NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3871 8.3044 120.3494 55.4812 33.1283 175.0789 2 E 4.1866 7.6376 114.5029 53.6904 32.3852 174.3478 3 G 4.1681 8.3280 112.9701 45.3325 0.0000 172.7107 4 V 4.5242 7.3181 118.3973 60.2977 35.0152 174.9687 5 D 4.7487 8.6522 123.1743 51.2227 40.7142 170.8665 6 P 4.8891 0.0000 0.0000 61.0459 32.2417 175.4184 7 A 3.8164 8.6820 126.9236 52.6286 16.8240 178.2420 8 V 3.7416 8.0695 120.4750 66.9408 31.9410 175.9466 9 E 4.5342 8.2093 118.4886 53.9880 29.5455 174.8748 10 E 4.0062 8.0108 121.5396 55.6147 30.8325 175.5177 11 A 4.5317 7.9238 125.1414 50.3133 21.8453 177.1582 12 A 3.5059 8.3778 120.5805 53.5087 18.3626 176.6385 13 F 4.5800 8.1349 112.1573 56.5260 39.3177 174.9136 14 V 3.6656 7.3970 121.7041 62.4547 32.6969 175.8046 15 A 4.2304 8.3045 125.4951 51.9659 20.2393 178.5589 16 D 4.7007 8.5063 122.4791 56.9503 40.7400 178.7068 17 D 4.2768 7.9831 116.4708 57.6786 41.5630 178.1792 18 V 3.7551 7.6806 118.1222 65.4701 31.6540 177.9134 19 S 4.1359 8.6595 114.9759 61.2168 62.6581 176.3598 20 N 4.3556 8.2317 120.6705 55.7516 37.2115 177.1083 21 I 3.7137 7.4439 122.4198 63.8666 37.2599 178.1130 22 I 3.6680 7.8363 119.0286 64.1172 37.8279 178.0787 23 K 4.5787 8.2137 119.0987 59.9035 31.9542 179.1247 24 E 4.0134 8.8993 119.4589 59.5131 28.7478 179.6202 25 S 4.0118 8.2366 113.0405 61.4175 62.4356 176.1779 26 I 3.5254 7.5534 122.4747 64.3214 36.7369 177.6180 27 D 4.2352 8.4051 118.9563 57.2989 40.8505 178.2116 28 A 4.0766 7.5815 120.1422 54.4425 19.0535 179.3011 29 V 3.5560 8.7453 115.0174 64.5878 31.6121 176.9980 30 L 3.2876 7.5931 116.7485 55.2391 43.6364 176.9197 31 Q 4.1458 7.5824 117.8353 56.4828 29.7127 175.9730 32 N 4.3373 8.0313 115.3438 55.6974 37.1027 173.8405 33 Q 4.6407 7.4844 116.6195 53.6825 32.2645 173.6352 34 Q 4.3159 8.4862 118.7365 55.1317 29.8767 174.9646 35 Y 4.6644 8.7210 121.8001 58.1873 38.7206 175.7870 36 S 4.5964 7.8245 123.5258 55.9263 66.2605 174.4974 37 E 3.4839 8.5814 126.7637 59.2267 28.5898 178.7429 38 A 3.9491 7.7822 120.0814 54.4160 18.2345 178.7594 39 K 3.8711 6.6999 115.8107 57.0609 32.3382 178.7289 40 V 2.1275 6.5559 118.7122 64.9356 30.9230 176.9373 41 S 4.5677 7.4354 112.3266 59.8190 64.3178 176.2273 42 Q 4.0855 7.2319 119.5999 58.1124 28.3651 177.7307 43 W 4.4795 8.9995 120.6672 60.9764 29.1091 178.1361 44 T 3.8597 8.0836 112.7034 65.0915 66.7583 176.4625 45 S 4.1781 7.6825 115.3900 61.5406 63.1562 176.6749 46 S 4.2518 8.4162 119.1776 61.2252 62.5207 176.1681 47 C 4.0650 8.0623 121.6506 62.3555 31.2056 175.6035 48 L 4.0284 7.8786 120.7233 57.7240 41.1587 179.0560 49 E 4.0445 8.1216 118.8819 59.0205 29.4342 177.4665 50 H 4.6213 8.5546 113.8725 56.3431 29.2442 175.6271 51 C 4.4625 7.8583 121.5175 61.1129 32.5195 175.4056 52 I 3.8268 7.8914 120.2118 64.2301 37.4091 178.0031 53 K 4.0142 8.2229 119.3726 59.3696 31.7589 179.3949 54 R 3.8938 7.8500 118.5787 59.3650 30.1173 178.3159 55 L 3.7410 7.9128 118.9566 57.7617 41.1435 179.6297 56 T 4.4503 8.0419 110.2841 64.0912 68.9247 176.4673 57 A 4.1182 7.4883 122.7447 54.7670 18.4745 179.1117 58 L 4.0524 8.0899 116.6692 54.7564 43.1427 176.7822 59 N 4.0177 7.9452 115.6006 51.8588 36.3060 175.0024 60 K 3.8508 6.9353 111.3772 55.8311 35.2148 173.0880 61 P 4.4323 0.0000 0.0000 62.6264 31.6576 174.7817 62 F 4.5263 8.6637 115.6712 59.8874 40.3034 175.6418 63 K 4.3306 7.9959 121.3698 55.8131 33.4846 175.0031 64 Y 5.4772 7.5899 122.6072 55.4397 41.7856 174.1509 65 V 4.7099 9.2837 121.7768 61.3651 34.8400 174.8988 66 V 4.7593 8.4160 124.5217 61.5997 33.4998 174.1047 67 T 4.9801 9.0063 122.5577 60.5641 71.0351 172.1116 68 C 5.2674 8.4378 118.6440 57.2023 32.9060 173.0243 69 I 4.7869 9.1253 121.0785 59.5130 40.5694 174.4377 70 I 4.4197 8.5208 120.4286 60.4574 39.1723 175.7189 71 M 4.5128 9.3074 127.3700 53.3227 32.4531 173.7573 72 Q 4.1793 8.4323 124.7113 56.8255 30.4129 177.1180 73 K 3.8921 8.5376 127.7815 56.1387 31.2261 173.7777 74 N 4.8896 8.5456 113.8356 54.4593 38.8969 176.3045 75 G 3.6592 7.8774 106.7103 47.5820 0.0000 174.1322 76 A 4.0847 7.2479 123.2980 52.0162 18.8880 176.8551 77 G 4.0481 8.4863 111.0920 44.0691 0.0000 173.1319 78 L 4.7314 8.2465 125.1896 53.5356 45.0040 175.2683 79 H 4.8453 8.7559 122.2476 55.0062 32.6224 172.8652 80 T 4.7113 8.5630 120.4523 61.7243 71.0644 173.5764 81 A 4.6838 8.1581 125.0364 50.6867 22.2149 176.0338 82 A 4.3394 8.3847 123.0530 51.4242 21.7487 175.6863 83 S 4.6436 8.7347 118.3104 56.8478 63.9315 173.0782 84 C 4.7069 8.3578 125.1097 57.7191 30.2997 174.8051 85 W 3.9109 8.1838 131.2218 56.6524 31.9197 174.9193 86 W 4.8528 7.3389 116.8242 56.1237 29.0807 175.8062 87 D 4.9482 8.1927 119.8387 54.1222 41.9024 176.3885 88 S 3.9696 8.6596 120.5089 60.9299 63.2454 175.5121 89 T 3.9986 8.1923 115.0799 65.0831 67.6869 174.2326 90 T 4.5624 7.1322 112.1895 60.0712 67.4051 173.3189 91 D 4.8205 7.7655 121.5052 53.3674 43.6340 173.2887 92 G 4.0967 8.4296 115.9301 44.1658 0.0000 172.2851 93 S 2.0000 7.0729 120.9845 57.4578 60.3247 171.5504 94 R 4.4339 8.2319 124.6111 54.4965 32.8836 174.4366 95 T 5.0646 8.4055 118.5206 59.9483 69.4732 173.8829 96 V 4.5319 8.8044 125.5779 61.1679 35.5835 174.1810 97 R 5.1561 8.2960 124.7918 54.4179 32.3152 175.0608 98 W 4.8071 9.8227 124.8882 55.5775 31.5618 175.5043 99 E 5.2499 8.7451 121.2259 55.4139 33.6433 174.1015 100 N 5.3198 9.2459 115.0794 52.7266 39.3973 176.2135 101 K 4.3937 8.1138 115.0561 57.2129 35.3239 176.1902 102 S 4.6009 7.9097 109.9210 59.3872 67.7282 174.8348 103 M 4.0064 8.0744 121.5466 55.1694 33.2840 174.3436 104 Y 5.4782 8.5634 123.3327 56.7108 41.6486 174.8215 105 C 5.1341 9.4575 119.6943 58.3831 32.2118 172.7320 106 I 5.1382 8.8756 125.3484 59.7898 39.8907 174.0361 107 C 5.2267 10.0912 128.9401 58.1145 34.9428 172.1460 108 T 5.1170 9.6559 121.4758 60.3451 69.9382 172.5662 109 V 4.5764 9.1177 129.0835 61.5114 33.8708 174.5042 110 F 4.7164 9.7547 128.2049 56.2309 39.6906 175.5096 111 G 4.3235 8.6208 112.9455 45.4235 0.0000 169.9918 112 L 4.8006 8.7906 126.8599 52.8802 42.9712 178.2516 113 A 4.3773 8.7996 127.6746 51.8955 16.0639 177.5937 114 I 3.5492 7.8947 122.0539 61.2849 37.2885 174.0911 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 4.39 0.00 1.99 2.12 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 7.64 4.19 0.00 2.00 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 2.34 2.38 0.00 3 G 8.33 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 4 V 7.32 4.52 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 0.89 0.00 0.00 0.94 0.00 0.00 5 D 8.65 4.75 0.00 2.73 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 6 P 0.00 4.89 0.00 2.21 2.07 0.00 3.98 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 1.90 1.94 0.00 7 A 8.68 3.82 1.30 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 0.00 0.00 8 V 8.07 3.74 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 0.78 0.00 0.00 1.04 0.00 0.00 9 E 8.21 4.53 0.00 1.81 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 2.17 2.14 0.00 10 E 8.01 4.01 0.00 1.71 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 1.95 1.92 0.00 11 A 7.92 4.53 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 12 A 8.38 3.51 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.13 4.58 0.00 2.92 2.88 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 14 V 7.40 3.67 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 0.90 0.00 0.00 0.93 0.00 0.00 15 A 8.30 4.23 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 16 D 8.51 4.70 0.00 2.68 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 17 D 7.98 4.28 0.00 2.61 2.66 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 18 V 7.68 3.76 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 1.11 0.00 0.00 0.88 0.00 0.00 19 S 8.66 4.14 0.00 3.90 4.20 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 20 N 8.23 4.36 0.00 3.31 3.15 0.00 0.00 7.13 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 21 I 7.44 3.71 1.83 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 1.37 0.79 0.87 0.00 0.00 22 I 7.84 3.67 2.03 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 1.88 1.20 1.26 0.00 0.00 23 K 8.21 4.58 0.00 2.14 2.04 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.72 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.64 1.80 7.81 24 E 8.90 4.01 0.00 2.24 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 2.33 2.38 0.00 25 S 8.24 4.01 0.00 4.07 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 26 I 7.55 3.53 1.27 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.31 0.31 0.00 0.00 27 D 8.41 4.24 0.00 2.78 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 28 A 7.58 4.08 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 29 V 8.75 3.56 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 0.74 0.00 0.00 0.73 0.00 0.00 30 L 7.59 3.29 0.00 1.36 0.96 0.07 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 31 Q 7.58 4.15 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.84 0.00 0.00 0.00 0.00 0.00 2.28 2.23 0.00 32 N 8.03 4.34 0.00 2.85 3.01 0.00 0.00 6.65 6.97 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 33 Q 7.48 4.64 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.12 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 34 Q 8.49 4.32 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.86 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 35 Y 8.72 4.66 0.00 3.19 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 36 S 7.82 4.60 0.00 3.63 3.44 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 37 E 8.58 3.48 0.00 2.02 1.83 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 2.29 2.30 0.00 38 A 7.78 3.95 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 39 K 6.70 3.87 0.00 1.32 0.74 0.00 1.49 0.00 0.00 1.37 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.34 7.81 40 V 6.56 2.13 1.76 0.00 0.00 0.00 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 0.27 0.00 0.00 41 S 7.44 4.57 0.00 4.01 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 42 Q 7.23 4.09 0.00 1.96 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.70 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 43 W 9.00 4.48 0.00 3.17 2.94 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 44 T 8.08 3.86 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 1.30 0.00 0.00 45 S 7.68 4.18 0.00 4.13 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 0.00 46 S 8.42 4.25 0.00 4.10 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 47 C 8.06 4.07 0.00 2.87 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 7.88 4.03 0.00 2.07 1.72 0.98 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.12 4.04 0.00 2.11 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 0.00 2.33 2.37 0.00 50 H 8.55 4.62 0.00 3.10 3.30 0.00 5.70 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 51 C 7.86 4.46 0.00 3.18 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 52 I 7.89 3.83 2.05 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.54 1.01 0.00 0.00 53 K 8.22 4.01 0.00 2.05 1.83 0.00 1.82 0.00 0.00 1.59 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.50 7.81 54 R 7.85 3.89 0.00 2.01 2.00 0.00 3.21 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 55 L 7.91 3.74 0.00 1.39 0.13 0.43 0.08 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 56 T 8.04 4.45 4.33 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 1.43 0.00 0.00 57 A 7.49 4.12 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 58 L 8.09 4.05 0.00 1.67 1.64 0.88 0.92 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 59 N 7.95 4.02 0.00 2.84 3.01 0.00 0.00 6.66 7.94 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 60 K 6.94 3.85 0.00 1.49 1.58 0.00 1.70 0.00 0.00 1.64 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.10 1.16 7.81 61 P 0.00 4.43 0.00 2.30 2.17 0.00 3.70 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 2.12 2.15 0.00 62 F 8.66 4.53 0.00 3.01 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 63 K 8.00 4.33 0.00 1.92 1.76 0.00 1.61 0.00 0.00 1.82 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.55 1.39 7.81 64 Y 7.59 5.48 0.00 3.09 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 65 V 9.28 4.71 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 0.83 0.00 0.00 1.03 0.00 0.00 66 V 8.42 4.76 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 0.85 0.00 0.00 1.08 0.00 0.00 67 T 9.01 4.98 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 1.38 0.00 0.00 68 C 8.44 5.27 0.00 3.13 2.84 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 69 I 9.13 4.79 1.95 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 1.34 0.61 0.97 0.00 0.00 70 I 8.52 4.42 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 1.35 0.47 1.04 0.00 0.00 71 M 9.31 4.51 0.00 2.21 2.35 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 2.63 2.68 0.00 72 Q 8.43 4.18 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 5.99 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 73 K 8.54 3.89 0.00 1.92 1.80 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.34 7.81 74 N 8.55 4.89 0.00 2.92 2.95 0.00 0.00 5.87 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 75 G 7.88 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 0.00 0.00 0.00 76 A 7.25 4.08 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 77 G 8.49 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 0.00 0.00 0.00 78 L 8.25 4.73 0.00 1.58 1.52 0.95 1.02 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 79 H 8.76 4.85 0.00 3.17 3.15 0.00 5.71 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 T 8.56 4.71 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 1.25 0.00 0.00 81 A 8.16 4.68 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 82 A 8.38 4.34 1.24 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 0.00 0.00 83 S 8.73 4.64 0.00 3.81 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 84 C 8.36 4.71 0.00 3.05 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 85 W 8.18 3.91 0.00 3.01 3.09 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 0.00 0.00 0.00 0.00 86 W 7.34 4.85 0.00 3.00 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 87 D 8.19 4.95 0.00 2.81 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 88 S 8.66 3.97 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 89 T 8.19 4.00 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 1.33 0.00 0.00 90 T 7.13 4.56 4.35 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 1.32 0.00 0.00 91 D 7.77 4.82 0.00 2.66 2.61 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 0.00 0.00 0.00 0.00 92 G 8.43 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 S 7.07 2.00 0.00 3.14 3.48 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 94 R 8.23 4.43 0.00 1.76 1.77 0.00 3.32 0.00 0.00 3.06 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.65 0.00 95 T 8.41 5.06 4.30 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 1.23 0.00 0.00 96 V 8.80 4.53 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 -0.65 0.00 0.00 0.83 0.00 0.00 97 R 8.30 5.16 0.00 1.59 1.90 0.00 3.48 0.00 0.00 3.28 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 98 W 9.82 4.81 0.00 3.39 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 99 E 8.75 5.25 0.00 2.07 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 0.00 2.11 2.48 0.00 100 N 9.25 5.32 0.00 2.92 3.05 0.00 0.00 6.44 7.03 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 0.00 101 K 8.11 4.39 0.00 1.79 1.89 0.00 1.34 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.26 1.47 7.81 102 S 7.91 4.60 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 0.00 103 M 8.07 4.01 0.00 2.38 2.15 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.80 0.00 104 Y 8.56 5.48 0.00 3.04 2.81 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 0.00 0.00 0.00 105 C 9.46 5.13 0.00 2.93 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 0.00 106 I 8.88 5.14 2.00 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 1.24 1.79 1.08 0.00 0.00 107 C 10.09 5.23 0.00 2.83 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 0.00 108 T 9.66 5.12 4.39 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 109 V 9.12 4.58 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 0.98 0.00 0.00 1.01 0.00 0.00 110 F 9.75 4.72 0.00 3.06 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 0.00 111 G 8.62 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 0.00 0.00 0.00 0.00 112 L 8.79 4.80 0.00 1.76 1.72 1.29 0.75 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 0.00 113 A 8.80 4.38 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 0.00 114 I 7.89 3.55 1.82 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 0.87 0.47 0.78 0.00 0.00