NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.4205 8.2544 120.8903 56.0622 31.4539 174.6293 3 Y 3.5499 8.5482 126.6896 57.0358 40.3086 172.4741 4 I 4.5364 7.6880 126.9636 59.5243 40.4991 173.9227 5 V 4.3835 8.4768 127.7902 60.9649 33.3114 174.3827 6 A 4.9690 9.0364 130.7831 50.9757 20.6286 175.3899 7 L 5.0763 8.9186 123.8459 53.5811 44.9120 175.2940 8 T 4.8885 8.5947 119.5481 60.4095 71.7179 172.0966 9 G 4.2433 8.0267 111.0227 46.0830 0.0000 173.0793 10 G 4.0226 7.8460 109.9912 43.7748 0.0000 172.9075 11 I 3.8117 8.1429 120.0572 62.3652 38.1092 176.2659 12 G 3.9930 8.9511 115.3985 45.4954 0.0000 174.0681 13 S 4.2249 7.8645 113.4703 58.5469 63.7190 174.0918 14 G 3.8122 8.0500 109.3413 46.6655 0.0000 175.8284 15 K 3.9113 8.2302 120.4983 59.5589 32.2297 178.7499 16 S 4.1511 8.0526 114.7156 61.8517 62.5725 176.5219 17 T 3.9054 7.4826 117.5952 66.6888 68.6122 176.5333 18 V 3.8083 7.7836 119.2019 66.0217 31.7303 177.6734 19 A 4.2136 8.3792 120.8583 55.5430 18.1794 179.4256 20 N 4.3499 8.8877 114.9742 56.1685 38.3108 177.5662 21 A 3.9605 7.7042 121.5760 55.1149 18.7244 179.3881 22 F 4.1462 8.3228 115.7226 60.3962 39.1476 177.5430 23 A 4.4601 8.2615 122.0448 54.8769 17.9781 179.4433 24 D 4.4288 8.2155 115.9923 56.6336 40.8621 177.8503 25 L 4.4633 7.5444 118.0170 54.2808 41.8052 177.3218 26 G 3.9391 8.0258 107.3110 45.2523 0.0000 173.7407 27 I 3.9751 7.4159 120.8477 60.1536 38.3443 174.6223 28 N 4.5824 8.8629 123.3308 53.1849 39.5595 174.0967 29 V 4.6934 8.4194 123.9811 61.4690 33.2981 174.7596 30 I 4.4308 9.0015 129.4981 59.7594 39.4873 174.1517 31 D 4.9648 8.6581 127.8829 52.7565 42.0479 176.6553 32 A 4.1509 8.8988 129.3526 55.5657 18.3555 179.0567 33 D 4.2765 8.1543 116.6250 57.5498 41.0204 178.6564 34 I 3.6978 7.9496 120.2694 64.7165 37.1516 178.5607 35 I 3.7337 8.0812 120.2958 64.3079 36.6737 178.3409 36 A 4.0586 7.9980 120.9332 55.2046 18.4053 179.6790 37 R 4.0233 8.0511 116.6428 59.4085 29.9781 178.7944 38 Q 4.2677 7.9835 119.6776 58.6996 29.0387 178.5927 39 V 3.7980 7.7981 117.9380 64.5204 31.8291 176.4130 40 V 4.4118 7.6984 112.2484 60.9043 32.1863 175.4524 41 E 4.4170 7.8569 118.9509 54.0528 31.1211 174.2356 42 P 4.1209 0.0000 0.0000 64.4611 31.4363 176.8510 43 G 3.8740 8.9225 110.0730 46.1677 0.0000 173.2801 44 A 4.2013 7.7019 122.5352 50.6527 19.4462 177.6051 45 P 4.1350 0.0000 0.0000 65.8641 31.1202 178.7885 46 A 3.9929 7.9597 117.5133 55.3674 18.3098 179.2220 47 L 4.0969 7.5743 115.7319 58.3006 41.7788 179.0348 48 H 4.3338 8.2749 114.3436 57.0483 29.0762 175.4979 49 A 4.6466 7.3922 122.0963 49.5174 21.1238 173.8103 *78 P 4.0819 0.0000 0.0000 63.5130 32.3559 174.6468 79 E 4.1700 8.4806 125.4754 57.2963 28.2138 175.9427 80 E 4.1702 8.0938 118.8463 59.5327 29.6449 179.6641 81 K 4.1016 8.1479 118.0858 59.4935 32.2054 178.7919 82 N 4.3860 8.8706 117.2155 56.0964 38.0732 177.5275 83 W 4.0653 8.4605 119.9619 59.6763 29.2645 178.1573 84 L 3.9171 8.1984 120.0215 57.6079 41.3609 178.9023 85 N 4.0615 8.0064 116.4801 56.0995 38.5063 177.0092 86 A 4.0590 7.7380 119.8140 53.7770 17.8006 178.4032 87 L 4.3166 7.1511 118.4931 57.2965 42.9627 178.4715 88 L 4.2851 7.8672 118.5100 57.4749 41.5182 179.2625 89 H 4.2871 8.2711 116.7495 58.5256 28.6483 175.8110 90 P 4.2972 0.0000 0.0000 65.7020 31.1370 178.6951 91 L 4.1552 7.4700 118.0686 57.9575 41.5687 179.6608 92 I 3.7482 7.9310 119.7747 64.1348 36.9614 178.3248 93 Q 3.9235 8.5012 121.1900 59.2661 29.0062 178.3225 94 Q 3.9766 8.3414 119.0626 59.2520 28.5358 178.1760 95 E 3.9448 8.4227 121.3039 59.2330 29.7447 178.8389 96 T 3.8125 7.9198 115.8183 66.7573 68.3901 176.4154 97 Q 3.8514 8.1137 121.3978 59.2224 28.8718 177.8784 98 H 4.1492 8.1796 119.4012 59.4231 29.5366 177.3874 99 Q 3.9603 8.2123 119.8180 58.8990 28.2294 178.8491 100 I 3.7323 7.4484 120.5805 64.0983 37.1744 178.0401 101 Q 4.1428 7.7353 117.9205 58.3578 28.7588 177.4167 102 Q 4.2127 7.5381 116.9815 55.6889 29.5847 176.0146 103 A 4.1290 6.9052 124.0411 52.7354 18.8792 177.4205 104 T 4.4497 8.2408 109.4286 61.3335 70.0785 175.0631 105 S 4.4495 7.6990 116.7601 57.0341 64.2188 172.2249 106 P 4.4546 0.0000 0.0000 65.6051 31.0706 175.8916 107 Y 5.1825 7.3268 113.6380 55.4941 42.1500 174.4596 108 V 4.4766 8.8468 112.4385 59.4540 35.8656 174.8065 109 L 4.9749 8.5231 125.0587 53.3780 44.1195 175.2042 110 W 5.3253 9.2731 135.0000 55.9944 32.1481 175.3396 111 V 4.2542 8.8299 129.8517 62.2285 32.2010 175.1068 112 V 4.2236 8.3862 129.1636 60.1017 32.5762 173.8787 113 P 4.1771 0.0000 0.0000 65.1771 31.4916 177.6710 114 L 5.2187 7.4711 115.5180 53.6625 42.3608 178.1099 115 L 3.6998 7.8240 123.4677 58.4112 42.3479 179.7111 116 V 3.9041 7.9093 117.3825 66.0793 32.1687 177.4675 117 E 3.9312 8.4169 118.9576 59.4719 29.3049 178.1587 118 N 4.5627 8.3659 112.9163 52.3234 38.8155 175.0175 119 S 2.7900 7.7604 113.4447 59.1655 61.1423 174.0226 120 L 4.1910 7.4411 119.8935 56.2564 41.7418 178.8200 121 Y 4.1883 6.8366 117.2481 59.2823 38.0963 177.9931 122 K 4.2362 7.2790 118.9034 58.2460 32.1247 177.5532 123 K 4.3637 8.1042 116.8809 55.8936 32.6430 175.8458 124 A 4.7923 7.6829 122.2473 50.5009 20.9423 176.9283 125 N 4.4638 8.1374 118.2773 55.3208 39.4379 175.7966 126 R 4.7449 7.3430 117.2425 54.5392 34.3423 173.8586 127 V 4.7470 9.2609 124.7587 61.0054 34.5855 173.6813 128 L 5.1595 9.2335 130.5918 53.3206 44.4257 174.8389 129 V 4.7774 8.6377 126.6222 61.0892 33.8344 174.5045 130 V 4.3337 8.7044 129.3590 62.4576 31.8503 174.4439 131 D 5.0646 9.2419 128.8410 52.9151 43.4822 175.4200 132 V 5.0085 8.0196 116.7580 59.8852 36.4445 174.5027 133 S 4.4553 9.0508 116.5718 57.3067 63.9419 173.7974 134 P 4.2576 0.0000 0.0000 65.5142 30.8886 178.4710 135 E 3.9112 8.2103 117.8694 59.8215 29.4267 178.9821 136 T 3.8748 7.9785 115.5386 66.6182 68.5435 176.6150 137 Q 3.9933 7.9489 119.8836 58.9720 28.5293 178.9881 138 L 3.9470 7.9221 118.7098 57.7817 41.8241 179.2340 139 K 4.0728 8.0698 117.3155 59.7764 32.3564 179.3807 140 R 4.1511 8.2417 118.2813 59.3652 29.9615 179.8556 141 T 4.1821 7.6704 113.5201 64.2420 68.4612 176.3285 *143 Q 4.2128 8.0924 121.8766 56.0439 31.0664 176.7509 144 R 3.8805 8.6088 118.4146 59.2313 30.1226 177.1723 145 D 4.6521 8.1752 113.7443 53.2126 41.6329 176.0911 146 D 4.2548 7.6062 115.9197 55.0272 39.4248 171.7686 147 V 4.4672 7.0572 119.0136 59.8269 35.6633 174.7733 148 T 4.1006 8.0928 115.9830 61.8335 69.1286 174.8500 149 R 3.9694 8.4503 124.6650 59.3345 29.7236 178.5004 150 E 4.1138 8.4858 118.4885 58.8988 29.2960 178.6049 151 H 4.2099 7.9948 118.4118 59.1923 30.0153 177.2924 152 V 3.5966 7.6895 120.0580 65.8871 31.3413 177.8792 153 E 3.9880 8.0937 118.1152 59.2561 28.9716 179.3555 154 Q 3.9823 7.4233 116.9520 58.9637 29.0527 178.4318 155 I 3.8299 7.3370 120.8294 64.4006 36.9254 178.5652 156 L 4.0325 8.3524 119.8873 57.5351 41.1492 179.3291 157 A 3.8906 7.8513 119.8539 54.2357 18.4358 178.6121 158 A 4.3255 7.7093 117.4284 52.0749 19.4712 177.0616 159 Q 4.4628 6.7955 115.2378 53.4195 31.0589 175.3004 160 A 4.1473 8.7863 123.2477 52.5294 19.1093 178.3100 161 T 4.3026 8.0853 110.4157 60.7490 71.4167 175.8960 162 R 3.8458 8.4048 120.9167 59.9234 30.0754 178.4316 163 E 4.0005 8.1712 117.4026 59.1901 29.2405 179.0439 164 A 4.0203 7.5992 119.9648 55.0337 18.7243 179.6261 165 R 3.9991 7.9658 116.6920 59.3611 30.1609 179.2130 166 L 4.0021 8.0574 118.5868 57.6246 41.3368 179.3875 167 A 4.0386 7.9244 119.9696 54.1599 18.3414 178.9407 168 V 3.9319 7.1166 107.4055 60.0283 32.7472 176.0208 169 A 4.1756 7.1498 122.5363 52.2807 18.9682 177.2269 170 D 4.7247 9.0367 122.4633 55.8569 42.1552 176.9151 171 D 5.1146 8.0217 116.2018 52.3584 45.2966 175.1178 172 V 4.8511 8.3858 120.0845 61.1529 34.8746 174.3288 173 I 4.5543 8.7045 127.4936 58.9463 40.7745 173.7449 174 D 4.9424 8.8757 129.9323 53.8691 41.8347 175.3012 175 N 5.0997 8.9041 126.8750 53.6107 38.6878 175.4252 176 N 4.5375 9.7241 117.9425 55.1733 39.6596 176.4824 177 G 4.0454 7.6335 109.5608 44.8765 0.0000 173.0531 178 A 4.2937 8.2991 124.4895 51.0179 19.6900 176.6703 179 P 4.2800 0.0000 0.0000 65.9651 31.2356 178.8975 180 D 4.4248 8.1647 116.6468 56.0511 38.9994 177.9184 181 A 4.1206 7.9212 121.3323 53.8443 18.6313 178.4647 182 I 4.0159 7.5937 110.3071 61.4105 38.1319 177.4514 183 A 3.8887 7.5623 124.1664 55.6370 18.2606 179.4030 184 S 4.0039 8.0066 110.6698 61.7899 62.4307 176.0362 185 D 4.3269 7.9709 120.9662 57.3115 40.6323 178.6924 186 V 3.3595 8.0325 118.8471 65.8440 31.5535 177.9870 187 A 3.9709 8.0180 120.4880 55.1157 18.1969 179.8951 188 R 3.8418 7.8493 116.3320 59.2867 30.1675 179.3390 189 L 3.5569 8.1515 119.1612 57.8766 41.5571 178.9413 190 H 4.5537 8.8511 119.6988 58.7971 29.8954 177.1361 191 A 3.9384 7.9010 122.1071 55.3115 18.1043 179.1251 192 H 4.1526 8.1066 116.7895 59.7015 29.9714 177.1691 193 Y 4.0327 8.1355 118.9019 60.9192 37.5126 178.4914 194 L 4.1689 8.1849 120.1672 57.8413 41.5896 179.4125 195 Q 3.9482 7.9910 119.2148 59.1395 28.9525 178.2148 196 L 3.8310 8.0801 120.1284 57.6861 41.3673 179.3707 197 A 3.4821 7.7176 120.1840 54.9115 18.3593 179.5387 198 S 4.3060 8.0679 111.7695 60.7230 63.4383 175.6907 199 Q 4.4948 7.8853 121.0272 56.4974 29.6319 177.3801 200 F 4.2499 8.5087 115.8768 60.2725 37.6507 176.9819 201 V 3.0736 6.9520 117.3099 64.6765 31.4160 176.2257 202 S 4.4020 7.6444 111.3617 57.9161 63.2387 173.2051 203 Q 3.8581 8.0534 121.1883 56.8973 28.9125 176.2422 204 E 4.1277 8.7630 124.7989 56.5036 29.7116 176.0369 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 R 8.25 4.42 0.00 1.81 1.92 0.00 3.53 0.00 0.00 3.30 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.77 0.00 3 Y 8.55 3.55 0.00 2.67 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 I 7.69 4.54 1.65 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.71 0.90 0.00 0.00 5 V 8.48 4.38 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.06 0.00 0.00 6 A 9.04 4.97 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.92 5.08 0.00 1.62 1.43 0.95 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 8 T 8.59 4.89 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 9 G 8.03 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 G 7.85 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.14 3.81 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.86 0.91 0.00 0.00 12 G 8.95 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 S 7.86 4.22 0.00 4.15 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.05 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.23 3.91 0.00 1.81 1.89 0.00 1.64 0.00 0.00 2.00 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.55 7.81 16 S 8.05 4.15 0.00 3.88 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 7.48 3.91 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 18 V 7.78 3.81 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 1.01 0.00 0.00 19 A 8.38 4.21 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 N 8.89 4.35 0.00 2.80 2.91 0.00 0.00 6.92 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 A 7.70 3.96 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.32 4.15 0.00 3.40 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.26 4.46 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.22 4.43 0.00 2.80 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 7.54 4.46 0.00 1.63 1.41 0.63 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.03 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 I 7.42 3.98 2.06 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.02 0.78 0.00 0.00 28 N 8.86 4.58 0.00 2.61 2.73 0.00 0.00 6.27 8.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 8.42 4.69 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.00 0.00 0.00 30 I 9.00 4.43 2.01 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.70 0.97 0.00 0.00 31 D 8.66 4.96 0.00 2.76 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.90 4.15 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.15 4.28 0.00 2.93 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 7.95 3.70 2.07 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.89 0.94 0.00 0.00 35 I 8.08 3.73 2.09 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.75 0.96 0.00 0.00 36 A 8.00 4.06 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.05 4.02 0.00 2.08 2.00 0.00 3.16 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 38 Q 7.98 4.27 0.00 2.17 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 7.00 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 39 V 7.80 3.80 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.00 0.00 0.00 40 V 7.70 4.41 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.04 0.00 0.00 41 E 7.86 4.42 0.00 2.15 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 42 P 0.00 4.12 0.00 2.04 2.02 0.00 3.79 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 43 G 8.92 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 A 7.70 4.20 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.13 0.00 2.14 2.12 0.00 3.58 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.14 0.00 46 A 7.96 3.99 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 L 7.57 4.10 0.00 1.81 1.77 1.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 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0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 V 7.69 3.60 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.99 0.00 0.00 153 E 8.09 3.99 0.00 2.23 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 154 Q 7.42 3.98 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.96 0.00 0.00 0.00 0.00 0.00 2.72 2.52 0.00 155 I 7.34 3.83 2.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.64 0.89 0.00 0.00 156 L 8.35 4.03 0.00 1.80 1.71 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 157 A 7.85 3.89 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 A 7.71 4.33 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 Q 6.80 4.46 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.86 0.00 0.00 0.00 0.00 0.00 2.30 2.49 0.00 160 A 8.79 4.15 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 T 8.09 4.30 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 162 R 8.40 3.85 0.00 1.89 1.97 0.00 3.18 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.85 0.00 163 E 8.17 4.00 0.00 2.08 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 164 A 7.60 4.02 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 R 7.97 4.00 0.00 2.05 1.96 0.00 3.12 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 166 L 8.06 4.00 0.00 1.82 1.70 0.91 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 167 A 7.92 4.04 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 V 7.12 3.93 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.77 0.00 0.00 169 A 7.15 4.18 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 D 9.04 4.72 0.00 2.70 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 D 8.02 5.11 0.00 2.69 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 V 8.39 4.85 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.94 0.00 0.00 173 I 8.70 4.55 1.96 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.38 1.05 0.00 0.00 174 D 8.88 4.94 0.00 2.74 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 N 8.90 5.10 0.00 2.72 2.84 0.00 0.00 7.29 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 N 9.72 4.54 0.00 2.84 2.87 0.00 0.00 6.72 8.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 G 7.63 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 A 8.30 4.29 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 P 0.00 4.28 0.00 2.16 2.13 0.00 3.61 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 180 D 8.16 4.42 0.00 2.85 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 A 7.92 4.12 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 I 7.59 4.02 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.83 0.97 0.00 0.00 183 A 7.56 3.89 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 S 8.01 4.00 0.00 3.88 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 D 7.97 4.33 0.00 2.86 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 V 8.03 3.36 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.76 0.00 0.00 187 A 8.02 3.97 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 R 7.85 3.84 0.00 2.01 1.93 0.00 3.10 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 189 L 8.15 3.56 0.00 1.86 1.25 1.10 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 190 H 8.85 4.55 0.00 3.33 3.39 0.00 5.83 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 A 7.90 3.94 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 H 8.11 4.15 0.00 3.21 3.20 0.00 5.61 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 Y 8.14 4.03 0.00 2.40 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 L 8.18 4.17 0.00 1.87 1.76 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 195 Q 7.99 3.95 0.00 2.31 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.51 2.40 0.00 196 L 8.08 3.83 0.00 1.29 1.10 0.80 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 197 A 7.72 3.48 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 S 8.07 4.31 0.00 4.08 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 Q 7.89 4.49 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.75 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 200 F 8.51 4.25 0.00 3.31 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 V 6.95 3.07 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.03 0.00 0.00 202 S 7.64 4.40 0.00 3.80 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 Q 8.05 3.86 0.00 2.22 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 204 E 8.76 4.13 0.00 1.95 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 * Residues marked with a * may have inaccurate shift predictions.