NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.7126 8.2833 118.1455 52.1473 38.8828 174.8707 2 I 3.6079 7.8585 119.1528 63.7915 36.8337 176.9593 3 Y 3.9060 8.7618 121.4056 60.8131 39.0893 177.7502 4 Q 3.7986 8.5906 119.2320 58.7185 28.7392 178.4082 5 F 4.3069 8.2159 121.7752 61.1219 39.4206 177.0094 6 K 3.3884 7.8943 119.3175 59.5035 31.8623 178.5695 7 N 4.3666 7.5602 116.4634 56.3030 38.3208 177.3700 8 M 4.1023 7.9766 120.3404 58.4374 32.0569 178.7824 9 I 3.5357 7.4327 119.8452 64.4738 37.0410 178.4414 10 E 4.2755 7.9480 118.0365 59.1363 29.2484 178.3603 11 C 4.4289 7.9556 118.5993 59.5368 43.8485 174.9592 12 T 4.1161 7.9153 109.6379 62.1150 69.0374 175.1602 13 V 4.4870 7.9774 121.0538 60.3576 31.1952 174.0100 14 P 4.4952 0.0000 0.0000 65.3306 32.0179 177.7552 15 A 4.1349 7.5426 118.3575 52.9361 18.1992 176.8727 *17 R 4.4523 7.5394 114.5470 56.3341 31.4911 175.3239 18 S 4.4670 8.1766 115.6879 57.4647 63.2422 175.1976 19 W 4.6070 9.2241 124.8856 59.6165 27.6698 178.3788 20 W 3.2141 7.4354 119.2380 59.3347 28.1208 177.6098 21 D 4.2812 7.9752 117.7483 56.0959 40.1649 177.4623 22 F 4.7506 7.9906 116.2247 57.2078 39.9959 176.2263 23 A 4.4035 8.2116 122.2458 54.0613 19.0492 177.0732 24 D 5.3946 7.7928 114.6666 53.1570 42.4598 172.0547 25 Y 4.6975 8.7523 122.8210 56.1136 42.7288 175.9646 26 G 3.8770 7.9578 115.7701 46.8036 0.0000 172.7122 27 C 4.4054 9.2638 116.0640 58.1095 40.8467 174.0282 28 Y 4.3979 8.7407 115.7066 58.2990 39.9197 175.1917 29 C 4.6865 8.4973 118.3547 59.1671 41.0378 172.0320 30 G 4.4755 8.1429 112.5612 45.4180 0.0000 175.1326 31 G 3.7434 8.4988 114.7488 45.6118 0.0000 170.4868 32 G 4.0649 9.4092 111.8141 45.5539 0.0000 174.8018 33 G 4.1548 8.0640 111.3214 43.2070 0.0000 171.3900 34 S 4.4097 7.1158 111.2149 57.5098 66.2129 174.0982 35 G 3.8084 8.7131 107.4318 44.9131 0.0000 172.2768 36 T 4.4386 8.0228 115.1025 61.4161 69.2280 173.4745 37 P 4.7116 0.0000 0.0000 63.3568 31.8176 176.7811 38 T 4.0853 9.0080 113.2138 64.4325 69.5192 173.4323 39 D 4.5799 7.5338 119.0540 51.8310 42.0287 174.9539 40 D 4.3609 8.8550 117.8296 57.9424 40.5942 178.3978 41 L 3.9885 8.0074 120.2501 58.3000 42.1386 178.3732 42 D 4.5657 8.8857 118.0597 57.4537 41.1532 178.4482 43 R 3.9413 8.0748 118.7795 59.0871 29.9651 178.3168 44 C 4.3605 8.0962 116.1834 60.4195 40.1483 175.5829 45 C 4.4160 8.2919 117.8955 59.8324 40.4525 176.0105 46 Q 3.4190 7.9683 121.5005 58.9269 28.4477 178.3446 47 V 3.4751 7.7071 119.3348 66.1667 31.5250 177.5023 48 H 3.9181 8.1778 118.0386 59.0859 29.7237 176.9120 49 D 4.2250 8.2845 120.9426 57.5953 40.7343 178.5662 50 N 4.3381 8.2696 116.9673 56.4566 38.5279 176.5965 51 C 4.2379 8.3578 120.0292 60.0063 44.4787 175.3366 52 Y 4.1369 8.0270 118.3132 61.1639 37.1753 178.1902 53 N 4.5929 7.9626 116.5641 56.3577 38.9781 177.2432 54 Q 4.1211 8.2097 119.4016 58.8906 28.8793 178.4619 55 A 4.0392 8.1674 122.0846 54.9267 18.2120 179.0650 56 Q 4.4374 7.8584 115.2127 57.4457 28.8374 177.5005 57 E 4.2099 7.8881 119.7705 56.8160 30.3017 176.5274 58 I 4.0277 7.3984 121.8085 60.3494 37.9876 175.4494 59 T 3.9511 8.6067 121.5510 65.4353 68.5108 173.9742 60 G 3.8099 8.8121 113.4592 46.2696 0.0000 173.1354 61 C 4.5745 8.1226 120.6430 54.8284 45.0698 172.9117 62 R 4.6633 8.1728 126.7473 53.3117 30.0156 174.2692 63 P 3.8117 0.0000 0.0000 65.3501 31.6810 179.3359 64 K 3.8834 7.8613 116.4701 58.1134 32.0004 178.3300 65 W 4.5310 7.2077 113.0396 56.2160 30.7652 176.0161 66 K 4.0252 8.1339 120.8194 56.5350 31.7769 176.0622 67 T 4.1990 8.4779 123.9869 62.7642 69.0549 173.6707 68 Y 4.8541 7.7051 124.4006 55.3984 40.9696 174.4920 69 T 4.9391 9.7017 116.8651 62.1751 70.4950 173.9173 70 Y 5.3410 8.5332 123.2862 56.0775 41.7042 173.5776 71 Q 4.2292 9.4001 119.8462 54.6715 33.1352 172.9488 72 C 5.4225 8.6494 124.4037 55.1152 46.6772 172.7333 73 T 4.6889 8.6037 114.6162 60.9865 71.9495 174.1398 74 Q 3.4196 9.7223 121.0536 57.2877 26.2724 174.6819 75 G 3.9474 8.2126 100.4966 46.2117 0.0000 172.9577 76 T 4.5246 7.9141 116.4669 61.1952 71.1407 172.4032 77 L 5.1780 8.5082 128.2461 53.8538 43.7199 175.5606 78 T 4.7406 8.9807 122.3207 62.0649 72.9486 172.1073 79 C 5.0452 8.7427 123.1320 55.6035 41.3830 174.0088 80 K 4.3160 8.8157 123.9196 55.9507 32.6059 177.4921 81 G 3.8615 8.6639 109.3012 46.2710 0.0000 174.4926 82 R 4.3521 7.7570 115.0454 56.0079 30.0906 176.2101 83 N 4.5972 7.8250 116.9292 52.9975 39.4759 175.3537 84 N 4.7155 8.4845 120.1072 51.7454 40.3108 175.7203 85 A 3.9613 8.5105 121.0955 55.6517 18.2277 180.1911 86 C 4.1277 8.2038 115.8644 59.8502 45.0097 175.3446 87 A 4.0234 9.0013 122.4287 55.2356 18.0245 179.4428 88 A 3.8849 8.4309 119.6009 55.4942 18.4360 180.0890 89 T 3.7258 7.8718 114.2056 67.1540 68.5288 177.0277 90 T 3.8479 7.9313 114.9537 64.9918 67.2974 175.4754 91 C 2.9315 8.0371 120.7395 59.1793 44.0867 175.1098 92 D 4.1416 7.8024 119.4679 57.2969 40.8768 177.4699 93 C 4.1603 8.0584 117.0340 60.2096 41.4536 175.9114 94 D 3.8497 8.0733 120.4417 57.0996 40.3700 178.8342 95 R 3.7910 8.1857 119.5322 59.5248 30.1325 178.6187 96 L 3.9341 8.0519 118.6693 57.5763 41.4713 179.4823 97 A 3.6744 7.7312 120.1547 54.8247 18.1469 179.4593 98 A 3.4742 7.8345 119.2896 55.2927 18.1907 180.0020 99 I 3.6432 7.4216 117.2530 64.4733 37.3235 177.5121 100 C 4.4254 8.1119 119.4127 59.7023 38.6440 175.5611 101 F 4.3319 8.4979 119.6122 60.7472 38.2556 177.5597 102 A 4.2434 7.9242 119.2334 54.0610 18.2248 178.7759 103 G 3.9300 7.7891 101.3568 43.6591 0.0000 173.1174 104 A 4.7503 7.2372 124.2094 49.6064 20.6992 175.6517 105 P 4.3757 0.0000 0.0000 62.5856 32.0538 175.6867 106 Y 4.1908 8.4730 122.8459 55.8635 39.5008 174.6115 107 N 4.8226 8.6635 127.7595 51.9756 39.3191 175.4290 108 D 4.6770 8.9197 126.7714 57.7232 41.1467 179.0469 109 T 3.9719 8.1224 114.2649 65.7540 68.7267 174.6247 110 N 4.4408 7.9933 117.9616 52.7983 38.8332 173.9623 111 Y 4.3529 7.4086 120.5621 58.2629 39.9498 174.6967 112 N 4.0363 8.0014 124.2994 53.0874 37.6986 173.2094 113 I 3.9934 6.8848 110.6883 59.8631 39.6826 176.7480 114 D 4.4785 8.1589 120.0252 53.2673 40.3600 176.0789 115 L 3.8792 8.2328 127.0765 57.6407 41.6141 179.0990 116 K 3.9360 8.1149 117.4519 58.8652 32.2245 177.7728 117 A 4.3733 8.0063 119.3500 53.1945 19.6636 178.2405 118 R 4.4656 8.1064 113.6706 55.8915 31.7024 175.7433 119 C 5.0009 8.0333 116.4958 56.4381 40.9363 174.0399 120 Q 4.2087 7.9645 122.8955 56.1011 28.5491 176.1884 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 N 8.28 4.71 0.00 2.97 3.02 0.00 0.00 6.12 6.96 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 2 I 7.86 3.61 1.75 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 1.43 0.62 0.86 0.00 0.00 3 Y 8.76 3.91 0.00 2.95 3.15 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 0.00 4 Q 8.59 3.80 0.00 1.82 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 5 F 8.22 4.31 0.00 3.20 3.15 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 0.00 6 K 7.89 3.39 0.00 1.22 1.35 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.38 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.55 0.21 7.81 7 N 7.56 4.37 0.00 2.78 2.84 0.00 0.00 7.06 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 8 M 7.98 4.10 0.00 2.01 2.22 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.53 0.00 9 I 7.43 3.54 1.86 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.82 0.00 0.00 10 E 7.95 4.28 0.00 2.07 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 2.45 2.49 0.00 11 C 7.96 4.43 0.00 3.14 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 12 T 7.92 4.12 4.23 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 1.25 0.00 0.00 13 V 7.98 4.49 2.27 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 1.18 0.00 0.00 0.96 0.00 0.00 14 P 0.00 4.50 0.00 2.10 2.12 0.00 3.75 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.27 0.00 15 A 7.54 4.13 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 *17 R 7.54 4.45 0.00 1.91 1.79 0.00 3.08 0.00 0.00 2.25 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.53 0.00 18 S 8.18 4.47 0.00 3.84 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 0.00 19 W 9.22 4.61 0.00 3.68 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 20 W 7.44 3.21 0.00 2.97 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 21 D 7.98 4.28 0.00 2.02 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 0.00 0.00 0.00 22 F 7.99 4.75 0.00 3.17 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 23 A 8.21 4.40 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 24 D 7.79 5.39 0.00 2.65 2.20 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 25 Y 8.75 4.70 0.00 3.04 2.69 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 0.00 0.00 0.00 26 G 7.96 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 0.00 0.00 0.00 27 C 9.26 4.41 0.00 3.02 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 28 Y 8.74 4.40 0.00 3.27 3.05 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 29 C 8.50 4.69 0.00 3.42 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 30 G 8.14 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 31 G 8.50 3.74 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 0.00 0.00 0.00 32 G 9.41 4.06 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 0.00 33 G 8.06 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 0.00 0.00 0.00 0.00 34 S 7.12 4.41 0.00 3.91 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 35 G 8.71 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 8.02 4.44 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 1.25 0.00 0.00 37 P 0.00 4.71 0.00 2.08 2.07 0.00 3.73 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 38 T 9.01 4.09 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 1.17 0.00 0.00 39 D 7.53 4.58 0.00 2.93 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 40 D 8.86 4.36 0.00 2.75 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 41 L 8.01 3.99 0.00 1.77 1.69 0.62 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 42 D 8.89 4.57 0.00 3.17 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 43 R 8.07 3.94 0.00 2.15 1.95 0.00 3.20 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.92 0.00 44 C 8.10 4.36 0.00 3.55 3.44 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 0.00 45 C 8.29 4.42 0.00 3.29 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 46 Q 7.97 3.42 0.00 0.98 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.80 0.00 0.00 0.00 0.00 0.00 1.96 1.25 0.00 47 V 7.71 3.48 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 0.96 0.00 0.00 0.95 0.00 0.00 48 H 8.18 3.92 0.00 3.19 3.34 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 49 D 8.28 4.22 0.00 3.10 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 50 N 8.27 4.34 0.00 2.82 2.84 0.00 0.00 6.74 7.94 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 51 C 8.36 4.24 0.00 3.11 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 52 Y 8.03 4.14 0.00 3.08 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 N 7.96 4.59 0.00 2.95 2.91 0.00 0.00 7.09 7.62 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 54 Q 8.21 4.12 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.56 2.51 0.00 55 A 8.17 4.04 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 56 Q 7.86 4.44 0.00 2.24 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.90 0.00 0.00 0.00 0.00 0.00 2.58 2.26 0.00 57 E 7.89 4.21 0.00 2.13 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 2.34 2.55 0.00 58 I 7.40 4.03 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 1.29 0.76 0.90 0.00 0.00 59 T 8.61 3.95 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 1.21 0.00 0.00 60 G 8.81 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 C 8.12 4.57 0.00 3.02 3.13 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 0.00 0.00 0.00 62 R 8.17 4.66 0.00 2.02 2.09 0.00 3.21 0.00 0.00 3.31 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 63 P 0.00 3.81 0.00 1.30 0.49 0.00 3.49 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 1.99 1.83 0.00 64 K 7.86 3.88 0.00 1.15 0.74 0.00 1.58 0.00 0.00 1.76 0.00 0.00 3.26 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.18 1.32 7.81 65 W 7.21 4.53 0.00 3.46 3.10 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 66 K 8.13 4.03 0.00 1.80 1.74 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.53 7.81 67 T 8.48 4.20 4.23 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 1.19 0.00 0.00 68 Y 7.71 4.85 0.00 3.14 2.98 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 69 T 9.70 4.94 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 1.26 0.00 0.00 70 Y 8.53 5.34 0.00 3.13 2.98 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 71 Q 9.40 4.23 0.00 1.99 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.80 0.00 0.00 0.00 0.00 0.00 2.19 2.20 0.00 72 C 8.65 5.42 0.00 3.06 2.94 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 73 T 8.60 4.69 4.23 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 1.19 0.00 0.00 74 Q 9.72 3.42 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.46 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 75 G 8.21 3.95 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 0.00 0.00 0.00 76 T 7.91 4.52 4.35 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 1.21 0.00 0.00 77 L 8.51 5.18 0.00 1.65 1.57 0.91 1.12 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 78 T 8.98 4.74 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 1.22 0.00 0.00 79 C 8.74 5.05 0.00 2.80 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 80 K 8.82 4.32 0.00 1.70 1.77 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.44 7.81 81 G 8.66 3.86 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 0.00 0.00 0.00 82 R 7.76 4.35 0.00 1.95 2.06 0.00 3.07 0.00 0.00 3.26 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 83 N 7.82 4.60 0.00 2.75 2.90 0.00 0.00 7.05 8.00 0.00 0.00 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 N 8.48 4.72 0.00 3.00 2.99 0.00 0.00 6.10 7.80 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 85 A 8.51 3.96 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 86 C 8.20 4.13 0.00 3.00 3.26 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 87 A 9.00 4.02 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 88 A 8.43 3.88 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 89 T 7.87 3.73 4.35 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 1.17 0.00 0.00 90 T 7.93 3.85 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 91 C 8.04 2.93 0.00 2.40 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 92 D 7.80 4.14 0.00 2.98 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.06 4.16 0.00 3.24 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 94 D 8.07 3.85 0.00 2.59 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 95 R 8.19 3.79 0.00 1.78 1.95 0.00 3.21 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 1.57 1.63 0.00 96 L 8.05 3.93 0.00 1.62 1.62 0.86 0.86 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 97 A 7.73 3.67 0.98 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 98 A 7.83 3.47 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 99 I 7.42 3.64 1.94 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 1.37 0.68 0.89 0.00 0.00 100 C 8.11 4.43 0.00 3.15 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 0.00 101 F 8.50 4.33 0.00 2.97 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 0.00 102 A 7.92 4.24 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 0.00 103 G 7.79 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 0.00 0.00 0.00 104 A 7.24 4.75 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 0.00 105 P 0.00 4.38 0.00 2.10 2.04 0.00 3.68 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 106 Y 8.47 4.19 0.00 2.84 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 0.00 107 N 8.66 4.82 0.00 2.90 2.73 0.00 0.00 6.85 8.22 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 0.00 108 D 8.92 4.68 0.00 2.81 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 0.00 109 T 8.12 3.97 4.31 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 1.17 0.00 0.00 110 N 7.99 4.44 0.00 2.03 2.01 0.00 0.00 6.47 6.99 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 0.00 111 Y 7.41 4.35 0.00 2.91 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 0.00 112 N 8.00 4.04 0.00 1.91 2.46 0.00 0.00 7.15 7.54 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 0.00 113 I 6.88 3.99 1.76 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.61 0.75 0.00 0.00 114 D 8.16 4.48 0.00 2.72 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 8.23 3.88 0.00 1.67 1.64 0.86 0.50 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 0.00 116 K 8.11 3.94 0.00 1.72 1.81 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.49 7.81 117 A 8.01 4.37 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.11 4.47 0.00 1.80 1.91 0.00 3.07 0.00 0.00 3.19 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 119 C 8.03 5.00 0.00 3.02 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 0.00 120 Q 7.96 4.21 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.65 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 * Residues marked with a * may have inaccurate shift predictions.