GLU- HN 3.30 # 2M 38997.0 290K_n101347
47 GLU-
HN 47 GLU- HA 3.20 # 2 56100.0 Ce1n100g 511
HN 47 GLU- QB 3.60 # i 2 84400.0*2 Ce1n100g 516
HN 48 LEU HN 2.90 # 2 108100.0 Ce1n100g1146
HA 47 GLU- QB 4.10 # m 2 75000.0*2 Ce1n100g 514
HA 48 LEU HN 4.00 # 2 13820.0 Ce1n100g1138
HA 50 ASP- HN 3.90 # 3 20990.0 Ce1n100g1147
HA 50 ASP- HB2 3.40 <# 3 45530.0 Ce1n100g2332
HA 50 ASP- HB3 3.90 ># 3 20420.0 Ce1n100g2335
QB 48 LEU HN 4.60 # m 2 27885.0*2 Ce1n100g1343
48 LEU
HN 48 LEU HA 3.30 # 2 48000.0 Ce1n100g 346
HN 48 LEU HB2 3.10 # 2 66380.0 Ce1n100g 352
HN 48 LEU HB3 3.50 # 2 34969.5 290K_n10 348
HN 48 LEU HG 2.20 # 1 93130.0 Ce1n100g1326
HN 48 LEU QD1 4.10 # 1M 30060.0 Ce1n100g 349
HN 48 LEU QD2 4.40 # 1M 20570.0 Ce1n100g 350
HA 48 LEU HB2 3.60 # 2 29760.0 Ce1n100g 362
HA 48 LEU HB3 3.20 # 2 57000.0 Ce1n100g 363
HA 48 LEU HG 3.30 # 1 15736.5 290K_n101325
HA 48 LEU QD1 4.90 ># 1M 10287.0 290K_n10 360
HA 48 LEU QD2 3.20 <# 1M 132800.0 Ce1n100g 365
HA 49 GLN HN 4.00 # 2 15640.0 Ce1n100g1140
HA 51 MET HN 4.20 # 3 12900.0 Ce1n100g1141
HA 51 MET HB2 3.60 <# 3 35250.0 Ce1n100g2425
HA 51 MET HB3 4.60 ># 3 7758.0 290K_n102426
HA 51 MET HG2 4.00 # 5 13000.0 Ce1n100g2456
HA 52 ILE HN 5.20 # 3 3300.0 Ce1n100g1161
HB2 48 LEU HG 3.00 # 1 24169.5 290K_n101327
HB2 48 LEU QD1 3.10 # 1M 173100.0 Ce1n100g 367
HB2 48 LEU QD2 3.80 # 1M 49720.0 Ce1n100g 366
HB2 49 GLN HN 3.40 # 2 41860.0 Ce1n100g1335
HB3 48 LEU HG 3.10 # 1 20330.0 Ce1n100g1331
HB3 48 LEU QD1 3.60 # 1M 64305.0 290K_n102713
HB3 48 LEU QD2 3.30 # 1M 116595.0 290K_n10 373
HB3 49 GLN HN 3.40 # 2 36860.0 Ce1n100g1336
HG 48 LEU QD1 3.30 # 1M 110800.0 Ce1n100g1332
HG 48 LEU QD2 3.30 # 1M 118300.0 Ce1n100g1329
HG 49 GLN HN 5.10 # 5 3235.9 290K_n101339
QD1 49 GLN HN 4.90 <# 5M 16596.0 290K_n101337
QD2 49 GLN HN 6.50 ># 5M 5301.0 290K_n101338
49 GLN
HN 49 GLN HA 3.20 # 2 51890.0 Ce1n100g 334
HN 49 GLN QB 3.60 # i 2 80200.0*2 Ce1n100g 336
HN 49 GLN QG 4.30 # m 1 15950.0*2 Ce1n100g 335
HN 49 GLN HE22 5.90 # 1 1622.7 290K_n102566
HN 50 ASP- HN 3.00 # 2 83590.0 Ce1n100g1314
HA 49 GLN QB 4.10 # m 2 74092.5*2 290K_n10 341
HA 49 GLN QG 3.30 # i 1 37867.5*2 290K_n10 342
HA 50 ASP- HN 4.10 # 2 12613.5 290K_n101315
HA 52 ILE HN 3.90 # 3 18590.0 Ce1n100g1313
HA 52 ILE HB 3.30 # 3 58390.0 Ce1n100g1905
HA 52 ILE QG2 5.10 # 5M 14008.5 290K_n102124
HA 52 ILE QD1 5.40 # 5M 11047.5 290K_n102399
HA 53 ASN HN 4.30 # 3 11400.0 Ce1n100g1319
QB 49 GLN QG 4.60 # mm 1 41250.0*2*2 Ce1n100g 339
QB 49 GLN HE22 5.20 # m 1 6295.5*2 290K_n102695
QB 50 ASP- HN 4.50 # m 2 35325.0*2 290K_n101317
QG 49 GLN HE21 4.20 # m 1 18930.0*2 Ce1n100g 844
QG 49 GLN HE22 3.80 # m 1 34290.0*2 Ce1n100g 845
QG 50 ASP- HN 5.50 # m 5 6797.2*2 290K_n101316
QG 53 ASN HN 5.50 # m 5 6543.0*2 290K_n102511
QG 53 ASN HD21 5.50 ># m 5 6763.5*2 290K_n101916
QG 53 ASN HD22 4.90 <# m 5 14958.0*2 290K_n101525
HE21 52 ILE HB 4.40 # 5 7281.0 290K_n102597
HE21 52 ILE QG2 5.20 # 5M 12690.0 290K_n102039
HE22 52 ILE QG2 6.00 # 5M 7362.0 290K_n102127
50 ASP-
HN 50 ASP- HA 3.10 # 2 69290.0 Ce1n100g 384
HN 50 ASP- HB2 2.90 # 2 100600.0 Ce1n100g 385
HN 50 ASP- HB3 3.30 # 2 51190.0 Ce1n100g 392
HN 51 MET HN 3.10 # 2 73520.0 Ce1n100g1308
HA 50 ASP- HB2 2.90 # 2 99720.0 Ce1n100g 390
HA 50 ASP- HB3 2.80 # 2 116400.0 Ce1n100g 391
HA 51 MET HN 4.00 # 2 13700.0 Ce1n100g1309
HA 53 ASN HN 3.80 # 3 23980.0 Ce1n100g1320
HA 53 ASN QB 4.30 # m 3 52350.0*2 Ce1n100g2089
HA 53 ASN HD21 3.60 <# 5 27508.5 290K_n101322
HA 53 ASN HD22 4.70 ># 5 5267.0 Ce1n100g1318
HA 54 GLU- HN 5.40 # 3 2731.0 Ce1n100g1321
HB2 51 MET HN 3.70 <# 2 24331.5 290K_n101311
HB3 51 MET HN 4.30 ># 2 9814.0 Ce1n100g1310
HB3 51 MET HA 3.80 # 2 18612.0 290K_n102854
51 MET
HN 51 MET HA 3.20 # 2 55580.0 Ce1n100g 556
HN 51 MET HB2 3.00 <# 2 83770.0 Ce1n100g 559
HN 51 MET HB3 3.60 ># 2 25500.0 Ce1n100g 560
HN 51 MET HG2 3.60 ># 1 11277.0 290K_n10 558
HN 51 MET HG3 2.70 <# 1 37813.5 290K_n10 557
HN 52 ILE HN 3.10 # 2 65010.0 Ce1n100g1303
HN 53 ASN HN 4.80 # 3 5643.0 290K_n102567
HA 51 MET HB2 3.30 # 2 50400.0 Ce1n100g 576
HA 51 MET HB3 3.20 # 2 59175.0 290K_n10 565
HA 51 MET HG2 2.70 # 1 37206.0 290K_n10 571
HA 51 MET HG3 2.90 # 1 27121.5 290K_n10 566
HA 52 ILE HN 3.70 # 2 25209.0 290K_n101269
HA 53 ASN HN 4.90 # 3 5277.0 Ce1n100g1271
HA 54 GLU- HN 4.00 # 3 17850.0 Ce1n100g1266
HB2 51 MET HG2 3.30 # 1 15615.0 290K_n10 574
HB2 51 MET HG3 3.30 # 1 16030.0 Ce1n100g 569
HB2 52 ILE HN 3.50 # 2 30900.0 Ce1n100g1305
HB3 51 MET HG2 2.90 # 1 27004.5 290K_n10 584
HB3 51 MET HG3 3.50 # 1 12910.0 Ce1n100g 581
HB3 52 ILE HN 3.70 # 2 23870.0 Ce1n100g1304
52 ILE
HN 52 ILE HA 3.30 # 2 44400.0 Ce1n100g 780
HN 52 ILE HB 2.80 # 2 120200.0 Ce1n100g 781
HN 52 ILE QG2 4.50 # 1M 17300.0 Ce1n100g 785
HN 52 ILE HG12 3.10 # 1 22400.0 Ce1n100g 783
HN 52 ILE HG13 2.70 # 1 39186.0 290K_n10 782
HN 52 ILE QD1 4.70 # 1M 13239.0 ! 290K_n10 784
HN 53 ASN HN 3.10 # 2 63000.0 Ce1n100g1293
HA 52 ILE HB 3.20 # 2 53910.0 290K_n10 793
HA 52 ILE QG2 3.60 # 1M 65210.0 Ce1n100g 791
HA 52 ILE HG12 2.70 <# 1 35260.0 Ce1n100g 789
HA 52 ILE HG13 3.30 ># 1 16950.0 Ce1n100g 788
HA 52 ILE QD1 4.10 # 1M 28476.0 ! 290K_n10 814
HA 53 ASN HN 4.00 # 2 13788.0 290K_n101300
HA 55 VAL HN 4.70 # 3 6493.5 290K_n101324
HA 55 VAL QG2 4.30 # 5M 27049.5 290K_n101720
HA 63 ILE HG12 4.60 # 5 5545.0 Ce1n100g2106
HA 63 ILE HG13 4.40 # 5 7015.5 290K_n102102
HA 63 ILE QD1 4.00 # 5M 38820.0 Ce1n100g1734
HB 52 ILE QG2 3.30 # 1M 118800.0 Ce1n100g 797
HB 52 ILE HG12 2.90 ># 1 29173.5 290K_n10 795
HB 52 ILE HG13 2.40 <# 1 65840.0 Ce1n100g 794
HB 52 ILE QD1 3.90 # 1M 41720.0 Ce1n100g 813
HB 53 ASN HN 3.10 # 2 63490.0 Ce1n100g1299
QG2 52 ILE HG12 4.30 # 1M 22558.5 290K_n10 805
QG2 52 ILE HG13 4.00 # 1M 35590.0 Ce1n100g 800
QG2 52 ILE QD1 4.40 # m 1M 103320.0 290K_n10 810
QG2 53 ASN HN 4.40 # 5M 25690.0 Ce1n100g1296
QG2 53 ASN HA 4.80 # 5M 18369.0 290K_n102611
QG2 53 ASN QB 8.00 # m w 5M 536.6*2 290K_n102726
QG2 56 ASP- HA 6.40 # 5M 5611.5 290K_n102025
QG2 62 THR HA 5.10 # 5M 14150.0 Ce1n100g2104
QG2 63 ILE HG12 6.00 # 5M 7455.0 Ce1n100g2117
QG2 63 ILE HG13 5.80 # 5M 8208.0 290K_n102006
QG2 63 ILE QD1 6.80 # m 5M 8470.0 Ce1n100g2007
HG12 52 ILE QD1 3.40 # 1M 87800.0 Ce1n100g 804
HG12 63 ILE HG13 5.20 # 5 2835.0 Ce1n100g2133
HG12 63 ILE QD1 4.90 # 5M 16740.0 Ce1n100g2118
HG13 52 ILE QD1 3.30 # 1M 112995.0 290K_n10 812
QD1 62 THR HA 4.50 # 5M 23571.0 290K_n102105
QD1 63 ILE HG12 4.80 # 5M 18004.5 290K_n102717
QD1 63 ILE HG13 4.40 # 5M 25848.0 290K_n102004
QD1 63 ILE QD1 5.40 # m 5M 25720.0 Ce1n100g2005
53 ASN
HN 53 ASN HA 3.10 # 2 64890.0 Ce1n100g 262
HN 53 ASN QB 3.70 # i 2 74150.0*2 Ce1n100g 266
HN 54 GLU- HN 3.30 # 2 51580.0 Ce1n100g1289
HA 53 ASN QB 3.70 # i 2 75400.0*2 Ce1n100g 264
HA 54 GLU- HN 3.60 # 2 25750.0 Ce1n100g1291
HA 56 ASP- HN 3.80 # 3 24830.0 Ce1n100g1358
QB 53 ASN HD21 3.60 <# m 1 42380.0*2 Ce1n100g2090
QB 53 ASN HD22 4.20 ># m 1 18100.0*2 Ce1n100g1838
QB 54 GLU- HN 4.60 # m 2 27660.0*2 Ce1n100g1292
54 GLU-
HN 54 GLU- HA 3.00 # 2 82590.0 Ce1n100g 680
HN 54 GLU- HB2 3.00 <# 2 82630.0 Ce1n100g 683
HN 54 GLU- HB3 3.50 ># 2 30560.0 Ce1n100g 684
HN 54 GLU- HG2 3.20 # 1 17716.5 290K_n10 681
HN 54 GLU- HG3 3.30 # 1 17070.0 Ce1n100g 682
HN 55 VAL HN 3.20 # 2 54220.0 Ce1n100g1285
HN 55 VAL QG2 6.40 # 5M 5526.0 290K_n102011
HA 54 GLU- HB2 3.00 # 2 80000.0 Ce1n100g 702
HA 54 GLU- HB3 3.00 # 2 89910.0 Ce1n100g 706
HA 54 GLU- HG2 2.90 <# 1 30000.0 Ce1n100g 691
HA 54 GLU- HG3 3.60 ># 1 11000.0 Ce1n100g 687
HA 55 VAL HN 4.10 # 2 12654.0 290K_n102774
HB2 54 GLU- HG2 3.10 # 1 20641.5 290K_n10 692
HB2 54 GLU- HG3 2.70 # 1 35630.0 Ce1n100g 698
HB2 55 VAL HN 4.30 # 2 8815.5 290K_n101288
HB2 55 VAL QG1 5.20 # 5M 12726.0 290K_n102700
HB3 54 GLU- HG2 2.70 # 1 35865.0 290K_n10 705
HB3 54 GLU- HG3 3.40 # 1 14683.5 290K_n10 699
HB3 55 VAL HN 4.10 # 2 13522.5 290K_n101287
55 VAL
HN 55 VAL HA 3.50 # 2 33354.0 290K_n10 876
HN 55 VAL HB 4.00 # 2 14790.0 Ce1n100g 877
HN 55 VAL QG1 4.10 ># 1M 31280.0 Ce1n100g 878
HN 55 VAL QG2 3.50 <# 1M 73575.0 290K_n10 875
HN 56 ASP- HN 2.90 # 2 110000.0 Ce1n100g1284
HN 56 ASP- HA 5.30 # 2 2681.0 Ce1n100g1323
HA 55 VAL HB 3.00 # 2 90940.0 Ce1n100g 880
HA 55 VAL QG1 3.40 <# 1M 100700.0 Ce1n100g 881
HA 55 VAL QG2 4.00 ># 1M 34443.0 290K_n10 892
HA 56 ASP- HN 4.00 # 2 14350.0 Ce1n100g1359
HB 55 VAL QG1 3.10 # 1M 169900.0 Ce1n100g 884
HB 55 VAL QG2 3.20 # 1M 133200.0 Ce1n100g 891
QG1 56 ASP- HN 5.90 ># 5M 7668.0 290K_n102233
QG1 63 ILE QG2 6.80 <# m 5M 8401.5 290K_n101719
QG1 70 THR HB 5.00 # 5M 14980.0 Ce1n100g2213
QG1 70 THR QG2 4.50 # m 5M 65340.0 290K_n101735
QG1 71 MET HN 4.70 <# 5M 19215.0 290K_n101375
QG1 71 MET HA 3.50 # 5M 66680.0 Ce1n100g2469
QG1 71 MET HG2 4.50 # 5M 24120.0 Ce1n100g2186
QG2 56 ASP- HN 4.70 <# 5M 19318.5 290K_n101361
QG2 63 ILE QG2 8.00 ># m w 5M 2782.3 290K_n102901
QG2 63 ILE HG12 5.30 # 5M 12010.0 Ce1n100g2012
QG2 63 ILE HG13 6.60 # 5M 4896.0 Ce1n100g2111
QG2 63 ILE QD1 5.20 # m 5M 30200.0 Ce1n100g1721
QG2 67 GLU- HB2 7.00 # w 5M 2484.9 290K_n102614
QG2 68 PHE HA 7.00 # w 5M 2777.8 290K_n102725
QG2 71 MET HN 6.10 ># 5M 6723.0 290K_n102010
QG2 71 MET HB2 5.40 # 5M 11394.0 290K_n102183
QG2 71 MET HG2 4.90 # 5M 16614.0 290K_n102253
56 ASP-
HN 56 ASP- HA 2.70 # 2 144500.0 ! Ce1n100g1365
HN 56 ASP- QB 4.70 # i 2 11930.0*2 Ce1n100g1363
HA 56 ASP- QB 3.90 # i 2 44887.5*2 290K_n101010
HA 63 ILE QG2 6.80 # 5M 4364.1 290K_n102809
58 ASP-
HN 58 ASP- HA 4.50 # 2 7029.0 Ce1n30h21712
HA 58 ASP- HB2 2.70 # 2 149100.0 Ce1n100g 855
HA 58 ASP- HB3 2.80 # 2 115900.0 Ce1n100g 856
HA 59 GLY HN 5.70 # 2 1623.6 290K_n102576
59 GLY
HN 59 GLY HA1 2.90 <# 2 97020.0 Ce1n30h21707
HN 59 GLY HA2 3.50 ># 2 30540.0 Ce1n30h21708
60 ASN
HN 61 GLY HN 3.90 # 2 16848.0 Ce1n30h21694
HA 60 ASN HB2 3.00 # 2 92520.0 Ce1n100g 847
HA 60 ASN HB3 3.10 # 2 71100.0 Ce1n100g 850
61 GLY
HN 61 GLY HA1 3.90 # 2 17577.0 Ce1n30h21696
62 THR
HA 63 ILE HN 3.00 # 2 85090.0 Ce1n100g2433
HA 63 ILE HG13 5.10 # 5 2937.6 290K_n102103
63 ILE
HN 63 ILE HB 3.40 # 2 38722.5 290K_n101732
HN 63 ILE HG13 3.60 # 1 12080.0 Ce1n100g2115
HB 63 ILE QG2 3.60 # 1M 68360.0 Ce1n100g1659
HB 63 ILE HG12 3.20 # 1 18240.0 Ce1n100g1649
HB 63 ILE HG13 2.90 # 1 29900.0 Ce1n100g1662
HB 63 ILE QD1 3.70 # 1M 55800.0 ! 290K_n101663
QG2 63 ILE HG12 4.50 # 1M 18250.0 Ce1n100g1724
QG2 63 ILE HG13 4.60 # 1M 14719.5 290K_n101727
QG2 63 ILE QD1 4.80 # m 1M 52450.0 Ce1n100g1725
QG2 67 GLU- HN 7.00 # w 5M 1805.4 290K_n102542
QG2 67 GLU- HB2 4.60 # 5M 21217.5 290K_n102615
QG2 68 PHE HN 4.30 # 5M 28400.0 Ce1n100g1061
QG2 68 PHE HA 3.90 # 5M 39856.5 290K_n101090
QG2 68 PHE QB 5.80 # m 5M 18410.0*2 Ce1n100g1091
QG2 68 PHE CG 7.10 # r 5M 14590.0*2 Ce1n100g1919
HG12 63 ILE QD1 3.70 # 1M 54200.0 Ce1n100g1651
HG13 63 ILE QD1 3.50 # 1M 80040.0 Ce1n100g1655
QD1 68 PHE HN 7.00 # w 5M 2104.6 290K_n102792
QD1 68 PHE HA 4.60 # 5M 20871.0 290K_n101925
QD1 68 PHE CG 8.80 # r 5M 4439.5*2 Ce1n100g2018
64 ASP-
HN 67 GLU- HB2 3.70 # 3 29019.0 Ce1n30h21700
HA 64 ASP- HB2 4.20 ># 2 10417.5 290K_n101680
HA 64 ASP- HB3 3.50 <# 2 33310.0 Ce1n100g1682
HA 65 PHE HN 3.40 # 2 36470.0 Ce1n100g1685
HB2 65 PHE HN 4.90 ># 2 4073.0 Ce1n100g1683
HB3 65 PHE HN 3.20 <# 2 59370.0 Ce1n30h21611
65 PHE
HN 65 PHE HA 3.60 # 2 26560.0 Ce1n100g1394
HN 65 PHE HB2 3.20 # 2 55140.0 Ce1n100g1272
HN 65 PHE HB3 3.10 # 2 63880.0 Ce1n100g1278
HN 65 PHE CG 6.00 # r 1 7595.0*2 Ce1n100g1759
HN 66 PRO HD2 3.50 # 5 31180.0 Ce1n100g1396
HN 66 PRO HD3 3.70 # 5 22210.0 Ce1n100g1395
HA 65 PHE HB2 3.90 ># 2 16660.0 Ce1n100g1588
HA 65 PHE HB3 3.20 <# 2 52660.0 Ce1n100g1589
HA 65 PHE CG 3.40 # m 1 62100.0*2 Ce1n100g1606
HA 65 PHE CZ 5.40 # i 1 3518.0*2 Ce1n100g1464
HA 68 PHE HN 3.90 # 3 18500.0 Ce1n100g1060
HA 68 PHE QB 5.20 # m 3 13485.0*2 Ce1n100g1092
HA 68 PHE CG 6.60 # r 5 5905.0*2 Ce1n100g1607
HA 69 LEU HN 4.60 # 3 7409.0 Ce1n100g1095
HB2 65 PHE CG 4.40 # r 1 61650.0*2 Ce1n100g1609
HB2 65 PHE CZ 8.00 # r w 1 1422.0*2 Ce1n100g1267
HB2 66 PRO HD3 4.20 # 5 9575.0 Ce1n100g1590
HB3 65 PHE CG 4.60 # r 1 43750.0*2 Ce1n100g2338
HB3 66 PRO HD3 4.20 # 5 10000.0 Ce1n100g1591
CG 65 PHE CZ 6.30 # rr 1 78425.0*2*2 Ce1n100g 914
CG 65 PHE HZ 5.50 # r 1 12360.0*2 Ce1n100g 913
CG 66 PRO HA 6.90 # r 5 3907.0*2 Ce1n100g2045
CG 66 PRO HD3 6.30 # r 5 8270.0*2 Ce1n100g2046
CG 68 PHE CG 8.30 # rr 5 8567.5*2*2 Ce1n100g1270
CG 69 LEU QD1 7.70 # r 5M 9320.0*2 Ce1n100g 829
CG 69 LEU QD2 8.00 # r 5M 7275.0*2 Ce1n100g1614
CZ 65 PHE HZ 4.00 # r 1 123700.0*2 Ce1n100g 912
CZ 68 PHE CG 8.20 # rr 5 10060.0*2*2 Ce1n100g1463
CZ 68 PHE CZ 8.20 # rr 5 9800.0*2*2 Ce1n100g2301
CZ 69 LEU HB3 6.50 # r 5 6817.5*2 290K_n102044
CZ 69 LEU HG 6.70 # r 5 4971.0*2 Ce1n100g1502
CZ 69 LEU QD1 6.50 # r 5M 22990.0*2 Ce1n100g1500
CZ 69 LEU QD2 6.70 # r 5M 19785.0*2 Ce1n100g1501
HZ 69 LEU HG 4.40 # 5 7632.0 ! Ce1n100g1522
HZ 69 LEU QD1 4.80 ># 5M 18440.0 Ce1n100g1613
HZ 69 LEU QD2 3.90 <# 5M 44100.0 Ce1n100g2242
66 PRO
HA 66 PRO HB2 2.80 <# 2 134000.0 Ce1n100g1565
HA 66 PRO HB3 3.70 ># 2 22000.0 Ce1n100g1566
HA 66 PRO HG2 3.60 # 1 11560.0 Ce1n100g1594
HA 66 PRO HG3 3.60 # 1 11420.0 Ce1n100g1563
HA 67 GLU- HN 6.00 # w 2 690.3 290K_n102780
HA 69 LEU HN 4.10 # 3 15640.0 Ce1n100g1055
HA 69 LEU HB2 4.20 # 3 12717.0 290K_n102650
HA 69 LEU HB3 3.80 # 3 21710.0 Ce1n100g1602
HA 69 LEU HG 3.80 # 5 16843.5 ! 290K_n101604
HA 69 LEU QD1 3.40 <# 5M 75180.0 Ce1n100g1603
HA 69 LEU QD2 6.00 ># 5M 7581.0 Ce1n100g1605
HA 70 THR HN 5.10 # 3 3876.0 Ce1n100g1599
HB2 66 PRO HG2 2.10 # 1 97290.0 290K_n101598
HB2 66 PRO HG3 2.20 # 1 85000.0 Ce1n100g1082
HB2 66 PRO HD2 2.80 # 1 31710.0 Ce1n100g1083
HB2 66 PRO HD3 3.40 # 1 14590.0 Ce1n100g1561
HB2 67 GLU- HN 3.80 <# 2 18530.0 Ce1n100g1085
HB3 66 PRO HG3 2.00 # 1 141000.0 Ce1n100g1078
HB3 66 PRO HD2 3.50 # 1 13000.0 Ce1n100g1077
HB3 66 PRO HD3 2.50 # 1 47250.0 Ce1n100g1080
HB3 67 GLU- HN 4.80 ># 2 4674.0 Ce1n100g1068
HG2 66 PRO HD2 3.50 # 1 13000.0 Ce1n100g1596
HG2 66 PRO HD3 2.50 # 1 47250.0 Ce1n100g1595
HG2 67 GLU- HN 4.80 # 5 4623.0 Ce1n100g2494
HG3 66 PRO HD2 2.60 # 1 42560.0 Ce1n100g1076
HG3 66 PRO HD3 2.20 # 1 89030.0 Ce1n100g1079
HG3 67 GLU- HN 5.10 # 5 2948.0 Ce1n100g1568
HD2 67 GLU- HN 5.30 ># 5 2328.0 Ce1n100g1073
HD3 67 GLU- HN 3.70 <# 5 19930.0 Ce1n100g1065
67 GLU-
HN 67 GLU- HA 3.60 # 2 27000.0 Ce1n100g 3
HN 67 GLU- HB2 3.70 <# 2 22200.0 Ce1n100g1066
HN 67 GLU- HB3 4.30 ># 2 9692.0 Ce1n100g1069
HN 68 PHE HN 3.40 # 2 41750.0 Ce1n100g1056
HN 69 LEU HN 5.60 # 3 2305.0 Ce1n100g1743
HA 67 GLU- HB3 3.20 # 2 62145.0 290K_n101750
HA 68 PHE HN 4.10 # 2 12163.5 290K_n101063
HA 70 THR HN 4.20 # 3 12330.0 ! Ce1n100g1475
HB2 68 PHE HN 4.50 # 2 7114.0 Ce1n100g1062
68 PHE
HN 68 PHE HA 3.00 # 2 78320.0 Ce1n100g 6
HN 68 PHE QB 4.10 # i 2 31675.0*2 Ce1n100g 9
HN 68 PHE CG 6.00 # r 1 7660.0*2 Ce1n100g2087
HN 69 LEU HN 3.30 # 2 44000.0 Ce1n100g1053
HN 69 LEU HG 5.10 # 5 3019.5 290K_n102544
HN 70 THR HN 5.20 # 3 3415.0 Ce1n100g1807
HA 68 PHE QB 3.70 # m 2 156250.0*2 Ce1n100g 8
HA 68 PHE CG 3.20 # m 1 87650.0*2 Ce1n100g1277
HA 69 LEU HN 3.50 # 2 35320.0 ! Ce1n100g1087
HA 71 MET HN 4.00 # 3 16430.0 Ce1n100g1376
HA 71 MET HB2 3.80 <# 3 23490.0 Ce1n100g2468
HA 71 MET HB3 4.30 ># 3 11530.0 Ce1n100g2410
QB 68 PHE CG 6.20 # mr 1 19365.0*2*2 Ce1n100g1276
QB 69 LEU HN 5.10 # m 2 13215.0*2 Ce1n100g1049
CG 68 PHE CZ 6.40 # rr 1 64600.0*2*2 Ce1n100g 908
CG 68 PHE HZ 5.00 # r 1 23130.0*2 290K_n10 907
CG 69 LEU HN 6.50 # r 5 6845.0*2 Ce1n100g1051
CG 69 LEU HA 6.90 # r 5 4097.5*2 Ce1n100g1545
CG 69 LEU HB2 6.80 ># r 5 4332.0*2 Ce1n100g2029
CG 69 LEU HB3 6.10 <# r 5 12090.0*2 Ce1n100g2322
CG 69 LEU QD2 7.40 # r 5M 11660.0*2 Ce1n100g2223
CG 72 MET QE 8.90 # r 5M 4208.0*2 Ce1n100g2484
CZ 68 PHE HZ 4.00 # r 1 181450.0*2 Ce1n100g 906
CZ 69 LEU HB3 6.20 # r 5 9625.0*2 Ce1n100g1548
CZ 69 LEU QD2 9.00 # r w 5M 2208.5*2 Ce1n100g2225
CZ 72 MET QE 7.60 # r 5M 9790.0*2 Ce1n100g2485
HZ 72 MET QE 5.40 # 5M 11043.0 290K_n102052
69 LEU
HN 69 LEU HA 3.30 # 2 44680.0 Ce1n100g 239
HN 69 LEU HB2 3.10 <# 2 63410.0 Ce1n100g1012
HN 69 LEU HB3 3.50 ># 2 31000.5 290K_n10 240
HN 69 LEU HG 3.60 # 1 11500.0 Ce1n100g2155
HN 69 LEU QD1 4.40 # 1M 19710.0 Ce1n100g1013
HN 69 LEU QD2 4.60 # 1M 15736.5 290K_n101014
HN 70 THR HN 3.30 # 2 49830.0 Ce1n100g1466
HA 69 LEU HB2 3.20 # 2 55620.0 Ce1n100g1020
HA 69 LEU HB3 2.90 # 2 98460.0 Ce1n100g 241
HA 69 LEU HG 3.10 # 1 22740.0 Ce1n100g2156
HA 69 LEU QD1 4.50 ># 1M 16370.0 Ce1n100g1029
HA 69 LEU QD2 3.30 <# 1M 125100.0 Ce1n100g1032
HA 70 THR HN 3.80 # 2 19100.0 Ce1n100g1470
HA 72 MET HN 4.00 # 3 15930.0 Ce1n100g1478
HA 72 MET QB 5.40 # m 3 9868.5*2 290K_n102910
HA 72 MET HG3 4.30 # 5 8590.5 290K_n102871
HA 73 ALA HN 4.50 # 3 8892.0 290K_n101483
HB2 69 LEU HG 2.50 # 1 55395.0 290K_n101038
HB2 69 LEU QD1 3.10 # 1M 173800.0 Ce1n100g1022
HB2 69 LEU QD2 4.10 # 1M 28656.0 290K_n101023
HB2 70 THR HN 3.60 <# 2 28440.0 Ce1n100g1471
HB2 70 THR QG2 4.90 # 5M 17160.0 Ce1n100g2513
HB3 69 LEU QD1 3.50 # 1M 77480.0 Ce1n100g2157
HB3 69 LEU QD2 3.30 # 1M 105300.0 Ce1n100g1024
HB3 70 THR HN 4.10 ># 2 12658.5 290K_n101472
HG 69 LEU QD1 3.30 # 1M 113400.0 Ce1n100g1027
HG 69 LEU QD2 3.40 # 1M 100600.0 Ce1n100g1034
QD1 70 THR HN 6.30 # 5M 5975.0 Ce1n100g1473
QD2 70 THR HN 6.60 # 5M 4900.0 Ce1n100g1474
70 THR
HN 70 THR HA 3.10 # 2 71160.0 Ce1n100g 641
HN 70 THR HB 2.80 # 2 128400.0 Ce1n100g 640
HN 70 THR QG2 3.60 # 1M 64650.0 Ce1n100g 642
HA 70 THR HB 3.30 # 2 44163.0 290K_n10 643
HA 70 THR QG2 3.70 # 1M 60075.0 ! 290K_n10 649
HA 73 ALA HN 3.90 # 3 21492.0 290K_n101482
HA 73 ALA QB 3.30 # 3M 43070.0 Ce1n100g2496
HB 70 THR QG2 3.30 # 1M 105500.0 Ce1n100g 650
QG2 71 MET HA 5.40 # 5M 11506.5 290K_n102414
71 MET
HN 71 MET HA 3.30 # 2 50710.0 Ce1n100g 610
HN 71 MET HB2 3.30 # 2 51030.0 290K_n10 613
HN 71 MET HB3 3.20 # 2 52560.0 Ce1n100g 634
HN 71 MET HG2 4.00 # 1 7362.0 290K_n10 611
HN 71 MET HG3 3.70 # 1 9877.5 290K_n102632
HN 72 MET HN 3.10 # 2 63450.0 290K_n102291
HA 71 MET HB2 3.50 # 2 35310.0 Ce1n100g 631
HA 71 MET HB3 3.20 # 2 60640.0 Ce1n100g 633
HA 71 MET HG2 2.50 <# 1 50400.0 290K_n10 616
HA 71 MET HG3 3.20 ># 1 19930.5 290K_n10 617
HA 72 MET HN 4.30 # 2 9981.0 290K_n101479
HA 74 ARG+ HN 3.60 # 3 30880.0 Ce1n100g1487
HA 74 ARG+ HE 4.50 # 5 6300.0 290K_n102315
HB2 71 MET HG2 2.80 # 1 31342.5 290K_n10 623
HB2 71 MET HG3 2.50 # 1 47530.0 Ce1n100g 639
HB2 72 MET HN 3.40 # 2 35960.0 Ce1n100g1477
HB3 71 MET HG2 2.90 # 1 26230.0 Ce1n100g 622
HB3 71 MET HG3 2.90 # 1 27819.0 290K_n10 628
HB3 72 MET HN 3.50 # 2 35450.0 Ce1n100g1476
72 MET
HN 72 MET HA 3.20 # 2 53770.0 Ce1n100g 586
HN 72 MET QB 4.20 # i 2 28410.0*2 Ce1n100g 589
HN 72 MET HG2 2.40 <# 1 55665.0 290K_n10 588
HN 72 MET HG3 2.90 ># 1 27800.0 Ce1n100g 587
HA 72 MET QB 5.00 # m 2 15565.0*2 Ce1n100g 596
HA 72 MET HG2 2.80 <# 1 34070.0 Ce1n100g 598
HA 72 MET HG3 3.70 ># 1 9967.5 290K_n10 591
HA 73 ALA HN 4.00 # 2 14750.0 Ce1n100g1481
HA 75 LYS+ HN 4.30 # 3 11710.0 Ce1n100g1498
QB 72 MET HG2 3.10 # m 1 98000.0*2 Ce1n100g 603
QB 72 MET HG3 3.30 # m 1 76550.0*2 Ce1n100g 602
QB 72 MET QE 7.10 # m 1M 2711.5*2 Ce1n100g2488
QB 73 ALA HN 5.30 # m 2 9515.0*2 Ce1n100g1480
HG2 72 MET QE 3.70 # 1M 60000.0 Ce1n100g2489
73 ALA
HN 73 ALA HA 3.20 # 2 59100.0 Ce1n100g 604
HN 73 ALA QB 3.00 # s 2M 154890.0 290K_n10 605
HA 73 ALA QB 3.00 # s 2M 174200.0 Ce1n100g 608
HA 74 ARG+ HN 3.60 # 2 26455.5 ! 290K_n101486
QB 74 ARG+ HN 3.30 # 2M 43317.0 290K_n101488
74 ARG+
HN 74 ARG+ HA 3.20 # 2 61920.0 Ce1n100g 652
HN 74 ARG+ HB2 3.80 ># 2 19430.0 Ce1n100g 654
HN 74 ARG+ HB3 3.00 <# 2 91930.0 Ce1n100g 655
HN 74 ARG+ QG 5.00 # m 1 7440.0*2 Ce1n100g 656
HN 74 ARG+ QD 4.60 # m 1 11005.0*2 Ce1n100g 663
HN 75 LYS+ HN 3.70 # 2 24250.0 Ce1n100g1157
HA 74 ARG+ HB2 3.40 # 2 36540.0 Ce1n100g 668
HA 74 ARG+ HB3 3.40 # 2 35890.0 Ce1n100g 672
HA 74 ARG+ QG 3.70 # i 1 21253.5*2 290K_n102643
HA 74 ARG+ QD 5.80 # m 1 3746.2*2 290K_n102642
HA 75 LYS+ HN 3.00 # 2 88910.0 Ce1n100g1484
HB2 74 ARG+ QG 3.20 # m 1 85000.0*2 Ce1n100g 679
HB2 74 ARG+ QD 4.40 ># m 1 14069.2*2 290K_n10 667
HB2 74 ARG+ HE 4.50 ># 1 4518.0 290K_n102897
HB3 74 ARG+ QD 3.70 <# m 1 37462.5*2 290K_n10 671
HB3 74 ARG+ HE 3.30 <# 1 17478.0 290K_n10 834
QG 74 ARG+ QD 5.40 # mm 1 14771.2*2*2 290K_n10 675
QG 74 ARG+ HE 6.00 # m 1 3070.5*2 Ce1n100g 835
QD 74 ARG+ HE 4.10 # m 1 22400.0*2 Ce1n100g 839
75 LYS+
HN 75 LYS+ HA 4.40 # 2 8696.0 Ce1n100g 517
HN 75 LYS+ HB2 3.30 # 2 49090.0 Ce1n100g 518
HN 75 LYS+ HB3 3.50 # 2 31740.0 Ce1n100g 519
HN 75 LYS+ QG 3.70 # m 1 40220.0*2 Ce1n100g 524
HA 75 LYS+ HB2 3.00 <# 2 92500.0 Ce1n100g 532
HA 75 LYS+ HB3 4.30 ># 2 8834.0 Ce1n100g 533
HA 75 LYS+ QG 3.30 # i 1 40000.0*2 Ce1n100g 534
HB2 75 LYS+ QG 4.20 ># m 1 18750.0*2 Ce1n100g 528
HB3 75 LYS+ QG 3.40 <# m 1 60000.0*2 Ce1n100g 527
QG 75 LYS+ QD 4.90 # mm 1 27150.0*2*2 Ce1n100g2536
QG 75 LYS+ QE 6.90 # mm 1 3321.0*2*2 290K_n102691
QD 75 LYS+ QE 5.20 # mm 1 17975.0*2*2 Ce1n100g2534
#
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