NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.3274 8.3231 115.4181 58.3299 64.4183 173.2220 5 G 3.4109 8.0358 108.5312 45.8759 0.0000 170.1201 6 Y 4.1571 8.0366 123.5817 57.6389 41.0870 173.7631 7 V 3.6415 7.6353 126.6039 60.8541 31.6324 173.4971 8 P 4.3018 0.0000 0.0000 64.0247 31.5775 177.2868 9 G 4.0318 9.2040 110.9338 45.6739 0.0000 174.5950 10 S 4.2668 7.8734 114.2777 59.5632 63.8558 173.7791 11 V 4.8825 8.1032 121.7969 61.2749 34.1435 174.5587 12 S 5.3148 9.3048 121.7753 56.6936 67.4272 172.5652 13 A 5.1182 9.1501 123.5983 50.3119 21.0727 175.4871 14 A 5.1244 9.0167 125.0942 50.3456 22.0001 175.3301 15 F 5.2682 9.6044 120.7109 55.7882 42.0716 175.1878 16 V 5.4649 8.5012 121.8634 60.7901 34.8219 173.9492 17 T 4.8226 8.6192 124.7206 62.9568 69.6109 173.9328 18 C 4.6874 8.8821 123.6380 56.9838 31.6069 173.5651 19 P 4.4176 0.0000 0.0000 65.5103 31.4965 176.0810 20 N 4.8659 7.4482 115.0163 50.8723 41.2403 174.8666 21 E 4.0302 8.6440 119.3323 58.9289 29.5806 179.3732 22 K 3.8820 8.0729 119.5797 59.4630 32.3093 178.7233 23 V 3.4624 8.5097 118.4933 65.8740 31.5303 177.3934 24 A 3.9174 7.6143 120.2163 55.5414 18.1174 179.6386 25 K 3.9222 8.0445 116.4228 59.8037 32.1159 179.5108 26 E 3.9846 7.9853 118.2264 59.4465 29.4495 179.4228 27 I 3.8230 8.2855 120.1224 64.2533 37.2119 178.4209 28 A 4.0382 8.5979 122.1082 55.0998 18.2437 179.8701 29 R 3.8541 8.2783 116.5613 59.4972 30.2100 179.2475 30 A 4.0065 7.9227 120.0397 55.1552 18.3868 180.0237 31 V 3.6915 8.0641 110.7529 63.7741 31.5487 179.2574 32 V 3.8330 7.6152 113.6074 63.3858 31.4710 177.7269 33 E 3.8453 7.6932 117.6639 59.5810 29.5417 178.9536 34 K 3.9935 8.0686 115.2312 56.4679 32.2341 177.1423 35 R 3.8102 7.8765 117.6654 57.3820 27.6784 177.0368 36 L 4.2535 8.2587 117.6103 55.4237 42.4130 176.9567 37 A 4.6016 7.4427 119.6699 50.9607 22.0578 176.9803 38 A 3.6583 8.1780 124.2096 54.9884 19.0682 177.8340 39 C 4.9484 7.5139 112.9330 58.7071 35.0929 173.1697 40 V 4.8730 8.3519 123.4895 61.4742 34.5998 173.5492 41 N 5.0856 9.2491 124.9968 51.4953 41.3129 173.4126 42 L 5.0318 8.5158 122.9422 53.3357 43.8204 176.1062 43 I 4.5020 9.1496 125.0707 58.9312 39.2707 173.6423 44 P 4.6844 0.0000 0.0000 62.5723 32.8850 175.8624 45 Q 3.8660 8.7913 118.3238 56.2402 27.2096 172.6674 46 I 4.3312 7.8591 109.8066 60.1557 39.6868 174.4987 47 T 5.0257 8.4067 120.4739 62.2144 70.3712 173.9488 48 S 4.9322 8.8752 122.7085 57.3672 65.3055 173.4332 49 I 5.2403 8.1638 123.1247 60.0240 40.6519 173.9985 50 Y 4.7827 7.9506 122.2569 56.1695 41.9794 172.6590 51 E 4.9883 8.7553 121.8573 55.1411 31.7060 174.9693 52 W 5.1227 9.4446 135.0000 56.5499 33.8239 174.8972 53 K 3.5882 8.5038 125.7509 57.8885 30.4175 176.0640 54 G 3.8844 8.1445 103.6428 46.4289 0.0000 172.9948 55 K 4.7190 7.5585 117.8369 54.6307 36.6446 175.4219 56 I 4.3226 8.2649 121.9794 61.1870 37.5934 175.5225 57 E 4.5225 9.3311 127.9275 54.9519 32.4293 175.6802 58 E 4.8106 8.3958 120.5854 55.6569 32.5088 174.3683 59 D 5.2175 9.0814 125.0143 52.4218 44.3773 175.5568 60 S 5.3075 8.5512 115.0059 57.1458 65.2328 172.9358 61 E 4.9893 9.6652 121.9645 55.3670 34.8204 173.7241 62 V 4.8418 8.5652 119.5519 61.1602 34.9771 173.8653 63 L 5.0103 8.9584 128.5927 53.5934 44.8744 174.6845 64 M 4.9284 8.9829 126.2311 54.0614 34.3243 174.5311 65 M 4.5352 9.1500 123.8963 53.6942 34.7634 174.3187 66 I 4.8795 8.6746 127.1258 59.4204 40.6994 174.5280 67 K 4.9760 8.5170 125.9636 55.2391 34.0051 175.5780 68 T 4.8531 8.4810 118.2030 60.8563 71.8938 172.4787 69 Q 4.3791 8.4970 121.8356 55.7815 29.5255 178.0337 70 S 4.1598 9.0058 119.3995 61.7317 62.6535 177.2122 71 S 4.1798 8.1382 115.4215 60.9103 62.7075 175.4644 72 L 4.4014 7.7955 120.9076 54.8943 41.8043 178.4716 73 V 3.6004 7.7143 119.8360 65.3681 31.4393 175.8186 74 P 4.2151 0.0000 0.0000 65.7978 31.2430 178.4193 75 A 4.1365 7.9336 118.8523 54.6714 18.3190 178.8845 76 L 3.9435 8.2592 119.5355 59.0330 42.0005 179.5344 77 T 3.8913 8.4269 115.8718 66.6258 68.2649 176.5412 78 E 3.9870 8.3290 119.6130 59.2507 29.3854 178.9440 79 F 4.1547 8.1289 120.9311 60.6814 39.9084 177.1075 80 V 3.5193 8.0795 118.1655 66.1619 31.3829 178.1697 81 R 3.9231 8.2783 118.2382 58.9930 29.6992 178.3073 82 S 4.5575 7.2664 111.4617 59.0107 63.5249 174.9730 83 V 4.1529 7.0085 118.0617 61.5994 33.2164 175.3359 84 H 4.2964 7.8864 121.2661 54.4317 30.1626 173.9355 85 P 4.5060 0.0000 0.0000 64.8176 31.1902 176.3093 86 Y 4.4127 7.9700 115.6612 57.5355 38.2900 176.6767 87 E 3.8430 8.4478 117.5479 57.3741 29.9046 174.4824 88 V 4.2805 7.2063 115.4467 60.6292 31.4699 173.3907 89 A 3.9611 7.8646 125.2608 51.0070 19.4039 177.2972 90 E 4.0337 8.6810 123.0318 56.7874 30.1831 175.1405 91 V 5.1107 8.2287 126.4277 60.8282 34.0368 174.4905 92 I 4.8903 8.8290 120.6022 59.0676 41.1265 174.1017 93 A 5.2970 8.6939 124.9031 50.2474 22.1091 175.1482 94 L 4.9488 8.9755 121.9968 52.1134 45.0925 174.2810 95 P 4.7491 0.0000 0.0000 62.5328 32.7590 176.0257 96 V 3.9977 9.0407 124.1382 62.3916 31.6726 176.3865 97 E 4.2964 9.0430 128.6179 58.5506 29.9886 176.6512 98 Q 4.8109 7.9532 114.6646 53.7979 33.4764 174.8880 99 G 3.8017 7.5896 104.0088 45.5274 0.0000 172.2206 100 N 4.5679 8.0647 120.5775 52.2212 39.6707 174.5744 101 P 4.3049 0.0000 0.0000 65.3438 31.6286 176.9154 102 P 4.4653 0.0000 0.0000 65.8750 31.0939 177.7789 103 Y 4.2235 8.0807 119.1596 60.6891 38.9065 177.7613 104 L 3.8347 8.0579 119.9820 57.7452 41.7118 178.8947 105 H 4.2392 8.8006 118.9253 58.7260 29.7463 177.0835 106 W 4.0476 8.1927 130.3367 60.3618 30.3042 177.7585 107 V 2.8347 7.4774 117.0614 66.1740 31.1540 176.8297 108 H 4.0582 7.8180 117.2700 59.5345 29.4572 176.8634 109 Q 3.8578 7.7306 119.2621 59.0411 28.4318 178.7888 110 V 3.9124 6.9996 109.6360 61.7052 31.6487 176.6059 111 T 4.3703 7.0443 107.2789 60.9023 69.4902 173.6556 112 E 3.9545 7.6954 128.5598 56.6674 29.5455 175.8118 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 4 S 8.32 4.33 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 5 G 8.04 3.41 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 0.00 6 Y 8.04 4.16 0.00 2.94 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 7 V 7.64 3.64 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 0.79 0.00 0.00 0.81 0.00 0.00 8 P 0.00 4.30 0.00 2.03 2.09 0.00 3.61 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.08 0.00 9 G 9.20 4.03 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 0.00 0.00 0.00 10 S 7.87 4.27 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 11 V 8.10 4.88 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 0.98 0.00 0.00 1.03 0.00 0.00 12 S 9.30 5.31 0.00 3.74 3.80 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 13 A 9.15 5.12 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 14 A 9.02 5.12 1.19 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 0.00 0.00 15 F 9.60 5.27 0.00 2.97 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 16 V 8.50 5.46 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 1.09 0.00 0.00 0.94 0.00 0.00 17 T 8.62 4.82 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 1.25 0.00 0.00 18 C 8.88 4.69 0.00 2.72 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.42 0.00 2.28 2.49 0.00 3.52 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.98 0.00 20 N 7.45 4.87 0.00 2.98 2.95 0.00 0.00 6.31 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 21 E 8.64 4.03 0.00 2.04 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 2.40 2.37 0.00 22 K 8.07 3.88 0.00 1.81 1.93 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.60 7.81 23 V 8.51 3.46 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 0.74 0.00 0.00 0.91 0.00 0.00 24 A 7.61 3.92 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 25 K 8.04 3.92 0.00 2.23 1.88 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.50 7.81 26 E 7.99 3.98 0.00 2.34 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 2.33 2.35 0.00 27 I 8.29 3.82 1.97 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.96 0.96 0.00 0.00 28 A 8.60 4.04 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 29 R 8.28 3.85 0.00 1.94 2.00 0.00 3.14 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 30 A 7.92 4.01 1.50 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 31 V 8.06 3.69 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 1.00 0.00 0.00 0.99 0.00 0.00 32 V 7.62 3.83 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 1.09 0.00 0.00 0.93 0.00 0.00 33 E 7.69 3.85 0.00 1.93 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 0.00 2.29 2.36 0.00 34 K 8.07 3.99 0.00 1.37 1.58 0.00 0.83 0.00 0.00 1.25 0.00 0.00 2.92 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.27 1.47 7.81 35 R 7.88 3.81 0.00 1.82 2.05 0.00 3.12 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.49 0.00 36 L 8.26 4.25 0.00 1.58 1.63 0.68 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 37 A 7.44 4.60 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 38 A 8.18 3.66 0.71 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 39 C 7.51 4.95 0.00 3.44 2.95 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 40 V 8.35 4.87 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 0.85 0.00 0.00 0.94 0.00 0.00 41 N 9.25 5.09 0.00 2.63 2.68 0.00 0.00 6.66 6.77 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 42 L 8.52 5.03 0.00 1.53 1.60 0.93 0.81 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 43 I 9.15 4.50 2.01 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.91 0.95 0.00 0.00 44 P 0.00 4.68 0.00 2.09 2.26 0.00 3.82 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 1.98 1.97 0.00 45 Q 8.79 3.87 0.00 2.20 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.95 0.00 0.00 0.00 0.00 0.00 2.21 2.40 0.00 46 I 7.86 4.33 1.90 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 1.33 0.73 0.99 0.00 0.00 47 T 8.41 5.03 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 48 S 8.88 4.93 0.00 4.10 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 49 I 8.16 5.24 1.92 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 1.41 0.63 0.91 0.00 0.00 50 Y 7.95 4.78 0.00 3.07 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 51 E 8.76 4.99 0.00 2.13 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 2.35 2.32 0.00 52 W 9.44 5.12 0.00 3.51 2.89 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 53 K 8.50 3.59 0.00 1.78 1.40 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.06 1.31 7.81 54 G 8.14 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 0.00 0.00 0.00 55 K 7.56 4.72 0.00 1.79 1.83 0.00 1.28 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.27 1.51 7.81 56 I 8.26 4.32 1.82 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.79 0.85 0.00 0.00 57 E 9.33 4.52 0.00 1.16 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 2.16 2.39 0.00 58 E 8.40 4.81 0.00 1.77 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 2.17 2.28 0.00 59 D 9.08 5.22 0.00 3.01 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 60 S 8.55 5.31 0.00 3.88 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 E 9.67 4.99 0.00 1.92 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 2.51 2.37 0.00 62 V 8.57 4.84 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 1.11 0.00 0.00 0.92 0.00 0.00 63 L 8.96 5.01 0.00 1.81 1.54 1.09 0.98 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 64 M 8.98 4.93 0.00 1.99 1.96 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 2.54 2.46 0.00 65 M 9.15 4.54 0.00 1.87 1.65 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 1.32 2.13 0.00 66 I 8.67 4.88 1.81 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 1.20 0.48 0.88 0.00 0.00 67 K 8.52 4.98 0.00 1.83 1.73 0.00 1.58 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.62 1.54 7.81 68 T 8.48 4.85 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 1.18 0.00 0.00 69 Q 8.50 4.38 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.67 0.00 0.00 0.00 0.00 0.00 2.45 2.28 0.00 70 S 9.01 4.16 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 71 S 8.14 4.18 0.00 4.00 4.01 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 72 L 7.80 4.40 0.00 1.95 1.69 0.87 0.60 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 73 V 7.71 3.60 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 0.99 0.00 0.00 0.94 0.00 0.00 74 P 0.00 4.22 0.00 2.20 2.10 0.00 3.74 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 75 A 7.93 4.14 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 76 L 8.26 3.94 0.00 1.93 1.89 0.92 0.75 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 77 T 8.43 3.89 4.47 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 1.21 0.00 0.00 78 E 8.33 3.99 0.00 2.23 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 2.38 2.36 0.00 79 F 8.13 4.15 0.00 3.10 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 80 V 8.08 3.52 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 0.95 0.00 0.00 1.05 0.00 0.00 81 R 8.28 3.92 0.00 2.00 1.93 0.00 3.15 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 82 S 7.27 4.56 0.00 3.92 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 83 V 7.01 4.15 1.67 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 0.30 0.00 0.00 0.65 0.00 0.00 84 H 7.89 4.30 0.00 3.34 3.12 0.00 5.78 0.00 0.00 0.00 0.00 6.73 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 4.51 0.00 2.33 2.17 0.00 3.23 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.90 0.00 86 Y 7.97 4.41 0.00 2.77 2.90 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 87 E 8.45 3.84 0.00 2.03 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 2.17 2.31 0.00 88 V 7.21 4.28 1.96 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 0.82 0.00 0.00 0.87 0.00 0.00 89 A 7.86 3.96 0.93 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 90 E 8.68 4.03 0.00 2.04 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.30 0.00 91 V 8.23 5.11 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 0.92 0.00 0.00 0.91 0.00 0.00 92 I 8.83 4.89 1.93 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.99 0.94 0.00 0.00 93 A 8.69 5.30 1.23 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 0.00 0.00 0.00 94 L 8.98 4.95 0.00 1.92 1.66 1.19 1.33 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 95 P 0.00 4.75 0.00 2.13 2.09 0.00 3.81 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 2.03 2.00 0.00 96 V 9.04 4.00 2.32 0.00 0.00 0.00 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 0.99 0.00 0.00 97 E 9.04 4.30 0.00 2.08 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 0.00 2.36 2.32 0.00 98 Q 7.95 4.81 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.00 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 99 G 7.59 3.80 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 0.00 100 N 8.06 4.57 0.00 2.79 2.75 0.00 0.00 6.93 7.71 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 0.00 101 P 0.00 4.30 0.00 2.25 2.18 0.00 3.68 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.21 0.00 102 P 0.00 4.47 0.00 2.33 2.37 0.00 3.65 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.06 0.00 103 Y 8.08 4.22 0.00 3.10 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 0.00 104 L 8.06 3.83 0.00 1.86 1.68 0.79 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 105 H 8.80 4.24 0.00 3.33 3.53 0.00 5.79 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 W 8.19 4.05 0.00 3.48 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 0.00 107 V 7.48 2.83 2.03 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 0.68 0.00 0.00 0.54 0.00 0.00 108 H 7.82 4.06 0.00 3.27 3.36 0.00 5.85 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 Q 7.73 3.86 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.69 0.00 0.00 0.00 0.00 0.00 2.23 2.51 0.00 110 V 7.00 3.91 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 0.13 0.00 0.00 -0.20 0.00 0.00 111 T 7.04 4.37 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 1.03 0.00 0.00 112 E 7.70 3.95 0.00 1.91 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 2.11 2.22 0.00