NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2198 8.1627 118.1848 53.7414 33.4019 176.0570 2 R 3.6529 8.0709 118.5578 56.5026 28.7596 173.1081 3 H 4.2786 8.3181 114.2096 57.7560 29.5659 175.0959 4 R 3.9351 8.7610 121.8428 56.3639 27.6034 176.1781 5 K 4.1787 8.0730 118.6581 55.7616 32.6028 176.9670 6 S 4.4545 8.5145 118.6096 57.4096 64.0606 172.8403 7 G 4.0240 8.6234 110.3710 45.8393 0.0000 172.7854 8 R 4.5820 7.8907 121.8570 54.4457 32.0926 175.9370 9 Q 4.4322 8.6139 120.5476 54.8996 30.2081 178.5934 10 L 3.6210 8.1072 117.2896 55.2363 41.7090 174.8452 11 N 4.5392 8.0646 114.1294 51.9865 41.7339 172.4814 12 R 4.2766 7.6972 117.7438 55.6374 34.5533 172.7953 13 N 4.5304 7.9816 117.3987 52.6642 37.5432 175.5898 14 S 4.3742 8.4808 111.6841 59.7461 62.6200 174.7815 15 S 4.3492 7.9640 113.9328 61.9452 62.8736 174.5719 16 H 4.3572 9.1701 120.3569 59.5708 30.0290 177.4157 17 R 4.8378 7.8179 117.0496 55.5001 28.3443 176.3718 18 Q 4.6981 7.9096 114.5450 56.3274 36.4637 176.5648 19 A 4.3721 8.7023 120.1655 53.9406 20.5278 178.1537 20 M 4.3095 8.0131 108.1281 56.3410 31.2330 176.5442 21 F 4.6059 7.8705 118.2493 58.4180 42.1737 177.4370 22 R 3.9672 7.7717 120.2841 59.5422 29.8564 178.1688 23 N 4.3384 8.7600 116.7149 56.3738 38.3378 177.1906 24 M 3.9172 7.9630 118.8836 58.4943 32.5468 177.4698 25 A 4.2438 8.1558 121.2036 55.5225 18.2796 179.6199 26 G 3.7096 7.9864 102.3142 48.1486 0.0000 175.2431 27 S 4.3051 7.8124 115.3385 60.9404 62.3210 175.8740 28 L 3.9640 8.6550 123.7376 58.4329 41.6621 179.0777 29 V 3.6041 7.9991 116.8361 66.1580 31.3665 176.8677 30 R 3.9821 8.1286 117.6767 58.4742 29.4169 177.4325 31 H 4.2443 8.6490 122.1602 57.1409 29.5000 176.3786 32 E 4.0861 8.8804 119.1259 56.5399 27.9100 173.4686 33 I 5.3037 7.4533 111.2131 59.8942 40.6857 174.3705 34 I 4.6132 9.2675 125.3193 59.8421 42.0424 174.1344 35 K 4.3664 8.2507 123.1162 53.9941 31.5991 175.5526 36 T 4.5472 7.2581 118.4627 60.8061 71.0969 173.1943 37 T 4.4684 8.2280 115.9634 62.9244 69.7216 174.8708 38 L 3.8576 8.5311 127.7739 58.2948 41.9663 178.0363 39 P 4.2626 0.0000 0.0000 65.4879 31.2736 178.4750 40 K 4.1853 8.0997 114.7913 58.0032 31.8526 177.3933 41 A 4.4331 7.5742 120.4097 53.7765 20.1903 178.8516 42 K 4.0298 8.2628 116.5551 59.5517 32.3059 179.1343 43 E 4.1211 8.2993 118.6594 59.2194 29.5829 178.4033 44 L 4.0763 7.5774 119.9411 59.1010 41.4544 178.1893 45 R 3.8745 8.7245 117.9792 59.9012 30.5810 177.5253 46 R 4.3338 7.8659 117.3042 55.5351 28.0702 176.1262 47 V 4.4092 7.2929 119.3493 64.4583 37.0150 176.5356 48 V 3.6321 7.9198 118.7927 66.0420 31.4409 177.5504 49 E 4.3103 7.7689 117.4801 59.4579 29.3666 177.9835 50 P 4.3100 0.0000 0.0000 65.3903 31.4134 178.3052 51 L 3.9564 7.5364 118.2236 58.3382 41.9852 179.1191 52 I 3.5736 8.4916 120.4850 64.6232 36.7360 178.4452 53 T 3.9356 8.0971 115.9408 66.7619 68.5645 176.1492 54 L 4.1683 8.4968 122.2178 57.9070 41.6807 178.8376 55 A 3.8625 8.3503 121.4384 54.5304 17.9431 179.3929 56 K 3.8797 7.7102 116.7446 59.7553 32.3651 177.2739 57 T 4.5676 7.2799 113.1366 62.2582 70.4455 174.9962 58 D 4.2611 8.2597 128.7746 56.2283 41.2823 173.6545 59 S 4.1884 8.0603 113.8203 57.8724 64.1604 170.6648 60 V 3.4295 8.4237 126.2078 65.7482 30.4902 176.4924 61 A 4.1652 7.1331 122.9777 55.0039 18.6912 178.2929 62 N 4.5491 7.6295 115.5978 52.8256 38.1358 175.9070 63 R 4.3593 7.2296 116.6128 56.9628 33.1021 176.6086 64 R 4.1586 8.8769 116.5674 59.4144 30.3423 178.9557 65 L 3.9481 7.7650 119.0095 58.2997 41.9722 178.8827 66 A 4.2452 8.1497 118.6496 55.2371 18.3325 178.8735 67 F 4.6833 8.7716 118.8093 61.8591 39.5429 176.1903 68 A 3.5000 8.2870 118.0510 55.2886 18.3101 177.5677 69 R 3.8064 7.2069 114.0116 56.5105 30.2375 175.8804 70 T 3.2602 8.5286 112.7517 61.9160 66.5093 172.2065 71 R 4.0140 8.3278 125.6899 57.4926 30.5539 176.2442 72 D 4.5809 7.8647 116.8205 54.6422 39.9347 175.4687 73 N 4.3005 8.7818 122.3448 53.9165 38.9228 175.0701 74 E 4.4510 8.5262 118.2923 57.7571 30.9101 178.0123 75 I 3.7726 7.7974 112.4223 63.9620 37.4157 178.2257 76 V 3.5206 7.8677 112.8987 64.2129 31.6395 177.8797 77 A 4.1935 7.9445 120.6601 55.0288 18.1485 179.4233 78 K 4.1485 7.9199 118.9601 57.7060 32.0344 176.7217 79 L 4.2567 7.1874 117.9685 54.3716 42.9062 176.6971 80 F 4.6190 8.1388 122.6387 58.6495 37.2437 176.0695 81 N 4.7282 7.0510 114.9072 55.1560 40.8075 177.1843 82 E 4.0265 8.8091 119.0267 57.2369 28.2241 179.5889 83 L 3.6817 9.3445 135.0000 60.0410 40.2528 177.5457 84 G 3.6350 8.2705 103.8959 48.8984 0.0000 172.9724 85 P 4.3938 0.0000 0.0000 64.2221 31.6535 178.7704 86 R 3.7554 7.3020 116.7432 58.6521 30.1381 177.5347 87 F 5.0451 7.6357 114.9831 57.3675 39.1307 177.2087 88 A 4.5684 8.3789 123.1585 51.8854 17.4294 178.8056 89 S 4.7533 8.7734 115.0005 60.7958 69.6623 175.4665 90 R 4.0514 8.2453 119.9636 56.7645 30.1239 175.7799 91 A 4.3274 9.0076 124.4466 52.6018 19.2428 176.9172 92 G 2.4810 7.6859 108.8930 45.1592 0.0000 175.4438 93 G 3.6802 7.2713 112.1391 45.5437 0.0000 174.0999 94 Y 3.7565 6.3886 113.7363 58.8912 38.5594 176.7358 95 T 5.8276 7.6858 113.3526 59.4954 71.1905 172.5013 96 R 4.8074 8.4868 123.8241 54.7739 33.9694 174.9807 97 I 4.0522 8.4096 114.7431 61.1297 40.7592 174.3414 98 L 3.7444 8.1520 118.6450 55.2483 38.1864 174.1816 99 K 4.4226 8.1399 122.0702 55.7818 33.3745 175.5755 100 C 4.7031 8.8549 119.8733 57.9341 31.9267 175.0686 101 G 2.9890 8.5547 107.0170 46.2649 0.0000 168.8753 102 F 3.7658 7.8814 121.7955 57.2013 35.3856 174.9022 103 R 4.3863 8.1951 126.3457 54.4571 31.3869 174.7907 104 A 4.1754 7.8360 122.1751 53.3793 19.0492 178.8873 105 G 3.9854 8.3488 106.5648 47.3472 0.0000 172.9605 106 D 4.9630 7.7577 119.9625 50.9219 41.2893 176.4321 107 N 4.8581 8.6177 120.2803 53.7620 39.0930 174.5890 108 A 4.1382 8.5852 120.9766 50.7372 19.3056 175.6956 109 P 4.3123 0.0000 0.0000 62.8449 32.4821 175.3166 110 M 5.1688 8.1530 126.7664 55.0953 35.0656 173.3133 111 A 4.5016 7.7871 121.2807 54.1943 24.9696 177.3510 112 Y 5.8234 8.8074 104.4526 58.6990 40.7732 174.1368 113 I 4.2727 7.8894 123.2506 60.7515 39.9200 173.7596 114 E 5.7695 8.3021 126.6189 56.3022 33.2413 173.7386 115 L 5.0276 8.4717 124.2518 54.2776 42.4091 178.3138 116 V 3.7489 8.3569 124.0467 63.2687 31.5532 176.3993 117 D 5.0543 7.9917 119.7257 52.3089 39.0185 175.6470 118 R 4.3119 7.7923 119.6804 58.5671 31.6380 176.5359 119 S 4.2511 7.7974 113.9384 59.2093 60.6006 173.6649 120 E 4.0582 8.3846 124.1341 56.3784 30.2132 174.0185 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 8.16 4.22 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 2 R 8.07 3.65 0.00 2.11 2.02 0.00 3.20 0.00 0.00 3.34 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 3 H 8.32 4.28 0.00 3.22 3.25 0.00 5.81 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 R 8.76 3.94 0.00 1.98 2.08 0.00 3.35 0.00 0.00 3.20 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 5 K 8.07 4.18 0.00 1.90 1.74 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.37 7.81 6 S 8.51 4.45 0.00 3.80 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 7 G 8.62 4.02 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 0.00 0.00 0.00 8 R 7.89 4.58 0.00 2.15 1.81 0.00 3.30 0.00 0.00 3.30 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 9 Q 8.61 4.43 0.00 2.28 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 5.68 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 10 L 8.11 3.62 0.00 1.87 1.59 0.95 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.06 4.54 0.00 2.67 2.73 0.00 0.00 6.64 7.66 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 12 R 7.70 4.28 0.00 1.91 1.89 0.00 3.27 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.44 0.00 13 N 7.98 4.53 0.00 3.00 2.96 0.00 0.00 5.57 7.31 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 14 S 8.48 4.37 0.00 3.86 3.93 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 15 S 7.96 4.35 0.00 3.86 4.11 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 16 H 9.17 4.36 0.00 3.34 3.33 0.00 5.66 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.82 4.84 0.00 1.92 2.03 0.00 3.49 0.00 0.00 3.45 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.78 0.00 18 Q 7.91 4.70 0.00 2.34 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.69 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 19 A 8.70 4.37 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 20 M 8.01 4.31 0.00 1.69 1.90 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.19 0.00 21 F 7.87 4.61 0.00 3.07 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 22 R 7.77 3.97 0.00 2.04 1.95 0.00 3.12 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 23 N 8.76 4.34 0.00 2.79 2.86 0.00 0.00 6.74 8.20 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 24 M 7.96 3.92 0.00 2.20 1.96 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.62 0.00 25 A 8.16 4.24 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 26 G 7.99 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 27 S 7.81 4.31 0.00 3.99 4.08 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 L 8.65 3.96 0.00 1.79 1.95 0.98 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 29 V 8.00 3.60 2.28 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 0.87 0.00 0.00 1.01 0.00 0.00 30 R 8.13 3.98 0.00 2.13 1.62 0.00 3.29 0.00 0.00 3.21 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.92 0.00 31 H 8.65 4.24 0.00 3.39 3.41 0.00 5.94 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 32 E 8.88 4.09 0.00 2.24 2.12 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 2.31 2.33 0.00 33 I 7.45 5.30 2.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.56 0.97 0.00 0.00 34 I 9.27 4.61 1.86 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 1.21 0.68 0.85 0.00 0.00 35 K 8.25 4.37 0.00 1.25 0.95 0.00 1.57 0.00 0.00 0.61 0.00 0.00 2.78 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.12 1.14 7.81 36 T 7.26 4.55 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 1.15 0.00 0.00 37 T 8.23 4.47 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 1.20 0.00 0.00 38 L 8.53 3.86 0.00 1.67 1.63 0.89 0.79 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 39 P 0.00 4.26 0.00 2.20 2.10 0.00 3.62 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 2.16 0.00 40 K 8.10 4.19 0.00 1.86 1.68 0.00 1.44 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.42 7.81 41 A 7.57 4.43 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 42 K 8.26 4.03 0.00 1.73 1.93 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.75 7.81 43 E 8.30 4.12 0.00 2.37 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 2.40 2.58 0.00 44 L 7.58 4.08 0.00 2.19 2.00 1.04 0.89 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 45 R 8.72 3.87 0.00 1.97 2.05 0.00 3.09 0.00 0.00 3.19 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 46 R 7.87 4.33 0.00 1.86 1.94 0.00 3.05 0.00 0.00 3.11 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.48 0.00 47 V 7.29 4.41 2.29 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 0.96 0.00 0.00 0.92 0.00 0.00 48 V 7.92 3.63 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 1.01 0.00 0.00 0.98 0.00 0.00 49 E 7.77 4.31 0.00 2.09 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 0.00 2.37 2.59 0.00 50 P 0.00 4.31 0.00 2.29 2.11 0.00 3.74 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 51 L 7.54 3.96 0.00 2.06 1.64 0.94 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 52 I 8.49 3.57 1.76 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.36 -0.09 0.00 0.00 53 T 8.10 3.94 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 54 L 8.50 4.17 0.00 1.77 1.92 1.05 1.22 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 55 A 8.35 3.86 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 56 K 7.71 3.88 0.00 1.96 1.98 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.11 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.70 7.81 57 T 7.28 4.57 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 1.21 0.00 0.00 58 D 8.26 4.26 0.00 2.58 2.34 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 59 S 8.06 4.19 0.00 4.06 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 60 V 8.42 3.43 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 0.88 0.00 0.00 61 A 7.13 4.17 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 62 N 7.63 4.55 0.00 2.96 2.94 0.00 0.00 6.87 7.54 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 63 R 7.23 4.36 0.00 1.77 1.84 0.00 2.85 0.00 0.00 2.75 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.62 0.00 64 R 8.88 4.16 0.00 1.93 2.08 0.00 3.21 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.88 0.00 65 L 7.77 3.95 0.00 1.81 1.89 0.95 1.06 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 66 A 8.15 4.25 1.68 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 0.00 0.00 67 F 8.77 4.68 0.00 2.99 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 68 A 8.29 3.50 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 69 R 7.21 3.81 0.00 2.01 1.97 0.00 3.40 0.00 0.00 3.43 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.75 0.00 70 T 8.53 3.26 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 1.25 0.00 0.00 71 R 8.33 4.01 0.00 1.77 2.03 0.00 3.07 0.00 0.00 2.97 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 72 D 7.86 4.58 0.00 2.85 2.64 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 73 N 8.78 4.30 0.00 2.49 2.66 0.00 0.00 7.01 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 74 E 8.53 4.45 0.00 2.03 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 0.00 2.20 2.26 0.00 75 I 7.80 3.77 1.87 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 1.82 0.91 0.99 0.00 0.00 76 V 7.87 3.52 2.28 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 0.97 0.00 0.00 0.93 0.00 0.00 77 A 7.94 4.19 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 78 K 7.92 4.15 0.00 1.82 1.95 0.00 1.82 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.70 1.42 7.81 79 L 7.19 4.26 0.00 1.11 0.64 0.81 0.77 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 80 F 8.14 4.62 0.00 3.24 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 81 N 7.05 4.73 0.00 3.01 2.77 0.00 0.00 7.11 7.54 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 82 E 8.81 4.03 0.00 2.14 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 2.27 2.20 0.00 83 L 9.34 3.68 0.00 1.78 1.77 0.86 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 84 G 8.27 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 0.00 0.00 0.00 85 P 0.00 4.39 0.00 2.13 2.10 0.00 3.94 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 2.18 2.19 0.00 86 R 7.30 3.76 0.00 1.33 1.45 0.00 3.07 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.66 0.00 87 F 7.64 5.05 0.00 2.74 2.64 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 88 A 8.38 4.57 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 89 S 8.77 4.75 0.00 3.96 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 90 R 8.25 4.05 0.00 2.22 2.47 0.00 3.46 0.00 0.00 3.57 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.76 0.00 91 A 9.01 4.33 1.25 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 92 G 7.69 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.27 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 0.00 0.00 0.00 94 Y 6.39 3.76 0.00 2.41 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 95 T 7.69 5.83 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 96 R 8.49 4.81 0.00 2.09 1.72 0.00 3.24 0.00 0.00 3.39 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 97 I 8.41 4.05 1.88 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 1.34 0.82 0.92 0.00 0.00 98 L 8.15 3.74 0.00 2.06 1.78 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.14 4.42 0.00 1.74 1.72 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.43 7.81 100 C 8.85 4.70 0.00 3.12 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 0.00 101 G 8.55 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 0.00 0.00 0.00 102 F 7.88 3.77 0.00 3.27 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 0.00 103 R 8.20 4.39 0.00 1.90 2.31 0.00 3.22 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 104 A 7.84 4.18 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 0.00 105 G 8.35 3.99 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 0.00 0.00 0.00 106 D 7.76 4.96 0.00 2.90 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 0.00 107 N 8.62 4.86 0.00 2.76 2.91 0.00 0.00 7.05 7.96 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 0.00 108 A 8.59 4.14 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 0.00 109 P 0.00 4.31 0.00 1.88 1.82 0.00 3.62 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.88 0.00 110 M 8.15 5.17 0.00 1.92 1.89 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.23 0.00 111 A 7.79 4.50 1.16 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 0.00 0.00 112 Y 8.81 5.82 0.00 3.02 2.82 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 0.00 113 I 7.89 4.27 1.89 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 1.25 2.54 0.94 0.00 0.00 114 E 8.30 5.77 0.00 2.12 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 2.35 2.20 0.00 115 L 8.47 5.03 0.00 1.79 2.08 1.09 1.01 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 0.00 116 V 8.36 3.75 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 0.98 0.00 0.00 1.00 0.00 0.00 117 D 7.99 5.05 0.00 2.75 2.80 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 0.00 118 R 7.79 4.31 0.00 1.95 2.20 0.00 3.44 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.92 0.00 119 S 7.80 4.25 0.00 3.91 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 0.00 120 E 8.38 4.06 0.00 2.07 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 2.17 2.34 0.00