NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3292 8.2649 123.5831 50.9412 19.9438 176.5741 2 P 5.1312 0.0000 0.0000 62.2277 31.7558 175.1178 3 Q 4.5548 8.6441 118.4119 56.2713 31.4142 175.7957 4 T 4.7259 7.3231 107.5986 58.8711 73.3314 174.2258 5 I 3.6493 8.2622 121.0870 64.5568 37.9393 178.1607 6 T 3.8113 7.7958 116.0802 66.5274 68.4094 176.0016 7 E 3.8924 8.0433 120.9731 59.1359 29.6537 178.5406 8 L 3.9715 7.9521 120.2801 58.4596 42.3309 178.0234 9 C 4.2535 8.7273 118.9713 59.7421 43.3200 175.5285 10 S 4.0540 7.9269 114.2519 60.6646 62.6615 175.6132 11 E 4.0216 8.0418 121.3062 57.0876 29.6312 175.9938 12 Y 4.8226 7.0650 115.8067 55.7498 39.8237 175.9014 13 R 4.2222 8.5555 121.2925 57.2468 31.0614 176.1984 14 N 4.2898 8.9416 115.0999 54.9058 36.0807 173.8481 15 T 5.3724 7.2886 103.8151 60.2558 71.9268 172.7623 16 Q 4.6023 8.7287 119.0598 55.1720 32.6370 173.1313 17 I 4.6127 8.1089 120.9904 60.6372 38.5555 174.7713 18 Y 4.3552 8.8717 125.3881 56.6928 39.8445 175.0215 19 T 4.4140 8.5047 121.7445 63.3751 68.6284 174.5557 20 I 3.7047 8.9012 128.4744 62.6534 37.7403 177.2836 21 N 4.0939 7.7339 116.8385 53.5778 37.2787 172.3924 22 D 4.5571 7.5752 114.1496 53.1991 45.1135 174.6325 23 K 4.8941 8.4162 122.0319 55.5002 33.6146 176.8571 24 I 3.5123 8.2739 121.3384 61.6234 37.6574 176.0422 25 L 4.4275 8.5379 128.6662 57.5704 42.5013 176.9852 26 S 4.7431 7.7037 112.1466 56.4938 66.8132 171.9794 27 Y 4.8613 7.9781 121.9012 56.0653 41.1489 174.6087 28 T 4.4388 8.3020 122.9320 61.5226 72.3394 172.5537 29 E 4.8571 8.4911 125.7988 54.3161 32.9938 174.4059 30 S 4.7773 9.0095 120.9250 56.4578 65.7112 173.8769 31 M 4.5754 8.5762 121.8283 54.7209 31.7436 175.6422 32 A 4.0885 7.9420 123.7300 51.8047 19.0844 177.9843 33 G 3.8383 8.4669 111.0889 47.1208 0.0000 174.1044 34 K 4.1380 8.8388 122.0151 56.7268 30.7923 176.4941 35 R 4.6564 7.7936 117.7259 55.8048 30.9477 176.6976 36 E 4.8542 8.3689 118.9709 55.5312 29.3263 176.1607 37 M 4.7003 8.0122 121.0045 54.1083 35.4576 173.4571 38 V 4.7057 8.1331 117.1094 61.0524 35.0839 174.1263 39 I 5.0994 8.6845 127.5344 59.3670 40.6460 174.4926 40 I 5.0641 8.8529 119.8482 59.2449 40.9169 174.4127 41 T 5.0659 8.3077 112.8572 60.0402 72.6068 172.4570 42 F 5.3315 8.6802 120.1520 55.1850 42.5456 176.8360 43 K 4.1923 9.1458 120.1317 59.3845 32.5286 178.4442 44 S 4.1603 8.1934 113.8675 59.9786 62.8891 175.1856 45 G 4.0069 8.4386 108.7352 44.6674 0.0000 173.1506 46 E 4.1121 8.1449 121.4009 56.0567 30.9654 175.4085 47 T 5.0070 7.6516 121.3857 61.7693 71.9100 173.2222 48 F 5.2924 9.1121 123.1833 55.7931 43.7330 173.6469 49 Q 5.1663 9.1611 118.6451 54.5107 32.5637 174.3118 50 V 4.4299 8.3357 120.5565 61.2962 32.9465 175.3129 51 E 4.6947 8.8416 127.3759 55.4950 30.3651 177.0567 52 V 3.8679 8.3151 122.2606 62.5243 32.1909 174.2043 53 P 4.3314 0.0000 0.0000 62.9504 32.1382 176.0575 54 G 4.1838 8.6006 109.1772 45.2660 0.0000 172.9795 55 S 4.2883 8.5686 113.1182 60.1872 62.9380 174.8688 56 Q 4.0520 7.9214 118.6827 57.3704 28.7499 174.8503 57 H 5.1873 7.7985 116.8393 54.0064 31.1387 174.2060 58 I 4.2696 8.5399 117.3379 59.7272 39.2876 176.4978 59 D 4.4020 8.7951 120.8805 57.7905 40.3213 179.4201 60 S 4.2464 8.0773 112.5918 61.1697 63.2234 175.7516 61 Q 4.2357 8.2090 121.0121 57.3212 28.4553 178.1456 62 K 3.8954 8.0047 120.4833 59.5973 32.1205 179.3313 63 K 4.0152 8.0480 117.8619 59.3423 31.9559 179.2083 64 A 4.0147 7.9566 120.7328 54.9961 18.4756 179.5840 65 I 3.6605 8.2698 118.8583 64.6212 37.2205 178.4825 66 E 3.9900 7.9736 119.2433 59.3073 29.2293 179.3452 67 R 3.8870 8.2037 118.8628 59.6461 30.0793 178.0799 68 M 4.0313 8.2106 117.9820 58.7787 32.2085 178.3531 69 K 4.0486 8.0109 118.0696 59.4752 32.2595 178.8363 70 D 4.4109 8.2101 119.1908 57.9537 40.7155 179.2924 71 T 3.9030 8.2639 116.2880 66.6232 68.3772 176.8143 72 L 4.0677 8.2855 121.1989 57.6775 41.5785 179.5761 73 R 3.2468 8.0276 118.5929 59.4141 30.1026 178.5247 74 I 3.6499 7.6651 118.2630 64.1731 37.9063 177.9533 75 T 3.8734 8.2195 117.0539 66.6240 68.3784 175.8317 76 Y 3.9947 8.2200 121.5539 60.8882 38.6405 178.3309 77 L 3.8401 7.9350 118.6838 57.2544 41.7905 178.6331 78 T 4.2115 7.7179 106.8813 60.6394 69.3683 174.3454 79 E 3.6818 7.6238 119.7560 57.7296 27.9578 174.5980 80 T 4.1374 7.6874 115.4392 63.0628 69.7357 174.4028 81 K 4.1004 8.6652 128.3111 56.6435 33.1901 176.0332 82 I 3.8556 8.7458 129.1672 61.0849 38.3338 175.2305 83 D 4.5976 9.4727 127.9498 55.0180 41.1728 175.4176 84 K 5.1242 8.5029 115.7704 54.4230 36.9307 174.6166 85 L 4.9411 8.7390 122.2171 53.0702 45.1361 174.6652 86 C 4.9640 8.7860 124.1285 55.4084 45.8418 172.7300 87 V 4.8751 8.5043 119.1664 59.1309 35.7630 174.8352 88 W 5.1355 9.3220 124.4458 56.4677 29.9265 176.4684 89 N 4.9589 9.4280 122.6175 52.4902 37.6605 175.0193 90 N 4.9673 8.1819 115.9550 52.8030 37.6838 174.6449 91 K 4.7219 7.8444 116.6599 55.5373 36.1266 175.3145 92 T 4.7314 8.2262 117.2778 60.9765 71.0386 172.5002 93 P 4.4935 0.0000 0.0000 62.0784 32.5467 175.9111 94 N 4.7784 8.7043 117.9717 53.6552 39.9776 173.7841 95 S 5.2944 9.0225 117.4541 56.7076 64.5159 173.1692 96 I 4.1025 8.9782 129.2626 61.6400 36.7615 175.5802 97 A 4.2181 8.6916 128.9741 53.2423 20.3319 176.7469 98 A 4.5602 7.2078 114.1383 50.9705 22.7485 175.2504 99 I 5.0731 8.1682 118.9109 59.2223 41.5333 174.5452 100 S 4.9077 9.0205 121.8275 56.9216 66.5742 172.6871 101 M 5.3117 8.5262 119.9105 53.6347 35.6057 174.6802 102 K 4.6915 8.6979 120.8027 55.0110 36.0343 175.6362 103 N 4.5294 8.4887 117.2522 53.9186 39.2372 173.9852 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 A 8.26 4.33 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 2 P 0.00 5.13 0.00 2.15 2.07 0.00 3.72 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.32 0.00 3 Q 8.64 4.55 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 4 T 7.32 4.73 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 1.20 0.00 0.00 5 I 8.26 3.65 1.83 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.86 0.87 0.00 0.00 6 T 7.80 3.81 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 1.19 0.00 0.00 7 E 8.04 3.89 0.00 2.06 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 2.31 2.31 0.00 8 L 7.95 3.97 0.00 1.91 1.82 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 9 C 8.73 4.25 0.00 3.11 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 10 S 7.93 4.05 0.00 4.08 4.09 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 11 E 8.04 4.02 0.00 1.85 1.61 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 2.26 2.54 0.00 12 Y 7.06 4.82 0.00 2.98 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 13 R 8.56 4.22 0.00 2.01 1.96 0.00 3.33 0.00 0.00 3.38 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.71 0.00 14 N 8.94 4.29 0.00 3.28 3.07 0.00 0.00 6.44 7.05 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 15 T 7.29 5.37 4.06 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 0.90 0.00 0.00 16 Q 8.73 4.60 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.92 0.00 0.00 0.00 0.00 0.00 2.33 2.12 0.00 17 I 8.11 4.61 1.79 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.80 0.85 0.00 0.00 18 Y 8.87 4.36 0.00 2.81 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 19 T 8.50 4.41 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 1.18 0.00 0.00 20 I 8.90 3.70 1.74 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.30 -0.02 0.00 0.00 21 N 7.73 4.09 0.00 2.74 2.78 0.00 0.00 6.72 8.47 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 22 D 7.58 4.56 0.00 2.91 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 23 K 8.42 4.89 0.00 1.94 1.84 0.00 1.20 0.00 0.00 2.35 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.49 7.81 24 I 8.27 3.51 2.12 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.73 0.92 0.00 0.00 25 L 8.54 4.43 0.00 1.70 1.83 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 26 S 7.70 4.74 0.00 3.62 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 27 Y 7.98 4.86 0.00 2.31 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 0.00 0.00 0.00 28 T 8.30 4.44 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 1.07 0.00 0.00 29 E 8.49 4.86 0.00 1.60 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 0.00 2.16 2.27 0.00 30 S 9.01 4.78 0.00 3.83 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 31 M 8.58 4.58 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.49 0.00 32 A 7.94 4.09 1.27 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 0.00 0.00 33 G 8.47 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 0.00 0.00 0.00 34 K 8.84 4.14 0.00 2.00 2.02 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.53 7.81 35 R 7.79 4.66 0.00 1.72 1.84 0.00 3.30 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 36 E 8.37 4.85 0.00 1.96 1.90 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 2.39 2.30 0.00 37 M 8.01 4.70 0.00 2.02 2.25 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.68 0.00 38 V 8.13 4.71 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 0.80 0.00 0.00 0.86 0.00 0.00 39 I 8.68 5.10 1.72 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.58 0.87 0.00 0.00 40 I 8.85 5.06 1.67 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 1.37 0.85 0.93 0.00 0.00 41 T 8.31 5.07 4.16 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 1.10 0.00 0.00 42 F 8.68 5.33 0.00 3.08 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 43 K 9.15 4.19 0.00 1.92 2.03 0.00 1.63 0.00 0.00 1.81 0.00 0.00 3.28 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.71 1.51 7.81 44 S 8.19 4.16 0.00 4.07 4.13 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 0.00 0.00 0.00 0.00 45 G 8.44 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 0.00 0.00 0.00 46 E 8.14 4.11 0.00 2.18 1.85 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 1.97 1.47 0.00 47 T 7.65 5.01 4.02 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 1.09 0.00 0.00 48 F 9.11 5.29 0.00 2.97 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 49 Q 9.16 5.17 0.00 2.10 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.79 0.00 0.00 0.00 0.00 0.00 2.58 2.35 0.00 50 V 8.34 4.43 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 0.99 0.00 0.00 0.98 0.00 0.00 51 E 8.84 4.69 0.00 1.97 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 2.46 2.23 0.00 52 V 8.32 3.87 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 0.79 0.00 0.00 1.01 0.00 0.00 53 P 0.00 4.33 0.00 2.07 1.93 0.00 3.73 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 54 G 8.60 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 0.00 0.00 0.00 0.00 55 S 8.57 4.29 0.00 3.96 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 56 Q 7.92 4.05 0.00 1.95 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.91 0.00 0.00 0.00 0.00 0.00 1.76 1.91 0.00 57 H 7.80 5.19 0.00 3.25 3.20 0.00 5.84 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 8.54 4.27 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.86 0.93 0.00 0.00 59 D 8.80 4.40 0.00 2.72 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 60 S 8.08 4.25 0.00 4.05 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 61 Q 8.21 4.24 0.00 2.34 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.84 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 62 K 8.00 3.90 0.00 1.78 1.85 0.00 1.67 0.00 0.00 1.63 0.00 0.00 3.08 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.67 1.63 7.81 63 K 8.05 4.02 0.00 1.81 1.87 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.51 7.81 64 A 7.96 4.01 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.27 3.66 1.98 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.17 0.88 0.00 0.00 66 E 7.97 3.99 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 2.52 2.47 0.00 67 R 8.20 3.89 0.00 1.88 2.09 0.00 3.12 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 68 M 8.21 4.03 0.00 2.32 2.08 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.67 0.00 69 K 8.01 4.05 0.00 2.05 1.92 0.00 1.76 0.00 0.00 1.65 0.00 0.00 3.13 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.63 7.81 70 D 8.21 4.41 0.00 2.95 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 71 T 8.26 3.90 4.43 0.00 0.00 0.00 0.00 0.00 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 72 L 8.29 4.07 0.00 1.86 1.91 1.00 1.19 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 73 R 8.03 3.25 0.00 1.72 1.98 0.00 3.00 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.04 0.00 74 I 7.67 3.65 1.85 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 1.51 1.04 1.01 0.00 0.00 75 T 8.22 3.87 4.50 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 1.32 0.00 0.00 76 Y 8.22 3.99 0.00 3.09 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 77 L 7.93 3.84 0.00 1.59 1.65 0.86 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 78 T 7.72 4.21 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 1.19 0.00 0.00 79 E 7.62 3.68 0.00 2.10 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 2.05 2.09 0.00 80 T 7.69 4.14 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 K 8.67 4.10 0.00 1.78 1.73 0.00 1.77 0.00 0.00 1.98 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.53 7.81 82 I 8.75 3.86 2.04 0.00 0.00 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 1.19 1.13 0.94 0.00 0.00 83 D 9.47 4.60 0.00 2.73 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 0.00 0.00 0.00 84 K 8.50 5.12 0.00 1.68 1.57 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.77 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.29 1.33 7.81 85 L 8.74 4.94 0.00 1.15 1.16 0.32 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 86 C 8.79 4.96 0.00 2.86 2.73 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 87 V 8.50 4.88 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 0.50 0.00 0.00 1.33 0.00 0.00 88 W 9.32 5.14 0.00 3.39 3.23 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 89 N 9.43 4.96 0.00 2.82 3.16 0.00 0.00 7.00 8.09 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 90 N 8.18 4.97 0.00 2.89 3.01 0.00 0.00 5.91 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 91 K 7.84 4.72 0.00 1.85 1.72 0.00 1.60 0.00 0.00 1.81 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.39 7.81 92 T 8.23 4.73 4.24 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 1.19 0.00 0.00 93 P 0.00 4.49 0.00 1.92 1.98 0.00 3.69 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 1.98 2.06 0.00 94 N 8.70 4.78 0.00 2.92 3.06 0.00 0.00 7.14 7.57 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 95 S 9.02 5.29 0.00 4.07 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 96 I 8.98 4.10 1.92 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 1.01 0.71 0.88 0.00 0.00 97 A 8.69 4.22 -0.18 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 0.00 0.00 0.00 98 A 7.21 4.56 1.08 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 0.00 0.00 99 I 8.17 5.07 1.85 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 1.40 0.97 0.91 0.00 0.00 100 S 9.02 4.91 0.00 3.85 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 0.00 101 M 8.53 5.31 0.00 1.86 1.94 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 2.50 2.66 0.00 102 K 8.70 4.69 0.00 1.79 1.72 0.00 1.50 0.00 0.00 1.62 0.00 0.00 2.74 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.37 7.81 103 N 8.49 4.53 0.00 2.64 2.65 0.00 0.00 6.87 7.56 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