NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 R 4.2763 8.2549 117.2771 55.3239 31.4845 175.0500 21 I 3.8515 7.5173 120.7135 60.5348 38.0303 174.3826 22 K 4.2903 9.7407 128.4362 56.2409 33.8892 175.7969 23 K 4.5151 9.2973 124.1002 54.5185 34.9607 175.0393 24 I 5.4957 8.3298 126.5486 58.6133 39.8992 174.9798 25 S 5.3138 8.7819 121.5372 57.2672 65.7486 172.9010 26 I 4.9714 9.0744 123.7102 60.0730 38.8562 174.6030 27 E 5.2085 10.7093 126.9700 53.8545 33.1033 175.7669 28 G 4.4293 8.8538 112.5811 44.5295 0.0000 171.5816 29 N 4.5496 7.8989 118.8599 52.7565 39.6427 174.1145 30 I 3.9751 8.3993 121.7063 62.8092 37.3205 176.0026 31 A 3.7704 9.0057 126.3904 53.0416 16.0056 178.1942 32 A 4.0478 7.9117 124.3833 56.6531 18.6985 178.9140 33 G 4.1749 8.3479 105.3886 46.2716 0.0000 176.6788 34 K 4.0904 8.6994 121.6140 59.1939 32.2504 178.7009 35 S 4.4454 8.0178 114.2261 61.2388 62.4149 175.7602 36 T 3.9432 8.1054 117.9006 66.8780 68.1967 175.9161 37 F 4.4141 8.5573 122.3202 61.5755 39.5261 177.6881 38 V 3.2524 8.0994 118.7302 64.6787 31.0066 178.0280 39 N 4.4141 8.0700 116.3939 56.0511 38.6167 177.1189 40 I 3.7852 7.7426 121.1861 64.4073 37.2759 178.0969 41 L 3.8480 7.7495 121.2142 58.0296 41.4580 178.6092 42 K 4.0709 8.5509 119.8552 60.0988 31.8165 178.2813 43 Q 3.9419 7.9492 116.0367 57.8299 28.7803 177.9122 44 L 3.9597 7.6952 119.9899 56.3976 42.3132 177.2454 45 S 4.3286 6.8451 111.4081 56.2088 65.3940 174.5865 46 E 4.0888 8.5491 125.4054 58.9775 29.6243 177.5882 47 D 4.6585 8.6960 118.1462 54.6478 41.2625 175.2580 48 W 5.5677 7.9858 119.9272 55.0817 31.0097 175.1215 49 E 5.0253 9.2464 123.2854 54.5157 33.5671 174.8100 50 V 5.0442 8.4560 119.8281 61.3071 34.9397 175.0780 51 V 4.3443 8.9488 127.5680 60.6288 32.6929 173.2768 52 P 5.0676 0.0000 0.0000 61.9125 32.3059 176.2798 53 E 3.9612 9.0101 123.9825 55.8147 30.5258 176.1177 54 P 4.2969 0.0000 0.0000 62.1886 31.0594 178.7282 55 V 2.5336 6.9114 119.8680 64.1909 31.0122 177.1245 56 A 3.9597 7.6125 121.3008 55.1710 18.0480 179.6263 57 R 4.0293 7.4258 115.0639 58.9892 30.4838 178.9109 58 W 4.8775 7.8558 118.9524 58.8412 29.0071 177.7388 59 S 5.2435 8.1353 111.3407 57.9834 63.9661 174.2103 60 N 4.7517 7.6868 119.9501 52.1104 39.6517 171.9785 61 V 3.9612 8.8391 123.7346 62.0825 31.9255 175.2927 62 Q 4.4225 8.4724 125.9750 54.1829 31.8103 174.8076 *78 G 4.1978 7.9357 111.1904 45.0082 0.0000 172.0038 79 G 3.5929 8.2034 106.9165 45.7414 0.0000 172.5929 80 N 5.1080 8.1857 120.6249 51.7550 37.9948 175.6553 81 V 3.6077 7.9002 124.7824 63.6741 31.7905 177.9417 82 L 3.5634 8.0046 121.0045 58.1126 41.9213 178.6399 83 Q 4.0117 8.4885 119.3397 59.6259 28.9759 178.1009 84 M 3.9085 8.2954 120.0165 58.7034 31.6689 178.4975 85 M 4.1412 8.0577 118.2691 58.7060 32.1063 177.9655 86 Y 4.3077 7.4660 116.2945 60.9109 38.1149 177.7305 87 E 4.2749 8.4255 118.9142 58.1173 31.3021 177.7737 88 K 4.7028 8.1984 118.3427 53.3148 32.6455 175.0030 89 P 4.5706 0.0000 0.0000 65.2434 31.5229 178.5499 90 E 4.2414 8.1327 118.3760 58.0698 29.4067 178.3445 91 R 3.9147 7.7541 117.4464 57.5222 30.8668 177.1851 92 W 4.9552 7.8905 115.8922 56.6229 30.1004 177.9799 93 S 4.2042 8.1254 116.5196 61.5905 62.2909 176.2899 94 F 4.1486 8.2544 122.8728 61.4942 39.2783 177.2617 95 T 3.8655 8.2023 114.9995 66.4856 68.3678 176.1417 96 F 3.8430 8.5768 122.7137 61.4875 39.4904 176.9898 97 Q 3.8084 8.4251 117.9451 59.3440 28.4500 179.4751 98 T 3.0259 7.3731 116.4373 66.4419 68.2932 176.2981 99 Y 4.1012 7.6174 121.2480 60.4207 38.7437 177.6958 100 A 3.2249 7.4693 122.1608 54.9072 18.1577 179.2621 101 C 4.2406 7.9124 117.1177 62.4125 31.6672 175.1736 102 L 4.0483 8.2322 122.3377 58.5439 41.6666 179.2760 103 S 3.9545 8.0521 114.0386 61.1641 62.7566 176.4324 104 R 3.7367 7.9829 122.2379 59.2683 29.8513 178.2001 105 I 3.4823 7.7830 119.9126 64.4660 37.1145 178.1143 106 R 3.6815 8.0274 119.0002 59.3986 30.0392 178.2403 107 A 3.9005 7.7897 120.3000 55.3321 18.2407 179.6426 108 Q 3.7426 8.1491 116.7704 59.0151 28.7383 178.9782 109 L 3.9531 8.0950 120.0954 57.8226 41.4135 179.5337 110 A 4.0387 7.7252 119.9471 55.0209 18.3549 179.5315 111 S 4.2748 7.8296 111.7552 61.3172 63.4969 176.4365 112 L 4.3022 7.9707 125.3172 58.1628 41.0591 179.7971 113 N 4.7207 7.6104 115.0596 53.6835 37.5097 175.7082 114 G 3.7573 7.1260 109.8969 46.5009 0.0000 174.0872 115 K 4.4208 8.0265 123.9286 56.6245 34.7677 176.0873 116 L 4.5462 7.7174 121.2080 54.2169 42.7704 176.8511 *118 D 4.4672 7.7463 121.4387 51.9278 41.6497 176.1947 119 A 4.6672 7.2692 121.9679 50.9000 22.0390 175.8609 120 E 3.9129 8.5260 123.5153 58.6170 30.1490 178.4375 121 K 4.5446 8.3422 127.5792 51.4609 32.8300 174.8912 122 P 4.8620 0.0000 0.0000 62.1792 33.1071 175.6330 123 V 4.4545 8.7503 123.3147 60.7056 34.5634 173.5904 124 L 4.9952 8.5742 129.9402 53.2844 44.4197 174.7408 125 F 5.0177 9.0790 126.1196 56.3095 40.7671 174.9073 126 F 5.3184 9.1983 123.8085 56.5753 40.8319 175.2343 127 E 4.6258 9.2987 123.6433 56.3377 29.9860 177.9807 128 R 4.4544 9.4274 125.9417 55.1231 30.3044 175.7663 129 S 4.8671 8.4982 111.8611 56.2473 67.2871 175.2584 130 V 4.0590 7.8580 115.5280 63.6447 31.0397 178.4959 131 Y 4.4041 7.2570 116.9775 61.0423 37.9113 177.9986 132 S 4.1890 8.4125 114.9685 61.0831 63.0166 176.0605 133 D 4.5863 8.2318 122.7990 57.2299 40.5598 178.4389 134 R 4.3575 7.6159 118.3400 58.4142 30.3592 177.8278 135 Y 4.2634 8.1711 114.6236 60.0298 38.2771 176.5419 136 I 4.0198 7.5739 119.6882 63.0793 38.2290 177.7805 137 F 3.9752 8.5318 117.6571 60.6003 39.1942 178.0114 138 A 3.8506 8.4291 120.6978 55.1251 18.1386 179.3743 139 S 3.1966 8.1374 111.7443 61.4990 62.3993 175.9730 140 N 4.2449 8.0730 119.4333 56.6138 38.5280 176.8421 141 L 3.9854 7.8324 120.4066 57.7227 41.7364 178.5934 142 Y 4.1456 7.6823 119.4214 60.9864 38.3783 178.0810 143 E 3.6090 7.9489 118.0851 59.1161 29.5951 178.7084 144 S 4.4423 7.6701 112.0710 57.6293 63.1605 174.1479 145 E 3.7324 7.5855 119.9182 57.4850 26.7740 175.7590 146 S 4.3761 8.3149 117.0519 60.0798 63.3434 174.0114 147 M 5.0081 7.7921 119.3439 53.1067 34.7751 175.7775 148 N 4.8777 9.4995 121.3683 51.8990 40.5665 176.0820 149 E 4.2348 8.7562 118.8540 59.9425 29.3279 179.8211 150 T 3.8785 7.9367 115.2470 66.7251 68.7174 176.4121 151 E 3.6821 8.9264 120.9287 59.2695 29.4903 179.3895 152 W 4.5682 8.4734 128.2759 60.6494 30.7070 178.3884 153 T 3.6481 8.1592 115.8940 66.5059 67.8272 176.6702 154 I 3.7491 8.1005 122.1307 64.5774 37.2375 177.8360 155 Y 4.0430 8.3709 120.2015 60.8916 38.6272 178.0720 156 Q 3.8036 7.8909 118.9046 58.8925 28.7544 178.4797 157 D 4.2510 8.1269 119.0109 56.9021 41.2743 178.0966 158 W 4.1251 8.6059 129.2953 60.8490 30.7880 177.3405 159 H 3.9929 8.9244 118.5184 59.3323 29.2308 176.7335 160 D 4.3902 8.7236 121.0499 57.1748 40.6125 178.7854 161 W 3.9396 8.0849 128.4487 60.5870 30.7507 177.4077 162 M 3.6482 8.2183 118.6126 58.9382 31.2301 177.9998 163 N 4.2695 7.6538 114.7740 56.3477 38.8263 176.7880 164 N 4.3671 7.5895 116.7786 56.7519 38.9879 176.3439 165 Q 3.7270 6.8903 119.1874 55.8378 28.7036 175.7869 166 F 4.5156 6.6660 123.4153 55.9909 39.8137 175.7552 *169 S 4.4400 8.5517 120.6872 57.9099 63.7418 174.2479 170 L 4.6177 7.7951 116.4885 54.3268 41.9750 176.4637 171 E 4.1211 8.0926 118.7004 56.9362 29.7948 176.6989 172 L 4.5956 9.1996 123.7785 54.6790 42.5856 176.8212 173 D 4.6180 8.7877 122.4048 55.9507 41.7632 176.5832 174 G 4.1809 7.4221 103.2778 45.7848 0.0000 172.4016 175 I 5.2548 8.4331 120.8914 59.4059 41.3212 174.5552 176 I 4.5396 8.8808 127.9143 59.8458 39.3185 173.9575 177 Y 5.1681 8.8590 129.7590 56.0874 40.1921 174.5107 178 L 4.5089 8.7813 128.7702 53.8133 42.6010 176.1967 179 Q 4.0998 8.4623 126.6451 54.0680 30.6298 174.2103 180 A 5.1209 8.2461 127.3884 49.9441 22.5246 175.7564 181 T 3.8426 8.9393 111.3854 60.7410 69.7756 173.7797 182 P 4.1586 0.0000 0.0000 65.9313 31.2018 178.8621 183 E 3.9347 8.0290 116.8920 59.5331 29.3493 179.2511 184 T 3.8095 7.8304 115.8077 66.9530 68.4523 176.4866 185 C 4.0921 7.9906 118.5752 62.5643 27.9492 175.9890 186 L 3.6285 7.9448 122.0783 58.0508 41.5956 178.3517 187 H 4.0858 7.9716 118.1633 59.5933 29.8576 177.5669 188 R 3.9258 8.1113 119.5976 58.9160 29.7832 179.1305 189 I 3.6806 7.7871 120.2330 64.6239 36.8560 178.0378 190 Y 4.5297 7.0869 116.2881 60.9721 37.7476 177.8642 191 L 4.1253 8.0138 119.3606 58.1975 41.9027 179.4644 192 R 4.0961 8.0040 116.9960 57.3385 30.0342 177.0089 193 G 3.8988 8.1886 105.1547 46.1532 0.0000 173.4075 194 R 4.0197 7.9665 120.3177 55.8918 30.7249 176.8541 195 N 4.3892 9.0683 123.1098 56.5891 38.7781 177.1524 196 E 4.1343 8.2934 115.7801 58.8582 29.8987 177.5643 197 E 4.2206 8.1077 116.9930 56.9049 30.2445 178.2086 198 Q 4.1611 7.8641 117.8199 58.4107 28.7879 177.4929 199 G 3.7849 7.8085 104.3383 45.5895 0.0000 173.8717 200 I 3.4022 7.3457 121.7571 61.1373 37.5440 174.1530 201 P 4.5768 0.0000 0.0000 61.7734 32.6942 176.5765 202 L 3.9135 8.8004 121.9608 58.9584 41.8058 179.3076 203 E 4.3066 8.2643 118.8261 59.0426 29.3340 178.7226 204 Y 4.1384 7.8959 119.6770 60.6636 38.7880 177.9672 205 L 3.8483 7.9315 119.5208 57.5608 41.6608 178.8708 206 E 3.4763 8.2731 118.8745 59.3131 29.5177 179.6025 207 K 3.9582 7.8580 118.0769 59.5794 32.1611 179.4458 208 L 3.7831 7.4928 119.1039 57.6985 41.3349 179.0610 209 H 4.1003 8.2240 118.5354 59.5717 29.7393 176.9655 210 Y 4.3367 7.4759 118.4513 60.9089 37.6003 178.7195 211 K 3.9738 7.9758 118.9604 59.9324 32.2479 178.9192 212 H 4.1632 8.2355 116.2339 59.0128 28.5637 177.7694 213 E 3.9457 8.4570 120.3960 59.4754 29.3444 179.2832 214 S 4.1974 8.4835 113.5337 61.1055 61.8828 176.1407 215 W 4.2826 8.6416 131.3767 60.1692 30.3834 177.4015 216 L 4.0489 8.0510 115.8995 54.2011 42.3773 176.5159 217 L 4.4504 7.5982 118.4589 56.9777 43.5074 177.3932 218 H 4.3472 7.8852 114.2779 56.8957 28.8909 175.8530 219 R 4.1338 8.1453 115.7774 56.9964 27.0471 176.6534 220 T 4.3063 7.9420 106.6885 61.4634 69.6058 174.0220 221 L 4.3070 7.9476 127.6445 54.6110 42.5815 176.0603 222 K 4.4168 8.5674 128.2541 53.3383 32.9444 172.4268 223 T 4.1310 8.0082 113.5727 58.8234 71.1038 172.9909 224 N 4.6989 8.6550 117.4595 53.1796 37.9729 175.5631 225 F 4.7636 7.9800 119.6254 56.4566 39.6040 175.9790 226 D 4.4460 8.6878 127.3537 57.1894 40.7243 178.0521 227 Y 4.2532 8.2566 117.7227 59.7771 38.1274 178.1450 228 L 3.3946 7.2021 120.4797 57.1321 41.3343 178.9870 229 Q 4.1372 7.5887 117.0969 57.9696 28.6722 177.3822 230 E 4.4219 7.7528 118.4701 56.3819 30.0987 176.5106 231 V 3.8679 6.7981 118.9464 61.8935 32.0334 174.3677 232 P 4.5542 0.0000 0.0000 63.2717 32.5710 175.0539 233 I 4.9220 8.2916 121.8697 59.5104 40.1833 174.4440 234 L 4.1372 8.1244 129.6245 53.7982 43.2518 175.0415 235 T 4.8257 8.2617 123.6269 62.1587 69.9468 174.2083 236 L 4.5372 8.5369 126.7601 52.6809 44.9190 175.1193 237 D 4.6816 8.5327 123.7172 53.3935 41.6815 175.9110 238 V 4.3271 8.2432 119.4970 61.3313 32.0522 177.1240 239 N 4.3546 8.5161 121.3989 56.2064 38.5333 175.9406 240 E 4.1936 7.8399 116.0004 55.3477 30.4353 175.9184 241 D 4.1985 8.4687 120.1899 54.2743 41.4349 177.4380 242 F 3.6484 8.2122 122.7687 59.9614 37.7868 176.2855 243 K 4.1155 7.5155 123.5295 54.8775 31.4061 183.0514 *245 K 4.4455 7.9820 118.3893 56.6244 34.2891 177.9294 246 Y 4.2272 8.2693 120.8172 61.3416 37.4391 178.6715 247 E 4.0584 8.3868 119.6315 61.1212 29.9447 183.4784 248 S 4.3751 8.1629 114.7168 61.5125 62.8430 176.6008 249 L 3.9248 7.7108 122.4547 57.2417 41.3900 179.4209 250 V 3.6501 7.7081 117.7176 66.2876 31.4782 177.8702 251 E 4.0723 7.9980 118.2161 59.5063 29.3105 179.5660 252 K 4.0694 8.2479 118.4824 59.2904 31.9480 179.6418 253 V 3.6755 8.1897 118.5906 66.0139 31.3845 177.7911 254 K 4.2587 8.3821 118.7865 59.5536 31.8546 177.3171 255 E 4.4915 8.2192 115.6852 57.3497 30.4164 177.9149 256 F 4.3075 8.2394 122.4600 61.4732 39.5597 176.9180 257 L 3.8268 8.4611 119.0883 57.5675 41.1628 179.3227 258 S 4.3469 7.5698 112.2960 60.4636 63.2535 175.6892 259 T 4.1448 7.5211 111.8825 62.7736 69.0283 174.5862 260 L 4.0746 7.2805 126.4687 54.9261 41.7700 176.2301 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 20 R 8.25 4.28 0.00 1.92 2.10 0.00 2.99 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.65 0.00 21 I 7.52 3.85 1.84 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 1.33 0.64 0.83 0.00 0.00 22 K 9.74 4.29 0.00 1.41 1.50 0.00 1.50 0.00 0.00 1.55 0.00 0.00 2.75 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.43 7.81 23 K 9.30 4.52 0.00 1.48 1.04 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.17 1.40 7.81 24 I 8.33 5.50 1.76 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.27 1.17 0.00 0.00 25 S 8.78 5.31 0.00 4.21 4.32 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 26 I 9.07 4.97 2.03 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.05 1.04 0.00 0.00 27 E 10.71 5.21 0.00 1.86 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 28 G 8.85 4.43 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 0.00 29 N 7.90 4.55 0.00 2.72 2.73 0.00 0.00 6.88 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 I 8.40 3.98 2.01 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.97 1.05 0.00 0.00 31 A 9.01 3.77 1.41 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 0.00 0.00 0.00 32 A 7.91 4.05 1.37 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 0.00 0.00 0.00 33 G 8.35 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.70 4.09 0.00 1.93 2.00 0.00 2.03 0.00 0.00 2.02 0.00 0.00 3.20 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.62 1.59 7.81 35 S 8.02 4.45 0.00 3.95 3.92 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 36 T 8.11 3.94 4.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 37 F 8.56 4.41 0.00 3.29 3.12 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 38 V 8.10 3.25 2.16 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 0.89 0.00 0.00 0.63 0.00 0.00 39 N 8.07 4.41 0.00 2.94 2.94 0.00 0.00 7.06 6.86 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 40 I 7.74 3.79 1.97 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.78 0.88 0.00 0.00 41 L 7.75 3.85 0.00 1.38 1.37 0.62 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 42 K 8.55 4.07 0.00 2.08 2.00 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.57 1.66 7.81 43 Q 7.95 3.94 0.00 2.07 2.12 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 2.66 2.52 0.00 44 L 7.70 3.96 0.00 1.26 1.26 0.93 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 45 S 6.85 4.33 0.00 3.00 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.55 4.09 0.00 1.95 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 2.29 2.28 0.00 47 D 8.70 4.66 0.00 2.67 3.02 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 48 W 7.99 5.57 0.00 3.44 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 49 E 9.25 5.03 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 50 V 8.46 5.04 2.18 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 0.89 0.00 0.00 1.07 0.00 0.00 51 V 8.95 4.34 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.18 0.00 0.00 52 P 0.00 5.07 0.00 1.93 1.96 0.00 3.73 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 53 E 9.01 3.96 0.00 1.93 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 0.00 1.86 2.32 0.00 54 P 0.00 4.30 0.00 1.70 1.75 0.00 3.30 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 2.00 1.90 0.00 55 V 6.91 2.53 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 1.06 0.00 0.00 56 A 7.61 3.96 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 R 7.43 4.03 0.00 1.82 2.12 0.00 3.32 0.00 0.00 3.20 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.70 0.00 58 W 7.86 4.88 0.00 3.64 3.35 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 59 S 8.14 5.24 0.00 4.14 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 N 7.69 4.75 0.00 2.69 2.74 0.00 0.00 7.08 7.59 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 S 8.13 4.20 0.00 4.16 3.97 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 0.00 0.00 0.00 94 F 8.25 4.15 0.00 3.21 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 8.20 3.87 4.77 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 1.36 0.00 0.00 96 F 8.58 3.84 0.00 3.14 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Q 8.43 3.81 0.00 1.83 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.59 0.00 0.00 0.00 0.00 0.00 2.62 2.39 0.00 98 T 7.37 3.03 3.68 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 -0.05 0.00 0.00 99 Y 7.62 4.10 0.00 2.84 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.47 3.22 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 C 7.91 4.24 0.00 3.30 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 L 8.23 4.05 0.00 2.19 2.01 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 103 S 8.05 3.95 0.00 3.87 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.98 3.74 0.00 2.08 2.10 0.00 3.09 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.60 0.00 105 I 7.78 3.48 1.84 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.55 0.61 0.00 0.00 106 R 8.03 3.68 0.00 1.80 2.07 0.00 3.07 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 107 A 7.79 3.90 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 0.00 108 Q 8.15 3.74 0.00 1.69 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.74 0.00 0.00 0.00 0.00 0.00 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0.00 2.72 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 A 7.27 4.67 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 E 8.53 3.91 0.00 1.92 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 0.00 2.29 2.38 0.00 121 K 8.34 4.54 0.00 1.79 1.56 0.00 1.86 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.27 1.20 7.81 122 P 0.00 4.86 0.00 2.10 2.23 0.00 3.60 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.96 0.00 123 V 8.75 4.45 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.34 0.00 0.00 0.69 0.00 0.00 124 L 8.57 5.00 0.00 1.58 1.15 1.05 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 125 F 9.08 5.02 0.00 3.07 2.93 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 0.00 126 F 9.20 5.32 0.00 3.05 3.11 0.00 0.00 0.00 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0.00 0.00 0.00 143 E 7.95 3.61 0.00 1.94 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 2.20 2.29 0.00 144 S 7.67 4.44 0.00 3.84 3.88 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 0.00 0.00 0.00 145 E 7.59 3.73 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 146 S 8.31 4.38 0.00 3.99 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 M 7.79 5.01 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.63 0.00 148 N 9.50 4.88 0.00 2.99 3.00 0.00 0.00 6.87 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 E 8.76 4.23 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.46 0.00 150 T 7.94 3.88 4.33 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 1.15 0.00 0.00 151 E 8.93 3.68 0.00 2.34 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.22 0.00 152 W 8.47 4.57 0.00 3.16 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 T 8.16 3.65 4.33 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 1.16 0.00 0.00 154 I 8.10 3.75 2.01 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.80 1.11 0.00 0.00 155 Y 8.37 4.04 0.00 3.38 3.28 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 0.00 156 Q 7.89 3.80 0.00 1.88 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.59 0.00 0.00 0.00 0.00 0.00 1.37 1.16 0.00 157 D 8.13 4.25 0.00 2.86 2.81 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 0.00 158 W 8.61 4.13 0.00 3.46 3.23 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 0.00 159 H 8.92 3.99 0.00 2.90 3.28 0.00 5.65 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 0.00 160 D 8.72 4.39 0.00 2.93 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.08 3.94 0.00 3.36 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 M 8.22 3.65 0.00 1.45 1.25 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.54 0.00 163 N 7.65 4.27 0.00 3.05 3.10 0.00 0.00 7.06 8.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 N 7.59 4.37 0.00 2.68 2.86 0.00 0.00 7.31 7.75 0.00 0.00 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 Q 6.89 3.73 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.50 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 166 F 6.67 4.52 0.00 2.76 2.87 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 *169 S 8.55 4.44 0.00 3.85 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 0.00 170 L 7.80 4.62 0.00 1.71 1.78 0.82 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 171 E 8.09 4.12 0.00 1.76 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 1.80 2.18 0.00 172 L 9.20 4.60 0.00 1.84 1.73 1.26 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 173 D 8.79 4.62 0.00 2.42 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 G 7.42 4.18 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 0.00 175 I 8.43 5.25 1.77 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.72 0.71 0.00 0.00 176 I 8.88 4.54 1.95 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.80 0.89 0.00 0.00 177 Y 8.86 5.17 0.00 2.76 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.78 4.51 0.00 1.48 1.42 0.79 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 179 Q 8.46 4.10 0.00 1.11 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.76 0.00 0.00 0.00 0.00 0.00 2.10 2.15 0.00 180 A 8.25 5.12 1.10 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 0.00 0.00 0.00 0.00 0.00 0.00 181 T 8.94 3.84 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 182 P 0.00 4.16 0.00 2.07 2.02 0.00 3.41 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.92 0.00 183 E 8.03 3.93 0.00 1.96 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 184 T 7.83 3.81 4.32 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 1.16 0.00 0.00 185 C 7.99 4.09 0.00 3.07 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.94 3.63 0.00 1.69 1.65 0.66 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 187 H 7.97 4.09 0.00 3.33 3.46 0.00 5.84 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 0.00 188 R 8.11 3.93 0.00 1.92 1.93 0.00 3.25 0.00 0.00 3.09 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.87 0.00 189 I 7.79 3.68 1.73 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 1.52 0.99 0.94 0.00 0.00 190 Y 7.09 4.53 0.00 3.00 2.86 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 0.00 0.00 0.00 0.00 191 L 8.01 4.13 0.00 1.68 1.73 0.81 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 192 R 8.00 4.10 0.00 1.84 2.07 0.00 3.41 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 193 G 8.19 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.97 4.02 0.00 1.92 2.01 0.00 3.51 0.00 0.00 3.44 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.71 0.00 195 N 9.07 4.39 0.00 2.83 2.88 0.00 0.00 7.14 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 E 8.29 4.13 0.00 2.12 2.31 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 2.42 2.49 0.00 197 E 8.11 4.22 0.00 2.26 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 2.41 2.43 0.00 198 Q 7.86 4.16 0.00 2.01 2.20 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 2.59 2.49 0.00 199 G 7.81 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 I 7.35 3.40 1.86 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.14 1.00 0.00 0.00 201 P 0.00 4.58 0.00 2.41 2.17 0.00 3.61 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.92 0.00 202 L 8.80 3.91 0.00 1.78 1.75 0.88 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 203 E 8.26 4.31 0.00 2.15 2.05 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 2.44 2.34 0.00 204 Y 7.90 4.14 0.00 2.98 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 L 7.93 3.85 0.00 1.85 1.63 0.88 1.07 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 0.00 206 E 8.27 3.48 0.00 2.05 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 207 K 7.86 3.96 0.00 1.84 1.77 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.65 7.81 208 L 7.49 3.78 0.00 1.57 1.52 0.74 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 209 H 8.22 4.10 0.00 3.17 3.15 0.00 5.79 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 0.00 210 Y 7.48 4.34 0.00 3.10 2.93 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 0.00 211 K 7.98 3.97 0.00 1.90 1.76 0.00 1.78 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.53 7.81 212 H 8.24 4.16 0.00 3.43 3.21 0.00 5.82 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 0.00 213 E 8.46 3.95 0.00 2.21 2.03 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 2.38 2.35 0.00 214 S 8.48 4.20 0.00 3.96 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 0.00 215 W 8.64 4.28 0.00 3.26 3.18 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 0.00 216 L 8.05 4.05 0.00 0.63 1.05 0.04 -0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 217 L 7.60 4.45 0.00 1.63 1.68 0.92 1.04 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 0.00 218 H 7.89 4.35 0.00 3.23 3.34 0.00 5.89 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 R 8.15 4.13 0.00 1.97 2.03 0.00 3.18 0.00 0.00 3.15 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 220 T 7.94 4.31 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 221 L 7.95 4.31 0.00 1.63 1.73 1.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 222 K 8.57 4.42 0.00 1.81 1.58 0.00 1.82 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.30 0.98 7.81 223 T 8.01 4.13 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 224 N 8.65 4.70 0.00 2.74 2.93 0.00 0.00 6.76 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 F 7.98 4.76 0.00 3.03 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 D 8.69 4.45 0.00 2.79 2.76 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 0.00 0.00 0.00 0.00 227 Y 8.26 4.25 0.00 3.28 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 L 7.20 3.39 0.00 1.61 1.51 0.36 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 229 Q 7.59 4.14 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.88 0.00 0.00 0.00 0.00 0.00 2.36 2.53 0.00 230 E 7.75 4.42 0.00 2.07 2.03 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 2.41 2.50 0.00 231 V 6.80 3.87 1.99 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 0.77 0.00 0.00 1.00 0.00 0.00 232 P 0.00 4.55 0.00 2.53 2.28 0.00 3.84 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 233 I 8.29 4.92 1.78 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.74 0.77 0.00 0.00 234 L 8.12 4.14 0.00 0.27 0.63 0.72 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 235 T 8.26 4.83 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 1.00 0.00 0.00 236 L 8.54 4.54 0.00 1.15 1.19 0.60 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 237 D 8.53 4.68 0.00 2.55 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 V 8.24 4.33 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.91 0.00 0.00 239 N 8.52 4.35 0.00 2.84 2.83 0.00 0.00 6.90 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 0.00 240 E 7.84 4.19 0.00 1.99 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 241 D 8.47 4.20 0.00 2.62 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 242 F 8.21 3.65 0.00 2.42 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 K 7.52 4.12 0.00 1.76 1.71 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.28 7.81 *245 K 7.98 4.45 0.00 1.95 1.95 0.00 1.63 0.00 0.00 1.81 0.00 0.00 2.85 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.46 1.50 7.81 246 Y 8.27 4.23 0.00 3.25 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 247 E 8.39 4.06 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 1.94 0.00 248 S 8.16 4.38 0.00 4.04 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 249 L 7.71 3.92 0.00 1.63 1.61 0.16 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 250 V 7.71 3.65 2.28 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 0.90 0.00 0.00 0.87 0.00 0.00 251 E 8.00 4.07 0.00 2.24 2.03 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 2.37 2.40 0.00 252 K 8.25 4.07 0.00 2.00 1.86 0.00 1.61 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.61 7.81 253 V 8.19 3.68 2.35 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 1.14 0.00 0.00 1.18 0.00 0.00 254 K 8.38 4.26 0.00 2.17 2.12 0.00 1.92 0.00 0.00 1.83 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.66 1.74 7.81 255 E 8.22 4.49 0.00 2.31 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.38 0.00 256 F 8.24 4.31 0.00 3.07 3.31 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 0.00 257 L 8.46 3.83 0.00 1.99 1.67 0.43 0.83 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 0.00 258 S 7.57 4.35 0.00 4.07 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 0.00 259 T 7.52 4.14 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 260 L 7.28 4.07 0.00 1.50 1.43 0.50 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.