NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 K 4.3850 8.2993 121.7841 56.6803 32.8496 176.2784 7 R 4.3448 7.5188 124.1853 53.3088 29.6160 173.6246 8 Y 5.2649 8.0638 116.4378 56.7091 37.8538 173.8121 9 R 3.9645 7.5229 126.8497 60.6905 30.4681 177.2314 10 A 4.1436 7.8877 119.4133 55.1687 18.5057 179.2068 11 L 3.9095 8.1041 115.8828 58.3242 41.4045 179.3642 12 L 3.9225 7.6274 119.1224 56.6857 41.8931 178.6772 13 E 5.0243 7.5789 118.4526 56.1358 29.8265 177.3861 14 K 4.4872 7.7903 117.3041 56.5712 35.4572 176.5408 15 V 4.1504 7.5411 109.1808 62.0919 31.9880 176.5987 16 D 3.9918 7.5241 117.5022 52.0928 42.1360 172.8328 17 P 4.4436 0.0000 0.0000 65.9715 32.0446 177.3375 18 N 4.6212 7.7630 117.2390 53.6635 38.7046 170.5267 19 K 3.7114 8.7395 130.2243 56.8364 32.1066 175.0369 20 I 4.5890 8.1671 124.0726 59.9977 39.0758 174.4202 21 Y 4.8449 8.9338 125.5519 56.1544 40.1455 175.5784 22 T 4.1509 8.9043 119.6557 62.8341 68.3862 175.5169 23 I 3.5379 8.0761 130.4218 64.6928 37.0717 177.2854 24 D 4.4068 8.4901 120.3006 57.3246 40.6704 178.6997 25 E 4.1873 8.6421 114.8993 57.7762 30.6702 178.1325 26 A 4.2393 8.1307 121.3598 54.6664 19.0532 178.7670 27 A 3.9463 8.1697 119.6528 56.0460 18.3211 179.5605 28 H 4.0766 8.0317 113.2602 58.9155 28.6755 177.3697 29 L 4.2053 8.1868 121.5737 56.8655 41.7557 178.7374 30 V 3.7481 8.4197 119.0992 64.2449 31.1489 178.1708 31 K 4.0626 7.7206 119.6596 58.7797 31.9924 177.7570 32 E 4.5850 7.9533 114.3975 56.5705 31.0386 177.3628 33 L 4.2583 8.0928 120.0493 56.5770 41.7199 176.4346 34 A 3.9723 7.1032 119.9836 52.9688 18.2011 176.6809 35 T 4.5712 7.8098 116.9922 63.0539 72.8257 170.9708 36 A 3.6533 8.7593 131.6956 52.3463 19.5206 179.0033 37 K 3.4670 7.9870 121.3600 57.7807 32.2538 176.9733 38 F 4.9594 8.0555 108.1162 57.6629 39.9765 175.2083 39 D 4.3553 6.5095 122.9177 53.5330 44.4687 174.3593 40 E 4.9207 8.2037 122.1875 57.0363 31.0581 177.3756 41 T 4.3071 8.2172 117.9546 63.8794 70.3326 173.3276 42 V 4.5247 8.0346 120.4563 62.4179 34.7745 173.6617 43 E 4.8728 8.8815 126.8473 53.9635 32.6935 175.6042 44 V 4.7370 7.0014 118.1794 60.7471 30.5742 175.6361 45 H 4.2224 7.9442 117.4831 56.8837 30.0816 175.7672 46 A 5.6373 8.3552 122.1276 50.8457 22.3667 175.3610 47 K 4.6819 8.6347 121.3209 54.7813 35.9257 175.2123 48 L 4.8703 8.7546 127.0657 54.0736 43.6578 177.2265 49 G 4.0053 8.1016 108.1965 43.5987 0.0000 172.3457 50 I 4.4537 7.2049 115.2555 60.3295 40.7657 175.3159 51 D 4.6808 8.2311 117.9571 51.7118 41.2285 175.5077 52 P 4.6892 0.0000 0.0000 62.1361 30.8012 178.5398 53 R 4.1659 8.8221 122.2369 59.5911 30.7934 177.2143 54 R 4.0016 7.7144 117.1158 56.3727 30.4681 177.0585 55 S 4.2344 8.7290 115.1134 58.9794 61.9335 173.8513 56 D 4.7936 7.8991 116.5349 53.3636 40.5074 176.2082 57 Q 4.6209 7.9272 117.7981 54.7871 29.0758 174.4177 58 N 6.0595 7.7403 113.7844 50.5141 42.4775 175.8710 59 V 4.5069 8.5756 115.5564 59.6481 34.9453 174.8542 60 R 5.2589 7.7034 121.5039 53.7420 34.4486 174.3889 61 G 4.2398 7.8618 106.4435 45.4368 0.0000 170.6977 62 T 5.1843 8.2724 115.5459 60.0661 72.5671 177.7560 63 V 4.2104 8.3187 125.8339 61.2313 30.4707 177.9459 64 S 4.1315 8.7471 113.4800 60.0569 61.9299 174.2815 *162 I 3.9520 7.5739 119.1691 59.2933 39.0768 174.4100 163 E 6.3000 7.4513 122.9061 56.5270 31.5146 175.5339 164 F 5.2809 8.2096 121.6115 55.2205 42.3535 173.6801 165 R 5.8035 8.7341 114.1004 54.0626 33.4498 172.5066 166 N 5.5035 8.4284 115.4583 51.3340 40.1154 173.8021 167 D 4.2792 8.9452 121.4183 54.1671 41.9727 174.8621 168 K 4.1309 8.5051 121.0991 56.2086 30.2961 177.1152 169 T 4.5593 8.6513 108.8684 60.5614 71.0202 176.0578 170 G 5.0325 7.3913 122.1194 46.4658 0.0000 171.0168 171 A 4.5251 6.9967 123.0856 52.0684 22.4532 175.2300 172 I 4.1313 8.0288 116.3426 61.1904 39.7062 176.0420 173 H 5.0004 8.0560 117.4333 54.5210 28.8398 174.3939 174 A 4.1519 7.4990 123.2473 51.5171 20.2607 176.5972 175 P 5.5678 0.0000 0.0000 61.2131 30.4098 176.3096 176 V 4.0409 8.0261 119.3015 61.2510 36.2082 173.1756 177 G 3.8166 7.5622 108.2806 43.7801 0.0000 171.1680 178 K 4.2346 7.3340 118.3616 55.9816 34.9741 178.4502 179 A 3.0302 9.6293 122.4531 52.0308 20.4575 180.0855 180 S 3.8942 8.4593 114.2275 59.8202 65.5434 175.5999 181 F 4.2830 8.1929 118.5001 56.3826 39.0195 172.8975 182 P 4.4490 0.0000 0.0000 61.9389 31.6925 175.7644 183 P 4.4544 0.0000 0.0000 64.0147 31.5854 178.0711 184 E 4.0552 7.9462 119.3933 59.2163 29.7622 178.2573 185 K 3.9852 7.5736 119.5951 59.4470 32.2109 178.8036 186 L 3.9905 7.9151 119.1866 59.0203 40.4927 178.5932 187 A 4.0338 7.6693 120.4753 54.4868 18.4263 178.3871 188 D 4.7313 7.7335 115.3562 55.7289 41.5570 177.8096 189 N 4.6883 8.0978 114.8370 54.0262 38.4975 176.1078 190 I 4.1382 7.5849 121.4957 61.6418 38.0326 178.0802 191 R 3.8382 7.8731 119.6645 59.2592 29.9070 178.5845 192 A 4.1404 7.9281 117.8021 54.1597 18.6444 178.9306 193 F 4.5547 7.7316 119.5575 61.2789 39.5774 177.1758 194 I 3.4216 7.4581 119.8592 64.5984 36.9300 178.3627 195 R 3.9792 7.7980 116.1996 59.2385 28.8462 178.2356 196 A 4.2495 8.0042 117.9494 52.7573 17.7996 177.8733 197 L 4.6586 8.0426 118.6561 57.0054 43.1125 177.4297 198 E 4.8088 7.7491 116.0281 54.7676 29.1583 175.5889 199 A 4.6844 7.9402 120.1238 53.2792 21.7130 176.8452 200 H 4.9063 8.1503 112.5252 55.3835 29.7849 173.8018 201 K 4.4787 7.9714 119.0360 54.7756 34.4993 175.7537 202 P 4.5600 0.0000 0.0000 62.2958 28.7996 175.6963 203 E 4.4023 7.9852 121.2909 57.2750 27.6493 176.5644 204 G 4.4795 8.0228 122.8936 45.7053 0.0000 170.2609 205 A 4.0659 6.8613 123.5373 51.0865 18.6949 177.4204 206 K 3.8691 8.1937 123.6396 57.5251 32.3312 178.5243 207 G 4.0317 8.2334 107.1911 46.3862 0.0000 172.8696 208 T 3.9172 8.3638 116.4246 64.9837 68.6901 172.9516 209 F 4.0705 9.6469 125.6688 61.0820 39.8821 176.2902 210 L 4.3561 9.3568 111.0325 55.1794 43.9418 176.2578 211 R 4.5043 8.5084 118.2602 57.2258 32.1265 175.2548 212 S 4.1158 8.9881 118.5544 58.5756 64.3783 174.8589 213 V 4.6412 7.9203 131.8093 62.1189 29.8926 174.5854 214 Y 4.3023 8.2692 121.5498 58.3308 39.9486 177.2140 215 V 4.6732 8.0067 120.7255 60.6969 33.2603 174.4963 216 T 5.5544 8.1977 123.2650 60.8635 70.4932 172.3590 217 T 4.8852 8.1323 108.5667 60.9751 71.5309 174.2179 218 T 4.0891 8.3613 117.7791 66.1631 68.6524 174.6266 219 M 4.6085 7.8544 117.3274 56.8165 35.8197 175.6264 220 G 3.9963 9.3915 106.0010 44.8711 0.0000 173.5780 221 P 4.7312 0.0000 0.0000 61.8433 31.3407 175.9334 222 S 4.9930 8.4060 117.6434 57.5474 65.9687 174.1030 223 V 3.8040 7.6376 131.8947 63.1630 33.0990 175.0898 224 R 4.2699 7.1844 113.0534 55.6074 34.3830 173.9825 225 I 5.4827 7.9830 121.4440 59.0592 40.7811 173.9451 226 N 4.9290 8.4841 120.5131 51.2597 40.6894 173.1220 227 P 3.9888 0.0000 0.0000 64.6902 31.4386 176.4582 228 H 4.9809 7.8327 116.0438 55.3412 29.3202 174.8050 229 S 4.3099 8.3972 120.9717 59.3296 62.6454 174.7296 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 6 K 8.30 4.39 0.00 1.75 1.81 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.37 1.50 7.81 7 R 7.52 4.34 0.00 1.75 1.74 0.00 2.82 0.00 0.00 2.95 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.67 0.00 8 Y 8.06 5.26 0.00 2.97 2.96 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 0.00 0.00 0.00 9 R 7.52 3.96 0.00 1.91 1.99 0.00 3.35 0.00 0.00 3.35 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 10 A 7.89 4.14 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 11 L 8.10 3.91 0.00 1.62 1.80 1.03 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 12 L 7.63 3.92 0.00 1.80 1.54 -0.19 1.11 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 0.00 0.00 13 E 7.58 5.02 0.00 2.06 1.93 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 2.27 2.19 0.00 14 K 7.79 4.49 0.00 1.71 1.80 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.33 1.44 7.81 15 V 7.54 4.15 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 0.82 0.00 0.00 0.99 0.00 0.00 16 D 7.52 3.99 0.00 2.66 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 17 P 0.00 4.44 0.00 2.08 2.16 0.00 3.72 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 18 N 7.76 4.62 0.00 2.69 2.67 0.00 0.00 6.96 7.61 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 19 K 8.74 3.71 0.00 1.71 0.82 0.00 1.47 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.83 1.22 7.81 20 I 8.17 4.59 1.87 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 1.39 0.63 0.93 0.00 0.00 21 Y 8.93 4.84 0.00 2.76 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 22 T 8.90 4.15 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 1.25 0.00 0.00 23 I 8.08 3.54 1.87 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 1.27 0.67 0.91 0.00 0.00 24 D 8.49 4.41 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 25 E 8.64 4.19 0.00 2.04 2.07 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 2.59 2.38 0.00 26 A 8.13 4.24 1.22 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 0.00 0.00 27 A 8.17 3.95 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 H 8.03 4.08 0.00 3.35 3.42 0.00 5.82 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 L 8.19 4.21 0.00 1.95 1.87 1.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.42 3.75 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 0.91 0.00 0.00 0.94 0.00 0.00 31 K 7.72 4.06 0.00 1.72 1.94 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.63 1.60 7.81 32 E 7.95 4.58 0.00 2.10 2.07 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 2.20 2.62 0.00 33 L 8.09 4.26 0.00 1.66 1.81 0.96 0.72 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 34 A 7.10 3.97 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 35 T 7.81 4.57 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 1.24 0.00 0.00 36 A 8.76 3.65 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 37 K 7.99 3.47 0.00 1.63 0.78 0.00 1.56 0.00 0.00 1.64 0.00 0.00 3.13 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.87 0.84 7.81 38 F 8.06 4.96 0.00 3.03 3.16 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 39 D 6.51 4.36 0.00 2.98 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.20 4.92 0.00 2.08 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 2.09 2.09 0.00 41 T 8.22 4.31 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 1.15 0.00 0.00 42 V 8.03 4.52 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 0.94 0.00 0.00 0.90 0.00 0.00 43 E 8.88 4.87 0.00 1.80 1.69 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 0.00 2.17 2.16 0.00 44 V 7.00 4.74 2.22 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 0.95 0.00 0.00 1.06 0.00 0.00 45 H 7.94 4.22 0.00 3.14 3.12 0.00 5.67 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 46 A 8.36 5.64 1.22 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 0.00 0.00 47 K 8.63 4.68 0.00 1.76 1.58 0.00 1.66 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.60 7.81 48 L 8.75 4.87 0.00 2.11 1.81 1.17 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.10 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 50 I 7.20 4.45 1.82 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.60 0.78 0.00 0.00 51 D 8.23 4.68 0.00 2.70 2.52 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 0.00 0.00 0.00 0.00 52 P 0.00 4.69 0.00 2.34 2.15 0.00 3.81 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 53 R 8.82 4.17 0.00 1.99 1.99 0.00 3.31 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 54 R 7.71 4.00 0.00 1.87 2.16 0.00 3.33 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.55 0.00 55 S 8.73 4.23 0.00 3.82 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 D 7.90 4.79 0.00 2.79 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 57 Q 7.93 4.62 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.62 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00 58 N 7.74 6.06 0.00 2.54 2.65 0.00 0.00 7.10 7.68 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 59 V 8.58 4.51 2.21 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 0.95 0.00 0.00 0.89 0.00 0.00 60 R 7.70 5.26 0.00 1.46 1.61 0.00 3.22 0.00 0.00 3.78 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.55 0.00 61 G 7.86 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 62 T 8.27 5.18 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 1.22 0.00 0.00 63 V 8.32 4.21 2.07 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 0.73 0.00 0.00 0.92 0.00 0.00 64 S 8.75 4.13 0.00 3.90 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 *162 I 7.57 3.95 1.87 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 1.30 0.63 0.91 0.00 0.00 163 E 7.45 6.30 0.00 2.03 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.82 0.00 164 F 8.21 5.28 0.00 3.08 3.03 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 0.00 165 R 8.73 5.80 0.00 1.86 2.00 0.00 3.18 0.00 0.00 3.38 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 166 N 8.43 5.50 0.00 3.05 3.07 0.00 0.00 5.59 8.07 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 0.00 167 D 8.95 4.28 0.00 2.91 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 K 8.51 4.13 0.00 1.96 1.97 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.33 1.36 7.81 169 T 8.65 4.56 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 1.23 0.00 0.00 170 G 7.39 5.03 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 0.00 0.00 0.00 171 A 7.00 4.53 1.45 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 0.00 0.00 172 I 8.03 4.13 1.97 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.88 0.98 0.00 0.00 173 H 8.06 5.00 0.00 3.18 3.18 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 A 7.50 4.15 1.04 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 0.00 0.00 175 P 0.00 5.57 0.00 2.08 1.56 0.00 3.32 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.85 0.00 176 V 8.03 4.04 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 0.63 0.00 0.00 0.95 0.00 0.00 177 G 7.56 3.82 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 0.00 0.00 0.00 178 K 7.33 4.23 0.00 1.39 1.63 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.75 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.99 1.17 7.81 179 A 9.63 3.03 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 0.00 180 S 8.46 3.89 0.00 4.16 4.09 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 0.00 181 F 8.19 4.28 0.00 2.94 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 0.00 182 P 0.00 4.45 0.00 2.20 2.14 0.00 3.67 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.02 0.00 183 P 0.00 4.45 0.00 2.36 2.44 0.00 3.66 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.93 0.00 184 E 7.95 4.06 0.00 2.05 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 2.42 2.36 0.00 185 K 7.57 3.99 0.00 1.84 2.05 0.00 1.70 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.50 7.81 186 L 7.92 3.99 0.00 2.01 1.96 0.95 0.59 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 0.00 187 A 7.67 4.03 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.73 4.73 0.00 2.85 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 0.00 189 N 8.10 4.69 0.00 3.15 2.92 0.00 0.00 6.77 7.18 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 0.00 190 I 7.58 4.14 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.96 0.70 0.00 0.00 191 R 7.87 3.84 0.00 2.02 1.97 0.00 3.27 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.79 0.00 192 A 7.93 4.14 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 0.00 193 F 7.73 4.55 0.00 2.87 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 0.00 194 I 7.46 3.42 1.94 0.00 0.00 0.47 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 0.49 0.81 0.00 0.00 195 R 7.80 3.98 0.00 2.05 2.22 0.00 2.81 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 196 A 8.00 4.25 1.58 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 0.00 0.00 0.00 0.00 0.00 0.00 197 L 8.04 4.66 0.00 2.38 2.18 0.98 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 198 E 7.75 4.81 0.00 2.33 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 0.00 1.58 2.11 0.00 199 A 7.94 4.68 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 0.00 200 H 8.15 4.91 0.00 3.04 3.28 0.00 5.89 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 K 7.97 4.48 0.00 2.00 2.00 0.00 1.63 0.00 0.00 1.91 0.00 0.00 3.48 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.60 7.81 202 P 0.00 4.56 0.00 2.15 2.22 0.00 3.74 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 1.89 1.90 0.00 203 E 7.99 4.40 0.00 1.99 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 2.37 2.51 0.00 204 G 8.02 4.48 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 0.00 0.00 0.00 205 A 6.86 4.07 1.02 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 0.00 206 K 8.19 3.87 0.00 1.70 1.62 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.37 7.81 207 G 8.23 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 0.00 0.00 0.00 208 T 8.36 3.92 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 1.28 0.00 0.00 209 F 9.65 4.07 0.00 3.13 2.65 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 0.00 210 L 9.36 4.36 0.00 1.51 1.58 0.64 0.92 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 0.00 211 R 8.51 4.50 0.00 1.91 1.79 0.00 3.29 0.00 0.00 3.18 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 212 S 8.99 4.12 0.00 3.96 3.75 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 0.00 0.00 0.00 213 V 7.92 4.64 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 0.90 0.00 0.00 0.97 0.00 0.00 214 Y 8.27 4.30 0.00 2.89 2.90 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 0.00 215 V 8.01 4.67 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 1.22 0.00 0.00 0.89 0.00 0.00 216 T 8.20 5.55 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 1.32 0.00 0.00 217 T 8.13 4.89 4.50 0.00 0.00 0.00 0.00 0.00 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 0.00 218 T 8.36 4.09 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 1.16 0.00 0.00 219 M 7.85 4.61 0.00 2.05 1.91 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 220 G 9.39 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.73 0.00 2.18 1.92 0.00 3.62 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.24 0.00 222 S 8.41 4.99 0.00 4.15 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 0.00 223 V 7.64 3.80 1.69 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 -0.44 0.00 0.00 0.71 0.00 0.00 224 R 7.18 4.27 0.00 1.67 1.69 0.00 3.10 0.00 0.00 3.29 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.04 0.00 225 I 7.98 5.48 1.81 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.02 0.95 0.00 0.00 226 N 8.48 4.93 0.00 2.72 2.65 0.00 0.00 6.65 7.71 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 0.00 227 P 0.00 3.99 0.00 2.16 2.07 0.00 3.68 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.89 0.00 228 H 7.83 4.98 0.00 3.15 3.29 0.00 5.71 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 S 8.40 4.31 0.00 3.85 3.96 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.