NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Y 4.6805 8.1444 118.3546 57.3054 39.5178 174.0996 2 E 3.8303 8.3775 122.3844 55.6213 30.8123 173.8280 3 R 4.9397 9.2207 126.9954 54.6995 33.1543 173.5582 4 L 5.0029 9.1104 127.4385 53.0076 44.2684 175.8735 5 S 5.2851 8.7552 116.7091 56.4810 66.4668 173.0063 6 L 4.5227 8.6753 123.5892 53.2649 44.9550 175.3626 7 R 4.4701 8.6588 125.8363 56.1431 31.1884 175.8470 8 T 4.4039 9.2209 120.0742 60.7396 69.0443 173.3141 9 V 4.6694 9.1144 122.1404 59.7578 36.9020 176.0615 10 Q 4.2286 8.7570 117.4371 57.2348 28.2110 177.0033 11 Q 4.5582 7.6519 115.7300 55.6588 30.7460 176.1274 12 T 4.0937 7.6715 115.6339 64.2369 69.1133 174.3520 13 T 4.6702 9.6436 117.3993 60.0272 72.1824 176.2675 14 G 3.7258 8.5688 108.1469 48.0455 0.0000 175.6602 15 A 4.1060 8.0641 122.7684 55.0273 18.4648 179.3119 16 E 3.9656 8.3630 117.0109 59.7655 29.4790 179.0636 17 Y 4.2123 8.1987 119.4620 60.6383 38.9198 177.6284 18 F 3.8261 8.8414 122.0224 61.3773 39.4579 176.7036 19 S 4.1717 9.0589 113.2329 61.5462 62.1073 175.9026 20 F 4.1623 8.2483 122.9249 61.5851 39.0877 177.1957 21 I 3.1604 7.5765 119.4190 64.2930 36.6727 178.5384 22 T 3.5506 7.7791 116.9947 66.5628 68.1776 176.6284 23 L 3.9317 7.8918 120.9209 57.5341 41.6056 179.3049 24 L 3.8125 7.4105 120.2873 58.0959 41.7468 179.2783 25 R 3.8208 7.7187 116.8618 59.3077 30.2957 178.2369 26 D 4.4627 8.2349 118.9525 57.5819 40.6675 178.7632 27 F 3.8979 8.2794 119.8489 61.4408 39.5750 177.0962 28 V 3.8432 7.7352 108.5452 61.2912 31.6750 176.6031 29 S 4.1312 7.2137 117.0351 58.1060 62.9730 174.7905 30 S 4.0327 8.3563 121.0861 59.6898 63.0968 174.9702 31 G 4.0539 8.1198 108.1317 45.4980 0.0000 173.9376 32 S 4.7857 8.1342 115.8238 57.7550 64.1203 172.8654 33 F 5.1778 8.3843 119.2289 56.1803 43.0690 174.3007 34 S 4.5369 8.7170 115.7014 57.9486 64.6282 173.6769 35 N 4.3196 10.0190 125.1626 54.5915 36.0522 175.0119 36 Q 3.9347 8.6104 113.0513 56.0353 26.5460 173.2549 37 I 4.5606 7.9428 120.3789 58.5256 39.0393 173.3130 38 P 3.9120 0.0000 0.0000 63.0651 31.9532 175.5153 39 L 4.7423 7.9333 121.9921 52.8235 44.9247 176.3091 40 L 4.6581 8.2492 121.5857 53.7901 42.8745 177.0501 41 R 3.9947 8.3069 119.3544 56.2167 30.7570 177.0771 42 Q 4.1236 8.3024 119.1210 56.0155 29.2638 177.8256 43 S 4.5093 8.5415 113.9110 59.2630 62.3872 174.8672 44 T 4.3019 7.8015 110.2616 62.2086 69.2051 175.0901 45 I 3.7978 7.4182 124.3668 60.6422 37.8739 173.9724 46 P 4.4791 0.0000 0.0000 62.2636 32.0552 177.7850 47 V 3.7455 8.4470 114.4029 64.5007 31.6169 177.8262 48 S 4.3323 8.0034 112.8354 59.9762 63.1121 174.1836 49 E 3.9120 8.4272 123.4351 56.7590 29.5639 177.5741 50 G 3.8214 8.6545 112.8337 47.0021 0.0000 173.6632 51 Q 4.9137 8.9049 118.2306 55.6440 30.3733 176.6189 52 R 3.9014 8.1039 120.4294 58.2611 30.3178 175.9146 53 F 5.4576 7.8381 114.3600 55.6496 43.0739 174.1833 54 V 4.3233 8.7264 120.9512 61.0912 34.5816 174.0953 55 L 4.9869 8.7477 127.5826 53.1888 43.9618 175.4129 56 V 4.8630 8.8976 124.5152 61.1642 33.9328 173.6608 57 E 5.1301 9.4533 129.9801 54.4843 31.9158 174.2636 58 L 5.1827 8.6638 127.0164 53.2784 44.7347 175.6440 59 T 5.2148 8.3662 119.1923 61.9482 72.2914 173.8603 60 N 5.6568 9.2079 124.1104 50.6833 39.6365 175.8329 61 A 3.9135 8.7280 121.1457 55.3824 18.3409 178.9477 62 G 3.6362 7.9327 102.1479 46.5909 0.0000 174.4346 63 G 3.9394 8.2528 108.7322 45.1535 0.0000 173.7412 64 D 4.5879 7.6838 119.9083 54.2192 41.5952 175.5357 65 S 5.6541 8.5297 117.2172 56.0857 67.1960 173.2907 66 I 4.9979 8.0008 115.5016 59.7672 41.5392 173.7560 67 T 5.1939 9.0181 119.3267 61.9276 72.0111 172.8221 68 A 5.0792 9.3022 128.5788 50.5182 21.6544 175.4105 69 A 4.8404 9.3698 124.6671 50.4575 21.1864 175.9444 70 I 4.9288 8.5771 124.4268 59.3266 39.9933 174.6735 71 D 4.9960 9.2982 128.2928 54.1880 41.3394 177.2012 72 V 3.8828 8.3794 127.4846 64.4532 31.3253 177.4489 73 T 4.1624 8.4764 110.7530 62.7888 69.1081 175.3109 74 N 4.5731 7.6299 115.6876 52.3119 40.2084 175.1177 75 L 3.8547 8.3132 118.1732 55.8911 39.9293 174.0682 76 Y 4.6946 7.2157 116.9826 57.9870 39.3120 174.7962 77 V 4.4275 8.3907 122.3759 62.5519 32.0536 175.9003 78 V 4.3729 8.8862 120.8028 62.0349 33.8179 175.2387 79 A 4.7423 7.3202 120.2429 51.5992 22.1333 174.4129 80 Y 5.0615 8.0021 116.2967 55.6295 42.1015 174.0143 81 R 4.9894 9.4525 121.3632 54.5859 33.2840 174.5667 82 A 4.7230 8.7973 127.3807 50.0676 22.1577 175.7858 83 G 3.7104 9.0659 113.1578 47.6596 0.0000 173.5066 84 D 4.8705 8.8457 122.9121 52.7266 39.6788 175.7625 85 Q 4.6489 8.0187 118.3451 54.6968 31.7836 174.8138 86 S 4.7478 7.6368 112.9637 56.8427 66.2597 172.8528 87 Y 4.7101 8.3667 119.9827 56.2073 41.3353 174.3026 88 F 5.1453 8.9534 121.8368 55.4428 41.5499 175.5309 89 L 4.3553 8.8251 123.4158 54.0493 42.8095 176.8576 90 K 4.0383 8.6557 122.7772 58.1149 32.6162 175.8852 91 D 4.4489 8.7676 121.7877 55.4251 37.9094 174.2121 92 A 4.4731 7.4971 120.1720 50.6907 19.3287 176.5653 93 P 4.2365 0.0000 0.0000 62.7325 31.9677 177.0146 *7777 A 4.1607 8.4786 124.2260 52.5684 18.7903 176.2916 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 Y 8.14 4.68 0.00 2.98 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 2 E 8.38 3.83 0.00 1.16 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 2.25 1.58 0.00 3 R 9.22 4.94 0.00 1.82 1.77 0.00 3.28 0.00 0.00 3.24 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 4 L 9.11 5.00 0.00 1.69 1.71 0.81 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.76 5.29 0.00 3.81 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 6 L 8.68 4.52 0.00 0.41 0.68 0.81 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 7 R 8.66 4.47 0.00 1.71 1.83 0.00 3.21 0.00 0.00 3.14 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 8 T 9.22 4.40 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 1.19 0.00 0.00 9 V 9.11 4.67 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 0.73 0.00 0.00 1.02 0.00 0.00 10 Q 8.76 4.23 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 11 Q 7.65 4.56 0.00 1.97 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.72 6.88 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 12 T 7.67 4.09 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 1.24 0.00 0.00 13 T 9.64 4.67 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 1.28 0.00 0.00 14 G 8.57 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 15 A 8.06 4.11 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 16 E 8.36 3.97 0.00 2.26 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 0.00 2.39 2.38 0.00 17 Y 8.20 4.21 0.00 3.13 3.27 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 0.00 18 F 8.84 3.83 0.00 3.25 3.27 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 0.00 19 S 9.06 4.17 0.00 4.14 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 0.00 20 F 8.25 4.16 0.00 3.12 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 21 I 7.58 3.16 1.34 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 -0.04 0.64 0.00 0.00 22 T 7.78 3.55 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 1.13 0.00 0.00 23 L 7.89 3.93 0.00 1.71 1.67 0.96 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 24 L 7.41 3.81 0.00 1.24 1.49 0.84 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 25 R 7.72 3.82 0.00 1.85 1.87 0.00 3.06 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 1.56 1.63 0.00 26 D 8.23 4.46 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 27 F 8.28 3.90 0.00 3.01 3.08 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 0.00 0.00 0.00 0.00 28 V 7.74 3.84 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 0.99 0.00 0.00 0.99 0.00 0.00 29 S 7.21 4.13 0.00 3.96 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 S 8.36 4.03 0.00 3.89 3.90 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 31 G 8.12 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 32 S 8.13 4.79 0.00 3.82 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 33 F 8.38 5.18 0.00 2.86 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 34 S 8.72 4.54 0.00 3.82 3.67 0.00 0.00 0.00 0.00 0.00 0.00 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 N 10.02 4.32 0.00 2.86 2.86 0.00 0.00 7.27 7.69 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 36 Q 8.61 3.93 0.00 2.27 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.51 6.70 0.00 0.00 0.00 0.00 0.00 2.16 2.35 0.00 37 I 7.94 4.56 2.01 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 1.35 1.04 0.91 0.00 0.00 38 P 0.00 3.91 0.00 1.72 1.58 0.00 3.59 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 1.95 1.89 0.00 39 L 7.93 4.74 0.00 1.46 1.43 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.25 4.66 0.00 1.44 1.63 0.90 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.31 3.99 0.00 1.70 1.79 0.00 3.05 0.00 0.00 3.12 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 42 Q 8.30 4.12 0.00 2.07 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.17 0.00 0.00 0.00 0.00 0.00 2.41 2.30 0.00 43 S 8.54 4.51 0.00 3.92 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 44 T 7.80 4.30 4.22 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 1.19 0.00 0.00 45 I 7.42 3.80 1.78 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 1.42 0.65 0.84 0.00 0.00 46 P 0.00 4.48 0.00 2.22 2.16 0.00 3.68 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.97 0.00 47 V 8.45 3.75 2.23 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 0.83 0.00 0.00 1.05 0.00 0.00 48 S 8.00 4.33 0.00 4.01 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 0.00 49 E 8.43 3.91 0.00 2.20 1.88 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 2.31 2.41 0.00 50 G 8.65 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 51 Q 8.90 4.91 0.00 2.30 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.95 0.00 0.00 0.00 0.00 0.00 2.52 2.35 0.00 52 R 8.10 3.90 0.00 1.82 1.60 0.00 2.84 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.62 0.00 53 F 7.84 5.46 0.00 2.00 2.47 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 54 V 8.73 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 0.74 0.00 0.00 1.11 0.00 0.00 55 L 8.75 4.99 0.00 1.86 1.56 0.76 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 56 V 8.90 4.86 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 1.21 0.00 0.00 1.00 0.00 0.00 57 E 9.45 5.13 0.00 2.04 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 2.20 2.40 0.00 58 L 8.66 5.18 0.00 1.59 1.46 0.88 0.09 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 59 T 8.37 5.21 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 1.26 0.00 0.00 60 N 9.21 5.66 0.00 2.76 2.94 0.00 0.00 6.72 8.24 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 61 A 8.73 3.91 1.29 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 0.00 0.00 0.00 62 G 7.93 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 0.00 0.00 0.00 63 G 8.25 3.94 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 0.00 0.00 0.00 64 D 7.68 4.59 0.00 2.97 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 8.53 5.65 0.00 3.80 3.70 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 66 I 8.00 5.00 1.98 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 1.32 0.84 0.96 0.00 0.00 67 T 9.02 5.19 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 1.27 0.00 0.00 68 A 9.30 5.08 1.24 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 69 A 9.37 4.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 I 8.58 4.93 1.91 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 1.16 0.75 1.03 0.00 0.00 71 D 9.30 5.00 0.00 2.94 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 V 8.38 3.88 2.24 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 0.67 0.00 0.00 1.06 0.00 0.00 73 T 8.48 4.16 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 1.14 0.00 0.00 74 N 7.63 4.57 0.00 1.87 2.54 0.00 0.00 6.30 6.67 0.00 0.00 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 L 8.31 3.85 0.00 1.84 1.89 0.90 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 7.22 4.69 0.00 2.95 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 77 V 8.39 4.43 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 0.80 0.00 0.00 0.96 0.00 0.00 78 V 8.89 4.37 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 0.83 0.00 0.00 0.74 0.00 0.00 79 A 7.32 4.74 0.24 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 80 Y 8.00 5.06 0.00 3.06 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 81 R 9.45 4.99 0.00 1.74 1.78 0.00 3.32 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 82 A 8.80 4.72 1.43 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 0.00 0.00 0.00 83 G 9.07 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 84 D 8.85 4.87 0.00 2.75 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 85 Q 8.02 4.65 0.00 2.20 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.78 0.00 0.00 0.00 0.00 0.00 2.25 2.44 0.00 86 S 7.64 4.75 0.00 3.70 3.68 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 87 Y 8.37 4.71 0.00 2.36 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 88 F 8.95 5.15 0.00 2.83 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 89 L 8.83 4.36 0.00 1.71 1.63 1.04 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 90 K 8.66 4.04 0.00 1.75 1.75 0.00 1.91 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.50 7.81 91 D 8.77 4.45 0.00 2.93 2.84 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 92 A 7.50 4.47 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.24 0.00 2.28 2.10 0.00 3.95 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.23 0.00 *7777 A 8.48 4.16 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 * Residues marked with a * may have inaccurate shift predictions.