NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 D 4.6716 8.2227 120.5388 53.9018 43.1623 176.7522 11 L 3.7437 8.0959 123.9664 57.8566 41.8444 177.0328 12 H 4.3037 9.0307 118.4472 58.6474 30.3597 176.3698 13 E 4.0499 8.0901 120.3480 59.1922 28.9334 178.7540 14 I 3.6765 7.8183 119.9448 64.4671 36.9560 178.5148 15 L 3.8685 7.4553 118.0685 57.9870 41.4611 178.9848 16 H 4.2891 7.6878 115.5471 58.8605 28.7110 177.4973 17 E 4.1008 8.0919 119.0313 58.5565 29.3764 178.2702 18 A 4.3459 7.4577 117.9730 51.8309 19.6286 177.5141 19 V 4.1193 7.0734 110.3071 59.2851 33.2399 173.6512 20 P 4.5338 0.0000 0.0000 61.4859 32.2525 172.6166 21 L 3.5189 9.6126 129.2748 54.6310 39.3113 173.7095 22 D 5.0023 8.0632 121.9234 51.8092 44.0783 177.6198 23 A 3.9636 8.5531 122.5599 55.6336 18.0121 179.7788 24 N 4.2294 8.0881 114.8475 56.9177 39.2159 176.8972 25 E 3.8800 8.1948 119.9497 59.5067 29.1983 179.2650 26 R 4.1393 8.0855 118.1380 59.2718 29.7298 177.9622 27 E 3.9566 7.7848 118.1652 59.3038 29.9550 178.6318 28 I 3.9158 7.2394 119.3698 64.4158 37.0690 178.2846 29 L 4.2697 8.2725 119.1189 57.0352 41.3880 178.4571 30 E 4.6359 7.6090 114.7330 56.0073 30.0004 176.0338 31 L 4.4235 8.2038 122.1371 57.4539 43.3156 178.5931 32 K 4.2598 7.8602 116.2568 58.0687 32.3016 177.0876 33 E 4.9148 8.1636 119.6847 56.2694 29.6757 176.7427 34 D 4.4909 8.0403 111.9859 52.2677 41.5518 175.1015 35 A 3.3428 7.9098 124.0420 53.2883 17.7972 180.9869 36 F 3.3102 8.4260 116.3621 59.9895 41.8470 177.5269 37 A 3.6806 8.6550 122.4596 55.2543 18.1561 179.3826 38 Q 3.7798 7.8154 117.0702 59.3472 29.2768 178.1352 39 R 3.7834 7.8156 119.1065 59.4343 30.0452 178.0214 40 R 3.5438 7.9656 118.6709 59.5043 29.8883 178.4623 41 R 3.9753 7.5548 118.1838 59.3217 30.1308 178.2927 42 E 3.9144 7.9984 118.2260 59.3873 29.4645 179.4377 43 I 3.6926 7.6416 119.7288 64.4931 37.1448 178.2150 44 E 3.9757 8.2422 119.4083 59.7881 29.2394 179.7356 45 T 3.8327 8.1593 115.8649 66.7633 68.5444 176.9006 46 R 3.9347 7.8328 119.5262 59.1190 29.9343 178.9774 47 L 3.9660 7.9665 120.4696 57.7940 42.0240 178.9505 48 R 3.8651 8.1823 116.1255 59.4800 29.2303 178.6260 49 A 3.9295 8.0590 121.7663 54.5610 18.2865 179.5074 50 A 3.9199 8.0158 119.2575 55.3697 18.4042 179.6527 51 N 4.3516 8.5585 115.4603 56.3161 38.4905 177.9347 52 G 3.5656 8.4526 107.6658 47.5596 0.0000 176.0535 53 K 3.9561 8.1348 120.8635 59.0813 31.9727 179.2317 54 L 3.8171 8.1162 119.3505 57.7735 41.5425 179.3569 55 A 3.9455 8.0425 120.3940 55.4979 18.2339 179.2821 56 D 4.2701 8.2547 117.1075 57.4708 40.8753 179.1777 57 A 3.9399 7.9542 121.0787 55.3271 18.2236 179.8345 58 I 3.9360 8.0301 118.4048 63.8392 37.1951 178.1039 59 A 4.1210 7.9527 120.9569 55.1331 18.2272 179.5215 60 K 4.3371 7.6336 116.0294 58.0611 32.7685 177.3412 61 N 4.5982 8.4517 119.7748 52.1512 40.7026 171.7088 62 P 4.7417 0.0000 0.0000 61.3081 29.7856 174.9783 63 A 4.5887 7.4934 127.5699 51.9236 22.3925 177.1849 64 W 4.2910 8.4807 131.2852 56.3050 29.1990 176.2678 65 S 4.5398 7.4668 118.7704 56.5424 65.4781 173.1981 66 P 4.2377 0.0000 0.0000 65.7281 30.8162 178.9002 67 E 3.8709 7.9679 116.9099 59.4145 29.4311 179.3296 68 V 3.2007 7.4364 118.1512 65.5344 31.3550 177.5537 69 E 3.9148 8.1012 119.2007 59.3007 29.5928 178.7881 70 A 3.9306 8.2265 120.7380 55.0208 18.3973 179.2546 71 A 3.8778 8.1015 119.6120 55.7180 18.3364 179.9099 72 T 3.7832 7.9426 114.1940 67.0773 68.5801 176.8427 73 Q 4.2550 8.2147 121.1224 58.3875 28.6469 178.9588 74 E 3.9757 8.0639 119.6922 59.2756 29.5043 179.4709 75 V 3.5959 8.0350 118.4874 66.0074 31.6744 177.8773 76 E 3.9862 8.4518 118.6008 59.4669 29.2822 179.4533 77 R 3.9869 8.0966 118.4473 59.3917 30.1876 178.4020 78 A 4.0389 8.2040 120.4249 55.0077 18.1619 179.4872 79 A 4.0581 8.1875 119.5942 55.2149 18.5687 180.1757 80 G 3.5600 8.1951 104.2789 48.0715 0.0000 175.6172 81 D 4.4313 8.5319 122.0190 57.0118 40.8073 178.7341 82 L 4.0059 8.1529 120.7925 58.1840 42.0843 179.0857 83 Q 4.0316 7.8581 117.9643 59.0035 28.6361 178.7599 84 R 3.8980 7.9598 119.1202 59.5052 30.1605 178.3777 85 A 4.1318 8.5076 120.9613 55.4605 18.3539 179.8339 86 T 3.8191 8.2940 114.3315 66.8085 68.4618 177.0447 87 L 4.0915 8.0420 120.9617 57.7705 41.6246 179.5086 88 V 3.6770 8.2367 118.6425 66.4315 31.1632 177.5203 89 H 4.1644 8.0362 116.7111 59.3742 29.7283 177.0889 90 V 3.8023 7.5332 120.1090 65.4340 31.3392 177.7385 91 F 4.3078 8.0577 116.7955 60.2308 38.9989 177.8334 92 E 3.9488 8.4150 115.5006 57.4917 29.4943 178.7503 *94 R 3.4519 8.0010 121.4792 56.0385 31.7773 177.4577 95 A 3.9704 7.8194 119.5630 54.3986 18.4239 178.1793 96 G 3.9730 7.8084 102.1669 45.2636 0.0000 173.4561 97 L 4.4679 7.2846 119.5189 53.0581 42.8838 177.1187 98 K 4.0673 8.5018 121.2305 55.8542 33.0796 176.3172 99 P 4.1927 0.0000 0.0000 66.2633 31.0439 178.7464 100 E 4.0162 8.1794 114.7862 59.2398 29.0979 178.0953 101 H 4.7982 8.2568 114.5061 56.3455 29.3030 177.4514 102 R 3.9677 7.8306 120.8419 58.7667 29.8915 176.9480 103 P 4.3729 0.0000 0.0000 65.4774 31.3878 178.5334 104 A 3.9871 7.9796 119.2953 55.0123 18.0395 178.6210 105 Y 3.9116 7.6960 117.1707 61.1449 38.8737 178.1648 106 D 4.4021 8.6715 119.9598 57.4751 40.8790 178.9529 107 R 3.8678 8.1485 119.1322 59.2974 30.0800 178.7508 108 V 3.4572 7.5673 117.8080 65.7380 31.5374 177.7282 109 L 3.7252 7.6686 120.0118 58.2042 41.9175 178.9616 110 I 3.6569 8.0329 120.0176 64.6123 36.9849 178.2796 111 D 4.3925 8.4091 119.7593 57.1006 40.6024 178.7392 112 A 3.9357 8.0314 121.4349 55.1535 18.1676 179.7548 113 L 3.9594 7.7731 116.4255 57.9318 41.9380 179.6206 114 R 4.0670 8.3618 118.5435 59.2268 29.9609 179.2428 115 R 4.1773 8.3301 118.2879 59.1838 29.9036 178.9070 116 G 3.8287 7.8857 103.4042 46.1680 0.0000 174.5498 117 S 4.6426 7.9223 115.1584 58.3627 63.7327 174.1113 118 Q 4.2350 7.8198 127.1023 56.2425 28.8273 175.1937 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 10 D 8.22 4.67 0.00 2.82 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 11 L 8.10 3.74 0.00 1.83 1.68 0.84 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 12 H 9.03 4.30 0.00 3.15 3.31 0.00 5.72 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.09 4.05 0.00 2.19 2.01 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 2.53 2.47 0.00 14 I 7.82 3.68 1.99 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 1.50 1.17 0.84 0.00 0.00 15 L 7.46 3.87 0.00 1.48 1.50 0.62 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 16 H 7.69 4.29 0.00 3.01 3.32 0.00 5.66 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.09 4.10 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 2.35 2.42 0.00 18 A 7.46 4.35 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 19 V 7.07 4.12 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 0.88 0.00 0.00 0.98 0.00 0.00 20 P 0.00 4.53 0.00 1.96 1.97 0.00 3.90 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 1.80 1.90 0.00 21 L 9.61 3.52 0.00 1.74 1.77 0.94 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 22 D 8.06 5.00 0.00 2.73 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 23 A 8.55 3.96 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 24 N 8.09 4.23 0.00 2.85 2.82 0.00 0.00 7.23 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 25 E 8.19 3.88 0.00 2.08 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 0.00 2.33 2.33 0.00 26 R 8.09 4.14 0.00 1.89 1.95 0.00 3.20 0.00 0.00 3.29 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 27 E 7.78 3.96 0.00 2.19 2.11 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 2.34 2.36 0.00 28 I 7.24 3.92 2.02 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 1.52 0.26 0.91 0.00 0.00 29 L 8.27 4.27 0.00 1.59 1.81 0.89 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 30 E 7.61 4.64 0.00 2.14 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 2.26 2.58 0.00 31 L 8.20 4.42 0.00 1.64 1.70 1.01 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 32 K 7.86 4.26 0.00 1.93 1.91 0.00 1.73 0.00 0.00 1.78 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.56 1.46 7.81 33 E 8.16 4.91 0.00 2.23 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 2.61 2.64 0.00 34 D 8.04 4.49 0.00 2.76 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 35 A 7.91 3.34 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 36 F 8.43 3.31 0.00 2.86 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 37 A 8.65 3.68 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 38 Q 7.82 3.78 0.00 2.27 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 39 R 7.82 3.78 0.00 1.91 1.97 0.00 3.25 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 40 R 7.97 3.54 0.00 1.01 1.69 0.00 3.09 0.00 0.00 2.88 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.44 0.00 41 R 7.55 3.98 0.00 1.79 1.98 0.00 3.11 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 42 E 8.00 3.91 0.00 2.17 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 2.29 2.46 0.00 43 I 7.64 3.69 1.93 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 0.82 0.91 0.00 0.00 44 E 8.24 3.98 0.00 2.23 1.98 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 2.31 2.34 0.00 45 T 8.16 3.83 4.40 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 1.19 0.00 0.00 46 R 7.83 3.93 0.00 2.09 1.97 0.00 3.11 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.79 0.00 47 L 7.97 3.97 0.00 1.76 1.80 0.92 0.79 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 48 R 8.18 3.87 0.00 2.05 2.29 0.00 2.91 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.64 0.00 49 A 8.06 3.93 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 50 A 8.02 3.92 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 51 N 8.56 4.35 0.00 2.91 2.86 0.00 0.00 6.91 8.44 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 52 G 8.45 3.57 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 0.00 0.00 0.00 53 K 8.13 3.96 0.00 1.94 1.81 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.59 7.81 54 L 8.12 3.82 0.00 1.84 1.65 0.87 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.04 3.95 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 56 D 8.25 4.27 0.00 2.98 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 57 A 7.95 3.94 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 58 I 8.03 3.94 1.91 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.96 0.90 0.00 0.00 59 A 7.95 4.12 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 60 K 7.63 4.34 0.00 1.84 1.86 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.58 7.81 61 N 8.45 4.60 0.00 2.69 2.62 0.00 0.00 7.00 7.72 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 62 P 0.00 4.74 0.00 2.24 2.08 0.00 3.86 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 1.99 1.96 0.00 63 A 7.49 4.59 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 64 W 8.48 4.29 0.00 3.45 3.06 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 65 S 7.47 4.54 0.00 4.20 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 66 P 0.00 4.24 0.00 2.16 2.15 0.00 3.58 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 2.12 2.20 0.00 67 E 7.97 3.87 0.00 1.96 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 0.00 2.36 2.38 0.00 68 V 7.44 3.20 1.64 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 -0.33 0.00 0.00 0.71 0.00 0.00 69 E 8.10 3.91 0.00 2.27 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 0.00 2.44 2.46 0.00 70 A 8.23 3.93 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 71 A 8.10 3.88 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 72 T 7.94 3.78 4.46 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 1.46 0.00 0.00 73 Q 8.21 4.26 0.00 2.30 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 74 E 8.06 3.98 0.00 2.24 1.98 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 2.32 2.44 0.00 75 V 8.04 3.60 2.26 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 1.05 0.00 0.00 0.99 0.00 0.00 76 E 8.45 3.99 0.00 2.24 2.01 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 2.38 2.58 0.00 77 R 8.10 3.99 0.00 2.04 2.06 0.00 3.10 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 78 A 8.20 4.04 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 79 A 8.19 4.06 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 80 G 8.20 3.56 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 0.00 0.00 0.00 81 D 8.53 4.43 0.00 2.82 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 82 L 8.15 4.01 0.00 1.87 1.85 0.97 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 7.86 4.03 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.64 2.54 0.00 84 R 7.96 3.90 0.00 1.95 1.96 0.00 3.12 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 85 A 8.51 4.13 1.53 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 0.00 0.00 0.00 86 T 8.29 3.82 4.54 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 1.24 0.00 0.00 87 L 8.04 4.09 0.00 1.94 1.90 1.03 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 88 V 8.24 3.68 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 1.10 0.00 0.00 0.98 0.00 0.00 89 H 8.04 4.16 0.00 2.98 3.01 0.00 6.01 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 V 7.53 3.80 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 0.94 0.00 0.00 0.92 0.00 0.00 91 F 8.06 4.31 0.00 3.18 3.06 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 92 E 8.42 3.95 0.00 2.18 2.01 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 2.39 2.63 0.00 *94 R 8.00 3.45 0.00 1.73 1.96 0.00 3.12 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.29 0.00 95 A 7.82 3.97 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 96 G 7.81 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 0.00 0.00 0.00 97 L 7.28 4.47 0.00 1.61 1.52 0.34 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.50 4.07 0.00 1.63 1.77 0.00 1.30 0.00 0.00 1.47 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.45 7.81 99 P 0.00 4.19 0.00 2.12 2.11 0.00 3.56 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 2.10 2.19 0.00 100 E 8.18 4.02 0.00 1.83 2.03 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 2.30 2.46 0.00 101 H 8.26 4.80 0.00 3.27 3.29 0.00 5.64 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 R 7.83 3.97 0.00 2.02 1.96 0.00 3.10 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.82 0.00 103 P 0.00 4.37 0.00 2.17 2.11 0.00 3.81 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 104 A 7.98 3.99 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 0.00 105 Y 7.70 3.91 0.00 3.06 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 0.00 106 D 8.67 4.40 0.00 2.86 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 0.00 107 R 8.15 3.87 0.00 1.85 2.03 0.00 3.08 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 108 V 7.57 3.46 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 0.80 0.00 0.00 0.92 0.00 0.00 109 L 7.67 3.73 0.00 1.32 1.58 0.77 0.74 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 0.00 110 I 8.03 3.66 1.86 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 1.48 0.48 0.89 0.00 0.00 111 D 8.41 4.39 0.00 2.76 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 0.00 112 A 8.03 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 0.00 113 L 7.77 3.96 0.00 1.74 1.73 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 114 R 8.36 4.07 0.00 1.99 1.96 0.00 3.24 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 115 R 8.33 4.18 0.00 2.00 1.97 0.00 3.11 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 116 G 7.89 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 0.00 0.00 0.00 117 S 7.92 4.64 0.00 4.02 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 0.00 118 Q 7.82 4.24 0.00 2.20 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.58 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 * Residues marked with a * may have inaccurate shift predictions.