NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3847 8.3049 120.3475 55.2523 33.2876 175.9484 2 L 4.1097 8.1925 124.5960 52.4799 40.2449 174.7776 3 T 3.9679 8.4415 117.7368 64.5944 68.5017 173.3649 4 D 4.6607 7.5427 120.8482 50.1176 41.6126 172.9724 5 P 4.0879 0.0000 0.0000 65.4506 31.5291 177.6879 6 I 3.4380 7.5681 117.4443 64.2558 37.0704 178.2585 7 A 3.8755 9.2573 122.8031 54.7916 18.0907 179.0328 8 D 4.1658 8.7074 117.5529 57.7215 41.3070 178.0407 9 M 3.8873 8.1461 118.7705 58.8428 32.2200 177.9043 10 L 3.8465 7.8440 118.8817 58.2287 41.1770 179.9302 11 T 3.7259 7.8553 115.2205 66.6466 68.4869 176.7039 12 R 4.0145 8.1334 120.4601 59.5935 30.1076 178.8321 13 I 3.5656 7.7142 118.9726 64.4329 37.0158 178.2787 14 R 3.7453 8.1416 119.6475 59.6203 29.6289 178.2480 15 N 4.2830 9.1223 114.9462 56.1326 38.8525 177.0559 16 A 4.1252 8.4300 122.7166 55.4884 18.4485 179.6973 17 T 3.8601 8.1813 108.6332 65.1738 68.1941 176.6387 18 R 3.8549 7.4281 120.2980 58.3953 28.9696 178.2552 19 V 4.3480 7.6639 110.1556 60.5391 31.5131 176.1028 20 Y 4.0009 7.1274 113.9109 57.9894 35.8182 170.3307 21 K 4.0026 7.2980 118.5792 57.0650 33.0202 176.8213 22 E 4.2931 8.8803 121.8026 58.5136 30.3439 175.1688 23 S 5.3320 8.2126 112.3595 58.0637 65.6513 172.3707 24 T 4.4950 7.5814 119.0481 62.5850 69.5850 172.7779 25 D 5.4678 8.4883 127.9373 52.5697 43.6679 176.0806 26 V 4.5047 8.1927 117.0538 60.0404 34.5807 170.9331 27 P 3.8593 0.0000 0.0000 62.6686 31.5968 176.0210 28 A 4.2129 7.8661 127.0584 52.3446 19.1652 177.0007 29 S 4.5195 8.4721 113.7989 55.9866 65.8707 175.1773 30 R 3.8737 8.8422 123.5472 59.7878 29.7428 178.4329 31 F 4.2584 8.3069 119.2007 61.8812 39.2297 177.2982 32 K 3.7431 8.5872 117.9664 59.4440 31.8941 178.8749 33 E 3.5842 8.4778 119.6905 59.2143 29.4192 178.3405 34 E 3.9968 8.7879 118.8966 59.7761 29.5321 179.3046 35 I 3.7975 8.2021 119.7293 64.7759 37.1711 178.3731 36 L 3.8908 7.9561 119.5228 57.7226 41.2308 179.4148 37 R 4.0456 8.0170 118.6381 59.7620 29.8784 178.7038 38 I 3.7926 7.6194 119.3293 64.3365 37.1139 178.0959 39 L 4.1039 8.2238 119.9798 58.0275 41.3812 179.6509 40 A 4.0301 8.9852 120.9653 55.1863 18.2671 179.2571 41 R 4.0012 8.0048 116.0453 59.9466 30.2357 178.0139 42 E 4.2087 8.7866 114.9997 56.6500 29.3858 177.2990 43 G 3.7673 8.7097 108.3488 46.5672 0.0000 174.8935 44 F 4.5797 8.2803 119.6111 57.9352 39.5070 176.0666 45 I 4.8047 7.3145 112.7823 58.6896 40.4548 176.2473 46 K 3.8760 8.9598 121.7017 58.3056 32.3799 177.1357 47 G 3.9379 6.3675 104.8698 44.9836 0.0000 171.5643 48 Y 5.5604 7.4770 116.3459 56.1972 40.5366 173.6569 49 E 4.6922 8.9312 117.6267 54.4029 33.6633 175.2693 50 R 4.6427 8.7901 120.3992 56.5816 30.5364 175.8858 51 V 4.4462 8.7347 124.6311 61.1777 35.2769 174.0908 52 D 5.2177 8.5881 120.7348 52.5426 42.9971 175.0491 53 V 4.0202 8.7557 123.8663 62.3286 32.5688 175.6468 54 D 4.2403 9.8983 126.9683 55.1548 39.5952 174.2124 55 G 4.0893 8.6351 106.2202 44.7122 0.0000 174.2099 56 K 4.6674 7.8016 119.0573 53.4605 34.7098 173.7387 57 P 4.7307 0.0000 0.0000 63.6184 32.4995 174.8351 58 Y 5.1652 9.2237 120.0065 56.5219 43.2557 173.7971 59 L 5.2442 8.9875 118.9780 53.1591 44.7749 177.0953 60 R 4.3794 9.2624 124.2611 56.2038 31.2708 176.5318 61 V 4.5029 8.3774 121.7974 61.1698 34.3873 174.4561 62 Y 4.2282 9.1474 127.6706 57.5787 38.1145 175.8586 63 L 4.4565 8.6958 125.1181 54.4600 42.7026 176.8349 64 K 4.7915 8.0977 121.6618 55.0522 35.1302 174.7569 65 Y 4.8638 8.6276 122.6666 56.1243 42.9485 175.5722 66 G 4.2954 8.8386 109.4047 45.5828 0.0000 170.9597 67 P 4.8670 0.0000 0.0000 61.4252 33.5858 175.4777 68 R 4.4190 8.5106 119.9021 56.8067 30.8220 175.1969 69 R 4.7285 8.4491 121.9107 54.4912 33.4435 175.1068 70 Q 4.4958 8.4203 117.1492 55.3031 31.0403 177.9701 71 G 3.7772 8.4884 107.6104 45.3023 0.0000 171.7541 72 P 4.2307 0.0000 0.0000 63.7565 31.8698 175.3087 73 D 4.2041 8.5044 118.2485 54.7355 38.5660 171.2504 74 P 4.5064 0.0000 0.0000 62.4872 32.1502 176.9942 75 R 3.8752 7.8299 118.9369 56.3679 30.2510 174.9683 76 P 5.1018 0.0000 0.0000 62.3250 32.3491 175.6589 77 E 4.4282 8.8043 122.1744 56.0160 31.1762 175.8715 78 Q 4.5340 8.4542 122.6953 55.3570 29.8909 176.4934 79 V 3.9056 8.1394 120.1784 64.6306 32.0904 176.4728 80 I 4.4088 7.1280 120.8016 59.7795 36.0597 174.6165 81 H 4.2711 8.5577 121.2071 58.0429 29.5457 174.6579 82 H 4.3849 8.1316 117.5319 53.2390 33.8836 172.1445 83 I 4.7282 6.2574 129.9017 60.9542 40.3173 172.4738 84 R 4.5311 7.7722 130.2043 54.2098 33.4209 174.9304 85 R 3.8062 8.5676 124.3221 56.8449 30.6007 174.7854 86 I 4.3586 8.1657 118.7176 62.6796 40.4468 175.8329 87 S 4.2768 7.8377 116.4780 58.4943 63.3352 174.0582 88 K 4.6142 8.5127 125.2224 53.9373 36.2688 174.0439 89 P 4.4819 0.0000 0.0000 63.6700 31.6574 176.1353 90 G 3.9050 8.5890 105.6871 45.8215 0.0000 174.0587 91 R 4.7061 7.0494 115.2160 55.9709 32.8036 174.4564 92 R 4.0821 7.8085 118.1502 56.1066 31.5132 176.9949 93 V 4.2193 8.3591 121.6725 61.4152 34.0617 173.6861 94 Y 5.3436 8.5955 125.1534 56.3546 40.9479 175.7496 95 V 4.7132 8.8298 115.4080 59.4092 36.2342 175.9460 96 G 4.1232 9.9850 113.9202 44.9562 0.0000 175.1769 97 V 3.7487 8.1921 118.8375 63.3934 31.6207 177.4356 98 K 4.1907 7.9455 119.2809 58.2935 32.4081 177.0627 99 E 4.4483 8.0511 117.2566 56.0882 29.3426 176.0784 100 I 4.0143 7.6312 121.0911 59.7381 36.8172 174.2020 101 P 4.3305 0.0000 0.0000 63.1455 31.3640 176.6569 102 R 4.4239 8.0661 118.8419 53.8291 30.3481 175.7014 103 V 3.4771 8.2865 122.5050 64.8138 32.8270 176.4887 104 R 3.1583 9.2215 123.5231 59.4488 26.9461 176.0651 105 R 3.6548 8.6030 113.3706 57.1144 29.0712 175.2083 106 G 4.2202 8.7157 106.3742 45.6306 0.0000 176.6481 107 L 4.0669 7.9285 118.8344 56.5251 41.7099 176.8724 108 G 4.4374 7.2859 107.2605 43.5826 0.0000 171.6452 109 I 5.0878 9.2804 111.8826 59.0743 41.7083 174.2397 110 A 5.0503 9.1107 123.4692 50.3474 22.2240 174.9762 111 I 4.4292 8.3375 123.3396 59.9310 39.1253 175.1329 112 L 5.0044 8.9574 126.6456 52.9191 45.8234 175.4777 113 S 5.0264 8.9336 116.2843 57.0217 64.5086 173.0601 114 T 5.0969 8.8580 117.7500 59.2549 72.1233 175.0521 115 S 4.3419 8.7218 113.4771 59.3009 62.8007 174.4902 116 K 4.4356 7.9209 120.7123 56.2638 32.8025 177.0686 117 G 3.7243 8.0815 108.2441 44.5834 0.0000 172.4178 118 V 4.7185 7.9849 118.7093 61.5857 32.2458 175.5703 119 L 5.1094 8.8508 127.4512 54.1491 44.5594 175.7070 120 T 4.7269 8.5467 111.0885 61.3650 70.2712 175.3410 121 D 4.3558 8.7071 122.0480 56.8756 39.1129 178.6659 122 R 3.8815 8.0966 119.7148 58.8956 30.1415 178.2892 123 E 3.9416 8.0834 117.3551 59.6516 29.5406 179.6257 124 A 3.9636 8.2733 120.5960 55.1458 18.5442 179.4100 125 R 3.8116 8.4269 117.5335 59.5416 29.9055 178.1983 126 K 3.8242 8.5528 118.6224 59.7719 32.2819 177.9820 127 L 4.2960 7.9406 115.2283 54.0750 42.4030 176.7799 128 G 4.0398 8.3861 107.7406 46.8609 0.0000 173.5146 129 V 4.5452 7.9383 109.1543 59.4269 36.2100 176.5504 130 G 4.1848 8.4686 109.4445 45.1239 0.0000 171.3624 131 G 4.1483 7.6587 103.5126 46.2465 0.0000 171.3992 132 E 4.5036 8.1139 121.7669 55.4910 30.5742 178.0231 133 L 4.3670 9.1112 132.9267 55.8900 39.4633 176.7350 134 I 3.3967 7.4776 119.6406 62.9230 38.1226 178.9399 135 C 4.7587 8.2387 118.1483 57.9023 33.6471 171.5984 136 E 4.9194 8.4863 118.6339 55.9790 32.5277 175.1158 137 V 4.5043 8.7714 127.8316 60.7711 35.1088 175.3337 138 W 4.8796 7.8446 122.3098 57.2701 28.1906 174.0915 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 M 8.30 4.38 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.56 0.00 2 L 8.19 4.11 0.00 1.74 1.59 0.95 0.59 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 3 T 8.44 3.97 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 1.18 0.00 0.00 4 D 7.54 4.66 0.00 2.60 2.40 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 0.00 5 P 0.00 4.09 0.00 2.10 2.05 0.00 3.60 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.26 0.00 6 I 7.57 3.44 1.79 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.13 0.61 0.00 0.00 7 A 9.26 3.88 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 8 D 8.71 4.17 0.00 2.78 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 9 M 8.15 3.89 0.00 2.10 1.94 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 2.51 2.48 0.00 10 L 7.84 3.85 0.00 1.60 1.57 0.81 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.86 3.73 4.33 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 1.15 0.00 0.00 12 R 8.13 4.01 0.00 1.89 1.98 0.00 3.13 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 13 I 7.71 3.57 1.97 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 1.33 0.64 0.79 0.00 0.00 14 R 8.14 3.75 0.00 1.79 1.95 0.00 3.00 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 15 N 9.12 4.28 0.00 2.85 2.83 0.00 0.00 7.07 7.23 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 16 A 8.43 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 T 8.18 3.86 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 0.97 0.00 0.00 18 R 7.43 3.85 0.00 1.88 2.02 0.00 3.08 0.00 0.00 3.47 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 19 V 7.66 4.35 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 0.92 0.00 0.00 1.06 0.00 0.00 20 Y 7.13 4.00 0.00 2.97 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 21 K 7.30 4.00 0.00 2.01 1.83 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.72 1.56 7.81 22 E 8.88 4.29 0.00 2.05 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 2.51 2.42 0.00 23 S 8.21 5.33 0.00 3.62 3.59 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 24 T 7.58 4.49 4.19 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 1.19 0.00 0.00 25 D 8.49 5.47 0.00 2.46 2.54 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 26 V 8.19 4.50 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 0.69 0.00 0.00 0.88 0.00 0.00 27 P 0.00 3.86 0.00 1.83 1.79 0.00 3.70 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 2.28 0.00 28 A 7.87 4.21 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 29 S 8.47 4.52 0.00 3.98 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 30 R 8.84 3.87 0.00 1.87 2.06 0.00 3.34 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.67 0.00 31 F 8.31 4.26 0.00 2.99 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 32 K 8.59 3.74 0.00 1.84 1.75 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.27 7.81 33 E 8.48 3.58 0.00 1.95 2.16 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 2.38 2.32 0.00 34 E 8.79 4.00 0.00 2.34 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 2.50 2.51 0.00 35 I 8.20 3.80 1.96 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.14 0.84 0.00 0.00 36 L 7.96 3.89 0.00 1.26 1.38 0.51 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.02 4.05 0.00 2.22 2.05 0.00 3.32 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.87 0.00 38 I 7.62 3.79 2.07 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.63 1.01 0.00 0.00 39 L 8.22 4.10 0.00 1.77 1.83 0.85 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.99 4.03 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 0.00 0.00 41 R 8.00 4.00 0.00 1.96 2.19 0.00 3.31 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 1.68 1.73 0.00 42 E 8.79 4.21 0.00 2.29 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 2.45 2.65 0.00 43 G 8.71 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 0.00 0.00 0.00 44 F 8.28 4.58 0.00 3.27 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 45 I 7.31 4.80 2.14 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.22 0.97 0.00 0.00 46 K 8.96 3.88 0.00 2.01 1.97 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.55 1.71 7.81 47 G 6.37 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 48 Y 7.48 5.56 0.00 3.38 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 49 E 8.93 4.69 0.00 2.05 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 2.57 2.45 0.00 50 R 8.79 4.64 0.00 1.80 2.03 0.00 3.23 0.00 0.00 3.21 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.78 0.00 51 V 8.73 4.45 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 1.12 0.00 0.00 1.11 0.00 0.00 52 D 8.59 5.22 0.00 2.58 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 53 V 8.76 4.02 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 0.59 0.00 0.00 0.79 0.00 0.00 54 D 9.90 4.24 0.00 2.74 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 55 G 8.64 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.80 4.67 0.00 2.08 1.68 0.00 1.62 0.00 0.00 1.85 0.00 0.00 3.11 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.41 7.81 57 P 0.00 4.73 0.00 2.03 2.16 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.93 0.00 58 Y 9.22 5.17 0.00 2.98 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 59 L 8.99 5.24 0.00 1.55 1.57 0.78 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 60 R 9.26 4.38 0.00 1.91 1.54 0.00 3.10 0.00 0.00 3.09 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.83 0.00 61 V 8.38 4.50 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 1.00 0.00 0.00 0.99 0.00 0.00 62 Y 9.15 4.23 0.00 3.25 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 63 L 8.70 4.46 0.00 1.90 1.38 0.91 0.83 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 64 K 8.10 4.79 0.00 1.73 1.71 0.00 1.74 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.47 7.81 65 Y 8.63 4.86 0.00 3.02 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 66 G 8.84 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 0.00 0.00 0.00 0.00 67 P 0.00 4.87 0.00 2.15 2.25 0.00 3.77 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 68 R 8.51 4.42 0.00 1.83 1.87 0.00 3.14 0.00 0.00 3.20 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 69 R 8.45 4.73 0.00 1.79 1.84 0.00 3.24 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 70 Q 8.42 4.50 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.11 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 71 G 8.49 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 0.00 0.00 0.00 72 P 0.00 4.23 0.00 2.19 2.07 0.00 3.92 0.00 0.00 3.58 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 73 D 8.50 4.20 0.00 2.78 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 74 P 0.00 4.51 0.00 2.21 2.23 0.00 3.72 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 1.98 1.93 0.00 75 R 7.83 3.88 0.00 1.89 1.81 0.00 3.10 0.00 0.00 3.07 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.38 0.00 76 P 0.00 5.10 0.00 2.36 2.41 0.00 3.18 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 1.94 1.89 0.00 77 E 8.80 4.43 0.00 2.14 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 2.42 2.43 0.00 78 Q 8.45 4.53 0.00 1.90 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.20 0.00 79 V 8.14 3.91 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 0.91 0.00 0.00 0.98 0.00 0.00 80 I 7.13 4.41 1.71 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.80 0.71 0.00 0.00 81 H 8.56 4.27 0.00 3.12 3.47 0.00 5.84 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 8.13 4.38 0.00 1.40 1.31 0.00 5.92 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 6.26 4.73 1.53 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.45 0.65 0.00 0.00 84 R 7.77 4.53 0.00 1.63 1.58 0.00 3.11 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.49 0.00 85 R 8.57 3.81 0.00 1.65 1.78 0.00 3.59 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 86 I 8.17 4.36 2.17 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 1.17 0.74 0.88 0.00 0.00 87 S 7.84 4.28 0.00 3.73 3.66 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 88 K 8.51 4.61 0.00 1.76 1.58 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.30 1.56 7.81 89 P 0.00 4.48 0.00 2.16 2.05 0.00 3.97 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 1.96 1.94 0.00 90 G 8.59 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 91 R 7.05 4.71 0.00 1.75 1.75 0.00 3.23 0.00 0.00 3.15 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.54 0.00 92 R 7.81 4.08 0.00 1.82 1.66 0.00 3.40 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.33 0.00 93 V 8.36 4.22 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 0.94 0.00 0.00 0.91 0.00 0.00 94 Y 8.60 5.34 0.00 2.87 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 95 V 8.83 4.71 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 0.84 0.00 0.00 1.03 0.00 0.00 96 G 9.98 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 97 V 8.19 3.75 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 0.77 0.00 0.00 1.01 0.00 0.00 98 K 7.95 4.19 0.00 1.78 1.91 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.42 1.46 7.81 99 E 8.05 4.45 0.00 2.14 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 2.30 2.28 0.00 100 I 7.63 4.01 1.89 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 1.50 0.64 0.94 0.00 0.00 101 P 0.00 4.33 0.00 2.20 2.09 0.00 3.74 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 102 R 8.07 4.42 0.00 1.79 1.90 0.00 3.22 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 103 V 8.29 3.48 2.30 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 1.22 0.00 0.00 1.08 0.00 0.00 104 R 9.22 3.16 0.00 1.66 1.77 0.00 2.95 0.00 0.00 2.66 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 105 R 8.60 3.65 0.00 1.71 1.86 0.00 3.20 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.62 0.00 106 G 8.72 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 0.00 0.00 0.00 0.00 107 L 7.93 4.07 0.00 1.66 1.76 0.88 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.29 4.44 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 0.00 109 I 9.28 5.09 1.99 0.00 0.00 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 1.52 1.38 1.10 0.00 0.00 110 A 9.11 5.05 1.27 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 0.00 0.00 111 I 8.34 4.43 1.89 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 1.27 0.76 0.97 0.00 0.00 112 L 8.96 5.00 0.00 1.59 1.57 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.93 5.03 0.00 3.90 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 0.00 114 T 8.86 5.10 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 1.29 0.00 0.00 115 S 8.72 4.34 0.00 3.98 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 0.00 116 K 7.92 4.44 0.00 1.74 1.81 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.35 1.33 7.81 117 G 8.08 3.72 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 0.00 0.00 0.00 118 V 7.98 4.72 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 1.03 0.00 0.00 0.82 0.00 0.00 119 L 8.85 5.11 0.00 1.85 1.75 0.95 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.55 4.73 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 1.36 0.00 0.00 121 D 8.71 4.36 0.00 2.87 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 0.00 122 R 8.10 3.88 0.00 1.90 2.06 0.00 3.18 0.00 0.00 3.36 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.78 0.00 123 E 8.08 3.94 0.00 2.38 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 0.00 2.36 2.39 0.00 124 A 8.27 3.96 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 0.00 125 R 8.43 3.81 0.00 2.02 1.96 0.00 3.13 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 126 K 8.55 3.82 0.00 1.83 2.03 0.00 1.86 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.51 7.81 127 L 7.94 4.30 0.00 1.94 1.70 0.93 0.81 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 0.00 128 G 8.39 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 0.00 0.00 0.00 129 V 7.94 4.55 2.09 0.00 0.00 0.00 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 0.94 0.00 0.00 130 G 8.47 4.18 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 0.00 0.00 0.00 131 G 7.66 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 0.00 132 E 8.11 4.50 0.00 2.31 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 2.22 1.98 0.00 133 L 9.11 4.37 0.00 1.71 1.52 0.93 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 0.00 134 I 7.48 3.40 2.14 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.29 0.84 0.00 0.00 135 C 8.24 4.76 0.00 2.93 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 0.00 136 E 8.49 4.92 0.00 2.07 1.81 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 2.44 2.47 0.00 137 V 8.77 4.50 1.61 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 -0.52 0.00 0.00 0.59 0.00 0.00 138 W 7.84 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