NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2855 8.2649 123.5825 52.2518 20.1219 176.7845 2 T 3.8954 8.0590 114.1283 61.2572 72.6648 172.4467 3 L 4.2295 9.1694 127.9698 58.1733 41.8847 179.5103 4 K 4.0645 7.9999 117.0203 59.2496 32.3396 178.8391 5 D 4.5056 7.9027 118.8084 57.6014 40.9801 178.6758 6 I 3.8173 8.3624 120.6118 64.7158 37.1079 178.5413 7 T 3.9644 8.3268 116.3425 65.6164 68.1685 176.8621 8 R 3.8460 7.8890 121.4510 59.8523 30.2208 177.8485 9 R 3.8755 8.1206 117.0998 59.2649 30.0022 178.4091 10 L 3.9074 8.2436 117.9818 58.1933 41.3991 179.7678 11 K 3.7977 7.8080 118.2100 59.8540 32.0830 179.4666 12 S 3.9661 8.6814 114.3755 61.5887 63.1343 176.4543 13 I 3.8344 8.2378 123.5218 63.5216 36.5664 178.5397 14 K 4.0196 8.0170 120.0141 59.3236 31.8070 179.0035 15 N 4.3780 7.7155 116.4791 56.5017 38.6213 177.4233 16 I 3.8505 7.7311 121.0851 64.5188 37.0750 178.3948 17 Q 3.9132 7.9307 119.8291 59.2548 28.9437 178.4529 18 K 3.9985 7.7100 119.4490 59.3628 31.9216 179.3072 19 I 3.6839 8.2694 120.7241 64.5263 36.7230 178.1440 20 T 3.8508 8.3626 116.7470 66.9212 68.0287 176.3708 21 K 3.9099 8.1019 121.1954 59.6521 32.0477 178.7484 22 S 4.1748 8.2099 113.4534 61.6057 62.3203 176.0476 23 M 4.1142 8.3557 121.5768 57.7876 31.4935 178.7671 24 K 3.9252 7.7661 119.8119 59.8227 32.6082 178.6738 25 M 3.8374 7.6569 117.7157 58.4020 31.7663 179.1271 26 V 3.5305 7.6637 118.0116 66.0841 31.7472 177.8168 27 A 4.0244 8.1067 120.2594 55.2478 17.8271 179.5954 28 A 4.0370 8.6041 118.8964 55.6466 18.7388 178.9372 29 A 3.9392 7.9151 118.4630 55.9152 18.2340 179.6800 30 K 3.8026 8.3802 115.1584 59.8751 32.1618 179.0551 31 Y 4.1371 7.7901 117.8069 60.2412 38.8874 177.5206 32 A 3.7127 8.2127 122.6123 54.7486 18.5544 179.3722 33 R 3.7464 7.9182 115.2628 59.5172 30.1750 178.7248 34 A 3.9202 8.1128 120.2816 55.3063 18.1757 179.3523 35 E 3.7939 7.5914 116.2869 59.0717 29.8825 179.1025 36 R 4.0206 7.6798 117.9231 59.2365 30.6258 178.4021 37 E 3.9802 8.1991 118.1915 59.2006 29.2504 179.4898 38 L 3.9001 8.4114 120.8615 58.9496 41.9754 178.9877 39 K 4.0543 7.5686 115.1501 59.4865 32.2724 176.5534 40 P 4.4485 0.0000 0.0000 65.6077 31.3645 178.6795 41 A 3.8764 7.3988 117.5778 55.0631 18.2153 179.5135 42 R 4.3785 7.7099 115.8800 58.6069 30.9527 177.5405 43 V 4.1249 7.7854 119.2559 62.0842 30.3798 174.7208 44 Y 4.7692 7.1085 118.1085 58.9450 47.4187 175.7124 *77 L 4.1514 7.5354 124.7934 56.1576 40.2580 176.8682 78 C 4.7077 7.8781 126.3717 60.0916 30.0432 174.8031 79 G 3.9841 8.2859 106.6928 45.9440 0.0000 174.9874 80 A 4.6596 8.1280 120.2371 52.0734 19.6501 179.1767 81 I 3.8668 6.6382 122.4419 64.7579 36.9323 176.9411 82 H 4.1995 8.4353 120.8762 59.4351 29.1670 177.5712 83 S 4.1253 7.9347 115.3854 61.5005 62.8992 176.2009 84 S 4.1061 7.9083 119.3690 61.4288 62.7047 177.4396 85 V 3.6111 7.6903 114.0555 64.2119 31.0931 178.1162 86 A 4.0045 7.5269 119.0804 55.4701 18.4413 179.5341 87 K 4.0398 8.5376 116.7288 59.7235 32.0726 179.0538 88 Q 4.1955 7.5510 116.3566 57.7542 29.0184 176.8237 89 M 4.2631 7.6509 117.2186 57.0059 33.5843 175.3383 90 K 4.3646 7.8211 118.6227 55.2182 32.2989 177.3506 *209 L 3.9796 7.4727 120.8415 54.5547 42.3882 176.1739 210 A 4.0782 8.4947 128.9192 55.0017 16.6072 178.0635 211 N 4.2353 8.3615 115.0329 56.7799 38.9095 176.3532 212 I 4.3879 7.6572 120.6371 63.2528 37.5894 178.0200 213 I 3.7649 7.9374 121.2348 64.7724 37.0478 177.7244 214 Y 4.2108 8.2192 119.6426 61.5149 38.5382 176.3574 215 Y 4.1434 7.8868 119.4680 59.8045 38.7064 177.3753 216 S 3.9788 8.7008 114.3183 61.7202 62.5156 176.9130 217 L 3.9374 7.8534 121.5906 57.4714 41.3447 179.2384 218 K 3.5937 7.8952 118.3624 58.7256 32.2089 178.5217 219 E 4.1344 7.6727 118.6529 58.4596 29.7243 178.0497 220 S 4.1920 7.9963 112.2594 60.3385 62.3335 175.2323 221 T 4.0279 7.4648 111.4036 64.0976 69.5774 177.0348 222 T 3.9366 7.8016 118.6549 66.7546 68.5563 176.8125 223 S 4.1123 8.0127 116.5693 61.8044 62.7318 175.9303 224 E 3.9463 7.7794 121.9090 59.0701 29.6158 178.6058 225 Q 4.0375 8.4782 118.2484 58.4476 28.8632 179.5925 226 S 3.6402 7.8725 116.5267 61.1574 63.0077 176.0710 227 A 3.8676 7.8258 123.3177 55.2454 18.1405 179.5377 228 R 3.7601 8.1919 117.4171 60.3591 29.9044 177.4640 229 M 3.8022 7.3325 114.8816 59.6256 32.1919 177.6945 230 T 3.9417 8.1937 114.4792 66.7105 68.9331 176.1229 231 A 3.9572 7.9928 122.3519 55.8585 18.1753 179.7286 232 M 4.0600 8.6255 116.4774 57.8323 31.5221 178.5934 233 D 4.3033 8.1441 119.1941 57.3635 41.4160 177.8000 234 N 4.4208 8.1006 116.0066 55.5374 38.5847 177.2301 235 A 3.9865 8.0464 123.0746 55.1854 18.4531 179.7670 236 S 4.1072 7.8429 112.1023 61.0175 63.2936 176.7630 237 K 3.9735 7.6505 122.2163 59.2956 31.6746 178.9908 238 N 4.3705 8.5655 117.2536 56.1120 38.5326 177.3580 239 A 4.0201 8.2245 122.5249 55.1597 18.4170 179.9300 240 S 4.0537 8.3487 113.9219 61.8936 63.0074 176.7740 241 E 3.9797 8.0691 120.6117 59.3097 29.0905 179.1545 242 M 4.0579 7.7731 118.0454 58.4988 32.3086 178.3037 243 I 3.9067 8.2515 120.3008 64.3623 36.7063 178.1669 244 D 4.3845 8.3127 120.0270 56.8677 40.5490 178.7300 245 K 3.8254 7.8357 119.8327 59.5671 32.1958 179.0313 246 L 4.0570 8.5390 119.6440 57.9916 41.4132 179.4599 247 T 3.9451 7.7726 115.9261 66.6929 68.2486 176.5557 248 L 3.9521 7.5769 120.5555 58.1643 41.6351 179.7127 249 T 3.9013 7.7217 115.8913 66.7536 68.3087 175.9903 250 F 4.0655 8.6622 123.1110 61.4732 39.5056 176.6905 251 N 4.3763 9.5286 116.7794 56.5495 38.4193 177.8272 252 R 3.9212 8.3313 119.7625 59.5030 30.1406 179.2208 253 T 3.7550 7.8526 115.6317 66.2822 68.5149 176.5303 254 R 3.5532 8.0610 121.0147 59.5667 29.9576 178.5103 255 Q 3.8892 7.8018 116.7208 58.9477 28.6988 178.4134 256 A 3.9361 8.0435 121.8838 55.2478 18.3548 179.6622 257 V 3.4729 8.2661 116.7861 66.3857 31.5302 178.1950 258 I 3.6906 7.5282 118.8495 64.6863 36.8120 178.6443 259 T 3.7992 7.8975 116.3978 66.4699 68.1299 176.3409 260 K 3.7698 7.9119 120.4224 59.8154 32.3839 177.7726 261 E 4.0000 8.1506 119.0393 59.2372 29.5387 178.1201 262 L 3.9273 7.7148 119.8392 58.7060 41.9796 179.2867 263 I 3.7059 8.0867 119.5374 64.2858 36.9721 178.3563 264 E 3.9602 8.5971 120.0459 59.3153 29.2718 179.2400 265 I 3.6717 7.6740 119.3026 64.4977 37.2876 178.0433 266 I 3.6889 7.9976 120.6897 64.7342 36.7748 178.5087 267 S 4.2164 8.1519 114.8014 61.8005 62.5776 176.9225 268 G 3.7014 8.2346 107.9336 47.5230 0.0000 175.6673 269 A 4.0088 8.2317 122.9402 55.0165 18.2443 179.4917 270 A 4.0531 8.0619 117.4269 54.1991 18.5376 178.6074 271 A 4.3342 7.2458 116.9063 52.3873 19.1098 177.3055 272 L 4.1289 7.5450 123.0653 54.9321 41.7449 176.8459 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 1 A 8.26 4.29 1.25 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 0.00 0.00 0.00 0.00 0.00 0.00 2 T 8.06 3.90 4.51 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 3 L 9.17 4.23 0.00 1.74 1.92 0.83 0.62 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 4 K 8.00 4.06 0.00 1.75 1.90 0.00 1.79 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.49 7.81 5 D 7.90 4.51 0.00 2.97 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 6 I 8.36 3.82 2.15 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.22 1.07 0.00 0.00 7 T 8.33 3.96 4.25 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 0.00 0.00 0.00 1.09 0.00 0.00 8 R 7.89 3.85 0.00 2.02 2.03 0.00 3.12 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 9 R 8.12 3.88 0.00 1.90 1.92 0.00 3.23 0.00 0.00 3.35 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.93 0.00 10 L 8.24 3.91 0.00 1.82 1.68 0.87 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 11 K 7.81 3.80 0.00 1.95 1.82 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.40 7.81 12 S 8.68 3.97 0.00 3.99 4.20 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.24 3.83 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 1.51 0.88 0.90 0.00 0.00 14 K 8.02 4.02 0.00 1.97 1.83 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.64 7.81 15 N 7.72 4.38 0.00 2.74 2.84 0.00 0.00 6.99 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 I 7.73 3.85 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.71 0.90 0.00 0.00 17 Q 7.93 3.91 0.00 2.15 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 18 K 7.71 4.00 0.00 1.93 1.83 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.64 7.81 19 I 8.27 3.68 2.03 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.79 0.90 0.00 0.00 20 T 8.36 3.85 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 21 K 8.10 3.91 0.00 1.84 1.99 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.45 7.81 22 S 8.21 4.17 0.00 3.93 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 23 M 8.36 4.11 0.00 2.09 2.23 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.54 0.00 24 K 7.77 3.93 0.00 1.81 1.94 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.46 7.81 25 M 7.66 3.84 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.57 0.00 26 V 7.66 3.53 2.23 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 1.01 0.00 0.00 0.97 0.00 0.00 27 A 8.11 4.02 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 28 A 8.60 4.04 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 29 A 7.92 3.94 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 30 K 8.38 3.80 0.00 1.87 1.91 0.00 1.84 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.63 7.81 31 Y 7.79 4.14 0.00 2.97 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 32 A 8.21 3.71 1.25 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 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.92 3.75 0.00 1.94 2.00 0.00 3.12 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 1.70 1.95 0.00 34 A 8.11 3.92 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 35 E 7.59 3.79 0.00 1.48 1.70 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 0.00 2.22 2.27 0.00 36 R 7.68 4.02 0.00 2.02 1.90 0.00 3.13 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 37 E 8.20 3.98 0.00 1.96 1.95 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 2.32 2.30 0.00 38 L 8.41 3.90 0.00 1.75 1.71 0.86 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 39 K 7.57 4.05 0.00 1.82 1.81 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.81 1.66 7.81 40 P 0.00 4.45 0.00 2.18 2.16 0.00 3.77 0.00 0.00 3.99 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 41 A 7.40 3.88 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 42 R 7.71 4.38 0.00 1.85 2.16 0.00 3.18 0.00 0.00 3.20 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.88 0.00 43 V 7.79 4.12 2.34 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 0.82 0.00 0.00 1.01 0.00 0.00 44 Y 7.11 4.77 0.00 3.16 2.85 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 *77 L 7.54 4.15 0.00 1.73 1.73 0.91 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 78 C 7.88 4.71 0.00 2.84 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 79 G 8.29 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 80 A 8.13 4.66 1.26 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 0.00 0.00 0.00 0.00 0.00 81 I 6.64 3.87 1.78 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.96 0.00 0.00 82 H 8.44 4.20 0.00 3.17 3.35 0.00 5.63 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 S 7.93 4.13 0.00 4.04 4.10 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 84 S 7.91 4.11 0.00 4.11 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 85 V 7.69 3.61 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 0.91 0.00 0.00 1.00 0.00 0.00 86 A 7.53 4.00 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 87 K 8.54 4.04 0.00 1.76 1.87 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.45 7.81 88 Q 7.55 4.20 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.95 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 89 M 7.65 4.26 0.00 2.21 2.21 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.54 0.00 90 K 7.82 4.36 0.00 1.71 1.67 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.33 7.81 *209 L 7.47 3.98 0.00 1.79 1.62 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 210 A 8.49 4.08 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 0.00 211 N 8.36 4.24 0.00 2.80 2.88 0.00 0.00 7.21 7.82 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 0.00 212 I 7.66 4.39 2.11 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.25 1.00 0.00 0.00 213 I 7.94 3.76 2.09 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.23 0.98 0.00 0.00 214 Y 8.22 4.21 0.00 2.99 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 0.00 215 Y 7.89 4.14 0.00 3.30 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 S 8.70 3.98 0.00 4.07 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 L 7.85 3.94 0.00 1.96 1.56 0.97 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 218 K 7.90 3.59 0.00 1.18 1.45 0.00 1.29 0.00 0.00 1.38 0.00 0.00 2.85 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.69 0.21 7.81 219 E 7.67 4.13 0.00 1.68 1.75 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 0.00 1.72 1.51 0.00 220 S 8.00 4.19 0.00 3.94 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 0.00 221 T 7.46 4.03 4.21 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 1.22 0.00 0.00 222 T 7.80 3.94 4.25 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 0.00 0.00 0.00 1.37 0.00 0.00 223 S 8.01 4.11 0.00 3.82 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 0.00 224 E 7.78 3.95 0.00 2.11 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 2.30 2.36 0.00 225 Q 8.48 4.04 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.61 0.00 0.00 0.00 0.00 0.00 2.60 2.60 0.00 226 S 7.87 3.64 0.00 3.86 3.62 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 0.00 227 A 7.83 3.87 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 0.00 228 R 8.19 3.76 0.00 1.84 1.91 0.00 3.12 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 229 M 7.33 3.80 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.56 0.00 230 T 8.19 3.94 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 1.16 0.00 0.00 231 A 7.99 3.96 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 0.00 232 M 8.63 4.06 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.88 0.00 233 D 8.14 4.30 0.00 2.75 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 0.00 234 N 8.10 4.42 0.00 2.75 2.83 0.00 0.00 7.00 7.87 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 0.00 235 A 8.05 3.99 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 0.00 236 S 7.84 4.11 0.00 4.04 4.29 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 0.00 237 K 7.65 3.97 0.00 1.98 1.89 0.00 1.87 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.54 7.81 238 N 8.57 4.37 0.00 2.89 2.85 0.00 0.00 6.82 7.35 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 0.00 239 A 8.22 4.02 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 0.00 240 S 8.35 4.05 0.00 4.08 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 0.00 241 E 8.07 3.98 0.00 2.17 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 0.00 2.33 2.53 0.00 242 M 7.77 4.06 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.57 0.00 243 I 8.25 3.91 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.18 0.89 0.00 0.00 244 D 8.31 4.38 0.00 2.69 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 0.00 245 K 7.84 3.83 0.00 2.10 1.93 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.49 7.81 246 L 8.54 4.06 0.00 1.81 1.73 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 247 T 7.77 3.95 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 1.25 0.00 0.00 248 L 7.58 3.95 0.00 1.77 1.74 0.93 0.71 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 0.00 249 T 7.72 3.90 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 1.23 0.00 0.00 250 F 8.66 4.07 0.00 3.16 3.24 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 0.00 251 N 9.53 4.38 0.00 2.81 2.92 0.00 0.00 7.19 5.65 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 0.00 252 R 8.33 3.92 0.00 1.81 1.95 0.00 3.13 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.87 0.00 253 T 7.85 3.75 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 1.09 0.00 0.00 254 R 8.06 3.55 0.00 1.14 1.89 0.00 3.24 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 255 Q 7.80 3.89 0.00 2.27 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 256 A 8.04 3.94 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 0.00 257 V 8.27 3.47 2.14 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 0.99 0.00 0.00 0.93 0.00 0.00 258 I 7.53 3.69 1.95 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.30 0.90 0.00 0.00 259 T 7.90 3.80 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 260 K 7.91 3.77 0.00 1.85 2.06 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.47 7.81 261 E 8.15 4.00 0.00 2.08 1.91 0.00 0.00 0.00 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 2.31 0.00 262 L 7.71 3.93 0.00 1.96 1.78 0.92 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 263 I 8.09 3.71 1.98 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.79 0.90 0.00 0.00 264 E 8.60 3.96 0.00 2.16 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 0.00 2.32 2.54 0.00 265 I 7.67 3.67 1.97 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 1.63 0.87 0.91 0.00 0.00 266 I 8.00 3.69 1.99 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 1.52 0.61 0.91 0.00 0.00 267 S 8.15 4.22 0.00 3.99 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 0.00 268 G 8.23 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 269 A 8.23 4.01 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 0.00 270 A 8.06 4.05 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 0.00 271 A 7.25 4.33 1.30 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 0.00 0.00 272 L 7.54 4.13 0.00 1.60 1.59 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.