NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3513 8.3044 120.3492 54.9616 33.3286 175.0023 2 E 3.9615 8.6449 126.6196 55.5913 30.4916 175.3190 3 D 4.7195 8.0827 123.1678 52.6699 40.5808 174.5509 4 T 4.7348 7.3960 110.6476 58.2904 72.3512 173.1415 5 P 4.3772 0.0000 0.0000 63.0673 31.8725 176.4593 6 L 4.4872 8.3562 120.2307 55.2644 42.7760 177.0897 7 V 4.4777 7.3468 110.1546 59.1870 35.6067 174.3828 8 I 4.3978 7.8685 115.3397 59.8261 39.6839 174.4147 9 S 5.0830 8.4242 118.3727 56.6124 65.6887 172.9579 10 K 4.8506 9.1135 124.9596 54.6178 35.8387 175.2408 11 Q 5.1585 8.5152 120.6618 54.7267 32.3473 174.3029 12 K 4.5219 8.8858 119.4653 55.8271 36.2609 174.1464 13 T 5.0646 8.5350 123.9012 62.0226 70.2482 173.5960 14 E 4.6773 9.1853 126.8157 54.2523 33.7749 174.3519 15 V 4.1678 8.4756 126.2847 62.5974 32.3738 175.2367 16 V 4.2523 8.6870 128.7242 62.2976 33.2376 175.3031 17 C 4.2403 9.9257 126.4737 60.9013 25.6404 174.2825 18 G 3.9093 8.4597 105.8555 45.1113 0.0000 173.4248 19 V 4.2488 7.6465 120.6591 60.0023 33.8671 173.0475 20 P 4.6497 0.0000 0.0000 63.3949 31.8945 175.9350 21 T 4.7402 9.0376 121.1899 61.8337 72.2413 172.7900 22 Q 4.9434 9.0597 125.8657 54.2908 31.0681 174.7540 23 V 4.9734 8.8644 124.2276 61.0913 34.7990 174.4194 24 V 4.9303 8.9121 126.5569 61.4456 35.2361 173.5577 25 C 5.4961 9.3143 124.9780 58.3409 31.7171 173.1057 26 T 4.9686 9.1319 119.4269 61.6550 72.1426 172.5691 27 A 4.9102 8.5120 128.1807 50.4331 20.1656 176.4587 28 F 4.7872 9.1863 121.4500 55.1823 42.1108 176.7351 29 S 4.0338 9.0787 116.1579 61.4194 62.0812 175.1297 30 S 4.7514 8.1942 112.2965 58.3840 64.2519 172.7383 31 H 5.3513 8.0778 117.0138 54.2851 33.7348 172.1666 32 I 4.9198 8.5123 121.8380 59.6859 39.3799 174.3767 33 L 4.9728 8.9582 129.9715 53.8697 43.8201 175.1669 34 V 4.8245 8.7235 126.2254 61.0765 34.4435 174.0382 35 V 4.8162 9.0664 128.2839 61.0980 34.1669 174.2699 36 V 4.7451 9.2437 128.0953 61.4964 33.9148 173.7498 37 T 4.9605 9.1025 123.4085 60.2792 70.3438 172.5970 38 Q 4.6516 8.5423 126.2920 54.6416 32.7416 175.8007 39 F 3.8263 9.1209 118.7333 58.5312 36.3696 176.5320 40 G 3.9827 8.4233 107.1946 45.4359 0.0000 174.2621 41 K 4.4289 7.5377 118.5278 55.4784 33.2513 176.8534 42 M 4.1100 8.6221 121.9687 56.5102 33.0654 177.7577 43 G 3.8490 7.9807 105.5552 45.2340 0.0000 171.8212 44 T 4.4262 8.1671 117.0648 62.9434 70.2218 173.9749 45 L 4.8660 8.6466 129.0475 54.2438 43.7240 175.4033 46 V 4.9671 9.1787 126.4633 61.1162 34.8083 174.2128 47 S 5.1157 8.9389 122.8679 57.2781 65.4297 173.1532 48 L 5.3201 9.2678 122.3885 53.0568 45.2172 175.3406 49 E 4.9508 9.0030 121.1991 53.6538 33.5426 173.0511 50 P 4.5272 0.0000 0.0000 63.0559 31.1420 176.3396 51 S 4.3680 9.3094 119.9820 58.6605 63.1063 174.9204 52 S 4.5142 8.5980 118.1996 59.7026 63.8153 175.7547 53 V 3.5559 7.7721 119.9119 65.1514 31.4748 175.1634 54 A 4.1726 7.1625 122.5490 52.7067 18.6483 176.9225 55 S 4.6347 8.2816 119.0918 59.5642 61.0773 175.6514 56 D 4.9962 7.0595 115.0593 53.7530 40.3488 176.6482 57 V 4.0409 7.3598 118.7601 61.7641 32.5055 176.0538 58 S 4.1758 8.8362 123.8022 60.4228 62.9401 174.2091 59 K 4.4462 7.7639 119.3584 54.0346 33.3273 174.4833 60 P 4.3645 0.0000 0.0000 62.4922 32.1538 176.6554 61 V 3.8951 8.1757 114.0483 61.6150 32.8179 175.0179 62 L 4.9906 8.3317 123.1912 53.7089 43.7812 176.0351 63 T 4.5265 8.9552 120.4326 62.8187 69.9316 173.8438 64 T 5.1773 8.5610 116.4464 59.7435 71.5704 173.4709 65 K 4.6033 8.7071 125.1096 54.6501 35.6172 175.0054 66 V 4.1784 8.5977 127.8919 62.8951 31.5018 175.2662 67 L 4.5850 9.0722 128.1129 55.8834 43.4676 177.0993 68 L 4.5004 7.7610 117.2564 54.7314 46.3145 176.8721 69 G 3.9251 8.7884 108.7459 44.2288 0.0000 171.8872 70 Q 4.0098 8.2987 118.2007 55.5424 29.0022 175.4969 71 D 4.6923 8.5873 123.8514 52.7812 39.5027 174.8368 72 E 4.8347 8.1548 123.3518 53.6416 33.2735 174.7549 73 P 4.4665 0.0000 0.0000 65.8802 31.8615 179.0173 74 L 4.0624 7.8797 115.7887 57.8419 41.4628 179.4091 75 I 3.7429 8.5419 118.7924 64.0752 37.7976 177.8364 76 H 4.1935 8.1150 117.0321 58.8244 28.6340 177.7952 77 V 3.6378 7.8628 119.6118 65.8360 31.3466 177.5657 78 F 4.0903 8.6775 120.4971 61.2268 39.2831 176.8446 79 A 3.9850 8.2802 120.2830 55.1757 18.1791 179.5225 80 K 3.8325 7.9536 116.8601 59.9771 31.9708 179.3157 81 N 4.3087 7.9201 115.0236 56.0844 38.4603 177.0403 82 L 4.0927 7.7192 121.0555 57.4468 42.3717 177.9602 83 V 4.1073 7.6660 108.4972 60.0761 33.3433 176.9156 84 A 3.9438 8.3447 125.2876 55.5389 17.9090 180.4030 85 F 4.2519 8.2474 112.3921 59.6472 38.0985 177.8108 86 V 2.3152 6.5204 118.3969 65.4537 31.2143 177.7437 87 S 3.7642 7.2672 112.6299 61.3850 62.0464 175.8311 88 Q 3.9473 7.7210 119.2706 59.3381 28.3223 178.8519 89 E 4.2795 8.4094 118.5790 58.3035 29.3782 177.9292 90 A 4.5467 7.2308 119.4591 51.5887 19.0102 177.2497 91 G 3.6755 7.7183 105.7582 49.2704 0.0000 174.1900 92 N 5.1133 8.1018 110.3426 52.1866 36.5556 175.1935 93 R 4.1327 7.0348 116.1104 56.4316 31.1229 176.8542 94 A 4.3192 8.2755 122.3345 51.9347 20.1599 176.6080 95 V 4.7732 8.7770 119.5039 60.8925 34.8835 174.1008 96 L 5.0252 8.6277 129.5572 53.2721 44.3688 174.4200 97 L 5.2069 9.3312 128.9314 53.2050 44.8421 174.5998 98 A 5.2671 8.9003 128.7212 50.2740 21.2387 175.7274 99 V 4.8633 8.8495 122.0198 60.4385 34.9268 174.7578 100 A 5.0697 9.4388 127.4948 49.4565 20.2439 172.9679 101 V 4.7011 7.9218 118.6255 61.3026 33.4537 175.0738 102 K 3.9757 9.2632 129.8576 58.8256 32.2592 176.4990 103 D 4.7429 7.8079 118.6621 52.1513 42.7635 175.4342 104 K 4.3067 8.3878 124.3355 56.0713 33.1746 177.2801 105 S 4.7280 8.3293 115.9952 56.1551 67.1181 175.0148 106 M 4.0337 8.6704 121.9069 58.9518 31.9704 178.2454 107 E 4.0542 8.2566 118.2270 59.4204 29.6641 179.4376 108 G 3.6669 8.4249 105.9773 47.6438 0.0000 175.3400 109 L 3.9659 8.6286 123.3108 57.8862 41.9930 179.2675 110 K 3.9272 8.0436 118.0347 59.4590 32.0779 179.1892 111 A 4.0212 8.1895 121.0402 55.1210 18.2756 179.6684 112 L 4.0039 8.3213 117.7725 58.1049 41.7550 179.7665 113 R 4.1890 8.1442 117.9362 59.6450 30.0892 178.9765 114 E 4.0145 8.0598 118.3506 59.2452 29.1727 179.5948 115 V 3.6421 7.4747 117.2440 65.9514 31.8350 177.6888 116 I 3.9753 8.0440 119.6655 64.5364 37.0114 178.1679 117 R 4.0476 8.3710 119.4190 59.7016 29.6970 178.7523 118 V 3.7139 7.6235 116.1578 65.1121 31.4328 176.6426 119 C 4.6483 7.6408 115.2176 58.1951 28.8438 173.2516 120 Q 2.5200 7.0991 122.3682 56.4990 28.6246 177.0638 121 V 4.4330 7.0093 119.7326 60.2949 33.0051 175.5533 122 W 4.7870 7.3106 122.1953 56.8730 27.9556 174.3124 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 4.35 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 2 E 8.64 3.96 0.00 2.03 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 2.29 2.42 0.00 3 D 8.08 4.72 0.00 2.65 2.57 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 4 T 7.40 4.73 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 1.21 0.00 0.00 5 P 0.00 4.38 0.00 2.04 2.00 0.00 3.65 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 6 L 8.36 4.49 0.00 1.64 1.72 0.94 0.85 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 7 V 7.35 4.48 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 0.71 0.00 0.00 0.70 0.00 0.00 8 I 7.87 4.40 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.61 0.87 0.00 0.00 9 S 8.42 5.08 0.00 3.78 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 10 K 9.11 4.85 0.00 1.80 1.58 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.29 1.28 7.81 11 Q 8.52 5.16 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.62 0.00 0.00 0.00 0.00 0.00 2.20 2.32 0.00 12 K 8.89 4.52 0.00 1.87 1.65 0.00 1.49 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.46 7.81 13 T 8.53 5.06 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 1.19 0.00 0.00 14 E 9.19 4.68 0.00 2.01 1.72 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 2.20 2.28 0.00 15 V 8.48 4.17 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 0.81 0.00 0.00 0.91 0.00 0.00 16 V 8.69 4.25 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 1.07 0.00 0.00 1.01 0.00 0.00 17 C 9.93 4.24 0.00 3.13 2.97 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 18 G 8.46 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 19 V 7.65 4.25 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 0.79 0.00 0.00 1.09 0.00 0.00 20 P 0.00 4.65 0.00 1.84 1.92 0.00 3.43 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 1.92 2.06 0.00 21 T 9.04 4.74 4.34 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 1.29 0.00 0.00 22 Q 9.06 4.94 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.75 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 23 V 8.86 4.97 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 1.06 0.00 0.00 0.98 0.00 0.00 24 V 8.91 4.93 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 0.99 0.00 0.00 0.96 0.00 0.00 25 C 9.31 5.50 0.00 3.11 3.02 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 26 T 9.13 4.97 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 0.71 0.00 0.00 27 A 8.51 4.91 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 28 F 9.19 4.79 0.00 3.26 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 29 S 9.08 4.03 0.00 3.89 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 30 S 8.19 4.75 0.00 3.90 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 31 H 8.08 5.35 0.00 3.10 3.17 0.00 5.78 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 I 8.51 4.92 1.68 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 0.97 0.53 0.89 0.00 0.00 33 L 8.96 4.97 0.00 2.00 1.83 1.00 0.72 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 34 V 8.72 4.82 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 0.93 0.00 0.00 0.86 0.00 0.00 35 V 9.07 4.82 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 0.99 0.00 0.00 0.98 0.00 0.00 36 V 9.24 4.75 2.18 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 1.07 0.00 0.00 1.00 0.00 0.00 37 T 9.10 4.96 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 38 Q 8.54 4.65 0.00 2.30 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 5.92 0.00 0.00 0.00 0.00 0.00 2.23 2.47 0.00 39 F 9.12 3.83 0.00 3.20 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 40 G 8.42 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 41 K 7.54 4.43 0.00 1.81 1.78 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.76 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.66 7.81 42 M 8.62 4.11 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.55 0.00 43 G 7.98 3.85 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 0.00 0.00 0.00 44 T 8.17 4.43 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 45 L 8.65 4.87 0.00 1.79 1.61 0.99 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 46 V 9.18 4.97 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 0.96 0.00 0.00 0.92 0.00 0.00 47 S 8.94 5.12 0.00 3.93 3.95 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 0.00 0.00 0.00 48 L 9.27 5.32 0.00 1.50 1.52 0.96 0.72 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 49 E 9.00 4.95 0.00 1.96 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 2.17 2.27 0.00 50 P 0.00 4.53 0.00 1.93 2.03 0.00 3.64 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.05 0.00 51 S 9.31 4.37 0.00 3.90 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 52 S 8.60 4.51 0.00 4.01 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 53 V 7.77 3.56 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 0.79 0.00 0.00 0.93 0.00 0.00 54 A 7.16 4.17 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.28 4.63 0.00 3.86 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.06 5.00 0.00 2.63 2.65 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 0.00 0.00 0.00 0.00 57 V 7.36 4.04 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 0.77 0.00 0.00 0.93 0.00 0.00 58 S 8.84 4.18 0.00 3.90 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 59 K 7.76 4.45 0.00 1.84 1.82 0.00 1.61 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.38 7.81 60 P 0.00 4.36 0.00 2.04 2.02 0.00 3.66 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 61 V 8.18 3.90 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 0.93 0.00 0.00 62 L 8.33 4.99 0.00 1.51 1.56 0.88 0.87 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 63 T 8.96 4.53 4.24 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 1.22 0.00 0.00 64 T 8.56 5.18 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 1.24 0.00 0.00 65 K 8.71 4.60 0.00 1.83 1.64 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.37 7.81 66 V 8.60 4.18 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 0.86 0.00 0.00 0.81 0.00 0.00 67 L 9.07 4.58 0.00 1.50 1.68 0.90 0.95 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 68 L 7.76 4.50 0.00 1.54 1.49 0.91 1.01 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 69 G 8.79 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 0.00 0.00 0.00 70 Q 8.30 4.01 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.98 0.00 0.00 0.00 0.00 0.00 2.35 2.27 0.00 71 D 8.59 4.69 0.00 2.65 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 E 8.15 4.83 0.00 2.18 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 2.25 2.38 0.00 73 P 0.00 4.47 0.00 2.21 2.15 0.00 3.61 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 2.12 0.00 74 L 7.88 4.06 0.00 1.93 1.74 0.92 0.65 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 75 I 8.54 3.74 2.01 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 1.52 1.25 0.97 0.00 0.00 76 H 8.11 4.19 0.00 3.44 3.36 0.00 5.68 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 V 7.86 3.64 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 1.09 0.00 0.00 0.97 0.00 0.00 78 F 8.68 4.09 0.00 3.25 3.19 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 79 A 8.28 3.99 1.44 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 80 K 7.95 3.83 0.00 2.10 1.88 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.51 7.81 81 N 7.92 4.31 0.00 2.79 2.78 0.00 0.00 7.07 7.13 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 82 L 7.72 4.09 0.00 1.28 1.68 0.83 0.89 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 83 V 7.67 4.11 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 0.62 0.00 0.00 0.91 0.00 0.00 84 A 8.34 3.94 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.25 4.25 0.00 3.33 3.26 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 0.00 86 V 6.52 2.32 1.56 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 -0.25 0.00 0.00 -0.11 0.00 0.00 87 S 7.27 3.76 0.00 3.71 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 88 Q 7.72 3.95 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 89 E 8.41 4.28 0.00 2.14 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 2.51 2.66 0.00 90 A 7.23 4.55 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 G 7.72 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 92 N 8.10 5.11 0.00 2.75 2.88 0.00 0.00 7.29 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 93 R 7.03 4.13 0.00 1.72 1.82 0.00 3.23 0.00 0.00 3.51 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 94 A 8.28 4.32 1.13 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 0.00 0.00 95 V 8.78 4.77 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 0.86 0.00 0.00 0.70 0.00 0.00 96 L 8.63 5.03 0.00 1.77 1.49 0.94 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 97 L 9.33 5.21 0.00 1.72 1.62 0.98 1.10 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 98 A 8.90 5.27 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 99 V 8.85 4.86 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 0.89 0.00 0.00 1.17 0.00 0.00 100 A 9.44 5.07 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 0.00 101 V 7.92 4.70 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 0.83 0.00 0.00 1.09 0.00 0.00 102 K 9.26 3.98 0.00 1.84 1.95 0.00 0.87 0.00 0.00 1.48 0.00 0.00 2.68 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.35 1.22 7.81 103 D 7.81 4.74 0.00 2.68 2.56 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 0.00 104 K 8.39 4.31 0.00 1.60 1.58 0.00 1.45 0.00 0.00 1.13 0.00 0.00 2.58 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 1.03 7.81 105 S 8.33 4.73 0.00 4.16 3.95 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 0.00 0.00 0.00 106 M 8.67 4.03 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.66 0.00 107 E 8.26 4.05 0.00 2.13 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 2.42 2.46 0.00 108 G 8.42 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 0.00 0.00 0.00 109 L 8.63 3.97 0.00 1.89 1.98 0.52 0.48 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 0.00 110 K 8.04 3.93 0.00 1.98 1.82 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.72 7.81 111 A 8.19 4.02 1.38 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 0.00 0.00 0.00 112 L 8.32 4.00 0.00 1.93 1.81 1.17 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 113 R 8.14 4.19 0.00 1.98 1.87 0.00 3.22 0.00 0.00 3.39 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 114 E 8.06 4.01 0.00 2.09 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 2.49 2.44 0.00 115 V 7.47 3.64 2.25 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 0.86 0.00 0.00 1.02 0.00 0.00 116 I 8.04 3.98 2.38 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.72 1.12 0.00 0.00 117 R 8.37 4.05 0.00 2.13 2.22 0.00 3.15 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 118 V 7.62 3.71 2.25 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 0.88 0.00 0.00 0.99 0.00 0.00 119 C 7.64 4.65 0.00 3.14 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 0.00 120 Q 7.10 2.52 0.00 1.68 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.11 7.42 0.00 0.00 0.00 0.00 0.00 1.48 1.16 0.00 121 V 7.01 4.43 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 0.87 0.00 0.00 1.18 0.00 0.00 122 W 7.31 4.79 0.00 3.29 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