NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.6615 8.4244 117.7960 52.3465 39.4365 173.7027 4 E 4.5049 8.3077 117.8809 55.4205 30.4074 172.0658 5 K 5.5100 10.2962 127.4200 54.5148 34.8384 175.3922 6 I 5.0735 8.0999 123.6542 59.4870 41.7351 173.5977 7 L 5.2467 8.7358 127.8737 53.4401 44.8652 175.1326 8 I 4.6586 8.6182 126.8873 59.8204 39.3741 174.6540 9 V 4.6058 8.4624 128.8307 61.7377 32.8294 174.3007 10 D 4.8860 9.0637 125.6571 53.5693 44.7181 175.0714 11 D 4.2809 9.1365 126.4764 57.7405 41.6584 177.0510 12 Q 4.2971 7.9989 118.8102 54.9897 29.6878 176.8159 13 S 4.2253 8.8767 122.2753 61.6838 62.9934 176.6903 14 G 3.7805 8.2132 107.8984 48.1214 0.0000 175.5080 15 I 3.8411 7.7678 115.6741 63.2559 37.7503 177.9132 16 R 3.9748 8.0533 120.5080 59.5476 30.0300 178.7013 17 I 3.7242 8.2697 119.8035 64.1286 37.1259 178.5924 18 L 3.8984 7.9839 120.0493 57.6285 41.5203 179.1464 19 L 3.4244 8.2362 119.6958 57.6141 41.4567 178.8636 20 N 4.2532 8.1680 116.9241 57.0621 38.9768 176.5626 21 E 3.9329 8.0279 119.8608 58.6693 29.5910 179.0406 22 V 3.3764 7.2595 118.4117 66.1353 31.6045 178.1176 23 F 4.7663 7.8088 117.3737 60.4214 38.7019 177.6198 24 N 4.6643 8.4033 117.9067 55.6274 38.1279 177.2595 25 K 3.9046 7.7260 119.5580 59.5752 32.4381 178.2753 26 E 4.1327 8.1493 118.2029 57.8513 29.6205 176.7453 27 G 3.6368 7.2128 104.2264 45.2026 0.0000 173.3140 28 Y 4.6638 8.4530 119.4898 56.8633 40.0234 174.6624 29 Q 4.4764 8.9532 125.5152 56.1346 30.1016 174.9804 30 T 5.3066 8.0473 115.3996 59.0657 72.3028 172.8605 31 F 5.1191 8.1802 118.5728 56.1939 43.7115 173.6905 32 Q 5.2673 8.8441 118.2169 54.4909 32.8121 174.3926 33 A 4.8849 9.1836 121.4825 50.7200 22.8370 176.6948 34 A 4.9630 9.0249 119.7349 50.6904 20.8078 175.9899 35 N 5.0884 7.7240 112.8518 50.2580 41.5816 175.2773 36 G 3.8245 8.8428 109.3479 48.8260 0.0000 176.1137 37 L 4.0657 7.9189 124.0598 59.2863 41.0396 181.3401 38 Q 4.1413 9.6963 119.3862 58.7137 28.7941 178.8123 39 A 4.1120 8.4063 122.0297 55.5906 18.4352 179.6719 40 L 4.0195 8.3132 119.4811 58.5734 41.5676 180.1523 41 D 4.2972 8.7139 121.4085 58.5557 39.8308 180.8326 42 I 3.6085 8.5035 121.9827 64.2398 37.0592 178.4298 43 V 3.4945 7.7170 118.7706 66.4712 31.0255 178.3295 44 T 3.8822 7.5741 116.0497 67.2553 68.5654 177.4811 45 K 4.2729 8.6742 126.3127 59.1809 31.8102 179.7084 46 E 4.5954 8.3937 109.9189 55.1431 33.7535 180.9438 47 R 3.9872 7.8832 115.1479 57.0473 27.6584 173.8264 48 P 4.6427 0.0000 0.0000 62.8248 32.8151 176.9920 49 D 4.6294 8.5587 118.4621 56.5458 42.2361 175.9419 50 L 5.3447 8.3162 119.0708 53.6132 46.7765 175.5910 51 V 4.9336 8.7069 120.6185 60.4696 35.2449 173.0410 52 L 5.0040 9.0771 125.4572 53.0618 43.9689 175.4718 53 L 4.7413 9.0923 128.2103 53.2528 42.4705 174.5625 54 D 4.6768 8.6452 126.4250 54.9268 40.9541 176.3016 55 M 4.1383 9.0837 128.8192 57.6614 32.3526 177.3945 56 K 4.4193 7.7471 120.4417 52.6085 31.2618 178.8578 57 I 4.2627 6.9777 125.4853 58.2166 37.4761 172.6980 58 P 4.0260 0.0000 0.0000 63.5062 28.4271 175.9763 59 G 3.9078 8.9916 110.8274 45.2900 0.0000 171.3026 60 M 4.4638 7.9073 119.1338 53.4785 33.9872 175.6001 61 D 4.7963 8.4171 125.3741 52.7822 41.7984 176.8790 62 G 3.6220 8.3962 114.5759 47.0481 0.0000 173.5033 63 I 3.6758 7.7543 121.8885 64.6524 37.2369 177.9539 64 E 4.0781 8.1707 119.0196 59.5780 29.1207 179.6793 65 I 3.7797 7.4584 119.9781 63.8567 37.2271 177.8779 66 L 3.9189 8.3263 121.6299 58.1528 41.8837 179.2242 67 K 3.9116 8.4058 118.4941 59.7757 32.1596 179.4684 68 R 4.0783 8.1231 118.1769 59.5750 29.8111 179.1200 69 M 4.0713 8.3107 118.7437 58.0230 31.6010 178.7154 70 K 3.9078 7.9955 118.6356 59.6482 32.0655 179.2014 71 V 3.8029 8.0394 117.1934 66.4058 31.3555 177.6937 72 I 3.9956 7.4233 117.5838 63.0630 37.1579 176.8226 73 D 4.7161 8.7946 120.7974 56.1145 42.3417 177.1401 74 E 4.3575 9.4895 120.3049 56.0538 29.1337 177.0397 75 N 4.6124 7.6689 115.5498 53.5073 38.2057 175.2708 76 I 3.7578 7.6008 119.6049 61.9445 38.9211 174.8860 77 R 4.6822 8.7173 127.3547 54.5746 32.0246 175.3545 78 V 4.7552 8.2879 123.8426 59.8826 34.4751 174.7861 79 I 4.7344 8.8042 124.4641 59.2980 40.3645 175.0029 80 I 4.4268 8.0118 121.1936 60.7759 39.6986 174.9621 81 M 5.2282 9.1074 124.1695 54.1063 34.1182 175.0073 82 T 5.0261 8.6865 113.8822 59.2826 72.3488 173.7155 83 A 3.9199 8.4860 123.9900 51.6434 19.3307 175.4764 84 Y 4.3498 8.4932 124.3624 55.0709 37.6269 178.2569 85 G 3.9130 8.3034 115.5703 48.3962 0.0000 171.2531 86 E 3.6314 8.2388 115.3668 57.2504 25.6489 174.7176 87 L 3.5449 7.0170 119.4320 59.7686 42.5626 177.2763 88 D 4.3368 8.0196 117.5152 57.5625 41.1817 178.4238 89 M 3.9768 8.9746 119.0585 58.5801 32.1723 178.3669 90 I 3.5770 7.6450 119.8989 64.3312 37.2158 177.8513 91 Q 3.8743 7.6063 119.7479 59.2813 28.7838 177.9017 92 E 4.1557 8.3459 120.1712 59.7795 29.7188 178.9775 93 S 4.0870 8.2036 114.9549 61.6825 62.8662 177.0933 94 K 4.0355 8.4524 121.5144 59.4256 31.5947 179.2417 95 E 4.0163 8.5974 118.7156 59.2300 29.4687 178.6792 96 L 4.2893 7.8783 116.6493 54.7667 41.9891 177.4251 97 G 3.9967 7.8483 105.9935 45.0053 0.0000 174.4292 98 A 4.1989 8.2570 124.0345 52.0273 18.9880 177.7581 99 L 4.1501 8.7292 123.7663 58.1959 42.1810 176.8202 100 T 4.4155 6.8659 110.6676 61.9776 70.8473 171.2017 101 H 5.0156 8.7507 114.6986 54.0601 32.0979 172.6493 102 F 5.2125 8.9678 118.1236 55.8610 42.0685 174.4474 103 A 5.1840 8.7862 124.4511 50.9170 21.0597 176.1633 104 K 4.5256 9.4143 119.9197 53.5109 34.8641 174.7623 105 P 4.2510 0.0000 0.0000 62.2848 31.8602 176.2279 106 F 4.3294 7.9147 119.6663 58.2304 39.6848 175.2156 107 D 4.7633 8.0828 119.9448 51.0955 41.1968 175.5069 108 I 3.4781 7.9341 124.4998 64.2232 37.4679 176.7762 109 D 4.4537 7.9439 121.7561 57.6295 40.4588 179.3799 110 E 3.9649 8.3904 118.8437 61.2802 29.1126 181.2674 111 I 3.1525 7.5677 120.7600 64.2262 36.8086 178.6304 112 R 4.6900 7.3534 117.0254 59.2603 30.1961 178.6193 113 D 4.5320 8.0550 118.0008 57.9962 40.8969 177.8756 114 A 4.2216 9.2148 121.7641 55.6565 18.2236 179.3626 115 V 3.7381 10.0347 118.0339 66.7964 31.4278 179.6724 116 K 4.1141 7.9957 122.6218 59.2754 31.5971 182.5041 117 K 4.2365 8.5244 119.6852 60.0582 32.3109 178.4513 118 Y 4.2523 7.9805 115.1837 59.6374 39.3091 176.0238 119 L 4.8099 8.4741 120.4969 52.0526 42.0181 173.6913 120 P 4.3658 0.0000 0.0000 62.6176 31.9878 176.9478 121 L 4.1169 8.5647 125.4796 56.9550 41.4021 177.7961 122 K 4.2529 8.8632 125.0538 54.6930 32.3819 172.9144 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 N 8.42 4.66 0.00 2.76 2.70 0.00 0.00 6.48 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 4 E 8.31 4.50 0.00 2.15 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 2.46 2.87 0.00 5 K 10.30 5.51 0.00 2.12 2.25 0.00 1.55 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.79 1.41 7.81 6 I 8.10 5.07 1.62 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.57 0.58 0.00 0.00 7 L 8.74 5.25 0.00 1.85 1.55 0.99 1.03 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 8 I 8.62 4.66 1.96 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 1.28 0.66 1.01 0.00 0.00 9 V 8.46 4.61 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 0.94 0.00 0.00 0.97 0.00 0.00 10 D 9.06 4.89 0.00 2.82 2.51 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 0.00 0.00 0.00 0.00 11 D 9.14 4.28 0.00 3.00 2.70 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 12 Q 8.00 4.30 0.00 2.32 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.53 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 13 S 8.88 4.23 0.00 3.87 3.94 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 0.00 0.00 0.00 14 G 8.21 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 0.00 0.00 0.00 15 I 7.77 3.84 2.49 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 1.87 1.31 1.06 0.00 0.00 16 R 8.05 3.97 0.00 2.06 2.16 0.00 3.23 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.73 0.00 17 I 8.27 3.72 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 1.53 0.89 0.90 0.00 0.00 18 L 7.98 3.90 0.00 1.77 1.57 0.93 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.24 3.42 0.00 1.64 1.50 0.84 -0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 20 N 8.17 4.25 0.00 2.87 2.95 0.00 0.00 6.87 7.61 0.00 0.00 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 8.03 3.93 0.00 2.09 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 2.27 2.32 0.00 22 V 7.26 3.38 1.69 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 0.58 0.00 0.00 0.67 0.00 0.00 23 F 7.81 4.77 0.00 3.19 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 24 N 8.40 4.66 0.00 2.84 2.87 0.00 0.00 6.54 6.49 0.00 0.00 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 7.73 3.90 0.00 1.93 1.94 0.00 1.79 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.43 7.81 26 E 8.15 4.13 0.00 2.27 2.54 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 2.62 2.52 0.00 27 G 7.21 3.64 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 0.00 0.00 0.00 28 Y 8.45 4.66 0.00 3.00 2.87 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 29 Q 8.95 4.48 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.62 0.00 0.00 0.00 0.00 0.00 1.70 1.96 0.00 30 T 8.05 5.31 4.21 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 0.00 0.00 0.00 1.28 0.00 0.00 31 F 8.18 5.12 0.00 3.00 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 32 Q 8.84 5.27 0.00 1.94 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 33 A 9.18 4.88 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 34 A 9.02 4.96 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 35 N 7.72 5.09 0.00 2.96 2.90 0.00 0.00 6.10 6.94 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 36 G 8.84 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 37 L 7.92 4.07 0.00 1.67 1.65 0.92 0.84 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 38 Q 9.70 4.14 0.00 2.02 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.39 2.83 0.00 39 A 8.41 4.11 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 40 L 8.31 4.02 0.00 1.79 1.72 0.91 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 41 D 8.71 4.30 0.00 2.64 2.67 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 42 I 8.50 3.61 1.80 0.00 0.00 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 1.36 0.67 0.52 0.00 0.00 43 V 7.72 3.49 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 1.10 0.00 0.00 0.94 0.00 0.00 44 T 7.57 3.88 4.26 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 1.18 0.00 0.00 45 K 8.67 4.27 0.00 1.79 1.72 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.32 7.81 46 E 8.39 4.60 0.00 1.86 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 2.15 2.14 0.00 47 R 7.88 3.99 0.00 1.88 1.95 0.00 3.30 0.00 0.00 3.27 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 48 P 0.00 4.64 0.00 2.43 2.30 0.00 3.69 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 49 D 8.56 4.63 0.00 2.86 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 50 L 8.32 5.34 0.00 1.63 1.29 0.83 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.71 4.93 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 0.71 0.00 0.00 0.94 0.00 0.00 52 L 9.08 5.00 0.00 1.75 1.77 1.30 0.56 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 53 L 9.09 4.74 0.00 1.66 1.57 0.95 1.22 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 54 D 8.65 4.68 0.00 3.06 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 55 M 9.08 4.14 0.00 2.06 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 2.62 2.88 0.00 56 K 7.75 4.42 0.00 1.70 1.61 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.25 7.81 57 I 6.98 4.26 1.88 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 1.52 0.60 0.96 0.00 0.00 58 P 0.00 4.03 0.00 2.10 2.09 0.00 4.24 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 2.01 2.02 0.00 59 G 8.99 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 60 M 7.91 4.46 0.00 1.92 2.08 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.43 0.00 61 D 8.42 4.80 0.00 2.73 2.55 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 62 G 8.40 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 63 I 7.75 3.68 1.99 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 1.62 0.82 0.90 0.00 0.00 64 E 8.17 4.08 0.00 2.05 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 2.71 2.55 0.00 65 I 7.46 3.78 2.04 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 1.74 0.99 0.91 0.00 0.00 66 L 8.33 3.92 0.00 1.71 1.85 0.89 0.59 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 67 K 8.41 3.91 0.00 1.91 1.83 0.00 1.86 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.45 1.68 7.81 68 R 8.12 4.08 0.00 1.96 1.99 0.00 3.12 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.94 0.00 69 M 8.31 4.07 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.51 0.00 70 K 8.00 3.91 0.00 1.77 1.85 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.59 7.81 71 V 8.04 3.80 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 0.82 0.00 0.00 0.93 0.00 0.00 72 I 7.42 4.00 1.95 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 1.51 0.72 0.89 0.00 0.00 73 D 8.79 4.72 0.00 2.73 2.77 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 0.00 0.00 0.00 74 E 9.49 4.36 0.00 2.14 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 2.12 2.09 0.00 75 N 7.67 4.61 0.00 2.83 2.97 0.00 0.00 5.93 7.81 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 76 I 7.60 3.76 1.86 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 1.33 0.67 0.94 0.00 0.00 77 R 8.72 4.68 0.00 2.07 1.80 0.00 3.17 0.00 0.00 3.26 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 78 V 8.29 4.76 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 0.92 0.00 0.00 0.87 0.00 0.00 79 I 8.80 4.73 1.56 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.55 -0.15 0.00 0.00 80 I 8.01 4.43 1.84 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 1.17 0.76 0.85 0.00 0.00 81 M 9.11 5.23 0.00 1.96 2.17 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.66 0.00 82 T 8.69 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 83 A 8.49 3.92 1.26 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 0.00 0.00 84 Y 8.49 4.35 0.00 3.03 2.98 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 85 G 8.30 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 86 E 8.24 3.63 0.00 2.17 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 0.00 2.21 2.29 0.00 87 L 7.02 3.54 0.00 1.72 1.52 0.90 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 88 D 8.02 4.34 0.00 2.82 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 89 M 8.97 3.98 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 90 I 7.65 3.58 1.91 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.29 0.80 0.00 0.00 91 Q 7.61 3.87 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.25 0.00 92 E 8.35 4.16 0.00 2.04 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 2.29 2.35 0.00 93 S 8.20 4.09 0.00 4.05 3.86 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 94 K 8.45 4.04 0.00 2.03 1.83 0.00 1.54 0.00 0.00 1.70 0.00 0.00 3.22 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.57 7.81 95 E 8.60 4.02 0.00 2.01 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 2.34 2.60 0.00 96 L 7.88 4.29 0.00 1.71 1.69 0.91 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 97 G 7.85 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 0.00 0.00 0.00 98 A 8.26 4.20 1.21 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 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.73 4.15 0.00 1.28 1.74 0.95 0.87 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 0.00 100 T 6.87 4.42 4.21 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 0.00 0.00 0.00 0.65 0.00 0.00 101 H 8.75 5.02 0.00 3.17 3.10 0.00 5.54 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 F 8.97 5.21 0.00 2.95 2.85 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 0.00 103 A 8.79 5.18 1.40 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 0.00 104 K 9.41 4.53 0.00 1.35 1.30 0.00 0.99 0.00 0.00 0.61 0.00 0.00 2.80 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.73 1.24 7.81 105 P 0.00 4.25 0.00 2.11 1.99 0.00 3.63 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.89 0.00 106 F 7.91 4.33 0.00 2.91 2.96 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 0.00 107 D 8.08 4.76 0.00 2.61 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 0.00 108 I 7.93 3.48 1.78 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.84 0.72 0.00 0.00 109 D 7.94 4.45 0.00 2.49 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 0.00 110 E 8.39 3.96 0.00 1.99 1.95 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 2.24 2.22 0.00 111 I 7.57 3.15 1.63 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 0.22 0.15 0.90 0.00 0.00 112 R 7.35 4.69 0.00 2.09 2.09 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 2.26 1.72 0.00 113 D 8.06 4.53 0.00 2.93 2.77 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 0.00 0.00 0.00 114 A 9.21 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 115 V 10.03 3.74 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 0.37 0.00 0.00 0.98 0.00 0.00 116 K 8.00 4.11 0.00 1.92 1.71 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.39 1.31 7.81 117 K 8.52 4.24 0.00 1.66 2.07 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.73 1.23 7.81 118 Y 7.98 4.25 0.00 2.98 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 0.00 119 L 8.47 4.81 0.00 1.44 1.54 0.97 0.90 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 0.00 120 P 0.00 4.37 0.00 2.23 2.10 0.00 3.61 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.14 0.00 121 L 8.56 4.12 0.00 1.53 1.56 0.48 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 122 K 8.86 4.25 0.00 1.93 1.85 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.24 1.22 7.81