NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 T 4.2276 8.1744 110.9424 61.4576 69.7905 172.5162 8 D 4.5169 8.2128 121.3719 50.4100 41.5034 174.6275 9 P 4.3732 0.0000 0.0000 65.6687 32.4648 177.2695 10 R 4.1352 8.2799 116.4064 57.4012 30.4624 176.8914 11 A 4.1894 7.4649 119.9120 51.2605 18.9456 177.1419 12 K 3.9589 8.5205 121.0232 56.3949 32.6941 176.3283 13 W 4.2578 8.8183 134.8690 57.1336 31.0649 175.6429 14 V 4.0654 7.6946 126.1531 60.0083 31.2755 173.1852 15 P 3.8831 0.0000 0.0000 62.2460 32.1197 175.8054 16 Q 4.6044 8.6749 117.1174 54.7072 32.0667 174.2631 17 D 5.5459 8.5563 116.0519 53.5808 41.2911 175.5671 18 N 4.9708 9.7016 112.5273 52.4706 39.9106 174.6650 19 D 4.2417 7.9353 119.3077 53.7804 41.9974 175.1498 20 I 3.0820 7.9043 119.8386 61.7921 37.7629 176.5441 21 Q 4.3349 8.5646 119.7250 55.8906 29.2678 175.2057 22 A 4.7683 7.5302 122.0588 50.6367 20.6568 177.8134 23 C 4.6676 8.8294 117.7538 59.1700 41.8887 174.3803 24 D 4.7352 8.1318 118.7407 52.9728 39.5452 175.2760 25 Y 4.7618 8.0863 122.7409 57.3331 39.2678 176.5786 26 W 4.6649 8.6454 125.2244 59.8827 28.0058 177.4589 27 R 3.3892 5.8400 115.0050 57.4511 29.8992 176.3632 28 H 5.1025 8.3620 115.8099 55.8021 28.8937 174.1860 29 C 2.4500 8.1614 116.7340 57.0572 42.1150 174.5348 30 S 4.6220 7.7492 114.6072 56.8242 62.2106 173.5659 31 I 3.4640 7.5268 118.2066 59.6731 39.6307 173.7635 32 D 4.8927 8.5259 126.4979 51.9749 43.9950 172.9981 33 G 4.2493 8.4242 111.1652 44.7074 0.0000 175.1459 34 N 5.4284 10.8159 123.0354 50.8925 41.8708 173.6427 35 I 4.2869 8.3098 122.9030 60.9719 37.1987 176.5596 36 C 3.8533 8.5074 125.3505 63.0660 27.9695 176.0185 37 D 4.8014 8.0987 116.8810 55.7675 40.7898 176.6260 38 C 4.6870 8.1732 115.3224 60.3372 28.4949 173.9857 39 S 4.6305 8.7001 113.8967 58.4988 63.3104 174.8367 40 G 4.0463 8.6498 108.2876 46.1108 0.0000 174.8048 41 G 4.1163 7.8619 109.9251 44.3131 0.0000 171.7908 42 S 5.2601 8.1322 113.9628 54.9628 66.5585 173.2404 43 L 4.0303 8.5890 121.0376 58.0495 41.5049 178.1201 44 T 4.7920 7.8081 104.1323 60.8313 69.6725 172.8634 45 N 5.0584 7.7929 119.0297 51.7156 42.1887 173.9902 46 C 4.5453 8.3581 118.5577 58.9248 29.3460 172.0331 47 P 4.5761 0.0000 0.0000 61.1367 31.8530 174.3196 48 P 4.2590 0.0000 0.0000 64.6053 31.5518 177.1715 49 G 3.9052 8.8350 110.5855 45.4365 0.0000 173.4606 50 T 4.0835 6.8369 109.2466 60.6786 70.7730 174.1434 51 K 4.5464 8.9429 121.4761 54.4042 35.0349 175.4496 52 L 4.5491 8.4555 127.0091 54.1557 42.9976 176.0705 53 A 4.7102 8.5987 128.9473 52.5765 19.2083 176.9120 54 T 4.3486 8.6875 109.4331 63.5430 70.7009 175.6135 55 A 4.6998 8.0484 123.5548 50.9432 20.5482 178.1544 56 S 3.8917 7.0079 117.2375 58.7473 65.7451 178.7721 *58 V 4.7584 8.6811 114.1236 61.7122 32.6666 172.9933 59 A 4.5468 8.0454 118.6461 51.7340 22.2031 175.7319 60 S 5.0470 8.9377 115.9907 57.6838 63.0963 173.8309 61 C 5.1901 9.3868 126.1598 55.5041 40.1389 172.6479 62 Y 4.8448 8.9974 124.7298 57.2753 40.2027 173.4708 63 N 3.7696 8.5189 126.4995 50.6591 39.1337 173.5532 64 P 3.9206 0.0000 0.0000 65.6075 31.6703 178.3278 65 T 3.8416 7.9961 116.2461 66.2612 68.2582 175.0530 66 D 4.6156 7.5645 116.3406 52.2048 39.8375 176.5658 67 G 3.8070 7.8090 106.8917 46.3022 0.0000 173.7219 68 Q 4.5172 8.1874 119.1931 54.4830 31.6040 174.5516 69 S 5.3085 8.1557 115.8651 57.1450 65.9644 173.0381 70 Y 5.1379 9.3797 121.6034 56.0189 41.8885 174.4047 71 L 4.8937 9.3452 125.0839 54.4681 43.6894 175.2648 72 I 4.5538 8.8438 127.8771 59.7670 39.2626 174.8642 73 A 4.4754 8.0596 129.5357 50.3925 19.0582 176.6334 74 Y 4.7497 7.9289 119.9215 58.2500 35.7349 175.3673 75 R 4.3953 8.0336 121.5124 55.8478 32.3502 175.3600 76 D 5.3566 8.6434 122.1465 53.4972 43.5881 175.0924 77 C 4.9776 9.0088 119.5885 58.7018 30.2436 172.9220 78 C 5.5585 8.9248 121.2889 57.0569 32.2940 175.0155 79 G 4.1305 9.1938 106.4777 45.8468 0.0000 172.8962 80 Y 4.8707 7.3131 114.8845 55.6204 41.9174 174.6730 81 N 4.5189 8.5268 120.3645 52.8607 39.8075 174.8359 82 V 3.7119 8.4427 122.1468 63.3616 31.9259 176.1075 83 S 4.1233 8.3547 122.3580 60.0668 62.7032 175.9788 84 G 3.9560 8.2966 106.2179 45.1453 0.0000 172.8228 85 R 4.5202 7.8655 118.4982 55.6252 32.8164 175.9104 86 C 4.0930 8.5047 118.0432 60.2988 25.2367 170.3961 87 P 5.2693 0.0000 0.0000 62.7945 32.9321 177.8480 88 C 5.0037 9.4495 118.3757 55.8621 45.4138 173.4374 89 L 4.8343 8.4234 123.6989 54.3100 43.4467 174.4344 90 N 5.1475 9.1363 124.1985 51.0298 42.7901 174.8472 91 T 4.4523 7.6713 109.3601 60.9537 69.6021 173.4553 92 E 3.9174 8.1126 123.1522 58.9685 29.3313 177.5749 93 G 3.7300 8.7858 111.7090 45.4737 0.0000 171.9926 94 E 4.3133 8.0893 121.6330 56.0509 29.8015 176.3169 95 L 4.7252 8.1409 126.7882 52.1891 44.4049 174.5106 96 P 4.4942 0.0000 0.0000 62.3946 32.0867 177.9665 97 V 3.6128 8.5471 120.5489 64.8255 31.1251 176.7203 98 Y 4.4796 7.8375 116.1363 57.8270 38.7589 175.4864 99 R 4.7227 7.7724 119.4664 54.3179 31.0653 174.3173 100 P 4.3690 0.0000 0.0000 66.0497 31.6127 178.6299 101 E 3.7993 8.1563 115.3347 58.1918 29.1423 177.4224 102 F 4.9479 8.4639 116.0645 56.7666 40.4907 173.6230 103 A 5.0197 8.6030 125.5586 51.2483 19.4714 177.5511 104 N 5.0912 9.2653 120.4458 52.8484 37.5338 175.3897 105 D 4.7153 7.9622 118.0236 55.2848 41.8438 177.0097 106 I 3.5845 7.1699 120.0314 60.7288 37.5754 176.3006 107 I 3.8631 7.5127 125.2644 60.2556 35.9847 176.3409 108 W 4.8106 8.4818 128.7578 55.9731 27.2617 176.9942 109 C 4.7936 7.2185 115.0166 58.8499 29.8266 174.3564 110 F 4.4474 7.5386 119.9774 59.2498 38.8891 176.3341 111 G 4.4731 9.4101 112.2551 46.4185 0.0000 173.6717 112 A 4.9309 7.6226 122.3671 51.2777 19.1381 177.1189 113 E 3.9892 8.5481 119.7046 57.7392 30.1125 177.2894 114 D 4.5337 9.1855 119.3345 54.9045 38.3909 173.5694 115 D 4.4052 7.9463 114.6377 54.8611 38.9999 173.7999 116 A 4.0427 7.6272 121.4505 53.3828 18.5072 178.3326 117 M 4.6631 8.5531 120.0698 54.7504 34.2111 175.2866 118 T 4.4915 7.5960 110.3065 60.7299 71.0680 173.2011 119 Y 4.5268 8.5812 125.8793 57.9954 39.5010 172.9200 120 H 4.6725 7.7734 124.5948 56.9094 32.5786 172.9019 121 C 4.5975 6.5761 109.8204 57.8657 32.6802 171.8847 122 T 5.3087 9.0768 115.7382 61.8238 71.4905 173.9675 123 I 4.3987 8.4822 118.5759 59.2911 40.4447 175.0403 124 S 4.9461 8.2282 117.0670 56.5372 61.8579 172.4947 125 P 4.4896 0.0000 0.0000 62.4081 33.5635 176.9458 126 I 4.5786 8.1105 122.5628 60.7543 38.0049 175.9699 127 V 4.3218 9.9806 118.9984 60.2285 32.9334 175.7570 128 G 4.2260 7.6290 110.6235 44.7914 0.0000 171.5827 129 K 4.5783 7.9635 118.7442 55.8477 33.2814 176.9763 130 A 5.0050 8.4977 124.9038 50.7190 22.1915 176.6196 131 S 4.3981 8.6160 110.6030 58.9766 62.8373 174.7641 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 7 T 8.17 4.23 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 8 D 8.21 4.52 0.00 2.83 2.61 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 0.00 0.00 0.00 9 P 0.00 4.37 0.00 2.24 2.20 0.00 3.83 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 10 R 8.28 4.14 0.00 1.98 2.04 0.00 3.18 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 11 A 7.46 4.19 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 12 K 8.52 3.96 0.00 1.77 1.79 0.00 1.80 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.53 1.52 7.81 13 W 8.82 4.26 0.00 3.34 3.21 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 0.00 14 V 7.69 4.07 1.92 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 0.83 0.00 0.00 0.94 0.00 0.00 15 P 0.00 3.88 0.00 2.25 1.85 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.24 0.00 16 Q 8.67 4.60 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 7.00 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 17 D 8.56 5.55 0.00 2.57 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 18 N 9.70 4.97 0.00 2.77 2.87 0.00 0.00 6.53 8.18 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 19 D 7.94 4.24 0.00 2.66 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 20 I 7.90 3.08 1.35 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 1.20 0.55 0.11 0.00 0.00 21 Q 8.56 4.33 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.24 0.00 22 A 7.53 4.77 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 23 C 8.83 4.67 0.00 3.14 3.34 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 24 D 8.13 4.74 0.00 2.64 2.78 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 25 Y 8.09 4.76 0.00 3.30 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 26 W 8.65 4.66 0.00 3.71 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 27 R 5.84 3.39 0.00 1.38 1.28 0.00 2.21 0.00 0.00 2.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.03 0.00 28 H 8.36 5.10 0.00 3.62 3.40 0.00 5.64 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 29 C 8.16 2.45 0.00 2.03 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 30 S 7.75 4.62 0.00 3.78 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 31 I 7.53 3.46 1.84 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 1.07 1.48 0.91 0.00 0.00 32 D 8.53 4.89 0.00 2.66 2.36 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 33 G 8.42 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 0.00 0.00 0.00 0.00 34 N 10.82 5.43 0.00 2.63 2.86 0.00 0.00 7.41 7.39 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 35 I 8.31 4.29 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 1.15 0.77 0.98 0.00 0.00 36 C 8.51 3.85 0.00 2.93 2.99 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 37 D 8.10 4.80 0.00 2.72 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 38 C 8.17 4.69 0.00 3.06 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 39 S 8.70 4.63 0.00 3.95 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 40 G 8.65 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 0.00 0.00 0.00 41 G 7.86 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 0.00 0.00 0.00 0.00 42 S 8.13 5.26 0.00 3.89 3.80 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 43 L 8.59 4.03 0.00 1.64 1.71 0.94 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 44 T 7.81 4.79 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 1.17 0.00 0.00 45 N 7.79 5.06 0.00 2.72 2.66 0.00 0.00 7.04 8.05 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 46 C 8.36 4.55 0.00 2.90 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 47 P 0.00 4.58 0.00 2.04 2.04 0.00 3.50 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 48 P 0.00 4.26 0.00 2.01 1.99 0.00 3.67 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 49 G 8.84 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 0.00 0.00 0.00 50 T 6.84 4.08 4.04 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 0.36 0.00 0.00 51 K 8.94 4.55 0.00 1.61 1.98 0.00 1.64 0.00 0.00 1.51 0.00 0.00 2.76 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.45 1.66 7.81 52 L 8.46 4.55 0.00 1.73 1.53 0.92 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.60 4.71 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 54 T 8.69 4.35 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 1.30 0.00 0.00 55 A 8.05 4.70 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 56 S 7.01 3.89 0.00 3.99 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 *58 V 8.68 4.76 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 0.46 0.00 0.00 0.99 0.00 0.00 59 A 8.05 4.55 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 60 S 8.94 5.05 0.00 3.95 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 61 C 9.39 5.19 0.00 3.26 3.54 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 62 Y 9.00 4.84 0.00 3.16 3.01 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 63 N 8.52 3.77 0.00 1.44 2.29 0.00 0.00 6.61 7.65 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 64 P 0.00 3.92 0.00 2.12 2.16 0.00 3.17 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.03 0.00 65 T 8.00 3.84 4.13 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 1.12 0.00 0.00 66 D 7.56 4.62 0.00 2.68 2.66 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 67 G 7.81 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 68 Q 8.19 4.52 0.00 1.87 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.57 6.70 0.00 0.00 0.00 0.00 0.00 2.51 2.38 0.00 69 S 8.16 5.31 0.00 3.75 3.83 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 70 Y 9.38 5.14 0.00 3.21 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 71 L 9.35 4.89 0.00 1.79 1.58 1.06 0.76 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 72 I 8.84 4.55 1.36 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.85 0.02 0.00 0.00 73 A 8.06 4.48 1.12 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 0.00 0.00 74 Y 7.93 4.75 0.00 2.96 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 75 R 8.03 4.40 0.00 1.80 1.88 0.00 3.33 0.00 0.00 3.50 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.76 0.00 76 D 8.64 5.36 0.00 2.96 2.75 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 77 C 9.01 4.98 0.00 2.73 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 78 C 8.92 5.56 0.00 2.77 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 79 G 9.19 4.13 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 0.00 0.00 0.00 80 Y 7.31 4.87 0.00 2.57 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 81 N 8.53 4.52 0.00 2.63 2.69 0.00 0.00 6.92 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 82 V 8.44 3.71 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 1.08 0.00 0.00 1.01 0.00 0.00 83 S 8.35 4.12 0.00 3.96 3.76 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 84 G 8.30 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 0.00 0.00 0.00 85 R 7.87 4.52 0.00 1.78 1.84 0.00 3.49 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 86 C 8.50 4.09 0.00 3.11 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 87 P 0.00 5.27 0.00 2.09 2.06 0.00 3.77 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 1.99 2.01 0.00 88 C 9.45 5.00 0.00 2.79 2.99 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 89 L 8.42 4.83 0.00 1.53 1.51 0.86 0.86 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 90 N 9.14 5.15 0.00 2.38 2.12 0.00 0.00 6.23 7.79 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 91 T 7.67 4.45 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 1.17 0.00 0.00 92 E 8.11 3.92 0.00 1.84 1.90 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 1.91 2.07 0.00 93 G 8.79 3.73 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 0.00 0.00 0.00 94 E 8.09 4.31 0.00 1.93 1.86 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 2.56 2.58 0.00 95 L 8.14 4.73 0.00 1.56 1.44 0.84 1.45 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 96 P 0.00 4.49 0.00 1.51 2.04 0.00 3.30 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.08 0.00 97 V 8.55 3.61 2.10 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 0.83 0.00 0.00 0.94 0.00 0.00 98 Y 7.84 4.48 0.00 3.10 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 99 R 7.77 4.72 0.00 1.75 1.92 0.00 3.40 0.00 0.00 3.33 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.53 0.00 100 P 0.00 4.37 0.00 2.45 2.50 0.00 3.83 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.07 0.00 101 E 8.16 3.80 0.00 1.46 1.85 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 1.47 1.47 0.00 102 F 8.46 4.95 0.00 3.07 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 0.00 103 A 8.60 5.02 1.44 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 0.00 0.00 104 N 9.27 5.09 0.00 2.76 2.88 0.00 0.00 6.98 8.71 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 0.00 105 D 7.96 4.72 0.00 2.61 2.66 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 0.00 106 I 7.17 3.58 0.89 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.29 -0.28 0.00 0.00 107 I 7.51 3.86 1.61 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.64 0.89 0.00 0.00 108 W 8.48 4.81 0.00 3.63 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 0.00 109 C 7.22 4.79 0.00 2.69 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 0.00 110 F 7.54 4.45 0.00 3.31 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 0.00 111 G 9.41 4.47 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 0.00 112 A 7.62 4.93 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 0.00 113 E 8.55 3.99 0.00 2.08 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 2.40 2.40 0.00 114 D 9.19 4.53 0.00 2.84 2.77 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 0.00 115 D 7.95 4.41 0.00 2.87 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 0.00 116 A 7.63 4.04 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 0.00 117 M 8.55 4.66 0.00 1.88 2.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.58 0.00 118 T 7.60 4.49 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 1.23 0.00 0.00 119 Y 8.58 4.53 0.00 2.96 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 0.00 120 H 7.77 4.67 0.00 3.28 3.25 0.00 5.87 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 C 6.58 4.60 0.00 3.13 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 0.00 122 T 9.08 5.31 4.42 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 1.57 0.00 0.00 123 I 8.48 4.40 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 1.50 0.90 0.92 0.00 0.00 124 S 8.23 4.95 0.00 3.74 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 0.00 125 P 0.00 4.49 0.00 2.05 2.11 0.00 3.74 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 2.03 1.93 0.00 126 I 8.11 4.58 1.85 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 1.26 0.40 1.08 0.00 0.00 127 V 9.98 4.32 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 0.61 0.00 0.00 1.00 0.00 0.00 128 G 7.63 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 0.00 0.00 0.00 0.00 129 K 7.96 4.58 0.00 1.59 1.62 0.00 1.61 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.84 1.25 7.81 130 A 8.50 5.01 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 0.00 131 S 8.62 4.40 0.00 3.76 3.77 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 0.00 * Residues marked with a * may have inaccurate shift predictions.