NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 S 4.4343 8.1927 115.2965 57.9451 64.0045 175.1441 4 K 3.7767 8.2741 121.2292 57.1681 32.7246 177.0979 5 G 4.1542 8.5847 107.2220 48.7615 0.0000 174.9561 6 T 3.9273 8.1240 117.3673 66.8504 68.6290 176.0497 7 R 3.7892 7.9889 120.0826 59.7561 29.8142 178.3556 8 F 4.4610 8.2706 116.7456 59.9830 39.1924 177.5058 9 E 3.9757 8.4242 118.4333 59.7036 29.1382 179.4621 10 R 3.9764 8.0486 116.6840 59.3980 30.3566 178.6606 11 D 4.5499 8.0234 118.2900 57.4002 40.8611 178.4988 12 L 3.4904 8.1303 120.8949 58.0283 41.8443 178.6680 13 L 4.0030 7.9121 118.8576 58.1015 41.4907 179.8763 14 V 3.6895 7.7371 117.4211 65.9677 31.2863 177.7320 15 E 4.0224 8.1152 116.5268 59.5631 29.6114 178.7192 16 L 4.0847 8.1135 118.9704 58.0235 41.6507 179.7647 17 W 4.4805 8.5651 120.1283 59.2337 28.7408 178.7161 18 K 4.1557 8.4908 117.6568 58.5349 31.6037 178.1884 19 A 4.4994 7.9249 119.2086 51.8713 18.9387 177.7103 20 G 3.7156 7.7106 106.3909 44.9500 0.0000 173.4377 21 F 4.2151 7.7702 118.8570 55.2459 40.7746 174.9515 22 A 2.5800 7.8419 126.7253 51.6619 18.8557 176.0487 23 A 5.2726 7.1729 123.1589 50.6803 22.9891 174.5615 24 I 4.7921 8.5144 111.4508 59.8478 41.6598 173.9278 25 R 4.9127 8.4662 121.4596 54.7918 31.9459 176.1660 26 V 4.0299 8.2497 123.0832 62.0863 32.3954 175.8709 27 A 4.3231 8.7549 130.6662 51.9964 19.8280 177.0796 28 G 3.9030 8.7816 105.8593 46.4620 0.0000 174.9178 29 S 4.2096 7.7588 114.0988 60.9747 63.2967 176.0507 30 G 3.6248 8.2970 106.8077 47.5076 0.0000 175.3787 31 V 3.8108 8.5311 124.5279 62.3167 30.5149 173.9421 32 S 4.8534 7.9433 118.6083 55.4111 65.0579 172.2361 33 P 4.2194 0.0000 0.0000 63.3784 31.4076 175.4533 34 F 4.8529 7.6595 116.0312 55.8136 43.2500 171.7345 35 P 4.4316 0.0000 0.0000 63.2131 31.3618 176.4952 36 C 4.0422 8.2579 121.0434 57.8706 31.2946 172.4148 37 P 4.4781 0.0000 0.0000 62.2430 32.8585 175.1871 38 D 4.6174 8.5526 116.6249 56.7991 42.2723 177.2012 39 I 5.1372 7.3657 116.7702 59.6829 42.1876 174.4914 40 V 4.9156 8.4472 123.4562 61.3473 35.0172 174.1103 41 A 5.1603 8.7292 127.0816 51.0477 23.0956 175.1483 42 G 4.7974 9.0267 105.5304 45.0029 0.0000 173.5476 43 N 4.5048 8.4824 119.4971 51.9325 37.7725 174.7578 44 G 3.9298 7.8227 107.7486 45.3846 0.0000 174.7928 45 R 4.3038 7.5245 116.1440 56.5170 32.4204 176.1082 46 T 4.7314 8.3247 113.2798 61.7058 72.7640 172.9335 47 Y 5.3107 8.6316 120.8700 56.2566 42.3783 174.2737 48 L 5.2686 9.4155 123.2837 52.9305 45.1288 175.2615 49 A 4.8407 8.5762 126.5996 50.9235 20.7783 175.9815 50 I 5.0847 8.3840 122.2792 59.4314 41.7311 173.9613 51 E 4.8617 9.4404 127.8621 54.5141 31.4677 174.6339 52 V 4.7795 8.9822 127.9833 61.8832 33.1928 175.3375 53 K 4.7466 9.2777 125.7899 55.0262 36.7473 174.6815 54 M 4.8807 8.6068 123.5942 53.6788 34.0626 174.7797 55 R 4.5798 8.3472 123.8805 54.0923 33.9517 176.8512 56 K 3.9051 8.7684 121.9938 59.3951 32.3830 177.0570 57 E 4.5602 7.2570 112.5190 54.8620 31.7009 174.7465 58 L 4.2562 8.0440 120.3507 54.1360 42.5934 174.8378 59 P 4.6097 0.0000 0.0000 62.0087 33.4086 174.6144 60 L 4.5495 8.2219 122.6647 53.6437 43.8320 174.5658 61 Y 5.1306 8.6095 123.7299 56.4900 40.2963 175.1526 62 L 4.9083 8.9940 123.1701 52.5597 45.2978 176.2312 63 S 4.7007 8.3777 119.3751 59.0347 63.7036 175.1821 64 A 4.5682 9.4152 125.5079 56.1493 18.0568 179.2752 65 D 5.0753 8.3758 116.6838 57.0637 41.1470 177.9757 66 E 3.8608 8.1981 119.0601 59.5731 29.6726 179.5992 67 V 3.4678 7.6528 117.5056 65.7481 31.4394 177.5075 68 E 3.9595 8.1564 118.4463 59.8473 29.3969 179.4746 69 Q 4.0389 8.3952 118.0241 58.8639 28.6729 178.8347 70 L 3.9682 7.8725 121.3025 58.2016 42.2046 179.2697 71 V 3.5456 8.0922 118.4979 66.1507 31.6041 177.8021 72 T 3.8868 8.5788 115.9977 66.8040 68.3052 176.1925 73 F 4.0249 8.4812 121.8384 61.2619 39.5514 176.7425 74 A 4.1365 8.8461 121.0864 55.4819 17.6478 179.6224 75 R 3.9368 8.6360 116.6474 59.4036 29.9814 179.2199 76 G 3.5008 7.5422 103.4507 48.1350 0.0000 175.1185 77 F 3.8911 7.8669 122.8414 58.3670 39.8611 175.4566 78 G 3.7481 8.3451 105.3550 45.7439 0.0000 171.6900 79 A 5.0639 7.9228 118.5837 50.0835 23.5068 176.3408 80 E 4.5111 9.1593 118.5663 54.6801 30.8816 176.2830 81 A 4.3807 8.5099 127.4402 52.4611 19.6782 175.6623 82 Y 5.1142 9.2252 119.5043 56.3100 43.1763 174.3287 83 V 4.9818 9.5124 122.0994 61.2346 34.3825 173.9958 84 A 4.9972 8.9594 130.0892 50.3727 20.9754 175.1358 85 L 5.2070 9.2932 125.5297 53.1422 45.3458 175.0517 86 K 4.2356 8.6684 126.8104 54.5077 34.5974 174.3290 87 L 4.5431 7.9859 127.4053 52.6021 43.4708 176.1430 88 P 3.5779 0.0000 0.0000 65.4273 32.4817 176.9436 89 R 3.9434 7.6904 123.7413 58.4498 30.7651 177.0445 90 K 4.3979 7.6313 116.9319 54.9595 33.8154 175.7076 91 K 4.3968 8.1087 119.4632 54.8681 33.4022 176.7458 92 W 4.2584 8.5714 120.3477 57.1549 29.4821 175.8700 93 R 4.5445 8.8150 124.8427 54.3495 32.5358 174.2112 94 F 5.1774 8.6464 124.5718 55.6225 41.9585 174.3498 95 F 5.2073 9.4868 122.5117 55.0189 42.0291 173.3488 96 P 4.4695 0.0000 0.0000 62.0436 31.9527 178.0296 97 V 3.5816 7.8501 114.2588 63.9580 31.6886 178.7586 98 Q 4.0144 7.9741 117.1459 58.9312 28.5574 176.8031 99 M 4.3076 8.4855 116.7938 56.2884 32.6636 176.0456 100 L 4.3881 7.3945 118.0974 55.4054 42.8019 176.0879 101 E 4.7766 8.7103 120.8836 54.6149 32.3430 175.1356 102 R 4.3011 8.5299 124.6772 56.0316 30.8423 176.3941 103 T 4.4340 8.4322 119.5352 61.1250 70.9714 173.6808 104 E 4.0473 8.8080 119.4702 59.4716 29.6367 178.7983 105 K 4.5884 7.4655 115.5975 56.0083 33.5265 175.2059 106 N 4.7765 7.3053 116.8577 53.9030 43.5769 172.9844 107 F 5.4737 8.8040 117.6628 56.9509 44.0530 173.9734 108 K 4.8933 8.9232 117.2437 56.3225 36.2776 174.7929 109 I 4.5420 8.4179 121.9937 59.9200 40.3586 174.1750 110 D 5.4767 8.1149 129.2963 51.6234 41.7802 176.1016 111 E 3.9618 8.7799 117.0063 59.7254 29.5513 178.2024 112 S 4.3930 8.1357 112.1499 59.4548 64.0502 174.9138 113 V 4.2076 7.6629 120.1102 64.4277 33.4405 176.4816 114 Y 4.4180 8.4314 121.2063 60.5012 38.7755 176.6915 115 P 4.3698 0.0000 0.0000 65.3990 31.4957 176.7687 116 L 4.4205 7.8439 116.9384 56.1105 40.6726 176.9961 117 G 3.3993 7.4686 105.9396 46.2726 0.0000 173.8109 118 L 5.0108 7.9436 120.0148 52.9598 44.4116 176.6464 119 E 4.5463 9.3739 121.9311 55.8674 30.1792 177.9794 120 I 3.1551 8.7282 120.5856 64.1041 37.9629 177.9764 121 A 4.0932 7.9244 121.2730 54.8288 18.0752 179.3010 122 E 4.0251 7.9003 116.2927 59.2868 29.6985 178.8680 123 V 3.5716 7.2399 116.8932 65.9660 31.4944 177.7429 124 A 4.3815 7.5552 117.9305 54.1632 19.6973 178.3934 125 G 4.2176 7.4353 103.2862 44.3435 0.0000 171.9239 126 K 4.4472 7.8984 119.1437 58.9610 35.0195 177.1586 127 F 4.3187 8.3610 118.2872 56.1276 37.5801 175.1325 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 3 S 8.19 4.43 0.00 3.89 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 4 K 8.27 3.78 0.00 2.05 1.92 0.00 1.74 0.00 0.00 1.88 0.00 0.00 2.76 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.81 1.95 7.81 5 G 8.58 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 6 T 8.12 3.93 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 1.23 0.00 0.00 7 R 7.99 3.79 0.00 1.80 1.87 0.00 2.96 0.00 0.00 2.93 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.48 0.00 8 F 8.27 4.46 0.00 3.46 3.56 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 9 E 8.42 3.98 0.00 2.24 2.02 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 2.39 2.72 0.00 10 R 8.05 3.98 0.00 1.91 2.01 0.00 3.17 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.86 0.00 11 D 8.02 4.55 0.00 3.21 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 12 L 8.13 3.49 0.00 0.39 1.47 0.33 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.91 4.00 0.00 2.01 1.90 0.98 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 14 V 7.74 3.69 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 1.17 0.00 0.00 1.02 0.00 0.00 15 E 8.12 4.02 0.00 2.08 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 2.59 2.56 0.00 16 L 8.11 4.08 0.00 1.79 1.59 0.69 0.41 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 17 W 8.57 4.48 0.00 3.61 3.29 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 18 K 8.49 4.16 0.00 2.06 1.93 0.00 1.74 0.00 0.00 1.78 0.00 0.00 3.11 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.54 7.81 19 A 7.92 4.50 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 20 G 7.71 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 21 F 7.77 4.22 0.00 2.78 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 22 A 7.84 2.58 0.99 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 23 A 7.17 5.27 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 24 I 8.51 4.79 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.57 1.03 0.00 0.00 25 R 8.47 4.91 0.00 1.73 1.89 0.00 3.44 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 26 V 8.25 4.03 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 0.63 0.00 0.00 0.82 0.00 0.00 27 A 8.75 4.32 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 G 8.78 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 0.00 0.00 0.00 29 S 7.76 4.21 0.00 4.12 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 30 G 8.30 3.62 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 0.00 0.00 0.00 31 V 8.53 3.81 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 0.78 0.00 0.00 0.93 0.00 0.00 32 S 7.94 4.85 0.00 4.25 3.69 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 33 P 0.00 4.22 0.00 1.66 1.76 0.00 3.83 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 34 F 7.66 4.85 0.00 3.11 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 35 P 0.00 4.43 0.00 2.39 2.31 0.00 4.00 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.26 0.00 36 C 8.26 4.04 0.00 2.86 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 37 P 0.00 4.48 0.00 2.16 1.85 0.00 2.72 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.21 0.00 38 D 8.55 4.62 0.00 2.71 2.72 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 39 I 7.37 5.14 1.79 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.06 0.91 0.00 0.00 40 V 8.45 4.92 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 0.68 0.00 0.00 0.73 0.00 0.00 41 A 8.73 5.16 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 42 G 9.03 4.80 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 0.00 0.00 0.00 43 N 8.48 4.50 0.00 2.07 1.42 0.00 0.00 6.41 7.00 0.00 0.00 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 G 7.82 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 45 R 7.52 4.30 0.00 1.40 1.18 0.00 2.94 0.00 0.00 3.33 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.41 0.00 46 T 8.32 4.73 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 1.29 0.00 0.00 47 Y 8.63 5.31 0.00 3.08 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 48 L 9.42 5.27 0.00 1.35 1.52 -0.09 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 49 A 8.58 4.84 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 50 I 8.38 5.08 1.83 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 1.17 0.98 0.95 0.00 0.00 51 E 9.44 4.86 0.00 2.02 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 2.21 2.28 0.00 52 V 8.98 4.78 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 0.98 0.00 0.00 0.88 0.00 0.00 53 K 9.28 4.75 0.00 1.69 1.61 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.54 7.81 54 M 8.61 4.88 0.00 1.32 0.73 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.51 0.00 55 R 8.35 4.58 0.00 1.59 1.80 0.00 3.30 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.62 0.00 56 K 8.77 3.91 0.00 1.68 1.81 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.39 7.81 57 E 7.26 4.56 0.00 1.93 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 0.00 2.10 2.24 0.00 58 L 8.04 4.26 0.00 1.54 1.49 0.74 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 59 P 0.00 4.61 0.00 1.34 1.75 0.00 3.48 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.99 0.00 60 L 8.22 4.55 0.00 1.66 1.39 0.90 0.80 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 61 Y 8.61 5.13 0.00 2.90 2.86 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 0.00 0.00 0.00 62 L 8.99 4.91 0.00 1.63 1.56 0.89 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 63 S 8.38 4.70 0.00 3.98 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 64 A 9.42 4.57 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.38 5.08 0.00 2.84 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 66 E 8.20 3.86 0.00 2.14 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 0.00 2.32 2.38 0.00 67 V 7.65 3.47 1.74 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 0.59 0.00 0.00 0.55 0.00 0.00 68 E 8.16 3.96 0.00 2.26 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 0.00 2.41 2.69 0.00 69 Q 8.40 4.04 0.00 2.25 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.64 0.00 70 L 7.87 3.97 0.00 1.76 1.77 0.91 0.98 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 71 V 8.09 3.55 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 0.78 0.00 0.00 0.95 0.00 0.00 72 T 8.58 3.89 4.53 0.00 0.00 0.00 0.00 0.00 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 73 F 8.48 4.02 0.00 3.26 3.24 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 74 A 8.85 4.14 1.47 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 0.00 0.00 75 R 8.64 3.94 0.00 2.03 1.98 0.00 3.15 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 76 G 7.54 3.50 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 0.00 0.00 0.00 0.00 77 F 7.87 3.89 0.00 2.06 2.72 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 78 G 8.35 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 0.00 0.00 0.00 79 A 7.92 5.06 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 80 E 9.16 4.51 0.00 1.99 1.73 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 2.28 2.33 0.00 81 A 8.51 4.38 1.22 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 82 Y 9.23 5.11 0.00 3.04 2.83 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 83 V 9.51 4.98 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 1.10 0.00 0.00 0.98 0.00 0.00 84 A 8.96 5.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 L 9.29 5.21 0.00 1.90 1.93 0.93 0.18 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 86 K 8.67 4.24 0.00 0.79 0.82 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.36 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.57 0.83 7.81 87 L 7.99 4.54 0.00 1.46 1.34 -0.07 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 88 P 0.00 3.58 0.00 1.99 1.88 0.00 3.59 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.05 0.00 89 R 7.69 3.94 0.00 1.75 1.92 0.00 3.21 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 90 K 7.63 4.40 0.00 1.85 1.87 0.00 1.80 0.00 0.00 1.88 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.35 7.81 91 K 8.11 4.40 0.00 1.78 1.82 0.00 1.79 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.48 7.81 92 W 8.57 4.26 0.00 3.14 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 93 R 8.81 4.54 0.00 1.66 1.67 0.00 2.65 0.00 0.00 2.84 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.54 0.00 94 F 8.65 5.18 0.00 2.64 2.46 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 95 F 9.49 5.21 0.00 2.97 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 96 P 0.00 4.47 0.00 2.14 1.68 0.00 3.78 0.00 0.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.27 0.00 97 V 7.85 3.58 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 0.85 0.00 0.00 0.86 0.00 0.00 98 Q 7.97 4.01 0.00 2.17 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.01 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 99 M 8.49 4.31 0.00 2.18 2.24 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.66 0.00 100 L 7.39 4.39 0.00 1.71 1.74 0.73 0.99 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 0.00 101 E 8.71 4.78 0.00 2.08 1.84 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 2.26 2.25 0.00 102 R 8.53 4.30 0.00 1.69 1.74 0.00 2.47 0.00 0.00 2.32 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.43 0.00 103 T 8.43 4.43 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 1.43 0.00 0.00 104 E 8.81 4.05 0.00 1.94 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 2.29 2.22 0.00 105 K 7.47 4.59 0.00 1.79 1.80 0.00 1.59 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.24 1.37 7.81 106 N 7.31 4.78 0.00 2.66 3.07 0.00 0.00 6.81 7.93 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 0.00 107 F 8.80 5.47 0.00 2.91 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 0.00 108 K 8.92 4.89 0.00 1.26 1.75 0.00 1.16 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.29 7.81 109 I 8.42 4.54 1.54 0.00 0.00 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 0.98 0.46 0.39 0.00 0.00 110 D 8.11 5.48 0.00 2.79 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 0.00 111 E 8.78 3.96 0.00 1.94 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 0.00 2.29 2.32 0.00 112 S 8.14 4.39 0.00 4.02 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 0.00 113 V 7.66 4.21 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 1.05 0.00 0.00 0.97 0.00 0.00 114 Y 8.43 4.42 0.00 3.14 3.04 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 0.00 115 P 0.00 4.37 0.00 2.15 2.17 0.00 3.91 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.21 0.00 116 L 7.84 4.42 0.00 1.81 1.79 1.06 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 117 G 7.47 3.40 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 0.00 0.00 0.00 118 L 7.94 5.01 0.00 1.68 1.53 1.07 1.22 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 0.00 119 E 9.37 4.55 0.00 1.91 1.91 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 2.33 2.51 0.00 120 I 8.73 3.16 2.09 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 1.38 0.78 0.96 0.00 0.00 121 A 7.92 4.09 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 0.00 122 E 7.90 4.03 0.00 2.09 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 2.31 2.36 0.00 123 V 7.24 3.57 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 0.20 0.00 0.00 0.14 0.00 0.00 124 A 7.56 4.38 1.34 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 0.00 0.00 125 G 7.44 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 0.00 126 K 7.90 4.45 0.00 1.93 2.14 0.00 1.75 0.00 0.00 1.86 0.00 0.00 3.17 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.56 7.81 127 F 8.36 4.32 0.00 3.24 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