NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4045 8.1927 115.3057 57.6512 63.7862 173.8939 2 D 4.3028 8.8285 121.5187 56.6396 40.5967 175.9677 3 K 4.3721 8.6036 116.2293 56.7155 34.2533 176.1027 4 I 4.2058 7.0490 119.0036 60.8362 37.9630 175.8808 5 I 4.0115 8.4426 127.7089 61.2385 38.6007 174.7564 6 H 4.9111 8.7116 123.8260 54.3458 29.4644 174.5705 7 L 4.6555 8.5762 124.1393 54.0974 42.7320 176.2962 8 T 4.9857 8.2689 109.1622 57.9328 72.1139 174.7386 9 D 4.4641 9.1980 121.2976 58.0529 40.7803 178.8324 10 D 4.5836 8.1054 117.4851 56.7080 41.1972 177.8013 11 S 4.5478 8.1600 112.8125 58.4812 63.3589 175.8172 12 F 3.8858 7.9290 125.3126 61.6329 39.2184 175.8931 13 D 4.4140 8.4183 117.1317 58.0470 39.4649 178.5275 14 T 3.7922 7.7536 115.0539 66.9165 68.4034 176.4560 15 D 4.4588 8.0565 119.4516 56.0454 40.9267 177.4605 16 V 3.7327 7.3648 116.5653 64.3896 32.7159 177.7891 17 L 4.0107 7.4369 116.6924 56.7099 41.6313 178.0725 18 K 4.3974 7.1166 112.9790 55.6752 33.0044 176.2239 19 A 4.0916 7.5528 124.2712 52.1122 18.9994 177.4306 20 D 4.8494 8.5684 123.4826 50.3487 40.1207 176.2576 21 G 3.8069 7.0846 108.3768 45.3698 0.0000 167.8004 22 A 5.2698 7.8400 120.8306 50.7497 21.4324 176.8358 23 I 4.9698 8.9492 122.0564 59.5064 41.6960 174.2388 24 L 4.8325 8.9012 129.6720 53.7908 43.2865 174.9074 25 V 4.4664 8.8870 127.9629 61.4988 33.5520 173.9882 26 D 5.2740 8.7591 128.0889 52.7109 43.1411 174.7720 27 F 5.2882 9.1698 126.6109 56.5343 40.7147 175.3975 28 W 5.5043 8.6252 119.1208 56.0331 32.2526 172.8346 29 A 3.8605 8.0885 119.2259 50.1060 21.2202 177.2646 30 E 4.1102 8.3344 120.9796 58.6870 29.8881 177.9408 31 W 4.4706 7.3568 113.2140 57.0535 29.0437 176.9744 32 C 4.8991 7.6803 120.8285 55.1222 44.6431 173.6159 33 G 3.7554 8.7954 115.6312 47.7673 0.0000 172.1121 34 P 4.2698 0.0000 0.0000 65.0940 31.2132 179.0783 35 C 4.1539 8.3275 114.8990 60.4229 39.9537 176.4971 36 K 3.7813 7.7836 118.0793 59.5088 31.6212 179.1358 37 M 4.2048 7.9145 118.8924 58.2109 32.1170 178.4389 38 I 3.8542 7.9834 112.5722 62.8818 37.8517 177.6973 39 A 3.7566 7.5312 123.6357 54.9880 17.9871 177.7993 40 P 4.1926 0.0000 0.0000 65.9736 31.1219 178.5844 41 I 3.7703 7.4606 119.1904 64.1455 37.2491 177.9285 42 L 3.9400 8.1063 120.0532 57.6107 41.4214 179.3735 43 E 3.8650 7.8523 118.9495 59.2197 29.5395 178.6362 44 E 3.9602 7.8470 118.6694 59.5195 29.5036 179.2189 45 I 3.8648 7.9001 119.5391 64.6687 37.0008 178.2272 46 A 4.0500 7.8097 119.9207 55.2132 18.1310 179.2247 47 D 4.4428 8.0067 116.7764 57.8294 40.8072 178.9597 48 E 4.0045 8.3620 117.4491 58.4819 29.4871 177.8860 49 Y 4.3042 8.2762 115.4390 56.2740 38.4518 174.8242 50 Q 3.7463 7.1254 120.7651 57.5157 29.4310 177.6930 51 G 4.0797 9.0620 113.3059 45.3466 0.0000 173.9157 52 K 4.4303 8.4282 118.0943 57.3556 33.7498 175.8629 53 L 4.8997 7.5797 115.5282 54.8918 43.8572 175.1616 54 T 4.6610 8.5631 115.6286 61.7403 71.8344 173.5636 55 V 4.5951 8.2790 124.9220 61.7409 33.5583 174.3759 56 A 5.1890 8.9317 128.0236 50.2070 23.1406 174.8882 57 K 4.9346 8.7985 118.8388 54.4148 36.5498 175.1935 58 L 5.0082 9.0091 126.0591 53.1459 45.0583 174.7556 59 N 4.0945 8.7632 126.2952 52.9056 39.3721 175.1662 60 I 4.2549 8.1769 119.7991 61.8412 38.4333 177.8602 61 D 4.4098 8.0213 122.6609 57.1670 41.2504 177.8558 62 Q 4.1538 8.3291 116.9065 58.0591 28.6868 176.2143 63 N 5.0087 8.1162 115.4859 50.7628 39.0099 172.7842 64 P 4.7577 0.0000 0.0000 62.9422 32.5074 178.6714 65 G 3.7302 8.5204 108.8060 48.6735 0.0000 175.5098 66 T 3.8926 7.9754 116.9756 66.0769 69.1124 176.7735 67 A 3.6188 8.1557 122.9125 54.8261 18.4992 177.4900 68 P 4.1153 0.0000 0.0000 65.9892 31.0979 178.8647 69 K 3.8743 7.5158 115.5379 58.4405 31.7758 177.3882 70 Y 4.4528 7.5884 115.4487 57.1785 38.2366 176.7204 71 G 4.0228 7.9157 106.4689 46.0687 0.0000 174.3355 72 I 3.6832 7.0772 120.9599 61.3207 37.3070 175.7070 73 R 4.4042 8.7123 125.1157 57.0520 31.6128 175.8937 74 G 4.3650 7.7082 103.6264 43.7537 0.0000 171.1879 75 I 4.8279 8.0272 112.6052 57.7120 40.8470 173.4733 76 P 4.8302 0.0000 0.0000 63.2907 32.9606 174.9868 77 T 5.0581 8.7098 117.1884 61.8940 72.2139 172.7254 78 L 5.1727 8.8549 126.4306 53.0377 44.1986 175.3374 79 L 5.0460 9.2410 124.5641 52.7316 44.6501 175.4353 80 L 4.7511 8.6594 126.9981 54.5712 43.2911 175.2762 81 F 5.1710 9.8276 126.1601 55.8385 41.7346 175.1600 82 K 4.7225 8.8428 121.8627 54.7127 35.0634 176.4548 83 N 4.3965 9.3159 124.9683 53.1621 36.6213 175.5831 84 G 4.1327 8.6582 104.8747 44.9785 0.0000 173.0309 85 E 4.7792 8.0578 118.1548 53.8387 31.8208 175.6324 86 V 3.4023 8.3431 122.3319 62.9785 31.8596 175.2748 87 A 4.4246 9.1289 130.4483 53.9271 19.9447 177.1555 88 A 4.6313 7.5371 114.7098 51.3013 22.6059 175.5336 89 T 4.9909 8.7054 117.1984 61.7003 71.9830 173.5619 90 K 4.5107 8.9144 125.4323 54.7749 35.8620 175.0330 91 V 4.5351 8.2074 125.5625 62.2371 34.6574 176.0294 92 G 4.0369 9.2209 111.1453 45.3038 0.0000 173.1701 93 A 4.0796 8.2169 123.0404 51.7615 18.8982 177.0385 94 L 4.8274 7.9891 121.6228 52.8595 43.9466 176.6056 95 S 4.4558 8.5676 114.9448 57.2442 65.1749 175.0477 96 K 3.9273 8.6147 122.2745 59.7780 31.7927 178.5848 97 G 3.6719 8.0945 105.2238 48.1071 0.0000 175.4983 98 Q 4.0697 8.0940 120.6100 58.4112 28.6491 178.5477 99 L 3.9824 8.1877 121.5794 58.0247 42.1742 178.9189 100 K 4.0796 8.2658 120.0389 58.8846 32.0428 178.8588 101 E 3.9386 8.1151 118.7753 59.1684 29.4916 178.2629 102 F 4.1439 8.4316 120.9169 61.5080 39.3715 177.2210 103 L 3.7334 8.3421 118.5383 57.9919 40.0938 179.1768 104 D 4.4584 8.6943 118.8824 57.4398 40.4854 178.8257 105 A 4.2196 7.8714 120.4226 54.1978 18.5701 178.4201 106 N 4.5575 7.3570 112.7830 53.8112 39.5068 176.5723 107 L 4.2290 7.7053 119.1878 55.9066 42.0843 176.4529 108 A 4.1545 7.2072 123.9881 52.3345 18.2938 177.0166 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 S 8.19 4.40 0.00 4.06 3.80 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 2 D 8.83 4.30 0.00 2.75 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 3 K 8.60 4.37 0.00 1.76 1.82 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.16 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.35 1.43 7.81 4 I 7.05 4.21 1.84 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.41 0.74 0.00 0.00 5 I 8.44 4.01 1.78 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 1.18 0.62 0.86 0.00 0.00 6 H 8.71 4.91 0.00 3.06 3.31 0.00 5.69 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.58 4.66 0.00 1.73 1.72 0.89 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 8 T 8.27 4.99 4.38 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 1.25 0.00 0.00 9 D 9.20 4.46 0.00 2.69 2.82 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 10 D 8.11 4.58 0.00 2.68 2.76 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 0.00 0.00 0.00 0.00 11 S 8.16 4.55 0.00 4.11 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 12 F 7.93 3.89 0.00 3.43 3.19 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 13 D 8.42 4.41 0.00 2.84 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 14 T 7.75 3.79 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 15 D 8.06 4.46 0.00 2.50 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 16 V 7.36 3.73 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 -0.30 0.00 0.00 -0.07 0.00 0.00 17 L 7.44 4.01 0.00 1.90 1.77 1.16 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.12 4.40 0.00 1.81 1.79 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.56 1.48 7.81 19 A 7.55 4.09 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 20 D 8.57 4.85 0.00 2.62 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.08 3.81 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 0.00 0.00 0.00 22 A 7.84 5.27 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 23 I 8.95 4.97 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 1.08 1.09 0.77 0.00 0.00 24 L 8.90 4.83 0.00 1.75 1.54 1.07 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 25 V 8.89 4.47 2.22 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 0.17 0.00 0.00 0.74 0.00 0.00 26 D 8.76 5.27 0.00 2.76 2.56 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 0.00 0.00 0.00 0.00 27 F 9.17 5.29 0.00 3.04 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 28 W 8.63 5.50 0.00 3.46 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.09 3.86 0.06 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 30 E 8.33 4.11 0.00 1.94 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 2.46 0.00 31 W 7.36 4.47 0.00 3.51 3.20 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 32 C 7.68 4.90 0.00 2.31 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 33 G 8.80 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.27 0.00 2.20 2.13 0.00 3.70 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.22 0.00 35 C 8.33 4.15 0.00 3.27 3.33 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 36 K 7.78 3.78 0.00 1.92 1.86 0.00 1.74 0.00 0.00 1.94 0.00 0.00 3.28 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.68 7.81 37 M 7.91 4.20 0.00 1.97 2.23 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.81 0.00 38 I 7.98 3.85 1.81 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 1.55 0.67 0.87 0.00 0.00 39 A 7.53 3.76 1.13 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 0.00 0.00 40 P 0.00 4.19 0.00 2.24 2.29 0.00 3.67 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.02 0.00 41 I 7.46 3.77 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 0.59 0.89 0.00 0.00 42 L 8.11 3.94 0.00 1.74 1.63 0.78 1.03 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 43 E 7.85 3.86 0.00 2.10 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 2.27 2.35 0.00 44 E 7.85 3.96 0.00 2.19 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 2.35 0.00 45 I 7.90 3.86 1.99 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.92 0.77 0.00 0.00 46 A 7.81 4.05 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 47 D 8.01 4.44 0.00 3.02 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 48 E 8.36 4.00 0.00 2.00 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 2.31 2.44 0.00 49 Y 8.28 4.30 0.00 3.12 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 50 Q 7.13 3.75 0.00 2.27 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.62 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 51 G 9.06 4.08 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 0.00 52 K 8.43 4.43 0.00 2.04 1.97 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.34 7.81 53 L 7.58 4.90 0.00 1.69 1.61 0.71 0.83 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 54 T 8.56 4.66 4.19 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 1.16 0.00 0.00 55 V 8.28 4.60 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 0.89 0.00 0.00 0.89 0.00 0.00 56 A 8.93 5.19 1.06 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 57 K 8.80 4.93 0.00 1.77 1.80 0.00 1.37 0.00 0.00 1.40 0.00 0.00 2.13 0.00 0.00 2.40 0.00 0.00 0.00 0.00 1.28 1.20 7.81 58 L 9.01 5.01 0.00 1.66 1.33 1.10 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.76 4.09 0.00 2.24 2.50 0.00 0.00 6.94 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 I 8.18 4.25 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 1.25 1.20 1.02 0.00 0.00 61 D 8.02 4.41 0.00 2.71 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 62 Q 8.33 4.15 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 7.09 0.00 0.00 0.00 0.00 0.00 2.36 2.24 0.00 63 N 8.12 5.01 0.00 2.82 2.93 0.00 0.00 6.62 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 64 P 0.00 4.76 0.00 2.17 2.16 0.00 3.52 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.91 0.00 65 G 8.52 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 66 T 7.98 3.89 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 0.50 0.00 0.00 67 A 8.16 3.62 1.17 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 68 P 0.00 4.12 0.00 2.09 2.08 0.00 3.59 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.16 0.00 69 K 7.52 3.87 0.00 1.44 1.31 0.00 1.54 0.00 0.00 1.56 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.33 7.81 70 Y 7.59 4.45 0.00 2.95 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 71 G 7.92 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 0.00 0.00 0.00 72 I 7.08 3.68 1.63 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 -0.14 0.79 0.00 0.00 73 R 8.71 4.40 0.00 1.74 1.91 0.00 3.20 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 74 G 7.71 4.37 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 0.00 75 I 8.03 4.83 1.90 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.81 0.99 0.00 0.00 76 P 0.00 4.83 0.00 2.17 2.26 0.00 3.66 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 77 T 8.71 5.06 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 1.34 0.00 0.00 78 L 8.85 5.17 0.00 1.43 1.57 0.79 0.28 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 79 L 9.24 5.05 0.00 1.83 1.35 0.85 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 80 L 8.66 4.75 0.00 1.87 1.50 0.97 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 81 F 9.83 5.17 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 82 K 8.84 4.72 0.00 1.67 1.70 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.37 7.81 83 N 9.32 4.40 0.00 2.82 2.86 0.00 0.00 7.14 7.27 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 84 G 8.66 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 0.00 0.00 0.00 85 E 8.06 4.78 0.00 2.19 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 2.34 2.26 0.00 86 V 8.34 3.40 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 0.65 0.00 0.00 0.23 0.00 0.00 87 A 9.13 4.42 1.17 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 88 A 7.54 4.63 1.07 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 0.00 0.00 89 T 8.71 4.99 4.29 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 0.00 0.00 0.00 1.23 0.00 0.00 90 K 8.91 4.51 0.00 0.79 1.08 0.00 1.02 0.00 0.00 0.62 0.00 0.00 2.70 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.75 1.09 7.81 91 V 8.21 4.54 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 0.86 0.00 0.00 0.93 0.00 0.00 92 G 9.22 4.04 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 0.00 0.00 0.00 93 A 8.22 4.08 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 94 L 7.99 4.83 0.00 1.84 1.54 0.78 0.54 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 95 S 8.57 4.46 0.00 4.09 4.04 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 96 K 8.61 3.93 0.00 1.85 1.88 0.00 1.74 0.00 0.00 1.85 0.00 0.00 3.06 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.55 1.54 7.81 97 G 8.09 3.67 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 0.00 98 Q 8.09 4.07 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 99 L 8.19 3.98 0.00 1.82 1.83 0.97 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.27 4.08 0.00 2.08 1.97 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.74 1.46 7.81 101 E 8.12 3.94 0.00 2.23 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 0.00 2.35 2.35 0.00 102 F 8.43 4.14 0.00 3.10 3.21 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 0.00 103 L 8.34 3.73 0.00 1.58 1.35 0.25 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 104 D 8.69 4.46 0.00 2.71 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 0.00 105 A 7.87 4.22 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 0.00 106 N 7.36 4.56 0.00 2.27 2.57 0.00 0.00 7.02 7.70 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 0.00 107 L 7.71 4.23 0.00 1.72 1.73 1.01 0.73 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 0.00 108 A 7.21 4.15 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