NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3791 0.0000 0.0000 62.5892 32.6508 174.9191 2 N 5.1765 8.4916 116.9489 51.6987 40.9590 173.3734 3 F 4.8237 10.6818 124.7949 57.5806 40.6077 176.1137 4 S 4.5091 8.3924 117.6180 57.8791 63.2181 174.1011 5 G 3.7109 7.8637 113.0001 45.4346 0.0000 170.5017 6 N 5.0920 7.5483 116.5925 51.4429 40.4371 174.3253 7 W 5.2407 9.4605 124.8847 54.6994 32.1563 174.8905 8 K 4.9860 9.3997 126.2167 54.5645 34.2282 174.9252 9 I 3.7528 8.3806 127.5536 60.7255 38.0441 175.1569 10 I 4.5184 8.6811 121.3823 60.8788 39.6545 175.6117 11 R 4.7240 7.4917 120.1878 55.0080 34.8923 174.0756 12 S 4.8967 8.2315 115.0327 57.4948 65.6969 173.3188 13 E 4.5501 9.2539 126.5831 55.5052 33.4549 175.9035 14 N 4.5511 9.1379 120.4860 54.2993 35.9787 176.3633 15 W 4.2933 8.4115 129.5654 60.8829 30.6370 177.6509 16 E 3.7705 8.2528 118.0818 59.3495 28.8663 179.0809 17 E 3.9578 8.0918 118.2702 58.9729 29.6969 178.5775 18 L 3.9094 8.1924 120.9500 58.3962 41.8395 179.2454 19 L 3.7394 7.4461 117.2190 57.6478 41.5908 179.4534 20 K 4.0980 10.4367 117.2950 59.3068 32.0755 179.5942 21 V 3.7343 8.2181 119.1340 64.1167 31.5071 176.9814 22 L 4.4825 7.4441 118.5941 52.7732 44.4857 176.7548 23 G 3.8856 8.5908 110.5157 49.9096 0.0000 176.7046 24 V 3.8759 7.2409 117.3317 60.3724 31.3593 181.4969 *38 K 4.0837 8.4409 114.8818 55.1494 32.3820 172.3538 39 P 4.9520 0.0000 0.0000 62.1475 33.0924 177.6753 40 A 4.6716 9.0302 125.4955 51.4940 20.7843 176.3178 41 V 4.6940 8.6225 119.2615 61.0827 35.2435 173.7175 42 E 5.2708 9.3758 129.1577 54.5356 32.0759 174.4032 43 I 5.1760 9.1493 127.6330 59.3727 40.9730 174.2989 44 K 4.8630 9.3871 127.7183 54.6106 34.8774 174.2879 45 Q 4.5244 9.0886 128.9714 54.1158 31.6231 174.5725 46 E 4.4428 8.7277 125.8121 55.0404 32.5046 176.3201 47 G 3.7620 8.1621 115.7612 47.2921 0.0000 173.5896 48 D 4.9984 8.7720 125.0330 54.6536 41.2624 175.0771 49 T 4.8511 7.7175 117.9982 62.2748 70.3498 173.9057 50 F 5.0075 8.9696 124.4606 55.5511 43.0826 173.3339 51 Y 5.1903 9.0000 123.1005 55.8928 41.7775 174.2613 52 I 4.6989 8.2499 126.5773 59.3273 41.0895 174.0069 53 K 4.6911 8.7810 129.2407 54.7405 34.5446 174.7610 54 T 5.0978 8.6233 123.8230 61.9686 71.5868 173.3794 55 S 5.1221 9.2086 121.2201 57.5986 67.4372 174.0393 56 T 4.5738 8.4391 113.7521 60.1639 71.0958 174.8551 57 T 4.0548 8.5448 109.9980 64.3769 68.9098 175.1614 58 V 4.3784 7.1894 109.3245 60.7948 33.6740 175.5289 59 R 4.7963 7.9936 118.3807 54.6555 33.7954 174.0828 60 T 5.0420 8.0880 112.8747 61.1672 70.6676 172.7127 61 T 4.8170 8.6895 120.7124 60.7803 71.3915 172.1124 62 E 5.1888 8.7645 124.9553 54.4615 33.2879 175.1205 63 I 4.8396 8.5946 116.0137 59.2273 41.4814 173.8924 64 N 5.5801 8.7480 120.3987 51.6081 41.7924 173.5775 65 F 4.7819 8.5268 117.3623 55.4230 42.0853 172.8496 66 K 5.1045 8.5488 120.0895 54.1741 35.2577 175.5012 67 V 3.7357 8.7205 127.3751 64.7772 31.7387 176.3748 68 G 4.0075 9.1668 115.3875 45.2058 0.0000 172.7269 69 E 4.7336 7.7904 118.9499 53.9518 32.0353 175.8244 70 E 4.5663 8.7800 123.4966 56.8182 30.5653 175.8955 71 F 5.0810 8.6982 117.0734 55.8897 42.3075 172.4685 72 E 5.0979 8.8603 118.2230 55.0959 31.4911 175.9928 73 E 4.6582 8.8060 120.4969 56.0041 32.8910 173.8443 74 Q 5.0580 8.6360 116.9655 54.7494 32.4051 175.1124 75 T 4.3278 8.4872 117.1742 62.5603 69.6547 176.3861 76 V 3.6021 8.5864 122.5342 66.4229 31.1480 177.0291 77 D 4.3509 7.8830 115.8176 53.9198 39.4772 176.5050 78 G 4.0659 7.7593 106.9867 45.2290 0.0000 174.2488 79 R 4.2647 7.9049 119.6491 54.8281 31.7538 174.1947 80 P 4.8045 0.0000 0.0000 63.7360 32.3946 174.9683 81 C 5.1153 9.4553 117.9318 56.5452 33.8041 172.6375 82 K 4.6203 8.6036 121.9159 55.6133 33.5287 175.5836 83 S 4.9336 8.5608 122.6054 56.5037 67.0595 172.8598 84 L 4.8597 8.1193 123.7373 53.5380 45.4321 174.9189 85 V 4.3843 8.3431 125.7777 61.1693 33.7491 174.4457 86 K 4.8060 8.5030 125.8636 54.0637 36.5260 175.5210 87 W 4.9117 8.5570 122.5303 56.5657 29.7222 176.3991 88 E 4.2468 9.2500 125.4679 58.5145 29.5523 175.6688 89 S 4.6628 7.7250 110.9541 57.2894 65.5517 174.1438 90 E 3.6762 8.7892 118.7477 58.8464 29.3611 177.6597 91 N 5.0442 8.2381 114.0890 52.6447 39.6858 173.6590 92 K 5.5788 8.5223 120.9780 55.2105 36.0860 174.6639 93 M 5.1343 9.4911 124.8256 53.5954 34.3723 175.0568 94 V 4.6766 8.4946 113.2568 59.6414 36.3821 174.0759 95 C 4.5445 8.3965 126.5800 57.9374 34.2600 172.9817 96 E 4.6997 8.3110 124.1475 55.2001 31.3827 171.7132 97 Q 5.0062 8.2424 123.7384 53.9786 32.5952 175.9976 98 K 4.5912 8.5043 124.4315 53.1673 35.9223 176.2383 99 L 4.5518 8.6401 125.3923 54.1524 41.6890 177.8560 100 L 4.0366 8.9794 125.4443 57.5435 41.9623 178.3806 101 K 4.0567 7.4727 115.5780 53.9159 34.9648 179.3813 102 G 4.1416 8.3750 112.7120 43.0869 0.0000 172.4430 103 E 4.6828 7.7738 115.5468 54.0126 32.7113 172.0673 104 G 4.0042 7.6999 106.1793 45.0880 0.0000 171.2466 105 P 4.8731 0.0000 0.0000 61.8979 32.4244 176.3722 106 K 4.1584 9.9156 124.9930 57.0125 32.6159 175.6722 107 T 5.7430 8.5677 117.1649 59.4990 72.2413 172.8811 108 S 4.6002 8.3241 116.5559 57.8885 66.5784 172.6686 109 W 5.8598 8.2871 116.5591 55.6344 31.8753 173.6512 110 T 5.2753 9.3141 109.7470 60.2325 72.1946 172.9863 111 R 5.4260 9.1335 121.5596 54.6670 34.3082 174.1615 112 E 5.5937 9.4884 120.4202 54.9572 33.6455 173.8858 113 L 5.1764 8.4682 121.3129 53.2434 43.8678 176.8412 114 T 4.3525 8.7924 113.9156 60.4133 70.1741 175.3872 115 N 4.4856 8.6233 120.5910 56.8019 38.9943 175.4166 116 D 4.5099 8.0679 115.2573 54.6900 41.1401 176.5712 117 G 3.9812 8.5651 107.8526 46.0350 0.0000 173.3244 118 E 4.7221 8.4719 119.2794 55.3659 31.3830 175.2995 119 L 4.7482 8.8825 126.0017 53.5697 44.0138 174.9090 120 I 4.8908 8.8365 128.0513 59.5881 39.5283 174.2473 121 L 5.2589 9.1627 130.3380 53.6174 44.1375 175.1757 122 T 5.3351 8.9075 115.6438 60.2778 72.4162 172.7365 123 M 5.3946 9.1756 122.1606 54.1155 36.4266 174.3984 124 T 5.1977 9.1099 119.2523 61.7097 72.7786 173.0499 125 A 4.8299 8.8401 126.7644 51.0878 22.3740 177.6518 126 D 4.0248 9.4856 124.3378 56.1477 41.1728 175.7453 127 D 4.7648 9.0961 126.8690 53.8349 40.5190 176.2278 128 V 4.0897 7.6086 121.5731 61.8168 32.5441 174.3412 129 V 4.8739 8.2673 126.2570 61.2124 33.9871 173.8086 130 C 5.1269 9.4667 127.9479 57.9350 34.4358 172.3314 131 T 5.1503 8.8178 121.8339 61.8616 71.4055 173.2198 132 R 5.0698 9.2285 124.8676 54.2886 34.1378 174.6204 133 V 4.9593 8.5765 122.6499 61.3593 34.6351 173.8771 134 Y 5.2843 9.3049 124.2843 56.3905 42.1551 174.8458 135 V 5.2599 8.8351 114.2876 59.4757 36.1234 175.2625 136 R 4.1215 8.3767 121.4632 55.7809 30.8047 176.8116 137 E 4.1746 8.8670 120.5105 56.4576 29.6667 175.6210 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 P 0.00 4.38 0.00 2.12 2.10 0.00 3.84 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.15 0.00 2 N 8.49 5.18 0.00 2.79 2.77 0.00 0.00 6.96 6.14 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 3 F 10.68 4.82 0.00 3.40 3.30 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 4 S 8.39 4.51 0.00 3.95 3.89 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 0.00 0.00 0.00 5 G 7.86 3.71 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 0.00 0.00 0.00 6 N 7.55 5.09 0.00 2.54 2.72 0.00 0.00 6.64 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 7 W 9.46 5.24 0.00 3.24 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 8 K 9.40 4.99 0.00 1.84 1.71 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.37 7.81 9 I 8.38 3.75 1.38 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.08 0.75 0.00 0.00 10 I 8.68 4.52 1.84 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 1.27 0.86 0.91 0.00 0.00 11 R 7.49 4.72 0.00 1.64 1.75 0.00 3.30 0.00 0.00 3.24 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 12 S 8.23 4.90 0.00 3.67 3.60 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.25 4.55 0.00 1.87 1.80 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 2.22 2.42 0.00 14 N 9.14 4.55 0.00 3.07 3.11 0.00 0.00 6.78 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 15 W 8.41 4.29 0.00 3.33 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 16 E 8.25 3.77 0.00 2.07 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 2.39 2.49 0.00 17 E 8.09 3.96 0.00 2.00 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 2.39 2.46 0.00 18 L 8.19 3.91 0.00 1.84 1.72 0.97 0.51 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 19 L 7.45 3.74 0.00 1.46 1.61 -0.04 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 20 K 10.44 4.10 0.00 1.75 1.83 0.00 1.68 0.00 0.00 1.73 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.39 7.81 21 V 8.22 3.73 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 0.77 0.00 0.00 0.91 0.00 0.00 22 L 7.44 4.48 0.00 1.76 1.60 0.86 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.59 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.24 3.88 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 0.74 0.00 0.00 0.93 0.00 0.00 *38 K 8.44 4.08 0.00 1.79 1.72 0.00 1.77 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 39 P 0.00 4.95 0.00 2.02 2.01 0.00 3.34 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.79 0.00 40 A 9.03 4.67 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 41 V 8.62 4.69 1.75 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 0.58 0.00 0.00 0.47 0.00 0.00 42 E 9.38 5.27 0.00 2.09 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 2.36 2.47 0.00 43 I 9.15 5.18 2.41 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.68 1.20 0.00 0.00 44 K 9.39 4.86 0.00 1.93 1.71 0.00 1.50 0.00 0.00 1.53 0.00 0.00 2.74 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.36 7.81 45 Q 9.09 4.52 0.00 1.63 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.53 0.00 0.00 0.00 0.00 0.00 1.94 1.16 0.00 46 E 8.73 4.44 0.00 1.90 1.77 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 2.16 2.15 0.00 47 G 8.16 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 0.00 0.00 0.00 48 D 8.77 5.00 0.00 2.87 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 49 T 7.72 4.85 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 1.13 0.00 0.00 50 F 8.97 5.01 0.00 1.51 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 0.00 0.00 0.00 0.00 51 Y 9.00 5.19 0.00 2.93 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 52 I 8.25 4.70 1.72 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.58 0.69 0.00 0.00 53 K 8.78 4.69 0.00 1.44 1.54 0.00 1.64 0.00 0.00 1.81 0.00 0.00 3.15 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.31 1.51 7.81 54 T 8.62 5.10 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 1.13 0.00 0.00 55 S 9.21 5.12 0.00 3.71 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 56 T 8.44 4.57 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 1.20 0.00 0.00 57 T 8.54 4.05 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 1.22 0.00 0.00 58 V 7.19 4.38 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 0.75 0.00 0.00 0.95 0.00 0.00 59 R 7.99 4.80 0.00 1.86 1.78 0.00 3.14 0.00 0.00 3.14 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 60 T 8.09 5.04 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 61 T 8.69 4.82 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 1.20 0.00 0.00 62 E 8.76 5.19 0.00 1.91 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 2.25 2.32 0.00 63 I 8.59 4.84 2.04 0.00 0.00 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 1.36 0.95 0.99 0.00 0.00 64 N 8.75 5.58 0.00 2.63 2.74 0.00 0.00 6.75 7.45 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 65 F 8.53 4.78 0.00 2.23 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 66 K 8.55 5.10 0.00 1.86 1.86 0.00 1.77 0.00 0.00 2.00 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.53 7.81 67 V 8.72 3.74 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 0.55 0.00 0.00 0.70 0.00 0.00 68 G 9.17 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 69 E 7.79 4.73 0.00 2.18 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 2.28 2.30 0.00 70 E 8.78 4.57 0.00 1.87 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 2.25 2.30 0.00 71 F 8.70 5.08 0.00 3.21 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 72 E 8.86 5.10 0.00 1.91 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 2.19 2.29 0.00 73 E 8.81 4.66 0.00 2.09 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 0.00 2.07 2.32 0.00 74 Q 8.64 5.06 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 7.07 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 75 T 8.49 4.33 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 1.29 0.00 0.00 76 V 8.59 3.60 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 0.60 0.00 0.00 0.98 0.00 0.00 77 D 7.88 4.35 0.00 2.78 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 78 G 7.76 4.07 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 0.00 0.00 0.00 79 R 7.90 4.26 0.00 1.77 1.83 0.00 3.14 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.81 0.00 80 P 0.00 4.80 0.00 2.05 2.00 0.00 3.55 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 81 C 9.46 5.12 0.00 2.88 2.91 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 82 K 8.60 4.62 0.00 1.79 1.59 0.00 1.52 0.00 0.00 1.66 0.00 0.00 2.75 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.25 1.44 7.81 83 S 8.56 4.93 0.00 2.72 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 84 L 8.12 4.86 0.00 1.60 1.28 0.88 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.34 4.38 1.78 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 0.50 0.00 0.00 0.18 0.00 0.00 86 K 8.50 4.81 0.00 1.57 1.60 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.76 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.27 1.25 7.81 87 W 8.56 4.91 0.00 3.35 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 88 E 9.25 4.25 0.00 1.97 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 2.37 2.28 0.00 89 S 7.72 4.66 0.00 4.04 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 90 E 8.79 3.68 0.00 1.93 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 2.18 2.25 0.00 91 N 8.24 5.04 0.00 2.83 2.97 0.00 0.00 6.21 6.90 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 92 K 8.52 5.58 0.00 1.93 1.77 0.00 1.82 0.00 0.00 1.92 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.52 7.81 93 M 9.49 5.13 0.00 1.26 1.47 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 94 V 8.49 4.68 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 0.68 0.00 0.00 0.79 0.00 0.00 95 C 8.40 4.54 0.00 1.23 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 96 E 8.31 4.70 0.00 1.73 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 2.17 2.15 0.00 97 Q 8.24 5.01 0.00 2.01 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.57 0.00 0.00 0.00 0.00 0.00 2.15 2.11 0.00 98 K 8.50 4.59 0.00 1.40 1.60 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.26 1.27 7.81 99 L 8.64 4.55 0.00 1.49 1.61 0.90 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 100 L 8.98 4.04 0.00 1.72 1.71 0.89 1.07 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 0.00 101 K 7.47 4.06 0.00 1.71 1.53 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.19 0.92 7.81 102 G 8.37 4.14 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 0.00 0.00 0.00 103 E 7.77 4.68 0.00 1.96 1.70 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 2.12 1.83 0.00 104 G 7.70 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 0.00 105 P 0.00 4.87 0.00 2.14 2.19 0.00 3.36 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.77 0.00 106 K 9.92 4.16 0.00 1.82 1.71 0.00 1.41 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.39 7.81 107 T 8.57 5.74 4.30 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 1.29 0.00 0.00 108 S 8.32 4.60 0.00 3.86 3.87 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 0.00 109 W 8.29 5.86 0.00 3.47 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 0.00 110 T 9.31 5.28 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 1.22 0.00 0.00 111 R 9.13 5.43 0.00 1.80 1.91 0.00 2.64 0.00 0.00 2.95 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.51 0.00 112 E 9.49 5.59 0.00 2.25 2.15 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 2.27 2.35 0.00 113 L 8.47 5.18 0.00 1.26 1.44 0.37 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 114 T 8.79 4.35 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 1.29 0.00 0.00 115 N 8.62 4.49 0.00 2.69 2.90 0.00 0.00 7.05 8.47 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 0.00 116 D 8.07 4.51 0.00 2.89 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 0.00 117 G 8.57 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 0.00 0.00 0.00 118 E 8.47 4.72 0.00 1.99 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 2.38 2.36 0.00 119 L 8.88 4.75 0.00 0.27 0.82 0.81 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 120 I 8.84 4.89 1.92 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 1.15 0.56 0.96 0.00 0.00 121 L 9.16 5.26 0.00 1.69 1.74 0.81 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 122 T 8.91 5.34 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 1.27 0.00 0.00 123 M 9.18 5.39 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.60 0.00 124 T 9.11 5.20 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 1.24 0.00 0.00 125 A 8.84 4.83 1.17 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 0.00 0.00 0.00 126 D 9.49 4.02 0.00 2.77 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 0.00 0.00 0.00 127 D 9.10 4.76 0.00 2.77 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 0.00 128 V 7.61 4.09 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 0.99 0.00 0.00 0.92 0.00 0.00 129 V 8.27 4.87 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 0.89 0.00 0.00 0.95 0.00 0.00 130 C 9.47 5.13 0.00 3.25 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 0.00 131 T 8.82 5.15 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 1.24 0.00 0.00 132 R 9.23 5.07 0.00 1.79 1.72 0.00 3.09 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.59 0.00 133 V 8.58 4.96 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 0.85 0.00 0.00 0.93 0.00 0.00 134 Y 9.30 5.28 0.00 2.87 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 0.00 135 V 8.84 5.26 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 0.83 0.00 0.00 1.00 0.00 0.00 136 R 8.38 4.12 0.00 1.36 1.43 0.00 2.80 0.00 0.00 2.82 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 137 E 8.87 4.17 0.00 1.94 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 2.33 2.17 0.00 * Residues marked with a * may have inaccurate shift predictions.