NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9089 8.3393 109.7357 44.8625 0.0000 173.2673 2 S 3.8644 8.4551 121.2515 56.4559 63.0285 173.3617 3 S 4.2206 8.7967 120.5887 61.2588 64.4907 172.8495 4 G 3.7421 8.6819 113.3485 43.9802 0.0000 171.1844 5 S 4.1189 8.6837 116.5850 59.1843 62.8806 173.8331 6 S 4.8328 8.7467 120.5928 56.7749 67.1552 173.3569 7 G 3.9787 7.6969 107.9411 44.4302 0.0000 177.1814 8 Q 4.3651 8.2319 122.4732 54.6988 29.5898 173.6192 9 K 4.1967 8.1696 122.9236 57.7802 33.8777 177.4854 10 N 4.2336 7.1653 113.3428 51.5764 38.9688 172.7858 11 P 4.3327 0.0000 0.0000 65.7049 31.9982 176.0082 12 D 4.5786 7.7210 114.6710 54.9105 46.5736 175.0622 13 S 4.2487 7.9069 113.7612 57.8206 62.4246 173.0814 14 Y 3.8312 8.8245 126.3998 58.9972 36.0303 171.4137 15 N 3.9804 8.5708 126.4282 52.9609 38.0432 174.5938 16 G 3.5428 7.5221 110.0780 45.8191 0.0000 170.3572 17 A 4.6746 6.4457 118.8548 50.2736 21.2249 176.4163 18 V 4.5435 7.8525 118.6911 61.3057 34.5749 174.8803 19 R 4.5737 8.0872 123.4583 55.4226 34.4858 175.5842 20 E 4.3933 8.1233 118.7164 53.8053 28.2184 173.4345 21 N 4.6507 7.5817 125.7490 53.8501 45.7800 173.6336 22 Y 4.7663 7.2152 111.9098 56.5326 40.5396 173.5909 23 T 4.6144 8.5824 121.1441 63.0756 69.5260 173.5402 24 W 5.9915 8.3478 117.7155 57.2624 31.9058 173.1351 25 S 3.9546 8.7012 113.6198 56.9259 66.0447 172.2473 26 Q 4.7844 7.9940 121.9500 54.6599 30.8021 174.1342 27 D 4.8797 8.0867 125.0146 52.0828 43.9598 174.5607 28 Y 3.7800 7.7972 114.3786 62.2023 38.6578 177.5221 29 T 4.7058 8.5338 111.4061 57.6985 69.0523 173.2232 30 D 4.9808 6.6783 130.0304 54.0397 41.5846 177.1004 31 L 5.1450 7.5269 120.1753 53.0522 46.0501 175.2487 32 E 4.8477 8.9034 121.6584 54.6634 32.7503 174.3628 33 V 5.1174 8.4898 126.5531 60.0079 34.3551 174.6645 34 R 5.0538 8.9527 123.9216 54.3199 32.6562 174.7678 35 V 4.7786 8.6077 124.2882 60.2779 33.9224 173.0187 36 P 4.5700 0.0000 0.0000 62.9272 32.0897 175.8334 37 V 4.7060 8.0904 114.7925 58.7319 35.4775 173.7032 38 P 4.5276 0.0000 0.0000 62.3854 32.3174 176.6388 39 K 4.4366 8.4573 115.5608 56.8630 31.6733 177.3311 40 H 4.7384 7.8856 112.8897 55.0269 29.7018 173.8487 41 V 4.2569 7.3866 121.7224 61.7087 31.7923 175.8380 42 V 4.1504 8.3020 118.9235 62.5694 34.4908 176.8884 43 K 4.3157 7.8549 118.2285 55.7494 32.8917 178.0779 44 G 3.9115 8.5641 110.3437 47.3969 0.0000 175.5509 45 K 4.2562 7.9752 117.8976 58.7553 33.1831 177.8780 46 Q 4.2682 7.9193 118.5986 57.2503 29.1469 175.6023 47 V 4.8678 7.4023 110.1340 59.6095 35.4322 175.1578 48 S 4.6713 8.6717 119.2384 56.7275 65.6017 173.4925 49 V 4.6890 8.2575 123.0104 59.9186 33.2998 174.0221 50 A 4.6403 8.2390 130.3442 50.1298 21.1497 174.9967 51 L 4.6623 8.4582 122.2471 53.4540 44.0809 175.0512 52 S 4.5144 8.3433 118.9843 57.6845 65.8519 174.4011 53 S 4.7875 7.1461 121.2213 58.8583 64.6320 179.3478 54 S 5.2588 7.5340 116.5628 55.5902 62.9282 172.5747 55 S 4.9987 7.8314 110.3387 56.8290 66.2457 172.5904 56 I 5.0123 8.2686 120.8010 58.6041 42.1152 173.6753 57 R 4.7008 8.1694 126.0499 54.6701 33.8788 173.8983 58 V 4.3296 9.1250 125.6317 61.3803 34.3583 173.6134 59 A 5.3948 8.6332 128.9070 50.3081 23.1379 174.2175 60 M 5.2189 9.0808 115.8996 53.4976 35.0910 174.4354 61 L 4.3655 9.4386 123.2040 55.1346 42.0002 176.3210 62 E 4.2697 8.8710 124.6417 56.8654 30.1907 175.7403 63 E 4.6773 7.3527 122.0813 56.7759 37.3905 175.9929 64 N 4.7926 8.0580 116.3411 53.9411 40.8971 175.2629 65 G 3.8298 7.2801 110.0268 45.3550 0.0000 172.5273 66 E 5.0611 8.4097 124.0545 55.7882 32.5185 173.8852 67 R 4.5767 9.0090 119.0308 54.9191 34.0463 174.4284 68 V 4.2870 8.3864 125.8303 61.8996 30.7738 175.5910 69 L 4.2564 8.6201 127.2727 57.3431 42.0407 177.2223 70 M 4.7363 8.2227 117.7403 53.9070 35.5275 173.2333 71 E 4.8363 7.9730 124.0407 54.9644 32.6921 173.6503 72 G 4.3125 7.4638 111.6861 43.3804 0.0000 172.6754 73 K 4.2190 7.9748 121.2847 55.8289 32.5549 177.5070 74 L 4.5672 8.4066 124.6770 54.5158 42.3893 177.7257 75 T 3.7224 7.9273 110.8877 64.5395 69.1014 173.6945 76 H 4.5532 6.2589 117.2789 53.7087 32.4113 172.4783 77 K 5.2217 8.6016 118.6708 55.5408 33.2707 175.5729 78 I 4.7032 7.7765 112.1225 60.1929 40.6419 174.6984 79 N 4.8697 8.3724 116.7807 51.3308 37.8538 174.9666 80 T 3.7405 8.1231 111.8425 64.6138 69.3262 175.9849 81 E 4.1247 8.3479 120.1269 59.4546 29.5453 178.7171 82 S 4.2655 9.1970 114.2764 61.2799 63.1304 175.3848 83 S 4.6450 8.4121 116.6959 58.6590 63.6103 173.4301 84 L 4.9214 8.5202 121.6073 55.0992 44.4408 174.3271 85 W 5.2971 8.1459 112.7374 56.0292 30.6190 174.0754 86 S 4.0749 9.3336 119.8913 56.3168 66.0547 172.6178 87 L 4.8391 7.7047 125.8569 53.6557 43.4806 175.1154 88 E 4.8406 8.2818 125.0187 53.6573 32.1511 174.1069 89 P 4.4942 0.0000 0.0000 63.4441 32.2633 176.5212 90 G 4.1170 8.5818 113.3037 45.8970 0.0000 173.3390 91 K 4.8593 8.1244 117.8434 56.1603 38.4170 178.4136 92 C 5.0724 9.1369 122.5050 58.6459 33.8912 174.0643 93 V 4.4782 9.5745 119.8866 61.3731 33.3924 174.0119 94 L 5.1443 9.2810 129.3195 53.2997 44.4437 175.1414 95 V 4.9282 8.4606 125.1826 61.4253 34.9838 173.4509 96 N 5.1568 9.2880 126.1637 51.6552 40.7214 173.7606 97 L 4.8274 8.1874 123.9623 52.9392 44.4531 175.3438 98 S 4.6439 8.4753 119.2781 56.1992 63.6841 173.8155 99 K 4.2581 8.5339 127.0918 56.9062 32.5095 177.3820 100 V 4.2795 9.3175 114.6674 59.9120 32.3786 176.4014 101 G 3.8168 7.5586 107.9069 45.0260 0.0000 173.8968 102 E 4.5922 8.5741 121.8045 55.2455 28.6367 174.7442 103 Y 4.7244 8.4585 119.9124 55.6574 41.7786 175.7278 104 W 4.6455 8.8705 132.1339 55.7749 30.2876 176.2693 105 W 4.5078 8.2479 128.2566 55.5707 27.3355 177.2205 106 N 4.5094 8.8213 120.9688 54.5790 37.4298 174.7580 107 A 4.8736 7.2471 120.0975 52.1634 22.8589 176.1562 108 I 3.8207 7.7225 118.7440 63.3723 37.6945 176.7280 109 L 4.8608 7.2858 117.7498 53.2226 43.8942 176.7764 110 E 4.2907 9.0121 121.4215 54.2618 28.1429 177.5645 111 G 5.0628 6.5670 110.5421 46.5918 0.0000 171.2744 112 E 4.7137 7.9574 119.1263 53.2978 32.7299 174.5792 113 E 3.9513 9.0165 124.2785 56.1958 30.1010 175.2151 114 P 4.7615 0.0000 0.0000 62.0524 32.1160 176.2737 115 I 3.8435 8.3357 117.0508 61.1003 37.9906 175.7739 116 D 4.4453 8.7324 119.8711 57.2977 41.3353 176.7493 117 I 3.7074 7.5969 117.2267 62.1985 37.4418 174.3389 118 D 4.7623 8.4728 122.1597 53.2930 44.2101 172.9417 119 S 4.8250 7.5628 115.5908 55.6271 66.5600 176.6963 120 G 4.1492 8.0048 111.8026 44.1041 0.0000 173.8872 121 P 4.4310 0.0000 0.0000 62.5801 31.9909 175.1197 122 S 4.3473 8.3567 116.0475 60.4270 65.5954 175.0606 123 S 4.1280 8.3685 112.8771 61.5073 62.1046 174.3128 124 G 3.7275 7.8803 111.5534 45.7603 0.0000 173.0645 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 G 8.34 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 2 S 8.46 3.86 0.00 4.06 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 3 S 8.80 4.22 0.00 3.94 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 4 G 8.68 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.68 4.12 0.00 3.87 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 6 S 8.75 4.83 0.00 3.79 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 7 G 7.70 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 8 Q 8.23 4.37 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.92 0.00 0.00 0.00 0.00 0.00 2.20 2.31 0.00 9 K 8.17 4.20 0.00 1.83 1.86 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.77 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.25 1.24 7.81 10 N 7.17 4.23 0.00 2.72 2.66 0.00 0.00 5.98 7.51 0.00 0.00 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 P 0.00 4.33 0.00 2.16 2.17 0.00 3.67 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.90 0.00 12 D 7.72 4.58 0.00 2.56 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 13 S 7.91 4.25 0.00 3.85 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 14 Y 8.82 3.83 0.00 2.90 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 15 N 8.57 3.98 0.00 2.86 2.79 0.00 0.00 7.06 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 16 G 7.52 3.54 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 0.00 0.00 0.00 17 A 6.45 4.67 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 18 V 7.85 4.54 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 0.80 0.00 0.00 0.87 0.00 0.00 19 R 8.09 4.57 0.00 1.59 1.64 0.00 3.37 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.48 0.00 20 E 8.12 4.39 0.00 2.07 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 2.21 2.23 0.00 21 N 7.58 4.65 0.00 2.64 2.79 0.00 0.00 7.51 7.78 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 22 Y 7.22 4.77 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 23 T 8.58 4.61 4.32 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 0.00 0.00 0.00 1.27 0.00 0.00 24 W 8.35 5.99 0.00 3.56 3.32 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 0.00 0.00 0.00 0.00 25 S 8.70 3.95 0.00 3.68 3.73 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 0.00 0.00 0.00 26 Q 7.99 4.78 0.00 2.21 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 5.11 0.00 0.00 0.00 0.00 0.00 2.02 2.32 0.00 27 D 8.09 4.88 0.00 2.75 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 28 Y 7.80 3.78 0.00 2.97 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 29 T 8.53 4.71 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 1.32 0.00 0.00 30 D 6.68 4.98 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 31 L 7.53 5.14 0.00 1.42 1.84 -0.18 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.90 4.85 0.00 1.98 1.80 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 2.23 2.25 0.00 33 V 8.49 5.12 2.33 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 0.79 0.00 0.00 1.16 0.00 0.00 34 R 8.95 5.05 0.00 1.86 1.92 0.00 3.15 0.00 0.00 3.15 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 35 V 8.61 4.78 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 1.02 0.00 0.00 1.01 0.00 0.00 36 P 0.00 4.57 0.00 2.15 2.07 0.00 3.84 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 2.03 2.04 0.00 37 V 8.09 4.71 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 1.07 0.00 0.00 38 P 0.00 4.53 0.00 2.00 2.17 0.00 3.60 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 1.48 1.88 0.00 39 K 8.46 4.44 0.00 1.76 1.88 0.00 1.61 0.00 0.00 1.77 0.00 0.00 3.12 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.48 7.81 40 H 7.89 4.74 0.00 3.22 3.39 0.00 5.50 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 7.39 4.26 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 1.01 0.00 0.00 0.86 0.00 0.00 42 V 8.30 4.15 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 0.77 0.00 0.00 0.95 0.00 0.00 43 K 7.85 4.32 0.00 1.82 1.75 0.00 1.69 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.39 7.81 44 G 8.56 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 45 K 7.98 4.26 0.00 1.92 1.99 0.00 1.60 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.50 7.81 46 Q 7.92 4.27 0.00 2.29 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 7.05 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 47 V 7.40 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 0.77 0.00 0.00 1.33 0.00 0.00 48 S 8.67 4.67 0.00 3.63 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 49 V 8.26 4.69 0.67 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 -0.31 0.00 0.00 -0.89 0.00 0.00 50 A 8.24 4.64 1.14 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 0.00 0.00 51 L 8.46 4.66 0.00 1.47 1.54 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.34 4.51 0.00 3.92 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 53 S 7.15 4.79 0.00 3.97 4.05 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 54 S 7.53 5.26 0.00 3.84 3.73 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 0.00 0.00 0.00 55 S 7.83 5.00 0.00 3.83 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 56 I 8.27 5.01 1.80 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 2.31 0.77 0.00 0.00 57 R 8.17 4.70 0.00 1.75 1.54 0.00 3.09 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 58 V 9.13 4.33 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 0.78 0.00 0.00 59 A 8.63 5.39 1.20 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 0.00 0.00 0.00 0.00 0.00 0.00 60 M 9.08 5.22 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 61 L 9.44 4.37 0.00 1.50 1.67 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.87 4.27 0.00 1.98 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 0.00 2.34 2.40 0.00 63 E 7.35 4.68 0.00 1.82 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 2.11 2.17 0.00 64 N 8.06 4.79 0.00 2.69 2.80 0.00 0.00 6.71 7.98 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 65 G 7.28 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 0.00 0.00 0.00 66 E 8.41 5.06 0.00 2.04 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 2.18 2.23 0.00 67 R 9.01 4.58 0.00 1.85 1.75 0.00 3.10 0.00 0.00 3.12 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 68 V 8.39 4.29 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 0.82 0.00 0.00 0.91 0.00 0.00 69 L 8.62 4.26 0.00 1.59 1.77 0.99 0.90 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 70 M 8.22 4.74 0.00 1.84 1.69 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.91 0.00 71 E 7.97 4.84 0.00 1.83 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 2.34 2.15 0.00 72 G 7.46 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 0.00 0.00 0.00 0.00 73 K 7.97 4.22 0.00 1.77 1.68 0.00 1.63 0.00 0.00 1.77 0.00 0.00 3.11 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.41 7.81 74 L 8.41 4.57 0.00 1.64 1.56 1.07 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 75 T 7.93 3.72 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 0.96 0.00 0.00 76 H 6.26 4.55 0.00 2.40 2.93 0.00 5.61 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 K 8.60 5.22 0.00 1.71 1.74 0.00 1.75 0.00 0.00 2.41 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.35 7.81 78 I 7.78 4.70 1.95 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 1.37 0.61 1.03 0.00 0.00 79 N 8.37 4.87 0.00 2.70 2.70 0.00 0.00 7.35 6.73 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 80 T 8.12 3.74 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 81 E 8.35 4.12 0.00 2.21 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 2.33 2.35 0.00 82 S 9.20 4.27 0.00 4.01 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 83 S 8.41 4.64 0.00 3.84 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 84 L 8.52 4.92 0.00 1.74 1.76 0.88 1.24 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 85 W 8.15 5.30 0.00 3.47 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 86 S 9.33 4.07 0.00 3.58 3.55 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.70 4.84 0.00 1.52 1.23 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 88 E 8.28 4.84 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 2.18 2.28 0.00 89 P 0.00 4.49 0.00 2.17 2.06 0.00 3.90 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 1.97 1.94 0.00 90 G 8.58 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 91 K 8.12 4.86 0.00 1.64 1.48 0.00 1.73 0.00 0.00 1.88 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.38 7.81 92 C 9.14 5.07 0.00 3.04 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 93 V 9.57 4.48 2.21 0.00 0.00 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 1.15 0.00 0.00 94 L 9.28 5.14 0.00 1.69 1.59 0.97 0.78 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 95 V 8.46 4.93 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 0.89 0.00 0.00 1.06 0.00 0.00 96 N 9.29 5.16 0.00 2.66 2.70 0.00 0.00 6.45 6.30 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 97 L 8.19 4.83 0.00 1.26 1.19 0.80 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 98 S 8.48 4.64 0.00 3.87 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.53 4.26 0.00 1.77 1.86 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.80 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.88 1.11 7.81 100 V 9.32 4.28 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 0.77 0.00 0.00 0.76 0.00 0.00 101 G 7.56 3.82 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 0.00 0.00 0.00 102 E 8.57 4.59 0.00 2.02 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 2.37 2.41 0.00 103 Y 8.46 4.72 0.00 3.15 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 0.00 104 W 8.87 4.65 0.00 3.48 3.07 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 0.00 105 W 8.25 4.51 0.00 3.53 3.30 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 0.00 106 N 8.82 4.51 0.00 3.20 3.47 0.00 0.00 6.08 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 0.00 107 A 7.25 4.87 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 108 I 7.72 3.82 1.52 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.30 0.73 0.00 0.00 109 L 7.29 4.86 0.00 1.61 1.61 0.84 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 110 E 9.01 4.29 0.00 1.94 1.86 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 2.20 2.28 0.00 111 G 6.57 5.06 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 0.00 0.00 0.00 112 E 7.96 4.71 0.00 1.96 1.86 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 2.38 2.49 0.00 113 E 9.02 3.95 0.00 2.06 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 2.37 2.39 0.00 114 P 0.00 4.76 0.00 2.30 2.18 0.00 3.86 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 2.05 2.01 0.00 115 I 8.34 3.84 1.88 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 1.62 1.00 1.01 0.00 0.00 116 D 8.73 4.45 0.00 2.68 2.75 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 0.00 117 I 7.60 3.71 1.92 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 1.31 0.88 1.08 0.00 0.00 118 D 8.47 4.76 0.00 2.79 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 0.00 119 S 7.56 4.83 0.00 3.49 3.35 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 0.00 120 G 8.00 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 0.00 121 P 0.00 4.43 0.00 2.15 2.02 0.00 3.67 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 122 S 8.36 4.35 0.00 3.65 3.74 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 0.00 0.00 0.00 0.00 123 S 8.37 4.13 0.00 3.78 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 0.00 124 G 7.88 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00