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nvt_onlyProt.gro
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2664 lines (2664 loc) · 179 KB
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Protein in water
2661
1MET N 1 4.388 4.805 6.086 -0.0647 -0.2592 -0.6783
1MET H1 2 4.305 4.830 6.138 0.6519 -0.6403 0.7048
1MET H2 3 4.368 4.796 5.987 -0.3048 2.4008 -0.9420
1MET H3 4 4.433 4.718 6.110 -0.5826 -0.6599 -1.1190
1MET CA 5 4.483 4.915 6.097 0.9860 -0.0518 -0.7076
1MET HA 6 4.425 5.003 6.071 1.2114 -0.2263 -1.8647
1MET CB 7 4.529 4.927 6.243 0.1983 0.4475 0.6425
1MET HB1 8 4.579 4.832 6.263 0.5301 0.7236 1.1728
1MET HB2 9 4.604 5.006 6.249 1.3998 -0.5727 -0.4876
1MET CG 10 4.442 4.946 6.371 0.4085 0.2195 -0.2304
1MET HG1 11 4.379 4.859 6.390 -1.2613 1.2120 -0.8759
1MET HG2 12 4.491 4.965 6.466 1.1400 -0.5532 -0.4477
1MET SD 13 4.327 5.084 6.341 -0.0402 -0.5432 -0.2510
1MET CE 14 4.441 5.214 6.362 -0.0536 -0.6810 -0.3822
1MET HE1 15 4.512 5.212 6.280 -1.1812 -0.2315 -1.4164
1MET HE2 16 4.381 5.305 6.361 -0.7995 -1.1253 1.0791
1MET HE3 17 4.502 5.205 6.451 0.4420 1.1874 -0.5004
1MET C 18 4.610 4.899 6.002 0.2272 -0.1237 0.4043
1MET O 19 4.629 4.986 5.919 -0.0476 0.1348 0.1268
2SER N 20 4.693 4.798 6.016 -1.0111 -0.0677 0.0382
2SER H 21 4.672 4.735 6.092 -2.0326 -0.4190 -0.5067
2SER CA 22 4.804 4.773 5.918 0.3375 -0.3700 -0.1341
2SER HA 23 4.774 4.824 5.826 0.9603 1.7102 0.7491
2SER CB 24 4.937 4.844 5.966 0.5775 1.2482 -0.7651
2SER HB1 25 4.924 4.952 5.970 -0.5258 1.1213 -0.5096
2SER HB2 26 4.968 4.812 6.065 -3.8252 0.3374 0.5367
2SER OG 27 5.053 4.801 5.894 -0.3960 -0.5358 -0.0395
2SER HG 28 5.055 4.838 5.807 3.9428 -0.0167 0.0762
2SER C 29 4.826 4.625 5.876 0.3922 -0.4923 0.1507
2SER O 30 4.856 4.600 5.761 0.4780 0.4483 0.8148
3GLN N 31 4.814 4.532 5.967 0.5464 0.1151 -0.8139
3GLN H 32 4.796 4.566 6.061 -1.9117 -1.7568 -0.5278
3GLN CA 33 4.819 4.388 5.952 -0.3288 0.4660 0.3201
3GLN HA 34 4.899 4.356 5.884 -0.1064 1.1190 0.2703
3GLN CB 35 4.840 4.327 6.090 -0.3086 0.5012 -0.4939
3GLN HB1 36 4.932 4.364 6.136 0.2945 0.0520 -1.3074
3GLN HB2 37 4.765 4.368 6.157 0.9026 2.9284 -0.5055
3GLN CG 38 4.853 4.171 6.086 -0.1693 0.3012 0.2079
3GLN HG1 39 4.791 4.115 6.017 1.5107 0.9176 -1.8994
3GLN HG2 40 4.954 4.151 6.049 -0.6993 0.0402 -1.1392
3GLN CD 41 4.827 4.109 6.227 0.2201 0.3068 -0.2220
3GLN OE1 42 4.816 4.176 6.330 -0.5511 -0.1455 0.0134
3GLN NE2 43 4.810 3.977 6.230 0.0417 0.1449 0.0138
3GLN HE21 44 4.820 3.926 6.143 -2.9245 -1.2755 0.4007
3GLN HE22 45 4.801 3.933 6.320 0.1059 0.4755 0.1832
3GLN C 46 4.694 4.333 5.884 0.1514 -0.3898 -0.2587
3GLN O 47 4.693 4.222 5.825 -0.3478 -0.5557 -0.0835
4SER N 48 4.584 4.416 5.884 0.0640 0.0870 -0.3451
4SER H 49 4.585 4.504 5.934 0.0769 -0.5269 0.7590
4SER CA 50 4.463 4.403 5.808 -0.3460 0.2487 0.0790
4SER HA 51 4.431 4.299 5.815 1.0706 -0.1489 1.1923
4SER CB 52 4.360 4.493 5.876 0.3138 0.9488 0.3757
4SER HB1 53 4.264 4.470 5.831 1.1052 -2.6300 0.2685
4SER HB2 54 4.361 4.458 5.979 2.1387 0.6200 0.2911
4SER OG 55 4.380 4.628 5.876 0.0046 -0.9021 0.2081
4SER HG 56 4.318 4.666 5.816 0.8684 -1.9188 -1.4197
4SER C 57 4.480 4.439 5.662 -0.3971 -0.0967 0.0946
4SER O 58 4.419 4.381 5.570 -0.0016 0.2218 -0.2152
5ASN N 59 4.571 4.530 5.627 -0.2458 -0.5620 -0.1028
5ASN H 60 4.628 4.579 5.695 -1.3868 0.7384 -0.0373
5ASN CA 61 4.579 4.572 5.490 -0.1320 -0.2280 0.1733
5ASN HA 62 4.483 4.594 5.444 -0.5376 1.5694 1.7540
5ASN CB 63 4.654 4.708 5.488 -0.0549 0.0884 -0.0735
5ASN HB1 64 4.738 4.703 5.558 1.0949 0.2026 -1.4026
5ASN HB2 65 4.716 4.725 5.400 -1.2021 3.2743 -0.3813
5ASN CG 66 4.573 4.838 5.510 -0.5448 -0.2130 -0.3616
5ASN OD1 67 4.463 4.844 5.461 0.2272 0.2255 0.4369
5ASN ND2 68 4.628 4.939 5.569 0.0697 -0.0539 -0.3842
5ASN HD21 69 4.727 4.942 5.590 -0.4701 1.3812 2.4147
5ASN HD22 70 4.574 5.024 5.581 -0.6116 -0.6223 0.7708
5ASN C 71 4.656 4.467 5.402 0.5910 0.4102 0.5552
5ASN O 72 4.628 4.456 5.279 -0.0737 -0.0783 -0.0562
6ARG N 73 4.743 4.381 5.471 0.0229 -0.6851 0.2870
6ARG H 74 4.762 4.411 5.566 -2.5312 2.1123 0.0907
6ARG CA 75 4.805 4.265 5.411 0.1665 -0.9835 -0.1203
6ARG HA 76 4.850 4.302 5.318 -1.9267 1.9010 -0.1295
6ARG CB 77 4.910 4.214 5.518 -0.4446 0.3557 -0.5777
6ARG HB1 78 4.966 4.301 5.553 -0.5745 0.9810 -1.8547
6ARG HB2 79 4.864 4.164 5.603 -2.3548 0.7407 -1.3497
6ARG CG 80 5.014 4.116 5.456 -0.2459 0.2998 -0.1411
6ARG HG1 81 4.978 4.022 5.414 1.0972 -0.3752 0.1524
6ARG HG2 82 5.039 4.156 5.358 -1.2998 0.8557 -0.2054
6ARG CD 83 5.135 4.090 5.545 0.7829 1.2750 0.8117
6ARG HD1 84 5.200 4.023 5.489 1.2014 0.8936 1.7409
6ARG HD2 85 5.189 4.183 5.565 1.3065 0.5014 3.3334
6ARG NE 86 5.098 4.025 5.668 0.3056 0.2235 0.1093
6ARG HE 87 5.020 3.961 5.663 -0.6277 1.3312 -0.0348
6ARG CZ 88 5.135 4.046 5.792 -0.3413 -0.5401 -0.4816
6ARG NH1 89 5.215 4.151 5.820 0.4505 -0.9498 0.2056
6ARG HH11 90 5.246 4.221 5.755 0.8375 0.1167 1.4780
6ARG HH12 91 5.225 4.188 5.914 0.0867 -0.9492 0.2468
6ARG NH2 92 5.090 3.962 5.888 -0.7270 -0.5493 -0.3054
6ARG HH21 93 5.019 3.894 5.866 -1.6489 -0.3391 1.7238
6ARG HH22 94 5.124 3.962 5.983 0.8558 0.4204 -0.8245
6ARG C 95 4.706 4.165 5.366 0.2933 -0.4525 -0.3684
6ARG O 96 4.720 4.095 5.272 -0.6577 0.1848 0.4700
7GLU N 97 4.596 4.160 5.441 0.2729 0.2534 -0.3788
7GLU H 98 4.587 4.228 5.515 -0.8762 -1.4419 1.1242
7GLU CA 99 4.491 4.059 5.417 0.1161 -0.1941 0.2837
7GLU HA 100 4.535 3.959 5.420 1.4617 0.3825 2.5937
7GLU CB 101 4.374 4.065 5.518 -0.1631 0.6446 -0.5233
7GLU HB1 102 4.350 4.171 5.524 1.1287 1.0097 -1.2396
7GLU HB2 103 4.283 4.021 5.478 1.6328 -3.4112 -0.6644
7GLU CG 104 4.396 4.018 5.660 0.0995 0.4945 -0.3087
7GLU HG1 105 4.430 3.915 5.650 -0.9561 0.1405 -0.3830
7GLU HG2 106 4.472 4.079 5.710 1.0308 -2.1955 1.8155
7GLU CD 107 4.261 4.019 5.734 0.4063 0.2335 0.4904
7GLU OE1 108 4.225 4.131 5.777 -0.2941 -0.2975 -0.0271
7GLU OE2 109 4.188 3.918 5.732 0.1417 0.1358 -0.3383
7GLU C 110 4.435 4.086 5.275 -0.0995 0.6319 0.6246
7GLU O 111 4.414 3.987 5.196 -0.1758 -0.1896 -0.2275
8LEU N 112 4.405 4.215 5.245 -0.4696 -0.0620 -0.3884
8LEU H 113 4.444 4.280 5.311 -0.8271 1.2198 -1.3936
8LEU CA 114 4.336 4.259 5.128 -0.0779 0.4668 0.2426
8LEU HA 115 4.241 4.208 5.135 -0.1030 0.6935 1.9145
8LEU CB 116 4.319 4.415 5.129 -0.8341 -0.4497 -0.5902
8LEU HB1 117 4.421 4.453 5.122 -0.8008 -0.4372 -0.0741
8LEU HB2 118 4.263 4.448 5.041 -1.4487 2.1813 0.7097
8LEU CG 119 4.248 4.472 5.254 0.6793 -0.2828 0.3235
8LEU HG 120 4.303 4.445 5.345 0.8199 -0.2641 0.2451
8LEU CD1 121 4.241 4.627 5.237 0.4617 0.0859 -0.2849
8LEU HD11 122 4.192 4.669 5.325 1.3595 -0.5483 0.5388
8LEU HD12 123 4.341 4.669 5.225 0.5356 -0.2357 -0.8004
8LEU HD13 124 4.209 4.658 5.138 2.1110 0.5948 -0.6898
8LEU CD2 125 4.106 4.405 5.268 -0.7522 -0.1483 -0.1536
8LEU HD21 126 4.051 4.429 5.177 -0.9376 1.8661 0.4431
8LEU HD22 127 4.114 4.296 5.276 0.8806 -0.1871 -1.7065
8LEU HD23 128 4.067 4.464 5.350 -2.7880 -0.4899 -0.8033
8LEU C 129 4.416 4.229 5.000 -0.3884 0.0544 -0.2804
8LEU O 130 4.369 4.247 4.894 0.1943 -0.0533 0.2940
9VAL N 131 4.549 4.218 5.018 -0.0453 0.3486 -0.4937
9VAL H 132 4.577 4.216 5.115 0.4160 -0.6511 -0.6394
9VAL CA 133 4.641 4.179 4.919 -0.7570 0.8269 0.2418
9VAL HA 134 4.612 4.229 4.827 -0.8638 -0.5547 -0.5027
9VAL CB 135 4.782 4.235 4.958 -0.0631 0.8036 -0.2469
9VAL HB 136 4.810 4.197 5.055 -0.4185 -2.4318 -1.2977
9VAL CG1 137 4.883 4.193 4.852 -0.0836 0.4503 -1.2607
9VAL HG11 138 4.887 4.088 4.824 1.7100 0.7099 -2.0684
9VAL HG12 139 4.862 4.233 4.753 -2.0130 0.7214 -0.8016
9VAL HG13 140 4.980 4.239 4.873 -0.8811 2.8616 -2.4624
9VAL CG2 141 4.794 4.392 4.973 0.6408 -0.4593 -0.4618
9VAL HG21 142 4.889 4.420 5.019 0.6900 1.1005 -1.4356
9VAL HG22 143 4.777 4.435 4.874 0.1165 0.6933 0.1159
9VAL HG23 144 4.708 4.435 5.023 1.2308 1.9455 -1.3722
9VAL C 145 4.636 4.025 4.916 -0.3841 -0.0536 -0.6387
9VAL O 146 4.576 3.976 4.820 0.8338 -0.4426 -0.0156
10VAL N 147 4.678 3.950 5.018 -0.3039 -0.4404 -0.1180
10VAL H 148 4.717 3.996 5.099 -1.3833 -0.3877 0.3902
10VAL CA 149 4.689 3.811 5.031 -0.5867 -0.1097 -0.5756
10VAL HA 150 4.767 3.784 4.960 0.4356 -0.2995 0.5743
10VAL CB 151 4.724 3.768 5.178 -0.8206 -0.0623 0.2107
10VAL HB 152 4.662 3.819 5.252 -0.7954 -2.0583 1.6735
10VAL CG1 153 4.694 3.617 5.218 0.4398 0.4355 -0.0137
10VAL HG11 154 4.721 3.595 5.321 -0.1127 0.0355 0.0529
10VAL HG12 155 4.585 3.607 5.215 0.6113 -3.4365 0.5339
10VAL HG13 156 4.739 3.553 5.142 2.3460 -0.2181 1.6017
10VAL CG2 157 4.870 3.802 5.216 0.2338 -0.1257 -0.2700
10VAL HG21 158 4.891 3.765 5.317 -1.6995 -2.1524 -0.5595
10VAL HG22 159 4.932 3.739 5.153 -1.0840 -0.5129 -1.2050
10VAL HG23 160 4.912 3.901 5.197 1.0978 -0.6018 -0.9200
10VAL C 161 4.560 3.742 4.981 0.2403 0.5008 -0.0487
10VAL O 162 4.569 3.648 4.904 0.6343 0.4201 0.5525
11ASP N 163 4.444 3.780 5.045 -0.2975 0.6187 0.5947
11ASP H 164 4.448 3.846 5.121 -5.7364 -0.2959 2.1267
11ASP CA 165 4.326 3.701 5.024 -0.4740 0.2353 0.0252
11ASP HA 166 4.358 3.597 5.028 -3.1255 -0.6238 0.9885
11ASP CB 167 4.218 3.733 5.127 0.0550 -0.2431 -0.0493
11ASP HB1 168 4.273 3.724 5.221 0.4607 1.3380 -0.1061
11ASP HB2 169 4.193 3.839 5.129 0.7047 -0.0734 1.9642
11ASP CG 170 4.104 3.630 5.131 -0.4516 0.8619 0.3895
11ASP OD1 171 3.992 3.658 5.092 -0.3338 0.1711 -0.1867
11ASP OD2 172 4.134 3.516 5.179 0.5701 0.0470 0.2415
11ASP C 173 4.266 3.727 4.886 0.1309 0.4386 0.0458
11ASP O 174 4.197 3.643 4.826 0.5698 -0.5770 0.2132
12PHE N 175 4.287 3.845 4.825 -0.6877 0.0421 0.3626
12PHE H 176 4.347 3.905 4.881 -0.0443 0.2595 -0.5373
12PHE CA 177 4.238 3.889 4.698 0.9602 -0.5961 0.8513
12PHE HA 178 4.138 3.847 4.683 1.4218 -1.6766 0.7642
12PHE CB 179 4.244 4.044 4.703 0.2261 0.1662 0.0790
12PHE HB1 180 4.195 4.080 4.794 -0.4305 0.2537 -0.3002
12PHE HB2 181 4.348 4.075 4.716 0.8303 -1.6269 -0.2808
12PHE CG 182 4.166 4.113 4.594 0.1177 -0.1407 -0.2053
12PHE CD1 183 4.029 4.073 4.580 -0.1230 -0.3157 -0.3741
12PHE HD1 184 3.976 4.004 4.643 0.0860 -3.1264 -3.0391
12PHE CD2 185 4.229 4.173 4.489 0.1007 -0.2972 0.0376
12PHE HD2 186 4.336 4.190 4.496 0.6349 -2.5920 -1.3212
12PHE CE1 187 3.958 4.117 4.466 0.4716 -0.1349 0.1140
12PHE HE1 188 3.854 4.090 4.465 0.0693 1.3274 0.1849
12PHE CE2 189 4.158 4.226 4.377 0.0895 0.0317 -0.2317
12PHE HE2 190 4.208 4.268 4.291 2.0562 -3.1735 -0.8364
12PHE CZ 191 4.020 4.185 4.358 -0.0944 -0.8625 -0.0378
12PHE HZ 192 3.957 4.221 4.279 -1.0806 -0.3663 0.9561
12PHE C 193 4.322 3.833 4.581 0.3061 0.2204 0.3573
12PHE O 194 4.279 3.790 4.470 1.1051 -0.0010 -0.1761
13LEU N 195 4.451 3.813 4.604 -0.1641 0.2748 -0.8882
13LEU H 196 4.480 3.851 4.692 -1.0519 -2.4400 0.6905
13LEU CA 197 4.545 3.734 4.513 0.1783 -0.3882 0.3786
13LEU HA 198 4.551 3.780 4.415 1.2582 -0.3450 0.4558
13LEU CB 199 4.687 3.731 4.570 -0.1605 -0.0766 -0.5764
13LEU HB1 200 4.694 3.690 4.670 -1.5099 0.8844 -0.0529
13LEU HB2 201 4.756 3.661 4.522 -0.4719 -0.2343 -0.8006
13LEU CG 202 4.767 3.868 4.564 -0.4348 0.2976 -0.9018
13LEU HG 203 4.727 3.935 4.640 0.5579 0.8532 -0.8558
13LEU CD1 204 4.918 3.845 4.596 0.2546 -0.6739 0.4964
13LEU HD11 205 4.934 3.776 4.679 0.6499 -2.9653 -1.3871
13LEU HD12 206 4.972 3.799 4.513 -0.5779 -1.0392 0.1518
13LEU HD13 207 4.967 3.942 4.609 -0.1154 -0.3163 -0.7027
13LEU CD2 208 4.748 3.948 4.436 0.2175 -0.0582 0.6162
13LEU HD21 209 4.745 3.895 4.341 2.7405 -1.3954 1.1783
13LEU HD22 210 4.666 4.018 4.450 -0.0425 -0.5452 1.5937
13LEU HD23 211 4.828 4.021 4.419 1.3283 -1.6543 -1.5279
13LEU C 212 4.494 3.589 4.508 -0.5855 -0.5379 -0.2407
13LEU O 213 4.494 3.522 4.406 0.5414 1.1167 -0.0494
14SER N 214 4.459 3.537 4.628 -0.3707 -1.1627 -0.1117
14SER H 215 4.468 3.597 4.708 2.0056 1.5242 -2.1939
14SER CA 216 4.422 3.394 4.648 -0.0859 0.1593 0.0738
14SER HA 217 4.495 3.330 4.598 0.8337 1.3268 -0.1257
14SER CB 218 4.428 3.358 4.798 -0.0433 0.1457 -0.3346
14SER HB1 219 4.522 3.387 4.845 -0.5828 1.8826 -0.2821
14SER HB2 220 4.350 3.410 4.853 0.6509 1.3041 -0.4196
14SER OG 221 4.412 3.219 4.837 -0.3759 -0.2867 0.1885
14SER HG 222 4.353 3.179 4.776 0.2171 -2.2685 0.8486
14SER C 223 4.280 3.368 4.589 -0.2387 -0.0555 0.3415
14SER O 224 4.247 3.260 4.540 -0.6367 0.3133 0.0832
15TYR N 225 4.203 3.475 4.566 -0.6275 -0.2269 -0.0431
15TYR H 226 4.244 3.561 4.599 -1.3331 0.0174 0.2003
15TYR CA 227 4.073 3.478 4.499 -0.1819 -0.3466 -0.4566
15TYR HA 228 4.008 3.398 4.533 -0.6847 0.7603 1.3223
15TYR CB 229 4.001 3.608 4.544 0.1231 0.3882 0.5172
15TYR HB1 230 3.983 3.600 4.652 0.6972 -0.8189 0.5289
15TYR HB2 231 4.065 3.693 4.520 -0.0449 0.5924 0.7801
15TYR CG 232 3.867 3.640 4.477 -0.0842 0.0524 0.1201
15TYR CD1 233 3.749 3.567 4.497 -0.7159 0.3257 -0.3859
15TYR HD1 234 3.763 3.489 4.571 0.4833 0.2933 -0.6287
15TYR CD2 235 3.871 3.740 4.374 0.8789 0.4031 0.3759
15TYR HD2 236 3.960 3.799 4.358 0.6421 1.5020 2.7892
15TYR CE1 237 3.633 3.593 4.420 0.8166 0.1446 0.3167
15TYR HE1 238 3.546 3.533 4.442 -0.2903 1.7947 0.6596
15TYR CE2 239 3.751 3.766 4.305 -0.0013 -0.5826 0.9423
15TYR HE2 240 3.751 3.845 4.232 -2.7342 -0.0845 1.3720
15TYR CZ 241 3.636 3.692 4.321 -0.4953 -0.6376 -0.0919
15TYR OH 242 3.521 3.721 4.251 -0.1376 0.3665 -0.3198
15TYR HH 243 3.439 3.691 4.288 -0.2033 -1.5222 -1.8315
15TYR C 244 4.092 3.478 4.346 0.2963 0.4436 0.2753
15TYR O 245 4.018 3.407 4.273 0.2331 -0.8112 -0.2604
16LYS N 246 4.192 3.542 4.294 0.6919 -0.3420 -0.1132
16LYS H 247 4.244 3.613 4.344 0.2170 0.3417 -0.5626
16LYS CA 248 4.223 3.527 4.150 -0.3202 0.6270 0.3078
16LYS HA 249 4.127 3.520 4.098 -0.3332 -1.6597 0.5296
16LYS CB 250 4.308 3.649 4.110 0.6977 0.7689 -0.5801
16LYS HB1 251 4.398 3.666 4.170 2.8274 -0.3212 -3.2548
16LYS HB2 252 4.344 3.637 4.008 -0.5577 -0.3353 -0.9214
16LYS CG 253 4.228 3.779 4.118 -0.7197 0.3901 0.3047
16LYS HG1 254 4.173 3.777 4.211 0.7962 -0.0981 1.2354
16LYS HG2 255 4.305 3.856 4.126 1.4042 -1.5876 -0.0023
16LYS CD 256 4.145 3.796 3.987 0.5290 0.3555 -0.0247
16LYS HD1 257 4.206 3.771 3.901 1.2201 0.7313 0.3508
16LYS HD2 258 4.061 3.727 3.998 1.2881 -0.4919 0.5955
16LYS CE 259 4.098 3.938 3.965 -0.6391 0.3932 -0.0916
16LYS HE1 260 4.033 3.969 4.047 1.1204 1.2203 1.0415
16LYS HE2 261 4.177 4.011 3.949 -0.1012 -0.4747 -1.7010
16LYS NZ 262 4.013 3.941 3.846 -0.0361 0.3856 0.3947
16LYS HZ1 263 3.927 3.891 3.862 0.0181 -0.3881 -1.5072
16LYS HZ2 264 3.995 4.039 3.833 0.4130 0.3113 -0.9177
16LYS HZ3 265 4.059 3.903 3.764 -0.3712 -1.0178 0.8186
16LYS C 266 4.298 3.402 4.116 -0.6773 0.1760 -0.5638
16LYS O 267 4.261 3.340 4.018 -0.3948 0.1058 0.8962
17LEU N 268 4.396 3.357 4.197 -0.7905 0.8132 -0.3140
17LEU H 269 4.424 3.419 4.272 2.4588 2.1772 -2.4466
17LEU CA 270 4.457 3.219 4.189 -0.8499 0.4908 0.8868
17LEU HA 271 4.495 3.210 4.088 0.5188 0.6693 1.3695
17LEU CB 272 4.565 3.190 4.298 0.1887 -0.4890 -0.1956
17LEU HB1 273 4.509 3.213 4.389 -0.4192 1.5819 -1.0356
17LEU HB2 274 4.591 3.085 4.308 -0.5686 -0.6897 -0.2856
17LEU CG 275 4.696 3.282 4.292 -0.4130 0.1350 -0.2466
17LEU HG 276 4.669 3.387 4.282 3.1094 1.0927 -1.1551
17LEU CD1 277 4.783 3.283 4.422 0.3794 0.6202 0.2690
17LEU HD11 278 4.875 3.225 4.410 1.8604 2.7750 0.6754
17LEU HD12 279 4.824 3.384 4.429 -0.1885 0.8430 0.4159
17LEU HD13 280 4.734 3.253 4.515 -2.3283 1.2972 -0.8456
17LEU CD2 281 4.775 3.234 4.171 0.1520 -0.1429 0.2713
17LEU HD21 282 4.813 3.133 4.189 1.6604 0.4365 0.4385
17LEU HD22 283 4.706 3.244 4.087 -1.8482 3.7046 2.1273
17LEU HD23 284 4.870 3.286 4.160 1.7659 -2.9152 0.0275
17LEU C 285 4.350 3.106 4.201 -0.3707 -0.5173 -0.1268
17LEU O 286 4.355 3.014 4.121 -0.1456 -0.0602 0.2695
18SER N 287 4.260 3.100 4.303 -0.4957 -0.1970 -0.5091
18SER H 288 4.245 3.175 4.370 -1.6146 -2.1617 1.5639
18SER CA 289 4.159 2.992 4.335 -0.1989 0.3642 0.3842
18SER HA 290 4.228 2.907 4.340 1.1538 1.4347 0.4227
18SER CB 291 4.090 2.998 4.468 -0.5398 -0.9072 -1.2550
18SER HB1 292 4.019 2.915 4.470 -4.0283 1.7872 0.0743
18SER HB2 293 4.157 2.985 4.553 0.5745 0.5845 -1.8616
18SER OG 294 4.001 3.110 4.481 -0.0588 -0.6825 -0.4941
18SER HG 295 3.962 3.112 4.566 -0.7000 1.0431 -0.7820
18SER C 296 4.062 2.977 4.219 0.0238 -0.1664 -0.3454
18SER O 297 4.034 2.868 4.173 0.1841 -0.0881 0.1596
19GLN N 298 4.023 3.096 4.161 0.4422 -0.3769 -0.5482
19GLN H 299 4.053 3.177 4.213 1.0174 -1.6098 1.1396
19GLN CA 300 3.945 3.100 4.034 0.2251 0.3448 0.4538
19GLN HA 301 3.853 3.045 4.052 1.0106 -1.4179 -0.5803
19GLN CB 302 3.904 3.249 4.005 0.0588 0.0356 0.4581
19GLN HB1 303 3.850 3.291 4.089 -1.9657 1.7009 -1.5491
19GLN HB2 304 3.997 3.305 3.998 0.3788 -0.5734 -0.3738
19GLN CG 305 3.818 3.284 3.884 -0.2551 -0.6153 -0.0015
19GLN HG1 306 3.740 3.209 3.868 0.9526 -2.1638 1.0765
19GLN HG2 307 3.755 3.371 3.904 -2.8426 -2.2268 -0.7066
19GLN CD 308 3.894 3.308 3.753 0.0498 0.3160 0.3199
19GLN OE1 309 3.962 3.410 3.747 -0.2408 0.0099 0.9238
19GLN NE2 310 3.882 3.217 3.649 -0.4297 0.0376 0.1914
19GLN HE21 311 3.842 3.126 3.666 1.7931 -0.8924 0.8233
19GLN HE22 312 3.940 3.224 3.566 0.3088 1.5253 0.7984
19GLN C 313 4.013 3.036 3.915 -0.0157 -0.6929 -0.2120
19GLN O 314 3.942 2.984 3.826 0.6069 -0.4471 0.1042
20LYS N 315 4.149 3.039 3.905 0.4238 -0.2350 0.1899
20LYS H 316 4.193 3.087 3.982 0.4674 1.2130 -0.7036
20LYS CA 317 4.231 2.964 3.805 -0.3425 0.1835 -0.4863
20LYS HA 318 4.176 2.966 3.711 -0.4730 1.4618 -0.3983
20LYS CB 319 4.371 3.039 3.801 0.5880 -0.1950 0.0085
20LYS HB1 320 4.400 3.077 3.899 0.0723 0.5287 -0.1147
20LYS HB2 321 4.458 2.975 3.786 1.3503 0.9177 -0.5375
20LYS CG 322 4.377 3.137 3.680 1.0257 -0.3533 0.4123
20LYS HG1 323 4.478 3.178 3.668 0.2824 0.9369 -2.0700
20LYS HG2 324 4.357 3.094 3.582 -0.3186 1.4182 -0.1287
20LYS CD 325 4.275 3.255 3.691 -0.5770 1.0100 0.7205
20LYS HD1 326 4.176 3.210 3.680 -1.1273 2.0687 1.1807
20LYS HD2 327 4.270 3.293 3.794 -0.1370 -0.4325 1.3023
20LYS CE 328 4.304 3.366 3.591 -0.5803 -0.1973 -0.0650
20LYS HE1 329 4.404 3.407 3.603 0.4772 -1.6378 -2.8849
20LYS HE2 330 4.305 3.329 3.488 -1.3863 -1.1035 0.2342
20LYS NZ 331 4.199 3.465 3.608 -0.6898 -0.3572 0.2420
20LYS HZ1 332 4.115 3.441 3.660 0.6335 1.6241 3.6462
20LYS HZ2 333 4.243 3.547 3.649 0.1541 0.6401 -2.4115
20LYS HZ3 334 4.163 3.488 3.517 -2.1293 -0.3201 0.7936
20LYS C 335 4.270 2.821 3.847 0.1435 0.3606 -0.3044
20LYS O 336 4.309 2.745 3.754 -0.1124 -0.1168 -0.0441
21GLY N 337 4.249 2.791 3.981 0.9182 -0.1359 0.5504
21GLY H 338 4.210 2.856 4.048 -0.2724 -0.9701 0.6963
21GLY CA 339 4.250 2.657 4.037 0.0562 -0.3477 -0.3604
21GLY HA1 340 4.151 2.649 4.081 -0.6760 0.9796 -1.6823
21GLY HA2 341 4.262 2.576 3.965 0.7227 -0.6044 0.0252
21GLY C 342 4.375 2.641 4.127 0.4695 -0.7985 -0.4044
21GLY O 343 4.374 2.546 4.199 -0.4366 -0.1502 0.2680
22TYR N 344 4.467 2.735 4.145 0.0999 -0.2003 0.0556
22TYR H 345 4.455 2.819 4.089 -1.5673 0.2506 1.0042
22TYR CA 346 4.585 2.729 4.227 -0.3133 0.6400 -0.0160
22TYR HA 347 4.632 2.631 4.225 -1.4940 -0.0230 2.2899
22TYR CB 348 4.663 2.841 4.161 -0.0299 0.0736 0.0626
22TYR HB1 349 4.610 2.936 4.163 2.3527 1.4768 0.0558
22TYR HB2 350 4.756 2.856 4.216 -0.5659 0.2326 0.9617
22TYR CG 351 4.710 2.822 4.017 0.1324 0.1023 0.2503
22TYR CD1 352 4.717 2.689 3.961 -0.3157 -0.6969 0.3484
22TYR HD1 353 4.692 2.602 4.019 -0.9241 -1.1863 -0.6342
22TYR CD2 354 4.729 2.931 3.934 0.5079 -0.1206 -0.0694
22TYR HD2 355 4.722 3.027 3.983 0.9000 -0.0066 -0.2279
22TYR CE1 356 4.750 2.678 3.821 0.6163 -0.2725 -0.2942
22TYR HE1 357 4.775 2.580 3.781 -1.7993 -1.4661 0.8880
22TYR CE2 358 4.762 2.918 3.800 0.4216 -0.1988 0.5251
22TYR HE2 359 4.796 3.005 3.745 2.1833 -0.5365 1.0333
22TYR CZ 360 4.785 2.791 3.745 0.0819 0.3736 0.0411
22TYR OH 361 4.832 2.781 3.616 -0.5835 -0.4328 0.1352
22TYR HH 362 4.860 2.860 3.572 0.7142 -1.1751 -0.4119
22TYR C 363 4.556 2.778 4.369 0.4901 -0.1723 -0.5824
22TYR O 364 4.478 2.876 4.388 -0.6853 0.4507 -0.3409
23SER N 365 4.613 2.720 4.474 0.3216 -0.0498 0.1379
23SER H 366 4.679 2.646 4.456 2.5923 1.8945 0.0490
23SER CA 367 4.594 2.753 4.614 -0.3492 0.0284 -0.5021
23SER HA 368 4.504 2.811 4.636 0.3757 1.0792 -0.2366
23SER CB 369 4.591 2.619 4.700 0.9330 -0.0594 0.6585
23SER HB1 370 4.684 2.566 4.680 0.0341 -1.3826 -0.1813
23SER HB2 371 4.591 2.644 4.806 0.1797 -0.0862 0.6698
23SER OG 372 4.486 2.540 4.652 -0.1044 -0.0121 -0.5206
23SER HG 373 4.502 2.508 4.565 0.6942 -3.3829 0.7112
23SER C 374 4.718 2.833 4.660 0.0073 0.6359 0.2902
23SER O 375 4.831 2.791 4.647 0.1798 0.3372 0.5117
24TRP N 376 4.693 2.954 4.713 0.0617 0.0070 0.0377
24TRP H 377 4.598 2.987 4.706 -0.9045 -2.2687 1.3913
24TRP CA 378 4.784 3.034 4.793 -0.0908 0.4472 -0.0514
24TRP HA 379 4.856 3.067 4.717 1.3750 2.0957 1.9469
24TRP CB 380 4.715 3.154 4.856 -0.5658 0.2957 0.1054
24TRP HB1 381 4.664 3.221 4.786 0.1652 1.1252 0.3453
24TRP HB2 382 4.641 3.117 4.927 -1.2205 -2.9317 -2.0689
24TRP CG 383 4.804 3.245 4.933 1.0733 -0.6281 0.1328
24TRP CD1 384 4.842 3.243 5.062 -0.3183 0.3137 -1.1885
24TRP HD1 385 4.793 3.172 5.127 1.6015 0.3729 0.4194
24TRP CD2 386 4.870 3.361 4.875 -0.6754 -0.0608 0.3345
24TRP NE1 387 4.917 3.354 5.088 -0.6811 -0.0571 0.6172
24TRP HE1 388 4.965 3.374 5.175 0.7127 -0.2438 -0.0786
24TRP CE2 389 4.943 3.429 4.977 0.1761 -0.2921 0.9271
24TRP CE3 390 4.889 3.403 4.742 0.1043 0.0746 -0.0390
24TRP HE3 391 4.841 3.344 4.666 0.5764 -0.0433 -0.2476
24TRP CZ2 392 5.034 3.530 4.938 -0.2770 0.0271 0.1930
24TRP HZ2 393 5.091 3.587 5.009 1.8281 -0.0795 -1.3338
24TRP CZ3 394 4.975 3.506 4.706 -0.3393 0.1421 0.5706
24TRP HZ3 395 4.975 3.543 4.604 0.6656 0.6925 0.7574
24TRP CH2 396 5.039 3.576 4.806 -0.4864 -0.2588 0.6052
24TRP HH2 397 5.103 3.660 4.784 -0.2186 -0.8332 -1.0058
24TRP C 398 4.872 2.955 4.899 -0.0847 -0.7260 0.8203
24TRP O 399 4.993 2.964 4.903 -0.2682 0.0839 0.2400
25SER N 400 4.810 2.870 4.976 1.0368 0.8562 -0.6055
25SER H 401 4.712 2.866 4.949 1.2719 -0.2046 -1.3617
25SER CA 402 4.865 2.780 5.079 0.9945 0.1598 -0.0008
25SER HA 403 4.928 2.840 5.146 2.7972 -2.0339 0.3768
25SER CB 404 4.740 2.717 5.148 0.3729 0.2723 -0.2009
25SER HB1 405 4.780 2.642 5.215 1.1742 0.6567 -0.2378
25SER HB2 406 4.702 2.794 5.215 0.9314 0.0748 0.3482
25SER OG 407 4.640 2.652 5.075 -0.0959 0.5017 0.3213
25SER HG 408 4.606 2.717 5.015 0.0101 0.0442 -0.2471
25SER C 409 4.961 2.671 5.024 -1.1600 0.1548 0.6158
25SER O 410 5.035 2.606 5.097 0.0520 -0.7069 0.0670
26GLN N 411 4.970 2.660 4.889 -0.2712 0.4432 -0.1977
26GLN H 412 4.918 2.731 4.839 -0.4800 2.1218 2.2622
26GLN CA 413 5.052 2.558 4.823 0.3269 -0.0411 0.0322
26GLN HA 414 5.069 2.476 4.893 1.7758 0.5462 0.3980
26GLN CB 415 4.979 2.499 4.696 0.2437 -0.0759 -0.1655
26GLN HB1 416 4.890 2.450 4.734 3.0122 -3.4684 2.6226
26GLN HB2 417 4.961 2.581 4.626 -0.0644 -0.8251 -0.9760
26GLN CG 418 5.057 2.390 4.619 0.6586 0.3160 0.4976
26GLN HG1 419 5.009 2.358 4.527 1.6654 0.9422 -0.2715
26GLN HG2 420 5.149 2.437 4.583 0.0523 2.2161 1.2869
26GLN CD 421 5.090 2.266 4.698 -0.2272 0.5930 0.3448
26GLN OE1 422 4.996 2.197 4.740 -0.3642 0.0068 0.4062
26GLN NE2 423 5.216 2.241 4.724 -0.6402 0.6903 0.7772
26GLN HE21 424 5.288 2.304 4.693 0.6422 -0.7495 0.7671
26GLN HE22 425 5.245 2.162 4.779 -0.1643 -0.5983 -1.2476
26GLN C 426 5.188 2.612 4.776 -0.6422 -0.5277 0.1030
26GLN O 427 5.287 2.544 4.762 -0.1262 -0.7727 -0.2430
27PHE N 428 5.191 2.746 4.761 0.1534 0.1951 -0.2085
27PHE H 429 5.108 2.802 4.771 -0.2394 -0.5708 1.0492
27PHE CA 430 5.310 2.812 4.718 0.2525 -0.2104 1.0170
27PHE HA 431 5.381 2.742 4.673 -1.2679 -1.4022 0.3817
27PHE CB 432 5.276 2.908 4.593 -0.1335 0.4513 -0.0003
27PHE HB1 433 5.215 2.989 4.634 -1.9828 -1.5710 1.4954
27PHE HB2 434 5.370 2.945 4.554 1.6432 -2.9402 0.6563
27PHE CG 435 5.194 2.850 4.478 0.3299 -0.9623 -0.0330
27PHE CD1 436 5.208 2.717 4.434 0.2373 -0.4116 0.5051
27PHE HD1 437 5.283 2.647 4.469 -0.7951 -1.6778 0.3093
27PHE CD2 438 5.082 2.920 4.428 -0.2281 -0.5670 -0.7518
27PHE HD2 439 5.075 3.025 4.452 -0.1078 -0.8243 0.5150
27PHE CE1 440 5.126 2.659 4.330 0.5687 -0.2941 -0.5481
27PHE HE1 441 5.141 2.555 4.303 3.2169 0.1880 -1.2295
27PHE CE2 442 5.003 2.864 4.332 0.2665 -0.4578 1.0875
27PHE HE2 443 4.926 2.923 4.284 0.4134 0.0338 1.4525
27PHE CZ 444 5.017 2.731 4.280 0.0449 -0.7525 -0.9905
27PHE HZ 445 4.948 2.687 4.209 -0.0270 -0.5492 -1.0486
27PHE C 446 5.378 2.898 4.824 -0.2129 -0.2286 0.4681
27PHE O 447 5.499 2.904 4.825 -0.5627 0.2589 0.2421
28SER N 448 5.288 2.951 4.909 -0.5519 0.3588 -0.3357
28SER H 449 5.189 2.950 4.893 -0.7337 -2.1681 0.4805
28SER CA 450 5.334 3.016 5.026 0.1237 -0.1400 0.1761
28SER HA 451 5.403 3.097 5.001 -1.0499 0.8276 -0.0311
28SER CB 452 5.203 3.077 5.088 0.0922 -0.0158 0.1761
28SER HB1 453 5.122 3.008 5.111 -0.5807 1.0620 1.1819
28SER HB2 454 5.244 3.111 5.183 2.1479 -1.8040 0.0314
28SER OG 455 5.148 3.194 5.020 -0.4601 0.1625 -0.3740
28SER HG 456 5.059 3.170 4.999 -0.5068 0.8822 -1.0296
28SER C 457 5.394 2.922 5.129 -0.3529 0.0331 -0.0742
28SER O 458 5.356 2.808 5.139 0.3550 -0.1426 0.4645
29ASP N 459 5.490 2.979 5.199 -0.2188 -0.3111 0.7268
29ASP H 460 5.512 3.076 5.184 -0.3866 -0.3057 0.5075
29ASP CA 461 5.544 2.911 5.315 -0.0823 0.8958 -0.8956
29ASP HA 462 5.548 2.803 5.298 -0.1051 0.5904 0.7978
29ASP CB 463 5.687 2.968 5.342 0.3032 0.4174 0.1578
29ASP HB1 464 5.681 3.076 5.356 -1.5348 0.1451 1.8204
29ASP HB2 465 5.741 2.934 5.431 1.1331 0.4145 -0.3313
29ASP CG 466 5.775 2.937 5.226 0.3416 0.2196 -0.0730
29ASP OD1 467 5.798 2.817 5.198 0.4341 1.4276 -0.1841
29ASP OD2 468 5.820 3.039 5.165 -0.2051 0.0532 -0.3267
29ASP C 469 5.451 2.946 5.436 -0.0556 0.0587 0.2072
29ASP O 470 5.423 3.064 5.461 0.1505 -0.1233 -0.2457
30VAL N 471 5.366 2.849 5.470 -0.1651 0.2076 -0.0590
30VAL H 472 5.384 2.761 5.422 1.3846 1.2061 -1.4524
30VAL CA 473 5.256 2.870 5.566 0.3597 -0.0094 -0.5661
30VAL HA 474 5.226 2.974 5.555 1.1614 0.3416 0.3399
30VAL CB 475 5.132 2.785 5.523 -0.3667 -0.1132 -0.0578
30VAL HB 476 5.166 2.687 5.490 1.6663 -0.5231 2.8617
30VAL CG1 477 5.021 2.776 5.626 0.5502 -0.0103 0.1589
30VAL HG11 478 5.011 2.868 5.683 -0.2621 -1.0281 1.7288
30VAL HG12 479 4.921 2.751 5.590 0.6539 0.3095 -0.3670
30VAL HG13 480 5.049 2.709 5.707 0.4817 2.2292 2.1501
30VAL CG2 481 5.074 2.847 5.395 -0.0839 -0.1960 -0.5219
30VAL HG21 482 5.142 2.837 5.310 -0.3808 0.0209 -0.7898
30VAL HG22 483 4.985 2.789 5.371 -0.0087 -0.7289 0.4464
30VAL HG23 484 5.055 2.954 5.405 -0.0833 -0.1708 -0.7806
30VAL C 485 5.298 2.838 5.709 -0.7246 0.2879 -0.5168
30VAL O 486 5.268 2.920 5.795 0.0099 0.5736 -0.7106
31GLU N 487 5.375 2.727 5.733 -0.3852 0.0539 -0.3607
31GLU H 488 5.395 2.664 5.657 1.2253 0.6381 -0.4648
31GLU CA 489 5.433 2.695 5.860 -0.0851 -0.2898 0.1304
31GLU HA 490 5.389 2.749 5.944 0.1150 -0.4444 0.3348
31GLU CB 491 5.405 2.546 5.884 0.1070 -0.2659 -0.5526
31GLU HB1 492 5.301 2.527 5.859 -0.5556 0.1596 1.6993
31GLU HB2 493 5.450 2.477 5.812 -1.1424 -1.2211 -0.4466
31GLU CG 494 5.423 2.508 6.033 0.4149 0.4740 -0.8299
31GLU HG1 495 5.440 2.400 6.038 -2.9537 -0.1538 -0.4069
31GLU HG2 496 5.504 2.561 6.083 -0.7351 1.4564 0.0649
31GLU CD 497 5.298 2.544 6.112 -0.4878 -0.3649 -0.7836
31GLU OE1 498 5.193 2.475 6.094 0.3930 -0.4024 0.0809
31GLU OE2 499 5.311 2.651 6.171 0.2335 0.0920 -0.5083
31GLU C 500 5.582 2.726 5.863 -1.0155 -0.1307 -0.3597
31GLU O 501 5.638 2.759 5.968 -0.3456 0.1482 -0.0202
32GLU N 502 5.657 2.718 5.754 0.3337 -0.0319 0.3733
32GLU H 503 5.620 2.683 5.667 -2.8707 -3.3886 2.7891
32GLU CA 504 5.797 2.753 5.754 -1.0223 -0.0478 0.0804
32GLU HA 505 5.842 2.720 5.847 1.6209 -0.5406 -1.2866
32GLU CB 506 5.868 2.710 5.622 -0.1685 0.3075 0.0371
32GLU HB1 507 5.813 2.757 5.540 -0.4308 -0.2144 -0.0861
32GLU HB2 508 5.970 2.750 5.622 -0.1486 0.2560 -0.1533
32GLU CG 509 5.857 2.555 5.603 0.0322 -0.6929 -0.4016
32GLU HG1 510 5.756 2.513 5.602 -0.9842 1.4992 1.1728
32GLU HG2 511 5.888 2.539 5.499 -0.1115 0.6078 -0.6635
32GLU CD 512 5.947 2.475 5.701 -0.1790 -0.3100 0.1270
32GLU OE1 513 6.058 2.452 5.656 0.4257 0.1412 0.1907
32GLU OE2 514 5.890 2.414 5.797 -0.6672 -0.3444 0.2605
32GLU C 515 5.816 2.911 5.756 0.0976 1.7267 0.9822
32GLU O 516 5.927 2.958 5.768 -0.6430 0.0926 0.4428
33ASN N 517 5.707 2.985 5.759 -0.6985 0.3749 0.1038
33ASN H 518 5.630 2.926 5.785 -0.2278 0.3354 1.4474
33ASN CA 519 5.691 3.126 5.766 -0.1258 0.4350 -0.3847
33ASN HA 520 5.744 3.153 5.857 1.0075 -0.0876 -0.8638
33ASN CB 521 5.753 3.195 5.639 0.1497 -0.1116 -0.4346
33ASN HB1 522 5.843 3.138 5.617 1.6956 1.6980 0.9595
33ASN HB2 523 5.696 3.175 5.548 0.6088 -2.8355 -0.1996
33ASN CG 524 5.790 3.344 5.657 0.2802 0.1337 -0.0636
33ASN OD1 525 5.700 3.434 5.660 -0.3709 1.1141 0.1855
33ASN ND2 526 5.916 3.378 5.675 -0.6364 0.2103 -0.4396
33ASN HD21 527 5.989 3.308 5.667 -0.5386 0.1278 1.0084
33ASN HD22 528 5.937 3.476 5.683 -0.7796 0.5810 -3.3810
33ASN C 529 5.550 3.165 5.791 -0.2649 -0.4835 0.7961
33ASN O 530 5.470 3.185 5.697 -0.4474 -0.1172 0.0097
34ARG N 531 5.501 3.157 5.914 -0.1269 -0.7098 -0.0537
34ARG H 532 5.565 3.128 5.987 1.8327 0.4819 -1.1861
34ARG CA 533 5.370 3.183 5.962 0.2401 0.0452 -1.2833
34ARG HA 534 5.297 3.146 5.890 -0.0390 1.3800 -1.7161
34ARG CB 535 5.344 3.120 6.098 -0.3212 -0.5145 0.2644
34ARG HB1 536 5.376 3.016 6.099 1.9122 0.0890 -0.8246
34ARG HB2 537 5.407 3.156 6.179 0.9249 -0.1598 -0.8150
34ARG CG 538 5.196 3.113 6.138 -0.3120 0.4131 0.8481
34ARG HG1 539 5.162 3.217 6.142 0.8374 0.8632 -0.2564
34ARG HG2 540 5.128 3.073 6.063 -0.2292 0.5378 0.7059
34ARG CD 541 5.178 3.037 6.269 -0.5707 -0.1233 -0.6394
34ARG HD1 542 5.077 3.001 6.290 -0.2343 0.6664 3.0252
34ARG HD2 543 5.232 2.943 6.268 -1.0525 -0.4918 1.9413
34ARG NE 544 5.244 3.118 6.377 -0.4783 -0.4104 -0.3310
34ARG HE 545 5.261 3.216 6.357 0.3935 -0.4173 0.3130
34ARG CZ 546 5.254 3.080 6.507 -0.3638 1.2148 -0.5372
34ARG NH1 547 5.227 2.951 6.552 0.1839 -0.0718 0.3357
34ARG HH11 548 5.204 2.875 6.490 -1.1101 1.1467 -0.7232
34ARG HH12 549 5.229 2.931 6.651 -0.6345 2.5392 0.9467
34ARG NH2 550 5.284 3.167 6.603 0.1457 -0.5504 0.3244
34ARG HH21 551 5.293 3.265 6.581 -1.3964 -0.4175 0.1917
34ARG HH22 552 5.295 3.148 6.701 -1.9870 -0.8361 0.5626
34ARG C 553 5.344 3.334 5.966 0.3235 -0.9407 -0.1656
34ARG O 554 5.413 3.406 6.037 -0.5008 -0.9046 -0.0684
35THR N 555 5.244 3.368 5.885 0.3767 -0.0259 -0.2822
35THR H 556 5.203 3.300 5.822 -3.0089 2.0433 -0.5976
35THR CA 557 5.191 3.504 5.876 -0.1341 -0.6595 0.3891
35THR HA 558 5.240 3.560 5.955 -2.4088 2.7122 -0.3201
35THR CB 559 5.244 3.568 5.748 -0.2883 -0.7304 0.1261
35THR HB 560 5.351 3.551 5.751 -0.1990 -0.2055 2.6386
35THR OG1 561 5.219 3.706 5.743 0.0425 0.2863 -0.0595
35THR HG1 562 5.283 3.743 5.802 0.1743 -1.2814 0.8174
35THR CG2 563 5.202 3.495 5.617 0.2571 0.1253 -0.2573
35THR HG21 564 5.095 3.480 5.604 -0.1752 2.8448 -0.3277
35THR HG22 565 5.227 3.556 5.531 -0.2392 0.1142 -0.4117
35THR HG23 566 5.233 3.390 5.611 -2.3848 -1.0955 3.4520
35THR C 567 5.039 3.503 5.907 0.4298 -0.1536 -0.1453
35THR O 568 4.960 3.440 5.832 0.6846 -0.3035 0.2695
36GLU N 569 4.996 3.573 6.007 -0.1023 0.4053 -0.1822
36GLU H 570 5.070 3.614 6.063 0.4982 -2.1911 1.1200
36GLU CA 571 4.866 3.568 6.069 -0.4282 0.3163 0.0604
36GLU HA 572 4.824 3.469 6.055 0.2569 -0.1353 1.0792
36GLU CB 573 4.883 3.590 6.220 -0.5482 -0.0759 0.7822
36GLU HB1 574 4.969 3.535 6.259 1.7050 1.4081 -1.7561
36GLU HB2 575 4.918 3.691 6.237 1.6488 0.1269 -3.6346
36GLU CG 576 4.756 3.547 6.297 0.4928 -0.1623 0.6401
36GLU HG1 577 4.663 3.602 6.279 0.4884 0.0565 1.2957
36GLU HG2 578 4.740 3.443 6.270 0.5426 0.0111 -0.0800
36GLU CD 579 4.760 3.547 6.447 -0.5155 0.3401 -0.0692
36GLU OE1 580 4.689 3.623 6.517 0.5037 -0.3995 0.4018
36GLU OE2 581 4.829 3.456 6.505 -0.0598 0.1415 0.7541
36GLU C 582 4.783 3.683 6.006 -0.9857 0.0734 0.5513
36GLU O 583 4.821 3.799 6.017 0.5891 0.4579 0.4082
37ALA N 584 4.662 3.649 5.961 0.9842 0.2358 0.6173
37ALA H 585 4.624 3.560 5.989 -4.1864 2.5727 2.2307
37ALA CA 586 4.564 3.754 5.923 -0.7492 -0.8646 -0.7645
37ALA HA 587 4.608 3.847 5.887 0.2253 0.3051 2.9967
37ALA CB 588 4.485 3.686 5.817 0.0039 0.8624 0.3416
37ALA HB1 589 4.397 3.747 5.797 -1.4378 -0.2723 2.7460
37ALA HB2 590 4.550 3.683 5.729 3.0233 0.7217 2.4154
37ALA HB3 591 4.461 3.582 5.837 0.3132 1.2859 3.4041
37ALA C 592 4.477 3.780 6.051 -0.1842 -0.4492 -0.1148
37ALA O 593 4.442 3.679 6.114 0.9771 -0.2858 -0.2324
38PRO N 594 4.437 3.902 6.090 -0.1119 -0.3816 0.2457
38PRO CA 595 4.346 3.928 6.196 0.3421 0.0474 0.1435
38PRO HA 596 4.375 3.855 6.271 1.0490 0.0686 -0.1058
38PRO CB 597 4.377 4.065 6.249 -0.3419 -0.5407 -0.0021
38PRO HB1 598 4.291 4.127 6.275 -1.6339 -1.6180 -1.5702
38PRO HB2 599 4.449 4.056 6.330 -0.2545 -0.7252 -0.1017
38PRO CG 600 4.435 4.137 6.122 -0.2768 -0.2634 -0.3906
38PRO HG1 601 4.370 4.204 6.066 0.2913 0.2846 -0.4002
38PRO HG2 602 4.519 4.194 6.162 -0.4211 -1.0550 1.1293
38PRO CD 603 4.487 4.025 6.033 0.0011 -0.0463 0.0312
38PRO HD1 604 4.444 4.029 5.933 1.5165 -0.2854 -0.6597
38PRO HD2 605 4.595 4.021 6.021 -0.0725 -1.5390 -0.4469
38PRO C 606 4.199 3.897 6.154 -0.3149 -0.1919 0.2391
38PRO O 607 4.168 3.850 6.043 -0.1964 0.8755 -0.2492
39GLU N 608 4.109 3.923 6.247 -0.4260 -0.6271 0.3187
39GLU H 609 4.147 3.963 6.331 1.3149 -0.7018 -0.4043
39GLU CA 610 3.962 3.918 6.223 -0.5105 0.2821 0.2356
39GLU HA 611 3.932 3.818 6.190 -1.6460 0.7178 -0.0766
39GLU CB 612 3.882 3.943 6.352 -0.8466 -0.5595 0.1967
39GLU HB1 613 3.920 3.888 6.438 -1.0054 2.0175 2.0431
39GLU HB2 614 3.911 4.046 6.375 -1.3109 -0.2526 -0.5658
39GLU CG 615 3.731 3.928 6.339 -0.1690 -0.8185 -0.1006
39GLU HG1 616 3.686 3.992 6.262 -0.7282 0.1606 1.0180
39GLU HG2 617 3.705 3.826 6.312 -1.9893 -0.2852 -0.5677
39GLU CD 618 3.652 3.943 6.469 -0.0592 -0.4984 0.7843
39GLU OE1 619 3.565 3.865 6.512 0.0907 -0.4131 0.6227
39GLU OE2 620 3.671 4.044 6.536 -0.3424 0.4021 0.1627
39GLU C 621 3.935 4.022 6.114 0.8384 -0.2847 -0.9158
39GLU O 622 3.996 4.130 6.113 0.0846 -0.0670 -0.3806
40GLY N 623 3.828 4.002 6.036 -0.6916 0.1522 0.4574
40GLY H 624 3.777 3.915 6.044 -0.5907 0.1159 0.7414
40GLY CA 625 3.817 4.066 5.909 -0.6288 0.1742 -0.5340
40GLY HA1 626 3.914 4.090 5.864 0.6098 1.2526 2.4706
40GLY HA2 627 3.794 3.990 5.835 1.7678 -1.3233 0.1429
40GLY C 628 3.715 4.177 5.908 -0.1583 0.2818 0.7571
40GLY O 629 3.630 4.184 5.816 0.4486 0.3082 0.3911
41THR N 630 3.711 4.255 6.015 0.2820 -0.2678 -0.5983
41THR H 631 3.772 4.223 6.089 -0.4681 -0.2004 0.0601
41THR CA 632 3.606 4.360 6.040 0.0750 -0.7230 0.5448
41THR HA 633 3.515 4.299 6.039 -0.7895 0.5272 -0.6824
41THR CB 634 3.637 4.434 6.174 -0.6297 -0.1398 0.0679
41THR HB 635 3.740 4.469 6.169 -0.5030 -0.6877 -3.1043
41THR OG1 636 3.625 4.343 6.283 -0.3297 -0.1908 -0.1545
41THR HG1 637 3.534 4.322 6.295 -0.5696 0.4815 -0.7460
41THR CG2 638 3.545 4.553 6.223 0.2188 0.3830 -0.2005
41THR HG21 639 3.444 4.517 6.241 0.0949 1.3261 1.1144
41THR HG22 640 3.582 4.590 6.319 0.4712 -0.7944 0.1728
41THR HG23 641 3.542 4.639 6.156 0.2057 0.5654 0.0320
41THR C 642 3.583 4.460 5.927 -0.3102 -0.4212 0.2356
41THR O 643 3.487 4.453 5.849 0.0913 -0.4318 0.4947
42GLU N 644 3.682 4.555 5.915 0.1357 0.0496 0.4571
42GLU H 645 3.767 4.552 5.969 -0.3889 -1.7393 1.2933
42GLU CA 646 3.697 4.640 5.796 -0.0132 0.3553 -0.5065
42GLU HA 647 3.597 4.679 5.779 -0.1997 -0.7231 -2.1461
42GLU CB 648 3.814 4.734 5.814 -0.1228 -0.1991 -0.4033
42GLU HB1 649 3.820 4.771 5.917 -0.4071 -0.8008 -0.1669
42GLU HB2 650 3.906 4.678 5.798 1.4872 2.1315 0.1861
42GLU CG 651 3.813 4.859 5.734 0.0827 0.4098 -0.6517
42GLU HG1 652 3.912 4.903 5.736 0.1390 0.2475 0.2090
42GLU HG2 653 3.791 4.839 5.629 1.5858 0.7944 -1.0581
42GLU CD 654 3.725 4.972 5.796 0.1928 -0.2267 0.4397
42GLU OE1 655 3.730 4.993 5.919 0.4187 0.2230 -0.1737
42GLU OE2 656 3.665 5.051 5.721 -0.4423 -0.3939 0.1483
42GLU C 657 3.725 4.561 5.673 0.0590 -0.1726 -0.9184
42GLU O 658 3.666 4.589 5.569 -0.5029 -0.7003 0.0345
43SER N 659 3.797 4.449 5.685 0.1427 0.4813 0.3005
43SER H 660 3.827 4.432 5.780 -1.3577 2.4005 1.1933
43SER CA 661 3.850 4.376 5.566 1.0346 0.4007 0.7473
43SER HA 662 3.895 4.449 5.500 2.1673 -1.3582 -0.5228
43SER CB 663 3.952 4.284 5.622 0.0789 -0.0530 1.0702
43SER HB1 664 3.905 4.198 5.671 -1.1038 -1.0684 -1.6178
43SER HB2 665 4.004 4.228 5.544 -1.3345 -0.9988 0.7737
43SER OG 666 4.042 4.355 5.708 -0.5272 0.5049 -0.2636
43SER HG 667 4.116 4.297 5.721 -3.9715 -3.9056 2.4568
43SER C 668 3.739 4.290 5.493 -1.0131 -0.2502 -0.0414
43SER O 669 3.758 4.261 5.373 -0.3104 0.2936 0.1407
44GLU N 670 3.615 4.287 5.543 -0.0477 -0.6127 0.0307
44GLU H 671 3.595 4.331 5.632 0.1121 1.0195 -0.7121
44GLU CA 672 3.501 4.239 5.475 0.0112 -0.0740 -0.3741
44GLU HA 673 3.528 4.142 5.433 -1.7336 -0.9241 0.3627
44GLU CB 674 3.387 4.222 5.583 0.0383 0.8980 0.0893
44GLU HB1 675 3.433 4.175 5.669 -1.0381 -0.7576 -0.1922
44GLU HB2 676 3.343 4.318 5.610 -0.6005 0.7299 -0.3394
44GLU CG 677 3.264 4.134 5.536 0.7061 0.1000 -0.0750
44GLU HG1 678 3.210 4.171 5.449 -0.5741 1.2670 1.1578
44GLU HG2 679 3.286 4.027 5.531 -1.6887 -0.4136 -0.9068
44GLU CD 680 3.161 4.142 5.651 -0.3895 1.3097 -0.0009
44GLU OE1 681 3.176 4.069 5.750 0.2576 -0.6667 -0.3412
44GLU OE2 682 3.058 4.207 5.638 -0.7501 -0.0046 -0.0281
44GLU C 683 3.449 4.339 5.378 -0.0339 -0.2825 0.1415
44GLU O 684 3.395 4.303 5.273 -0.1334 0.1285 0.0567
45ALA N 685 3.464 4.468 5.403 -0.6581 -0.3109 0.0056
45ALA H 686 3.524 4.504 5.475 -2.1487 0.3339 0.9837
45ALA CA 687 3.390 4.568 5.332 0.8515 -0.3568 0.2770
45ALA HA 688 3.289 4.535 5.310 0.7919 -0.3126 0.4845
45ALA CB 689 3.373 4.694 5.427 -0.4318 0.2214 -0.5464
45ALA HB1 690 3.311 4.670 5.513 0.7168 0.8361 0.5017
45ALA HB2 691 3.470 4.715 5.473 0.0022 1.9441 -2.1405
45ALA HB3 692 3.336 4.784 5.378 -0.8158 0.2127 -0.2798
45ALA C 693 3.474 4.618 5.209 -0.2730 -0.2225 -1.5235
45ALA O 694 3.424 4.636 5.104 -0.8090 0.8806 0.2687
46VAL N 695 3.607 4.627 5.231 -0.6677 -0.2363 -0.0975
46VAL H 696 3.653 4.604 5.317 -1.1502 2.4220 0.9530
46VAL CA 697 3.692 4.685 5.127 0.0606 -0.0412 -0.5583
46VAL HA 698 3.634 4.751 5.062 -0.5201 -1.8107 -1.9243
46VAL CB 699 3.806 4.759 5.187 -0.6908 -0.6385 -0.7706
46VAL HB 700 3.775 4.856 5.227 1.2775 -0.3448 0.1258
46VAL CG1 701 3.882 4.702 5.306 -0.0443 0.1061 0.1995
46VAL HG11 702 3.973 4.758 5.328 2.1958 -2.6665 -1.2559
46VAL HG12 703 3.822 4.717 5.395 -1.5550 -1.2148 -0.5464
46VAL HG13 704 3.911 4.598 5.294 -0.1288 0.1029 0.0170
46VAL CG2 705 3.903 4.807 5.084 -0.5551 0.7398 -0.1373
46VAL HG21 706 3.985 4.868 5.121 -0.7694 0.2578 1.1926
46VAL HG22 707 3.946 4.719 5.036 0.3669 0.9837 0.2234
46VAL HG23 708 3.860 4.853 4.995 1.0005 0.5344 -1.0299
46VAL C 709 3.738 4.572 5.034 -0.3076 0.0247 -0.9100
46VAL O 710 3.762 4.597 4.918 0.0384 0.6765 -0.3154
47LYS N 711 3.754 4.452 5.082 0.1920 0.0575 -0.0961
47LYS H 712 3.754 4.437 5.182 -0.6245 -0.8802 -0.2144
47LYS CA 713 3.778 4.338 4.990 -0.6674 0.4231 0.0169
47LYS HA 714 3.857 4.353 4.917 -1.4320 1.5717 -0.6132
47LYS CB 715 3.816 4.214 5.071 -0.3213 0.5231 -0.4948
47LYS HB1 716 3.901 4.240 5.135 0.2353 -0.8000 -0.6673
47LYS HB2 717 3.734 4.188 5.138 -0.3172 3.3040 0.7159
47LYS CG 718 3.859 4.098 4.989 0.6440 -0.7085 -0.3467
47LYS HG1 719 3.776 4.054 4.934 0.7785 0.4703 -1.5271
47LYS HG2 720 3.920 4.134 4.906 0.0610 0.8354 -0.1255
47LYS CD 721 3.926 3.992 5.074 -0.3065 0.1317 -0.2788
47LYS HD1 722 3.964 3.914 5.007 0.8239 1.2642 -1.0050
47LYS HD2 723 4.013 4.037 5.122 -0.8755 3.2949 -1.9221
47LYS CE 724 3.822 3.937 5.186 -0.7049 0.2339 0.0353
47LYS HE1 725 3.819 4.014 5.263 -0.1178 0.1893 0.1091
47LYS HE2 726 3.725 3.927 5.137 -1.2719 1.1683 0.9289
47LYS NZ 727 3.863 3.814 5.248 0.4017 0.5210 0.9142
47LYS HZ1 728 3.925 3.836 5.324 1.2224 1.0044 0.1170
47LYS HZ2 729 3.783 3.757 5.273 1.7738 -2.1436 -0.3489
47LYS HZ3 730 3.907 3.756 5.178 1.4009 1.3847 0.8120
47LYS C 731 3.661 4.309 4.897 -0.1076 -0.3487 0.0911
47LYS O 732 3.687 4.289 4.779 0.2361 -0.0696 -0.0406
48GLN N 733 3.533 4.328 4.941 -0.2710 -0.1545 -0.5528
48GLN H 734 3.521 4.358 5.036 0.1619 2.1933 -1.1853
48GLN CA 735 3.419 4.333 4.856 0.3114 0.3819 0.4836
48GLN HA 736 3.412 4.244 4.793 3.8299 1.6249 -1.9681
48GLN CB 737 3.290 4.349 4.948 -0.0957 -0.4712 -0.3778
48GLN HB1 738 3.279 4.274 5.026 -0.9094 2.3437 2.4517
48GLN HB2 739 3.289 4.441 5.007 -0.5639 -1.0155 0.4715
48GLN CG 740 3.153 4.370 4.873 0.0864 0.5275 0.8455
48GLN HG1 741 3.079 4.396 4.949 1.4722 0.4164 2.2905
48GLN HG2 742 3.161 4.459 4.811 0.2599 -0.0671 -0.0003
48GLN CD 743 3.098 4.250 4.788 -0.4068 0.6851 0.2488
48GLN OE1 744 3.159 4.141 4.798 0.6156 -0.0382 -0.5203
48GLN NE2 745 2.997 4.283 4.710 0.1805 0.2789 -0.3199
48GLN HE21 746 2.962 4.377 4.696 1.0131 0.5333 -0.7725
48GLN HE22 747 2.965 4.212 4.645 0.0655 0.2640 -0.2468
48GLN C 748 3.427 4.445 4.749 1.2791 -0.8960 -0.5853
48GLN O 749 3.409 4.437 4.627 -0.5893 0.0732 -1.1736
49ALA N 750 3.464 4.562 4.807 -0.2237 0.2228 0.3068
49ALA H 751 3.476 4.552 4.907 0.9250 -0.3244 0.1286
49ALA CA 752 3.502 4.692 4.734 -0.3428 -1.2111 -0.6396
49ALA HA 753 3.407 4.724 4.690 -0.1326 -0.1023 -0.3190
49ALA CB 754 3.529 4.805 4.829 -0.7905 -0.7020 0.7677
49ALA HB1 755 3.633 4.811 4.860 -0.0891 -0.9250 -1.3980
49ALA HB2 756 3.508 4.902 4.784 0.7462 -0.0987 1.2936
49ALA HB3 757 3.466 4.792 4.917 0.2024 0.1442 1.6335
49ALA C 758 3.601 4.675 4.620 0.1464 -0.3744 0.3177
49ALA O 759 3.569 4.712 4.507 0.0986 -0.0852 0.3076
50LEU N 760 3.707 4.589 4.646 -0.4548 -0.7506 0.0097
50LEU H 761 3.727 4.566 4.742 0.3296 0.0714 0.0559
50LEU CA 762 3.804 4.570 4.535 0.3955 -0.3874 0.2010
50LEU HA 763 3.816 4.666 4.484 -0.5138 -0.8876 -1.0259
50LEU CB 764 3.942 4.522 4.590 -0.0421 0.1969 0.0533
50LEU HB1 765 3.938 4.452 4.674 0.6401 1.4740 1.1937
50LEU HB2 766 3.986 4.456 4.516 -0.6981 -0.6212 0.3824
50LEU CG 767 4.048 4.631 4.621 0.6565 -0.4177 -0.3047
50LEU HG 768 4.144 4.589 4.590 0.8968 0.7169 -1.1697
50LEU CD1 769 4.054 4.758 4.535 1.1080 -0.1540 -0.1005
50LEU HD11 770 4.146 4.809 4.563 0.8420 -0.4197 1.2807
50LEU HD12 771 4.060 4.729 4.430 2.5118 -0.0942 -0.0632
50LEU HD13 772 3.974 4.829 4.558 1.3895 0.1924 -0.1714
50LEU CD2 773 4.046 4.664 4.770 0.0072 0.8948 -0.0718
50LEU HD21 774 4.097 4.757 4.799 -1.1680 1.3131 0.7338
50LEU HD22 775 3.940 4.675 4.793 -0.3669 -1.9016 -0.1126
50LEU HD23 776 4.086 4.588 4.837 -0.4806 1.5671 1.0104
50LEU C 777 3.755 4.460 4.439 0.1912 0.8366 -0.3846
50LEU O 778 3.801 4.459 4.330 -0.6810 0.4445 -0.1128
51ARG N 779 3.661 4.378 4.480 0.1674 0.2175 -0.0660
51ARG H 780 3.657 4.364 4.580 1.3387 4.8813 0.8743
51ARG CA 781 3.597 4.269 4.401 -0.2110 -0.5089 0.3250
51ARG HA 782 3.672 4.213 4.345 0.7743 0.0992 1.0077
51ARG CB 783 3.541 4.165 4.503 -0.0952 -0.1463 0.6002
51ARG HB1 784 3.615 4.155 4.582 0.9517 1.5816 -0.1113
51ARG HB2 785 3.462 4.216 4.557 -0.0221 -0.6331 1.1758
51ARG CG 786 3.499 4.023 4.468 -0.6871 0.5881 0.3180
51ARG HG1 787 3.434 4.031 4.381 1.1989 -1.3234 -1.3934
51ARG HG2 788 3.582 3.964 4.429 0.2930 1.5890 0.8177
51ARG CD 789 3.423 3.954 4.580 0.2742 0.3633 -0.0244
51ARG HD1 790 3.340 4.018 4.607 2.0397 2.5874 0.4575
51ARG HD2 791 3.386 3.854 4.560 -0.2739 0.5954 -0.1798
51ARG NE 792 3.515 3.935 4.685 -0.5509 0.1121 -1.3008
51ARG HE 793 3.610 3.916 4.656 -0.0112 0.7665 -0.0222
51ARG CZ 794 3.476 3.925 4.813 -0.1380 -0.3600 -0.3687
51ARG NH1 795 3.358 3.982 4.854 0.0888 -0.2794 -0.7437
51ARG HH11 796 3.294 4.029 4.792 -0.3744 -0.7495 -0.6282
51ARG HH12 797 3.319 3.969 4.946 1.9295 1.3338 0.3470
51ARG NH2 798 3.556 3.856 4.899 -0.0890 0.3504 -0.5951
51ARG HH21 799 3.650 3.822 4.884 1.1343 0.4323 4.8441
51ARG HH22 800 3.521 3.820 4.986 0.4821 0.3686 -0.3529
51ARG C 801 3.481 4.317 4.312 0.2064 -0.4351 -0.3851
51ARG O 802 3.466 4.278 4.195 -0.1376 0.1600 0.5397
52GLU N 803 3.404 4.412 4.362 0.1755 -0.6389 -0.2908
52GLU H 804 3.419 4.448 4.455 -1.7776 -1.2342 0.3098
52GLU CA 805 3.301 4.484 4.281 0.2112 0.5954 0.8859
52GLU HA 806 3.242 4.408 4.229 -2.3126 0.5633 3.5555
52GLU CB 807 3.217 4.561 4.375 -0.0913 -0.3199 0.0834
52GLU HB1 808 3.292 4.601 4.443 0.2836 -0.5411 -0.1967
52GLU HB2 809 3.165 4.638 4.317 0.1872 -0.6807 -0.6584
52GLU CG 810 3.116 4.470 4.456 -0.1314 -0.3451 -0.6760
52GLU HG1 811 3.167 4.400 4.522 0.6497 0.9646 0.1475
52GLU HG2 812 3.073 4.534 4.533 0.4613 0.0795 -0.6940
52GLU CD 813 3.016 4.394 4.380 0.5810 -0.1568 -0.3133
52GLU OE1 814 3.042 4.276 4.358 -0.2488 0.1848 0.9629
52GLU OE2 815 2.906 4.452 4.352 -0.4040 -0.1566 -0.2336
52GLU C 816 3.371 4.580 4.175 -0.8177 -1.0838 0.1556
52GLU O 817 3.333 4.588 4.060 -0.5034 -0.5924 -0.4377
53ALA N 818 3.476 4.658 4.216 -0.1421 0.2728 0.6025
53ALA H 819 3.501 4.653 4.314 -2.4929 2.3906 1.4337
53ALA CA 820 3.553 4.750 4.134 0.6283 -0.7547 -0.2138
53ALA HA 821 3.483 4.809 4.075 1.9477 1.5078 0.3650
53ALA CB 822 3.632 4.846 4.223 -0.1050 0.2386 -0.0792
53ALA HB1 823 3.666 4.940 4.180 1.4062 -0.8153 -1.2875
53ALA HB2 824 3.584 4.860 4.321 1.5981 -0.4906 0.9005
53ALA HB3 825 3.722 4.801 4.265 0.3625 2.7017 1.8376
53ALA C 826 3.651 4.677 4.041 0.4318 0.6139 -0.3632
53ALA O 827 3.675 4.731 3.932 0.2453 -0.0234 -0.0662
54GLY N 828 3.702 4.557 4.078 -0.6939 -0.3719 0.2211
54GLY H 829 3.680 4.518 4.168 -1.0126 -0.5565 0.0614
54GLY CA 830 3.799 4.480 4.000 -0.6108 0.2056 -0.5233
54GLY HA1 831 3.892 4.524 3.966 -0.6304 1.6513 1.1140
54GLY HA2 832 3.834 4.395 4.058 1.0915 0.5155 -1.0507
54GLY C 833 3.725 4.425 3.876 -0.5801 0.2903 -0.0671
54GLY O 834 3.786 4.431 3.766 -0.3548 0.2514 0.3832
55ASP N 835 3.596 4.398 3.899 1.4296 0.6154 0.1027
55ASP H 836 3.555 4.386 3.991 0.3089 -0.9994 -0.5481
55ASP CA 837 3.495 4.366 3.793 0.3073 -0.5256 -0.6982
55ASP HA 838 3.537 4.290 3.727 -1.0426 -1.9746 0.0385
55ASP CB 839 3.373 4.300 3.863 -0.3440 -0.1292 -0.2011
55ASP HB1 840 3.399 4.218 3.930 1.4637 1.1231 0.6957
55ASP HB2 841 3.322 4.376 3.921 -0.8940 -1.1295 0.6627
55ASP CG 842 3.274 4.251 3.760 -0.1167 -0.0663 -0.0316
55ASP OD1 843 3.301 4.164 3.677 -0.2263 0.1714 -0.5535
55ASP OD2 844 3.171 4.312 3.755 -0.1672 0.3972 0.3720
55ASP C 845 3.461 4.489 3.711 -0.3717 -0.5853 -0.1292
55ASP O 846 3.454 4.470 3.588 0.1394 -0.7005 -0.1946
56GLU N 847 3.442 4.611 3.764 0.1955 0.4592 -0.0699
56GLU H 848 3.423 4.615 3.863 2.1070 0.9021 0.3141
56GLU CA 849 3.417 4.726 3.683 0.8526 0.3876 -0.4072
56GLU HA 850 3.327 4.695 3.630 -0.2198 -1.0634 2.0703
56GLU CB 851 3.375 4.850 3.765 0.6260 0.1688 0.0678
56GLU HB1 852 3.295 4.822 3.833 0.5286 -0.1814 -0.1864
56GLU HB2 853 3.451 4.865 3.841 1.3841 0.5264 -0.7358
56GLU CG 854 3.329 4.973 3.685 0.3796 -0.9022 0.2733
56GLU HG1 855 3.403 4.991 3.607 -0.0892 -0.4231 -0.0684
56GLU HG2 856 3.228 4.962 3.645 0.1044 -0.9498 0.9591
56GLU CD 857 3.330 5.097 3.773 -0.2294 -0.0303 -0.3316
56GLU OE1 858 3.227 5.160 3.786 0.1500 -0.2495 -0.1514
56GLU OE2 859 3.443 5.132 3.819 0.7716 0.3028 -0.0443
56GLU C 860 3.531 4.758 3.591 -0.1078 -0.9249 -0.2485
56GLU O 861 3.504 4.793 3.475 -0.2877 -0.3427 0.7244
57PHE N 862 3.660 4.751 3.638 -0.0134 0.3706 0.1884
57PHE H 863 3.663 4.715 3.732 0.9639 0.4654 0.2013
57PHE CA 864 3.776 4.785 3.565 -0.2066 -0.2263 0.2118
57PHE HA 865 3.748 4.880 3.519 -0.1553 -0.1511 0.3384
57PHE CB 866 3.903 4.783 3.658 -0.1917 -0.1092 0.1326
57PHE HB1 867 3.876 4.850 3.740 0.1885 -1.7657 1.6770
57PHE HB2 868 3.937 4.682 3.682 0.7573 -0.4810 -2.4478
57PHE CG 869 4.021 4.864 3.599 0.1396 0.1035 0.3753
57PHE CD1 870 4.034 5.003 3.618 -0.1445 0.4029 -0.4360
57PHE HD1 871 3.965 5.055 3.683 0.1345 -0.3747 0.5014
57PHE CD2 872 4.114 4.789 3.526 -0.0063 0.3517 -0.0711
57PHE HD2 873 4.099 4.683 3.510 0.7277 0.3786 -1.0547
57PHE CE1 874 4.141 5.063 3.556 -0.3783 0.2259 -0.2830
57PHE HE1 875 4.151 5.170 3.550 0.4168 0.1459 -0.5809
57PHE CE2 876 4.220 4.858 3.463 0.7623 0.5880 -0.4710
57PHE HE2 877 4.288 4.798 3.405 -1.5108 -2.0104 -0.6685
57PHE CZ 878 4.230 4.994 3.477 -0.7418 -0.0069 -0.1183
57PHE HZ 879 4.294 5.050 3.411 -0.3406 -1.3775 -0.9204
57PHE C 880 3.797 4.679 3.455 -0.4590 -0.0092 0.7212
57PHE O 881 3.829 4.720 3.346 -0.5883 -0.2540 -0.0592
58GLU N 882 3.768 4.555 3.492 -0.2868 -0.3971 0.0293
58GLU H 883 3.740 4.535 3.587 -0.3426 2.4685 0.7004
58GLU CA 884 3.787 4.443 3.396 0.3926 -0.5084 0.2486
58GLU HA 885 3.886 4.451 3.350 0.5668 -0.3114 0.6607
58GLU CB 886 3.776 4.309 3.479 0.4899 -0.7700 0.3611
58GLU HB1 887 3.837 4.329 3.567 1.1599 -0.0298 -0.2486
58GLU HB2 888 3.675 4.283 3.511 0.4374 -0.6298 0.3079
58GLU CG 889 3.836 4.193 3.390 -0.2005 0.7642 0.0899
58GLU HG1 890 3.759 4.168 3.318 -0.1754 -0.8562 0.5866
58GLU HG2 891 3.922 4.227 3.332 0.9286 -0.6294 0.8615
58GLU CD 892 3.887 4.075 3.474 -0.1075 -0.1458 -0.1786
58GLU OE1 893 4.004 4.079 3.523 0.2660 -0.1460 -0.1002
58GLU OE2 894 3.805 3.988 3.516 0.3151 -0.7152 -0.3346
58GLU C 895 3.683 4.449 3.280 -0.3326 -0.6762 0.0451
58GLU O 896 3.713 4.379 3.180 0.1487 -0.3575 0.3117
59LEU N 897 3.575 4.531 3.295 0.0464 0.3668 -0.4780
59LEU H 898 3.558 4.568 3.387 0.2617 3.3073 -1.5150
59LEU CA 899 3.464 4.534 3.197 -0.3118 -0.3686 0.1681
59LEU HA 900 3.467 4.455 3.123 2.4369 -1.4255 1.2459
59LEU CB 901 3.327 4.530 3.269 0.2458 0.0528 -0.1016
59LEU HB1 902 3.318 4.454 3.347 -1.3737 -0.3254 -0.6062
59LEU HB2 903 3.317 4.620 3.330 1.5978 -0.3317 0.7264
59LEU CG 904 3.200 4.520 3.178 0.3226 -0.1596 0.5502
59LEU HG 905 3.176 4.609 3.120 0.2175 -1.0224 -0.7565
59LEU CD1 906 3.217 4.409 3.068 0.8021 -0.2120 -0.5457
59LEU HD11 907 3.246 4.314 3.112 0.2362 -0.1126 0.0587
59LEU HD12 908 3.126 4.398 3.010 0.1820 -0.2911 0.4168
59LEU HD13 909 3.289 4.433 2.990 -1.6161 0.5145 -2.6857
59LEU CD2 910 3.077 4.471 3.263 0.4631 0.1067 0.0864
59LEU HD21 911 3.079 4.366 3.293 1.6098 0.3842 1.0664
59LEU HD22 912 3.056 4.536 3.348 -1.2983 -0.3465 0.0321
59LEU HD23 913 2.990 4.469 3.197 1.8137 -0.9614 -1.7601
59LEU C 914 3.489 4.661 3.112 0.5869 -0.0911 -0.1986
59LEU O 915 3.479 4.666 2.989 0.4557 -0.6922 0.0393
60ARG N 916 3.507 4.775 3.181 -0.0487 -0.0906 -0.0124
60ARG H 917 3.509 4.778 3.282 0.0184 1.2929 -0.0277
60ARG CA 918 3.529 4.906 3.117 0.2999 0.0748 0.9822
60ARG HA 919 3.450 4.927 3.044 0.9214 1.7706 0.7274
60ARG CB 920 3.525 5.017 3.222 -0.0385 -0.3230 0.3450
60ARG HB1 921 3.585 4.984 3.307 0.7662 2.2712 0.8926
60ARG HB2 922 3.563 5.113 3.187 0.4567 -0.8902 -0.7035
60ARG CG 923 3.380 5.044 3.275 0.0031 -0.5775 -0.4430
60ARG HG1 924 3.338 4.951 3.313 -1.3745 -0.4287 -1.5062
60ARG HG2 925 3.389 5.112 3.360 -0.5064 -1.8240 0.6334
60ARG CD 926 3.276 5.114 3.182 0.2428 0.0405 -0.7400
60ARG HD1 927 3.249 5.053 3.096 1.7135 -3.8031 1.2428
60ARG HD2 928 3.186 5.128 3.242 1.1270 -0.7045 0.8415
60ARG NE 929 3.329 5.241 3.146 0.2085 0.2449 0.4495
60ARG HE 930 3.342 5.301 3.227 -2.8867 2.1564 -0.3103
60ARG CZ 931 3.359 5.293 3.023 -0.1970 0.4490 -0.7636
60ARG NH1 932 3.350 5.219 2.911 -0.8216 0.3000 -0.5395
60ARG HH11 933 3.307 5.128 2.910 -0.0526 -0.0756 -0.8520
60ARG HH12 934 3.397 5.252 2.828 2.2569 -0.5747 0.6786
60ARG NH2 935 3.397 5.422 3.008 -0.0376 0.5631 -0.1633
60ARG HH21 936 3.400 5.485 3.086 0.3405 -0.0992 0.3717
60ARG HH22 937 3.417 5.471 2.921 0.2318 3.3523 1.3603
60ARG C 938 3.666 4.920 3.054 0.0442 -0.0524 -0.5438
60ARG O 939 3.680 5.008 2.966 0.1780 0.2946 -0.0149
61TYR N 940 3.769 4.858 3.110 -1.3213 0.9356 -0.6959
61TYR H 941 3.752 4.785 3.177 -2.8318 -1.8301 -3.7458
61TYR CA 942 3.912 4.889 3.089 -0.2996 0.5696 0.5833
61TYR HA 943 3.917 4.951 3.000 -1.0634 -3.7398 -2.7432
61TYR CB 944 3.979 4.976 3.204 0.2202 0.8792 0.3312
61TYR HB1 945 3.976 4.926 3.301 0.1212 1.5226 0.6636
61TYR HB2 946 4.085 4.996 3.192 0.3940 0.6368 1.3870
61TYR CG 947 3.922 5.112 3.211 -0.6955 0.2008 -0.8100
61TYR CD1 948 3.951 5.198 3.101 -0.2911 0.0878 0.1477
61TYR HD1 949 4.027 5.179 3.027 -1.0625 1.0588 -0.9145
61TYR CD2 950 3.840 5.153 3.316 -0.2495 -0.0777 -0.1611
61TYR HD2 951 3.818 5.095 3.404 -1.4592 -1.8067 -1.5374
61TYR CE1 952 3.897 5.329 3.103 -0.3123 -0.1281 0.8249
61TYR HE1 953 3.919 5.397 3.023 -2.2080 0.1942 0.5361
61TYR CE2 954 3.791 5.285 3.315 -0.1990 0.3178 -0.7307
61TYR HE2 955 3.739 5.322 3.402 -1.0340 0.1321 -1.1379
61TYR CZ 956 3.811 5.371 3.206 -0.6985 0.6978 -0.0941
61TYR OH 957 3.769 5.501 3.220 -0.3432 0.1399 -0.6741
61TYR HH 958 3.751 5.538 3.136 0.4186 -0.8864 -1.3196
61TYR C 959 4.002 4.764 3.057 0.4262 -0.5463 0.1945
61TYR O 960 4.125 4.765 3.085 0.1205 0.0433 -0.1414
62ARG N 961 3.947 4.665 2.993 0.3528 0.0895 0.0271
62ARG H 962 3.853 4.683 2.963 0.1894 -1.0499 -0.1690
62ARG CA 963 4.007 4.535 2.973 0.1051 0.5281 0.7656
62ARG HA 964 4.033 4.496 3.071 -0.8119 1.2536 1.3177
62ARG CB 965 3.905 4.435 2.914 0.9781 -0.3612 -0.1084
62ARG HB1 966 3.815 4.458 2.971 0.9768 0.8645 -0.5813
62ARG HB2 967 3.878 4.461 2.812 0.0158 0.7972 0.4138
62ARG CG 968 3.947 4.291 2.926 0.3101 0.6712 0.6041
62ARG HG1 969 4.039 4.270 2.871 0.3017 2.1131 0.0065
62ARG HG2 970 3.962 4.275 3.033 1.4086 -2.3446 0.1029
62ARG CD 971 3.845 4.183 2.886 -0.1892 0.0770 0.1690
62ARG HD1 972 3.907 4.094 2.886 -0.7932 -0.3537 0.1756
62ARG HD2 973 3.764 4.187 2.960 0.2046 -0.9365 0.6640
62ARG NE 974 3.801 4.199 2.749 0.2583 0.2680 0.2927
62ARG HE 975 3.875 4.176 2.684 -2.3353 -5.2797 -1.3158
62ARG CZ 976 3.679 4.218 2.702 0.5141 -0.3086 0.6675
62ARG NH1 977 3.571 4.221 2.779 0.0710 -0.9498 -0.1888
62ARG HH11 978 3.574 4.225 2.880 -0.0953 -0.6438 -0.1949
62ARG HH12 979 3.479 4.241 2.742 -0.1529 -0.4018 0.6229
62ARG NH2 980 3.649 4.233 2.569 0.6691 0.4096 -0.2956
62ARG HH21 981 3.709 4.203 2.493 -0.8962 -0.7278 -1.1253
62ARG HH22 982 3.563 4.273 2.535 -0.2252 -1.8884 -0.9558
62ARG C 983 4.129 4.540 2.878 0.2251 -0.2756 0.3492
62ARG O 984 4.223 4.468 2.909 -0.0751 0.0201 -0.0616
63ARG N 985 4.131 4.629 2.775 0.2025 -0.6175 0.2316
63ARG H 986 4.046 4.680 2.757 -0.7748 -2.4362 -0.6098
63ARG CA 987 4.252 4.656 2.692 0.3568 -1.0980 -0.1326
63ARG HA 988 4.286 4.556 2.667 -0.8270 -1.1933 -1.5403
63ARG CB 989 4.220 4.727 2.559 0.2050 0.2635 0.1268
63ARG HB1 990 4.127 4.689 2.516 0.6011 1.2714 -1.7644
63ARG HB2 991 4.200 4.832 2.581 -3.4718 -0.6134 1.6398
63ARG CG 992 4.328 4.712 2.452 -0.9789 0.9372 0.3953
63ARG HG1 993 4.320 4.783 2.369 1.0069 0.6693 -0.0718
63ARG HG2 994 4.422 4.753 2.489 -0.4201 0.1343 -0.1064
63ARG CD 995 4.349 4.572 2.391 0.1083 -0.6225 -0.3043
63ARG HD1 996 4.436 4.578 2.325 1.2995 2.9497 1.3119
63ARG HD2 997 4.381 4.494 2.460 0.9408 1.1650 1.4135
63ARG NE 998 4.235 4.529 2.304 -0.2115 0.2304 0.5766