NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3226 8.2649 123.5815 52.6003 20.1149 176.7746 2 T 4.0133 7.9234 112.1408 61.0023 72.9854 172.7258 3 L 3.9387 9.2482 127.6704 57.9844 42.1745 179.2622 4 K 3.9318 8.1441 117.5676 60.1125 31.9613 178.3855 5 D 4.3643 8.1785 118.2520 57.3286 40.7697 178.4257 6 I 3.7486 8.1768 119.8391 65.1210 37.3802 178.4086 7 T 3.7910 8.2646 116.2442 66.7030 68.3173 176.3341 8 R 3.8667 8.0171 120.1956 59.7005 30.1180 178.5619 9 R 3.9368 8.3271 118.0374 59.4596 30.0087 179.0802 10 L 4.0279 8.4252 118.9849 57.6622 41.6757 179.7812 11 K 3.9731 8.1033 118.7647 59.3515 31.9067 179.3459 12 S 4.0904 8.1959 114.5668 61.7849 63.0509 176.7165 13 I 3.6857 8.2761 124.8181 63.2858 36.6309 178.7401 14 K 4.0133 8.3360 120.0532 59.2189 31.7409 179.0618 15 N 4.3465 7.9677 116.4479 56.4902 38.4617 177.1475 16 I 3.6462 7.8498 121.2495 64.6986 37.2120 178.0167 17 Q 3.9415 7.9684 119.7860 59.2249 28.7861 178.7799 18 K 3.9713 7.7763 119.2860 59.4002 32.0982 179.3376 19 I 3.6736 7.9011 120.2061 64.9511 37.1941 178.6156 20 T 3.8457 8.1646 116.6285 66.4222 68.0943 176.6441 21 K 3.9235 7.7975 121.2060 59.5993 32.2677 178.9245 22 S 4.1243 8.3144 113.6094 61.6133 62.3161 176.0009 23 M 4.1582 8.3310 121.4223 57.8159 31.5440 178.6456 24 K 3.9742 7.8890 120.1462 59.6584 32.4856 178.8370 25 M 4.0693 7.8248 118.9048 58.1206 31.8413 178.9812 26 V 3.5397 7.8910 118.2289 65.9596 31.7198 177.7613 27 A 4.2563 8.1763 121.6195 54.6370 18.3228 179.3858 28 A 4.0390 8.2905 118.9790 55.2000 18.5331 179.8158 29 A 3.9123 7.9378 118.7175 55.2801 18.5736 179.8122 30 K 3.8540 8.0173 117.0356 59.9788 32.1955 178.8768 31 Y 4.1789 8.4195 119.6320 60.4974 38.8024 177.7854 32 A 3.5342 7.7937 121.2698 55.1553 18.4943 179.7012 33 R 3.7482 7.7162 115.5711 59.3352 30.1908 178.8141 34 A 3.8945 7.8112 120.3825 55.4358 18.1138 178.9934 35 E 3.7229 8.0600 116.2094 59.6317 29.5833 179.0118 36 R 4.0192 7.4029 116.0986 59.3279 30.5806 178.3860 37 E 4.1975 8.0231 116.1375 57.5542 29.3396 178.0426 38 L 3.8118 7.5303 120.5495 58.3309 42.1556 178.4613 39 K 4.0582 7.9201 116.8884 59.2343 32.3930 177.0988 40 P 4.2082 0.0000 0.0000 65.9896 30.8163 178.4881 41 A 4.2900 8.0040 118.7036 54.8967 18.0371 178.9990 42 R 4.6434 8.1377 114.8376 57.5912 30.3877 177.9074 43 V 4.1242 7.8936 117.9389 64.5658 31.9340 175.4357 44 Y 4.3253 7.8560 114.7798 59.3147 38.8480 175.1675 *77 L 4.0374 7.4417 118.7254 56.0423 42.1733 177.0384 78 C 4.7925 7.8537 122.0566 58.8733 29.6103 173.7085 79 G 3.6616 7.7955 109.7448 46.8965 0.0000 173.8477 80 A 4.8442 8.2137 127.0031 51.7325 18.3002 179.0415 81 I 3.7103 6.8901 119.5732 65.7460 36.8277 177.6801 82 H 4.1728 8.1163 116.0267 59.4711 29.0575 177.5717 83 S 4.0970 8.1520 116.0527 62.0123 62.8032 176.5347 84 S 4.1119 8.4082 117.6510 62.1545 62.4616 177.4408 85 V 3.6424 7.3899 113.4350 64.2728 31.5220 178.4464 86 A 4.1196 8.0300 120.4778 55.2639 18.1185 179.7986 87 K 3.9178 8.1814 115.9926 59.5013 32.1939 178.6266 88 Q 4.2010 7.8560 117.2947 57.1134 29.7789 175.6795 89 M 4.5059 8.0140 120.0479 54.6455 32.7367 176.1852 90 K 4.3333 7.5309 114.6944 54.6844 32.4865 175.2559 *209 L 4.1340 7.2613 120.5075 53.4412 44.1170 178.5852 210 A 3.4721 7.3521 113.4331 54.4237 19.4342 179.5721 211 N 3.8453 7.9849 111.8487 55.1236 40.5575 176.3962 212 I 3.7937 7.8875 120.4491 64.7630 37.5307 178.2320 213 I 3.7365 7.8887 120.1600 64.6622 36.9883 177.8805 214 Y 4.0889 8.4147 120.3874 60.7911 38.6275 177.3237 215 Y 3.9286 8.6167 121.0317 60.6499 38.9012 177.7158 216 S 4.0691 8.4016 115.3963 61.8834 62.8067 176.4630 217 L 3.8861 7.9423 123.1746 56.8595 41.3942 179.8139 218 K 3.7073 7.6546 118.2110 59.3510 31.9955 179.0097 219 E 3.7087 7.7584 118.7409 59.4595 29.3754 179.1367 220 S 4.0504 8.0761 113.3696 61.7263 62.3776 176.2037 221 T 3.8150 8.0190 112.3516 65.3233 68.3403 175.9097 222 T 3.9204 7.6811 118.7941 66.3828 68.4659 176.1730 223 S 4.0281 8.0432 116.5863 62.0687 62.8650 176.1288 224 E 3.8600 8.5289 121.6440 60.0824 28.8253 179.1046 225 Q 3.9844 8.3148 117.5291 58.6802 28.7640 179.4202 226 S 3.5734 7.8096 116.2781 61.4204 62.8903 175.8180 227 A 3.8600 8.0643 123.6086 55.5160 18.0262 179.2968 228 R 3.7512 8.2500 116.3763 59.9405 30.1271 178.3423 229 M 3.9985 7.7523 117.2416 59.0203 32.1566 178.4203 230 T 3.8065 7.8799 115.5408 66.3597 68.6335 176.5019 231 A 3.9460 8.5051 122.9626 55.6860 18.3960 179.5188 232 M 4.0143 8.3914 117.3328 58.5569 31.9671 178.5791 233 D 4.3004 8.0485 118.0790 57.4571 41.3593 178.1847 234 N 4.3251 8.3397 116.7807 56.2985 38.6912 177.4156 235 A 4.0645 8.6571 122.7467 54.9133 18.3542 179.7212 236 S 4.1907 8.4978 113.3150 61.1035 63.2902 176.9615 237 K 3.9638 7.7856 121.8978 59.3798 31.8144 178.9456 238 N 4.4413 8.5670 116.9579 56.2123 38.4740 177.3338 239 A 3.9638 7.8854 121.7753 55.2420 18.5172 179.5437 240 S 4.0738 8.3234 114.0893 62.0957 62.9522 176.9586 241 E 3.9589 8.1501 120.8484 59.7555 29.2138 179.2384 242 M 4.0849 8.2374 117.8195 58.1249 32.2132 178.5187 243 I 3.7149 7.7223 120.3898 64.3735 37.5013 177.7891 244 D 4.3301 7.9923 119.7050 57.4790 40.7612 178.9521 245 K 3.9779 8.2278 119.9001 59.4243 32.0149 178.6774 246 L 4.1669 7.7557 118.8878 57.6787 41.6620 179.3097 247 T 3.9083 8.4935 116.2392 66.3989 68.2234 176.6657 248 L 3.9843 7.8808 120.5771 58.3175 41.7855 179.4851 249 T 3.8872 7.7725 115.1008 66.8450 68.2814 176.3585 250 F 4.0253 8.5593 122.6961 61.3040 39.3868 176.9543 251 N 4.4377 8.3745 116.1850 55.9559 38.3069 177.6592 252 R 3.8754 8.3580 120.0030 59.6056 30.2447 178.8787 253 T 3.7644 7.7245 115.2748 66.7722 68.4684 176.4003 254 R 3.6447 7.8480 120.3782 59.4969 30.0595 178.6142 255 Q 3.9062 8.1439 117.4286 58.9350 28.7263 178.5308 256 A 3.9637 8.1580 122.0212 55.1032 18.3712 179.8190 257 V 3.4713 8.1556 117.0288 66.2166 31.6149 178.0881 258 I 3.6643 7.6460 119.4990 64.8854 36.8732 178.5299 259 T 3.8341 7.9007 116.2752 66.4550 68.2795 176.6464 260 K 3.8901 8.1535 121.6058 59.5780 32.2488 178.4971 261 E 3.9396 8.2087 119.6303 58.8553 29.5131 178.3661 262 L 3.9393 7.8782 120.5727 58.3367 42.1908 179.1480 263 I 3.7287 8.0775 119.9840 64.2623 37.0177 178.2523 264 E 3.9580 8.3131 119.4653 59.4956 29.2315 179.3006 265 I 3.6808 7.7432 119.6823 64.5236 37.1817 178.5524 266 I 3.6566 7.7250 120.2576 64.5251 37.0238 178.3201 267 S 4.2166 8.1199 116.1334 62.0391 62.5420 177.4729 268 G 3.6339 7.8946 106.0710 47.3379 0.0000 175.3812 269 A 4.1598 7.7695 122.7476 54.9884 18.3981 179.4157 270 A 4.0329 8.3611 117.6331 54.1828 18.5922 178.7373 271 A 4.2594 7.5733 117.1926 52.8988 19.0190 177.3541 272 L 4.1206 7.4911 122.5415 54.8728 41.7013 176.8631 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 4.32 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 7.92 4.01 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 1.28 0.00 0.00 3 L 9.25 3.94 0.00 1.66 1.74 0.75 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 4 K 8.14 3.93 0.00 1.78 1.90 0.00 1.73 0.00 0.00 1.84 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.51 7.81 5 D 8.18 4.36 0.00 2.93 2.70 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 6 I 8.18 3.75 2.12 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.68 1.15 0.00 0.00 7 T 8.26 3.79 4.53 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 1.19 0.00 0.00 8 R 8.02 3.87 0.00 2.00 2.10 0.00 3.11 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 9 R 8.33 3.94 0.00 1.88 1.98 0.00 3.20 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 10 L 8.43 4.03 0.00 1.82 1.65 0.74 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.10 3.97 0.00 1.97 1.84 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.48 7.81 12 S 8.20 4.09 0.00 4.05 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 13 I 8.28 3.69 1.93 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 0.98 0.90 0.00 0.00 14 K 8.34 4.01 0.00 1.79 1.83 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.60 7.81 15 N 7.97 4.35 0.00 2.97 2.85 0.00 0.00 6.98 6.66 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 16 I 7.85 3.65 2.00 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 0.94 0.90 0.00 0.00 17 Q 7.97 3.94 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 18 K 7.78 3.97 0.00 1.95 1.83 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.46 7.81 19 I 7.90 3.67 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 1.52 0.68 0.90 0.00 0.00 20 T 8.16 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 1.19 0.00 0.00 21 K 7.80 3.92 0.00 2.05 2.01 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.44 7.81 22 S 8.31 4.12 0.00 4.01 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 23 M 8.33 4.16 0.00 2.09 2.09 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 2.78 2.54 0.00 24 K 7.89 3.97 0.00 1.85 2.03 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.66 7.81 25 M 7.82 4.07 0.00 2.07 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 2.76 2.55 0.00 26 V 7.89 3.54 2.08 0.00 0.00 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 0.93 0.00 0.00 27 A 8.18 4.26 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 28 A 8.29 4.04 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 29 A 7.94 3.91 1.39 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 0.00 0.00 0.00 30 K 8.02 3.85 0.00 2.07 1.92 0.00 1.90 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.47 7.81 31 Y 8.42 4.18 0.00 2.98 3.09 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 0.00 0.00 0.00 32 A 7.79 3.53 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 33 R 7.72 3.75 0.00 1.98 1.95 0.00 3.14 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 1.61 1.82 0.00 34 A 7.81 3.89 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 35 E 8.06 3.72 0.00 1.29 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.25 0.00 36 R 7.40 4.02 0.00 1.98 1.93 0.00 3.15 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 1.59 1.84 0.00 37 E 8.02 4.20 0.00 2.09 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 0.00 2.30 2.27 0.00 38 L 7.53 3.81 0.00 1.60 1.74 0.90 0.66 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 39 K 7.92 4.06 0.00 1.81 1.88 0.00 1.80 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.50 7.81 40 P 0.00 4.21 0.00 2.10 2.09 0.00 3.54 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 41 A 8.00 4.29 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 42 R 8.14 4.64 0.00 2.09 2.22 0.00 3.23 0.00 0.00 3.32 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.97 0.00 43 V 7.89 4.12 2.40 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 0.98 0.00 0.00 1.05 0.00 0.00 44 Y 7.86 4.33 0.00 2.92 2.82 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 0.00 0.00 0.00 *77 L 7.44 4.04 0.00 1.72 1.70 0.90 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 78 C 7.85 4.79 0.00 2.74 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 G 7.80 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 8.21 4.84 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 81 I 6.89 3.71 1.97 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 1.58 0.88 0.98 0.00 0.00 82 H 8.12 4.17 0.00 3.15 3.34 0.00 5.66 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 83 S 8.15 4.10 0.00 3.94 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 84 S 8.41 4.11 0.00 3.93 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 85 V 7.39 3.64 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 1.00 0.00 0.00 86 A 8.03 4.12 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 87 K 8.18 3.92 0.00 1.71 1.90 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.68 7.81 88 Q 7.86 4.20 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 7.53 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 89 M 8.01 4.51 0.00 2.10 2.18 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 2.57 2.53 0.00 90 K 7.53 4.33 0.00 1.71 1.68 0.00 1.86 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.42 7.81 *209 L 7.26 4.13 0.00 1.80 1.54 0.94 0.99 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 0.00 210 A 7.35 3.47 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 0.00 211 N 7.98 3.85 0.00 2.82 2.74 0.00 0.00 6.90 7.74 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 0.00 212 I 7.89 3.79 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 1.67 0.82 0.97 0.00 0.00 213 I 7.89 3.74 2.07 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.13 0.97 0.00 0.00 214 Y 8.41 4.09 0.00 3.12 3.22 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 0.00 215 Y 8.62 3.93 0.00 3.16 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.40 4.07 0.00 4.08 4.26 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 0.00 217 L 7.94 3.89 0.00 1.83 1.68 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 218 K 7.65 3.71 0.00 1.51 1.53 0.00 1.47 0.00 0.00 1.43 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.79 0.49 7.81 219 E 7.76 3.71 0.00 1.86 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 1.66 1.90 0.00 220 S 8.08 4.05 0.00 3.83 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 0.00 221 T 8.02 3.82 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 1.23 0.00 0.00 222 T 7.68 3.92 4.38 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 1.40 0.00 0.00 223 S 8.04 4.03 0.00 4.00 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 0.00 224 E 8.53 3.86 0.00 2.08 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 2.31 2.38 0.00 225 Q 8.31 3.98 0.00 2.21 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.60 0.00 0.00 0.00 0.00 0.00 2.57 2.59 0.00 226 S 7.81 3.57 0.00 3.85 3.45 0.00 0.00 0.00 0.00 0.00 0.00 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 8.06 3.86 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 0.00 228 R 8.25 3.75 0.00 1.83 2.03 0.00 3.10 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 1.63 0.00 229 M 7.75 4.00 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.56 0.00 230 T 7.88 3.81 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 1.16 0.00 0.00 231 A 8.51 3.95 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 0.00 232 M 8.39 4.01 0.00 2.23 2.12 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 2.61 2.94 0.00 233 D 8.05 4.30 0.00 2.91 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 N 8.34 4.33 0.00 2.91 2.83 0.00 0.00 6.95 7.52 0.00 0.00 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 8.66 4.06 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 0.00 236 S 8.50 4.19 0.00 4.22 4.28 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 0.00 237 K 7.79 3.96 0.00 1.97 1.89 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.45 1.57 7.81 238 N 8.57 4.44 0.00 2.85 2.86 0.00 0.00 6.94 6.68 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 0.00 239 A 7.89 3.96 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 0.00 240 S 8.32 4.07 0.00 3.98 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 0.00 241 E 8.15 3.96 0.00 2.02 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 2.59 0.00 242 M 8.24 4.08 0.00 2.18 2.14 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 2.58 0.00 243 I 7.72 3.71 2.04 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 1.51 0.56 0.89 0.00 0.00 244 D 7.99 4.33 0.00 2.97 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 0.00 245 K 8.23 3.98 0.00 1.83 1.91 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.50 7.81 246 L 7.76 4.17 0.00 1.91 1.73 0.96 1.06 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 0.00 247 T 8.49 3.91 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 0.00 248 L 7.88 3.98 0.00 1.89 1.73 0.93 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 249 T 7.77 3.89 4.44 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 0.00 0.00 0.00 1.23 0.00 0.00 250 F 8.56 4.03 0.00 3.19 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 8.37 4.44 0.00 3.00 2.89 0.00 0.00 7.01 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 252 R 8.36 3.88 0.00 1.81 1.95 0.00 3.15 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 253 T 7.72 3.76 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 1.10 0.00 0.00 254 R 7.85 3.64 0.00 1.53 1.91 0.00 3.17 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 1.53 1.47 0.00 255 Q 8.14 3.91 0.00 2.25 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.60 0.00 256 A 8.16 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 0.00 257 V 8.16 3.47 2.19 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 0.98 0.00 0.00 0.93 0.00 0.00 258 I 7.65 3.66 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 1.50 0.48 0.90 0.00 0.00 259 T 7.90 3.83 4.36 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 1.20 0.00 0.00 260 K 8.15 3.89 0.00 1.85 2.02 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.43 7.81 261 E 8.21 3.94 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 2.29 2.30 0.00 262 L 7.88 3.94 0.00 2.07 1.80 0.92 1.10 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 0.00 263 I 8.08 3.73 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 0.75 0.90 0.00 0.00 264 E 8.31 3.96 0.00 2.01 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 2.55 0.00 265 I 7.74 3.68 2.02 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 1.54 0.91 0.00 0.00 266 I 7.73 3.66 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 0.62 0.91 0.00 0.00 267 S 8.12 4.22 0.00 4.02 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 0.00 268 G 7.89 3.63 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 0.00 0.00 0.00 269 A 7.77 4.16 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 0.00 270 A 8.36 4.03 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 0.00 271 A 7.57 4.26 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 0.00 272 L 7.49 4.12 0.00 1.73 1.59 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.