NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4050 8.3193 115.2907 57.9135 64.3479 173.9823 3 S 4.3926 7.8989 114.0725 56.8257 64.1461 171.6943 4 L 4.7054 8.9110 124.5950 53.0884 44.8606 177.4878 5 I 3.9142 8.2307 122.8651 61.4707 38.1916 174.9644 6 R 5.1323 8.6004 127.3993 54.6459 32.5587 174.5362 7 R 4.7580 9.2811 125.1791 54.3904 34.7427 174.6893 8 V 4.3415 8.4632 122.6783 62.6081 32.6235 174.9816 9 I 4.4473 8.5649 128.8769 60.0313 38.6752 175.5047 10 S 4.6640 8.5004 121.1473 57.3815 65.1260 172.8700 11 T 4.5655 9.4606 122.0421 60.0442 69.8104 174.3153 12 A 4.2654 8.5746 129.9596 53.7824 18.6926 178.3154 13 K 4.1601 7.8758 114.0890 57.2644 32.4256 176.6377 14 A 4.8517 7.4385 120.5926 49.0432 21.9812 174.1974 15 P 4.4081 0.0000 0.0000 62.2154 32.0125 177.2928 16 G 3.7121 8.3815 110.0104 44.9086 0.0000 173.3380 17 A 3.7877 8.2220 123.9998 52.1044 18.6190 177.8249 18 I 4.1926 8.7622 115.8994 60.8290 38.2703 175.2296 19 G 4.2276 6.8613 108.9155 44.1138 0.0000 171.8969 20 P 4.5218 0.0000 0.0000 61.3531 29.4876 174.4487 21 Y 4.9035 6.8617 121.7040 56.6376 41.4495 175.1501 22 S 4.8838 8.3746 115.9336 56.6744 65.5202 174.5224 23 Q 4.4065 8.7327 121.4973 59.3462 29.5282 176.3869 24 A 4.9546 7.5980 117.0217 51.1430 22.8762 175.2996 25 V 4.7549 8.5777 119.1766 61.0514 34.8923 174.0437 26 L 5.0526 9.1952 131.0316 53.7351 43.8207 175.5071 27 V 4.8487 8.9843 126.0467 60.4409 34.5185 175.2909 28 D 4.4086 10.1815 127.4404 55.1249 40.3334 174.3830 29 R 4.2010 8.1834 116.8372 55.9130 28.9136 176.0900 30 T 4.7330 7.9232 115.5585 62.3460 70.3801 173.8159 31 I 4.7915 8.6316 127.1412 59.7973 39.9307 174.2520 32 Y 4.6819 8.9323 126.2326 56.8968 38.8034 174.6724 33 I 4.8044 8.5581 126.3585 59.3838 39.3375 176.1880 34 S 4.2261 8.8725 123.3257 58.2067 63.7334 174.5271 35 G 3.7549 8.4049 109.3544 46.3685 0.0000 172.8376 36 Q 4.8616 9.2563 125.2128 54.4126 31.0569 174.9091 37 I 4.8995 8.2094 115.5453 58.0658 41.4278 174.7833 38 G 3.9774 8.1989 107.4551 46.7311 0.0000 173.2043 39 M 4.8967 7.9023 119.5229 54.3480 33.8632 175.2698 40 D 4.6640 9.0016 126.8588 53.4060 41.9598 175.4586 41 P 4.4043 0.0000 0.0000 64.8395 31.7614 177.1773 42 S 4.5018 8.9005 113.7577 59.5325 63.9426 175.4281 43 S 4.2707 8.3904 114.1652 58.1287 63.5590 174.9402 44 G 3.9226 8.2598 107.7304 46.0435 0.0000 172.8525 45 Q 4.8243 7.7700 117.7839 53.2477 32.2109 175.2824 46 L 4.5414 8.3944 121.2172 54.9379 42.3333 177.6992 47 V 4.0219 8.3801 116.4060 61.2872 32.3945 176.3177 48 S 4.4466 8.3527 117.7890 57.7297 64.2882 174.1727 49 G 3.8988 9.1268 107.2702 45.0214 0.0000 173.5125 50 G 3.8385 8.2520 105.5210 44.0940 0.0000 174.5240 51 V 3.5947 8.3904 117.1252 64.8450 31.3066 178.1035 52 A 4.1907 7.9405 120.7702 54.5992 18.2975 179.3625 53 E 3.9473 8.1111 117.0745 59.6372 29.6661 179.1399 54 E 3.9657 8.4098 118.4911 59.2200 29.4472 179.1926 55 A 3.9636 8.4288 121.2294 55.1066 18.3862 179.7565 56 K 3.8804 7.8956 116.5248 59.8029 32.0959 179.4162 57 Q 3.9158 8.2236 119.4879 59.0340 28.9414 178.0125 58 A 4.1030 8.5626 122.2507 55.1700 18.3827 179.6687 59 L 3.8380 8.0033 117.6799 57.5484 41.5551 179.7248 60 K 3.9869 8.0598 118.7166 59.5287 31.9956 178.9931 61 N 4.3090 8.4043 116.9376 56.6230 38.4219 177.0449 62 M 4.0889 8.2408 119.6470 58.5498 32.2601 178.4190 63 G 3.2978 8.4404 106.2273 47.8539 0.0000 175.5612 64 E 3.9762 8.2733 121.1863 59.0254 29.3034 179.5571 65 I 3.7059 7.7422 119.9553 64.2475 37.1719 178.4189 66 L 3.8828 8.0186 120.1127 57.6658 41.3243 179.5540 67 K 4.0229 8.2744 119.4771 58.8796 31.8644 179.0102 68 A 4.0621 7.8010 118.0675 53.7121 18.3815 178.2773 69 A 4.4995 7.3876 118.0786 51.2546 19.3112 177.5042 70 G 3.7724 8.1370 105.9264 46.3386 0.0000 173.0224 71 C 4.8886 8.3618 117.4242 57.4354 31.8851 171.8953 72 D 4.6625 7.8585 118.1407 51.8548 42.2745 175.9200 73 F 4.1248 8.5969 116.4275 60.6344 38.8583 177.8610 74 T 4.0489 8.1157 110.0823 64.1082 68.6993 175.0732 75 N 4.5189 8.2500 119.2574 54.4726 39.0351 175.1208 76 V 4.1552 7.6785 119.1987 62.9409 32.1214 175.7469 77 V 4.4240 8.6947 119.3947 61.5442 34.3409 175.4294 78 K 5.1947 7.7538 121.0811 55.3039 35.7056 174.5927 79 T 5.2161 9.0301 116.0216 60.3111 73.0455 172.5896 80 T 4.9616 8.6979 118.9314 61.8746 72.0633 173.1400 81 V 4.2349 8.8959 127.5341 61.3636 33.3597 174.3416 82 L 4.6893 8.7552 129.8541 53.2294 43.2309 175.8635 83 L 5.2150 8.5261 123.9185 52.8271 44.1717 177.7354 84 A 4.0936 8.6659 123.9174 54.3248 19.3725 177.6890 85 D 4.6334 7.8788 115.2221 51.8023 43.9223 175.4226 86 I 3.7559 9.3751 128.0367 64.3442 37.6984 177.0861 87 N 4.6083 8.6555 115.9447 55.0345 38.6390 175.7834 88 D 4.6979 8.1623 120.2135 54.4097 41.1434 177.7439 89 F 3.8072 8.2186 123.3178 61.4134 39.5082 176.6919 90 N 4.3995 8.2658 115.5056 56.5628 38.2624 177.3058 91 T 3.8432 7.8428 116.5562 66.7424 68.6315 176.6335 92 V 3.5341 7.7586 120.0472 66.0170 31.5035 177.5264 93 N 4.2427 8.3385 117.1764 56.5677 38.4864 176.6989 94 E 4.0245 7.8747 119.0096 59.4463 29.8666 179.1283 95 I 3.9554 7.6489 119.8968 64.4233 37.2110 177.5379 96 Y 4.2570 8.5231 120.9073 61.0939 38.3526 178.6769 97 K 4.4489 8.2788 117.4727 59.2430 32.1530 179.0412 98 Q 3.9498 8.0039 118.0651 58.3456 28.5532 177.2526 99 Y 3.7019 7.5811 115.8438 57.4995 38.7453 175.5938 100 F 4.6120 7.6208 118.9303 55.9414 39.7397 175.5131 101 K 4.4613 8.1065 125.0002 56.7529 33.7084 176.0249 102 S 3.3728 7.2868 110.4146 57.6341 65.1525 174.8582 103 N 4.1332 8.6099 115.7179 54.2698 35.7030 175.1019 104 F 4.4081 7.8675 114.7476 56.8179 40.2073 174.3515 105 P 4.7078 0.0000 0.0000 62.4008 32.0888 176.2408 106 A 4.3257 8.8659 124.3671 52.5424 19.6397 176.5445 107 R 5.2514 8.3179 117.9526 54.9282 33.6291 174.0039 108 A 5.0258 8.8790 125.1965 50.2873 22.6041 174.9197 109 A 5.3214 8.5459 120.8635 50.4081 22.6219 174.8907 110 Y 4.6091 7.7942 116.7197 56.5908 41.0267 172.2292 111 Q 4.9642 8.9546 121.8137 55.3617 30.2253 175.3291 112 V 4.4681 8.5269 119.7360 59.6142 33.8838 176.0841 113 A 4.1117 8.7029 123.8561 55.1598 18.5421 177.7688 114 A 4.5200 7.4070 114.2070 51.4907 21.8702 175.1334 115 L 4.8296 7.9424 119.4471 51.7350 45.0835 174.5823 116 P 4.2831 0.0000 0.0000 64.1925 31.6728 176.8189 117 K 3.5491 9.6518 119.1588 57.2560 29.6952 175.6597 118 G 3.9106 7.9582 104.1095 46.4778 0.0000 175.0593 119 S 4.3988 7.8129 115.0551 58.7827 63.4395 174.5790 120 R 4.5118 9.4498 120.1161 56.6955 31.2704 176.0335 121 I 4.8587 7.2268 116.7711 60.0148 40.9705 172.9937 122 E 4.9112 9.0856 128.6349 54.6497 33.4355 173.9164 123 I 4.9598 8.8089 127.1510 59.5692 40.7416 174.6391 124 E 5.0070 8.8350 124.8980 55.1207 32.7032 174.5207 125 A 5.1161 8.2175 119.3045 51.1393 23.4598 175.2686 126 V 4.7232 9.0523 119.1663 61.0640 34.6678 174.5051 127 A 5.2440 8.9711 128.2573 50.1721 23.2351 174.6157 128 I 4.8677 8.3204 119.4847 59.2074 39.6315 176.0163 129 Q 4.0386 8.8124 129.1853 56.3505 29.8036 176.1171 130 G 4.0307 8.2795 113.2869 43.1200 0.0000 171.5114 131 P 4.4696 0.0000 0.0000 62.2702 31.8707 176.2030 132 L 4.8877 8.1621 119.8673 53.2628 44.8931 176.3605 133 T 4.4623 8.1618 116.8570 62.2335 71.6336 174.2098 134 T 4.2143 8.4676 123.5981 62.0427 67.8648 174.7204 135 A 4.1692 8.3627 128.3652 52.2836 18.4355 177.1465 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 2 S 8.32 4.41 0.00 3.85 3.96 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 3 S 7.90 4.39 0.00 4.10 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 0.00 4 L 8.91 4.71 0.00 1.56 1.64 0.94 0.89 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 5 I 8.23 3.91 1.88 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 1.24 0.54 0.92 0.00 0.00 6 R 8.60 5.13 0.00 1.78 1.79 0.00 3.36 0.00 0.00 3.24 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 7 R 9.28 4.76 0.00 1.70 1.74 0.00 3.17 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 8 V 8.46 4.34 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 0.84 0.00 0.00 0.95 0.00 0.00 9 I 8.56 4.45 1.88 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 1.13 0.99 0.96 0.00 0.00 10 S 8.50 4.66 0.00 3.82 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 11 T 9.46 4.57 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 1.24 0.00 0.00 12 A 8.57 4.27 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 13 K 7.88 4.16 0.00 1.80 1.93 0.00 1.64 0.00 0.00 1.99 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.38 7.81 14 A 7.44 4.85 1.22 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 0.00 0.00 0.00 15 P 0.00 4.41 0.00 2.10 2.02 0.00 3.71 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.26 0.00 16 G 8.38 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 0.00 0.00 0.00 17 A 8.22 3.79 0.50 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 18 I 8.76 4.19 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 1.45 0.88 0.97 0.00 0.00 19 G 6.86 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 0.00 0.00 0.00 20 P 0.00 4.52 0.00 2.21 2.10 0.00 3.88 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 2.06 1.98 0.00 21 Y 6.86 4.90 0.00 3.04 2.91 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 22 S 8.37 4.88 0.00 3.93 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 0.00 23 Q 8.73 4.41 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.77 0.00 0.00 0.00 0.00 0.00 2.53 2.43 0.00 24 A 7.60 4.95 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 25 V 8.58 4.75 2.20 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 1.13 0.00 0.00 0.98 0.00 0.00 26 L 9.20 5.05 0.00 1.76 1.67 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 27 V 8.98 4.85 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 1.09 0.00 0.00 1.04 0.00 0.00 28 D 10.18 4.41 0.00 2.68 2.72 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 0.00 0.00 0.00 29 R 8.18 4.20 0.00 2.01 2.23 0.00 3.44 0.00 0.00 3.33 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 30 T 7.92 4.73 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 0.58 0.00 0.00 31 I 8.63 4.79 1.78 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 1.19 0.77 0.89 0.00 0.00 32 Y 8.93 4.68 0.00 2.94 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 33 I 8.56 4.80 1.99 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 1.23 1.17 0.92 0.00 0.00 34 S 8.87 4.23 0.00 3.83 3.65 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 35 G 8.40 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 0.00 0.00 0.00 36 Q 9.26 4.86 0.00 1.93 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.51 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 37 I 8.21 4.90 1.87 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.69 0.96 0.00 0.00 38 G 8.20 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 39 M 7.90 4.90 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 40 D 9.00 4.66 0.00 2.85 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 P 0.00 4.40 0.00 2.22 2.14 0.00 3.81 0.00 0.00 3.82 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 42 S 8.90 4.50 0.00 3.95 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 0.00 43 S 8.39 4.27 0.00 4.00 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 44 G 8.26 3.92 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 0.00 0.00 0.00 45 Q 7.77 4.82 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.19 6.93 0.00 0.00 0.00 0.00 0.00 2.27 2.47 0.00 46 L 8.39 4.54 0.00 1.54 1.61 0.98 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.38 4.02 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 0.70 0.00 0.00 0.94 0.00 0.00 48 S 8.35 4.45 0.00 3.98 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 49 G 9.13 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 0.00 0.00 0.00 50 G 8.25 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 51 V 8.39 3.59 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 0.96 0.00 0.00 0.92 0.00 0.00 52 A 7.94 4.19 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 53 E 8.11 3.95 0.00 2.16 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 0.00 2.51 2.54 0.00 54 E 8.41 3.97 0.00 2.13 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 2.55 0.00 55 A 8.43 3.96 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 56 K 7.90 3.88 0.00 2.02 1.95 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.85 7.81 57 Q 8.22 3.92 0.00 2.18 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.49 2.42 0.00 58 A 8.56 4.10 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 59 L 8.00 3.84 0.00 1.07 0.44 0.74 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.06 3.99 0.00 1.96 1.89 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.58 1.75 7.81 61 N 8.40 4.31 0.00 2.90 2.99 0.00 0.00 6.69 7.90 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 62 M 8.24 4.09 0.00 2.28 2.09 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.47 0.00 63 G 8.44 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 0.00 0.00 0.00 64 E 8.27 3.98 0.00 2.12 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 2.53 2.70 0.00 65 I 7.74 3.71 1.98 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.91 0.90 0.00 0.00 66 L 8.02 3.88 0.00 1.51 1.62 0.29 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 67 K 8.27 4.02 0.00 1.94 1.83 0.00 1.65 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.47 7.81 68 A 7.80 4.06 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 69 A 7.39 4.50 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 70 G 8.14 3.77 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 0.00 0.00 0.00 71 C 8.36 4.89 0.00 2.91 2.74 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 72 D 7.86 4.66 0.00 2.80 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 73 F 8.60 4.12 0.00 2.90 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 74 T 8.12 4.05 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 1.21 0.00 0.00 75 N 8.25 4.52 0.00 2.91 3.00 0.00 0.00 6.47 6.98 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 76 V 7.68 4.16 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 0.91 0.00 0.00 1.16 0.00 0.00 77 V 8.69 4.42 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 0.66 0.00 0.00 0.96 0.00 0.00 78 K 7.75 5.19 0.00 1.85 1.60 0.00 1.67 0.00 0.00 1.90 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.54 7.81 79 T 9.03 5.22 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 1.14 0.00 0.00 80 T 8.70 4.96 4.34 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 1.12 0.00 0.00 81 V 8.90 4.23 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 0.83 0.00 0.00 0.84 0.00 0.00 82 L 8.76 4.69 0.00 1.60 1.47 0.88 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.53 5.22 0.00 1.63 1.73 1.21 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 84 A 8.67 4.09 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 85 D 7.88 4.63 0.00 2.65 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 86 I 9.38 3.76 2.02 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 1.49 1.03 0.92 0.00 0.00 87 N 8.66 4.61 0.00 2.93 2.89 0.00 0.00 7.02 8.66 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 88 D 8.16 4.70 0.00 2.86 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 F 8.22 3.81 0.00 3.37 3.05 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 90 N 8.27 4.40 0.00 2.81 2.88 0.00 0.00 7.11 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 91 T 7.84 3.84 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 1.21 0.00 0.00 92 V 7.76 3.53 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 0.84 0.00 0.00 0.89 0.00 0.00 93 N 8.34 4.24 0.00 2.77 2.86 0.00 0.00 7.23 7.25 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 94 E 7.87 4.02 0.00 2.21 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 2.54 2.51 0.00 95 I 7.65 3.96 2.06 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 1.61 1.23 1.07 0.00 0.00 96 Y 8.52 4.26 0.00 3.16 3.15 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 97 K 8.28 4.45 0.00 2.03 1.96 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.63 1.71 7.81 98 Q 8.00 3.95 0.00 2.05 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.50 0.00 99 Y 7.58 3.70 0.00 2.05 1.43 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 0.00 100 F 7.62 4.61 0.00 3.02 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 0.00 101 K 8.11 4.46 0.00 1.61 1.78 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.06 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.42 7.81 102 S 7.29 3.37 0.00 3.76 3.65 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 0.00 103 N 8.61 4.13 0.00 2.75 2.85 0.00 0.00 6.92 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 F 7.87 4.41 0.00 3.05 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 0.00 105 P 0.00 4.71 0.00 1.89 1.96 0.00 3.78 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 1.45 2.25 0.00 106 A 8.87 4.33 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 0.00 107 R 8.32 5.25 0.00 1.75 1.72 0.00 2.87 0.00 0.00 2.94 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.78 0.00 108 A 8.88 5.03 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 0.00 109 A 8.55 5.32 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 0.00 110 Y 7.79 4.61 0.00 2.93 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 0.00 111 Q 8.95 4.96 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.85 0.00 0.00 0.00 0.00 0.00 2.33 2.60 0.00 112 V 8.53 4.47 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 0.88 0.00 0.00 1.02 0.00 0.00 113 A 8.70 4.11 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 0.00 114 A 7.41 4.52 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 0.00 115 L 7.94 4.83 0.00 1.85 1.55 0.94 1.06 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 0.00 116 P 0.00 4.28 0.00 2.18 1.98 0.00 3.73 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 2.08 2.10 0.00 117 K 9.65 3.55 0.00 1.89 1.88 0.00 1.89 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.38 1.44 7.81 118 G 7.96 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 0.00 119 S 7.81 4.40 0.00 3.89 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 0.00 120 R 9.45 4.51 0.00 1.76 1.95 0.00 3.33 0.00 0.00 3.10 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.70 0.00 121 I 7.23 4.86 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.60 0.90 0.00 0.00 122 E 9.09 4.91 0.00 2.00 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 2.15 2.23 0.00 123 I 8.81 4.96 1.92 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 1.31 0.52 1.06 0.00 0.00 124 E 8.84 5.01 0.00 2.21 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 0.00 2.21 2.27 0.00 125 A 8.22 5.12 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 0.00 126 V 9.05 4.72 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 0.74 0.00 0.00 0.98 0.00 0.00 127 A 8.97 5.24 1.18 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 0.00 128 I 8.32 4.87 1.85 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 1.07 0.96 0.93 0.00 0.00 129 Q 8.81 4.04 0.00 2.19 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.71 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 130 G 8.28 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 0.00 131 P 0.00 4.47 0.00 2.05 1.98 0.00 3.61 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 132 L 8.16 4.89 0.00 1.58 1.52 0.97 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 133 T 8.16 4.46 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 1.21 0.00 0.00 134 T 8.47 4.21 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 1.22 0.00 0.00 135 A 8.36 4.17 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