NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2016 8.2649 123.5788 52.8105 18.9653 176.5327 2 T 3.1923 8.3207 121.8639 63.7973 66.5207 171.5069 3 M 4.3306 8.4531 120.3670 55.5408 34.2131 175.6766 4 T 4.6513 8.4145 118.2098 62.7923 69.6858 174.0762 5 L 5.1418 8.8675 127.0709 53.3490 44.3392 175.7575 6 T 4.9100 9.6137 111.3367 59.6613 72.1243 174.5669 7 D 4.3541 9.1829 121.3544 57.2312 40.9705 178.5065 8 A 4.2104 8.1458 121.4114 54.2648 18.8326 178.1846 9 N 4.8275 7.9129 111.8540 52.9879 38.1147 176.2916 10 F 3.8783 8.4138 124.0227 62.1404 39.1632 176.6454 11 Q 4.0406 8.3062 116.8179 59.0568 29.0235 178.7704 12 Q 4.0095 7.9784 119.5730 59.2818 29.2468 178.0508 13 A 3.9098 8.1261 122.0512 55.1479 18.2576 179.6679 14 I 3.2044 7.7348 118.5900 63.8814 36.6457 177.6461 15 Q 4.5697 7.3673 116.4695 54.9249 28.8061 176.0347 16 G 3.7996 7.2594 109.0641 46.3610 0.0000 174.7064 17 D 4.6156 8.5446 124.4865 51.8684 39.7824 175.4767 18 G 4.2423 7.2125 109.4933 44.2000 0.0000 169.3628 19 P 4.7285 0.0000 0.0000 62.5059 32.7986 175.9505 20 V 4.8126 8.6973 122.3738 61.1162 35.0902 173.7702 21 L 4.9556 9.4327 130.6902 53.7032 43.7658 174.9152 22 V 4.6337 8.7680 127.5953 61.5790 33.4969 173.9169 23 D 5.0296 9.2375 128.5867 52.8248 42.5920 174.9586 24 F 5.0644 9.3779 126.9067 56.4917 40.4427 175.3306 25 W 5.3604 8.9207 120.0326 55.5663 32.4409 173.2002 26 A 3.8210 7.9746 118.7134 50.2683 21.2257 177.5056 27 A 4.2787 8.1893 122.4179 54.1409 18.6910 178.7356 28 W 4.5506 7.5261 110.9838 56.9274 29.0923 177.4387 29 C 4.7886 7.6385 120.8155 55.1273 44.4328 173.8050 30 G 3.6754 8.6379 115.4731 47.6519 0.0000 172.1196 31 P 4.3726 0.0000 0.0000 64.9175 31.0867 179.5752 32 C 4.3787 8.1322 114.6356 60.1276 34.6946 175.7087 33 R 3.9468 8.1440 119.6550 59.5366 29.3968 179.0460 34 M 4.1735 8.1064 117.7170 58.6782 32.2338 178.4219 35 M 4.2104 8.2930 118.4804 57.5255 31.9512 178.3681 36 A 3.8940 7.6391 121.3663 54.8083 18.3844 177.9209 37 P 4.1919 0.0000 0.0000 65.8928 31.4353 178.6864 38 V 3.5999 7.7265 117.5273 65.8999 31.5187 177.8929 39 L 4.0578 8.0244 118.6865 57.7785 41.3325 179.3464 40 E 4.0403 8.0275 118.5405 59.4708 29.2893 179.2853 41 E 4.0087 8.0349 118.8220 59.1543 29.4604 179.2016 42 F 4.1012 8.2973 120.3687 61.3167 39.3289 177.0452 43 A 4.0004 8.4268 119.5096 55.3677 18.4139 178.7421 44 E 3.9527 7.9480 117.7744 59.2106 29.5189 178.0317 45 A 4.1984 7.4729 117.6198 52.8385 18.4090 177.4937 46 H 4.6878 7.4144 113.3330 56.4376 30.9397 175.4315 47 A 4.1537 7.8540 124.5477 54.4604 18.1819 179.2382 48 D 4.5795 7.9256 113.8209 54.2721 40.1330 177.1198 49 K 4.5318 7.8873 117.7654 56.2839 34.1877 176.0416 50 V 4.7415 7.3466 115.9244 60.8566 34.2297 173.3109 51 T 4.6653 8.6149 118.5954 61.8421 71.6648 173.1956 52 V 4.8213 8.3625 124.8969 61.3074 33.8657 174.2410 53 A 5.3330 9.3004 128.6332 50.1212 23.1674 174.5274 54 K 4.9883 8.8871 118.4460 54.4476 35.7287 175.3091 55 L 4.8822 8.9760 126.2620 53.0945 44.9606 175.0210 56 N 4.0265 8.6823 126.0078 52.6335 39.1678 176.1210 57 V 3.9024 8.0115 120.0237 63.8461 31.9689 177.6634 58 D 4.5092 7.9574 119.4402 56.9356 40.6556 177.1598 59 E 4.3567 8.0753 115.7442 56.9569 30.8532 175.9617 60 N 5.1844 7.6119 116.4065 49.9559 39.0308 173.0151 61 P 4.2932 0.0000 0.0000 65.8714 31.6543 178.6700 62 E 3.9308 8.4474 118.1835 59.5446 29.4276 179.3548 63 T 3.8717 8.3129 115.7453 66.9189 68.3473 176.5994 64 T 3.9576 7.8299 117.7105 66.8908 68.5456 176.7463 65 S 4.1214 8.3649 116.1090 61.4728 62.8929 176.1434 66 Q 3.9100 8.3931 121.2096 58.4858 28.5490 178.4322 67 F 4.4860 8.2071 115.2600 55.7785 39.7174 175.9845 68 G 3.8773 7.9114 106.3297 46.4744 0.0000 175.2201 69 I 3.8825 7.7308 119.8436 60.9530 36.8249 176.3302 70 M 4.5684 8.4746 124.5379 55.1103 33.6245 176.3501 71 S 4.7489 7.7805 112.5438 56.3643 65.6572 172.7163 72 I 4.8330 8.1734 119.5695 58.0167 40.5823 173.2257 73 P 4.8272 0.0000 0.0000 63.6676 32.7807 175.1045 74 T 5.1976 8.4272 116.4555 62.2555 73.4038 172.8130 75 L 5.4479 9.1581 124.9163 53.0802 45.7385 175.5796 76 I 4.8570 8.6761 122.6223 59.4566 40.9264 174.0576 77 L 4.8489 8.9077 130.0704 54.0026 43.7260 175.0644 78 F 5.2955 9.2178 124.8938 55.5944 41.9816 174.5547 79 K 4.4427 9.0038 123.8849 55.2808 34.9880 176.3281 80 G 3.7274 9.2976 116.0349 46.4724 0.0000 173.9708 81 G 4.4071 8.5565 106.5386 45.1096 0.0000 173.9458 82 R 4.9093 7.5156 119.0554 53.3696 32.3151 173.1510 83 P 4.2622 0.0000 0.0000 62.8447 31.8877 176.2726 84 V 4.4014 8.6053 114.7841 61.2551 34.0837 175.7130 85 K 4.5562 7.5131 120.2036 55.1349 35.6144 173.9393 86 Q 4.9685 8.5804 126.6677 54.2474 32.0754 173.9548 87 L 4.7660 9.0431 126.2599 53.0028 44.6269 175.2481 88 I 4.5230 8.6170 124.6368 60.6792 39.0639 176.7838 89 G 4.0075 9.1141 112.5120 44.7583 0.0000 172.3055 90 Y 3.9825 8.3676 119.2375 57.9585 38.9923 175.5907 91 Q 4.2809 7.3298 124.7952 52.7823 31.1565 174.2176 92 P 4.3383 0.0000 0.0000 61.6325 33.6191 176.7827 93 K 3.7873 8.5878 119.3505 60.1816 31.9320 178.2159 94 E 3.9715 8.2605 117.8194 59.6433 29.3699 179.4274 95 Q 3.9529 7.9318 117.3500 58.8316 28.8954 178.3415 96 L 3.7263 7.8195 119.9615 57.8032 41.7192 179.3945 97 E 4.1661 8.4071 118.2274 59.5949 29.2590 179.4471 98 A 4.0271 7.7812 119.1379 55.3683 18.5427 179.4648 99 Q 4.0693 8.4288 115.9155 58.2479 29.0413 177.8694 100 L 4.4854 8.0443 117.6633 54.2785 41.6301 178.0038 101 A 4.0505 7.7278 122.0326 55.5912 18.1168 179.1733 102 D 4.5037 8.0461 112.5334 55.7502 40.9294 176.9394 103 V 4.3502 7.8831 117.7146 62.4136 32.8101 175.4781 104 L 4.4275 9.2123 118.2345 55.5253 41.6485 176.6933 105 Q 4.2261 7.8869 123.6860 56.0369 28.9084 175.4168 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 4.20 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 2 T 8.32 3.19 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 1.10 0.00 0.00 3 M 8.45 4.33 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.54 0.00 4 T 8.41 4.65 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 1.29 0.00 0.00 5 L 8.87 5.14 0.00 1.69 1.77 0.78 0.65 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 6 T 9.61 4.91 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 1.24 0.00 0.00 7 D 9.18 4.35 0.00 2.69 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 8 A 8.15 4.21 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 9 N 7.91 4.83 0.00 2.94 3.06 0.00 0.00 6.61 7.97 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 10 F 8.41 3.88 0.00 3.35 3.12 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 11 Q 8.31 4.04 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.83 0.00 0.00 0.00 0.00 0.00 2.62 2.51 0.00 12 Q 7.98 4.01 0.00 2.10 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 13 A 8.13 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 I 7.73 3.20 1.17 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.52 0.00 0.00 15 Q 7.37 4.57 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.67 0.00 0.00 0.00 0.00 0.00 2.59 2.49 0.00 16 G 7.26 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 0.00 0.00 0.00 17 D 8.54 4.62 0.00 2.64 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 18 G 7.21 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 0.00 0.00 0.00 0.00 19 P 0.00 4.73 0.00 2.12 2.02 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 20 V 8.70 4.81 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 0.99 0.00 0.00 0.87 0.00 0.00 21 L 9.43 4.96 0.00 1.85 1.61 0.95 0.88 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 22 V 8.77 4.63 2.35 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 0.47 0.00 0.00 1.05 0.00 0.00 23 D 9.24 5.03 0.00 2.76 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.38 5.06 0.00 3.21 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.92 5.36 0.00 3.38 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 26 A 7.97 3.82 -0.10 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 27 A 8.19 4.28 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 28 W 7.53 4.55 0.00 3.44 3.17 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 29 C 7.64 4.79 0.00 2.19 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 G 8.64 3.68 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 0.00 0.00 0.00 31 P 0.00 4.37 0.00 2.27 2.22 0.00 3.68 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00 32 C 8.13 4.38 0.00 3.21 3.27 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 33 R 8.14 3.95 0.00 2.01 1.99 0.00 3.29 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.88 0.00 34 M 8.11 4.17 0.00 2.02 2.40 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.83 0.00 35 M 8.29 4.21 0.00 1.98 2.27 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 3.01 0.00 36 A 7.64 3.89 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 37 P 0.00 4.19 0.00 2.28 2.31 0.00 3.78 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.03 0.00 38 V 7.73 3.60 2.15 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 0.95 0.00 0.00 0.95 0.00 0.00 39 L 8.02 4.06 0.00 1.82 1.69 0.85 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 40 E 8.03 4.04 0.00 2.06 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 2.28 2.63 0.00 41 E 8.03 4.01 0.00 2.14 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 2.34 2.47 0.00 42 F 8.30 4.10 0.00 3.16 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 43 A 8.43 4.00 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 44 E 7.95 3.95 0.00 2.14 2.11 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 2.24 2.28 0.00 45 A 7.47 4.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 H 7.41 4.69 0.00 2.94 2.90 0.00 5.82 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 A 7.85 4.15 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 48 D 7.93 4.58 0.00 2.77 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 49 K 7.89 4.53 0.00 1.67 1.83 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.34 1.30 7.81 50 V 7.35 4.74 2.11 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 0.71 0.00 0.00 1.04 0.00 0.00 51 T 8.61 4.67 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 1.19 0.00 0.00 52 V 8.36 4.82 2.11 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 0.99 0.00 0.00 1.06 0.00 0.00 53 A 9.30 5.33 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 54 K 8.89 4.99 0.00 1.67 1.75 0.00 1.29 0.00 0.00 0.80 0.00 0.00 2.60 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.16 1.22 7.81 55 L 8.98 4.88 0.00 1.46 0.87 0.81 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 56 N 8.68 4.03 0.00 2.27 2.52 0.00 0.00 7.17 7.71 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 57 V 8.01 3.90 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 1.20 0.00 0.00 0.91 0.00 0.00 58 D 7.96 4.51 0.00 2.76 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 59 E 8.08 4.36 0.00 1.88 1.96 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 2.22 2.33 0.00 60 N 7.61 5.18 0.00 2.76 2.85 0.00 0.00 6.59 7.92 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 61 P 0.00 4.29 0.00 2.26 2.32 0.00 3.88 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 2.07 0.00 62 E 8.45 3.93 0.00 2.26 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 0.00 2.45 2.51 0.00 63 T 8.31 3.87 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 0.32 0.00 0.00 64 T 7.83 3.96 4.42 0.00 0.00 0.00 0.00 0.00 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 65 S 8.36 4.12 0.00 4.02 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 0.00 66 Q 8.39 3.91 0.00 2.33 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.18 0.00 0.00 0.00 0.00 0.00 2.35 2.58 0.00 67 F 8.21 4.49 0.00 2.91 3.02 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 68 G 7.91 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 0.00 0.00 0.00 69 I 7.73 3.88 1.74 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 -0.19 0.76 0.00 0.00 70 M 8.47 4.57 0.00 1.98 2.08 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 2.49 2.56 0.00 71 S 7.78 4.75 0.00 3.79 3.68 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 72 I 8.17 4.83 1.99 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.73 1.00 0.00 0.00 73 P 0.00 4.83 0.00 2.18 2.28 0.00 3.74 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 74 T 8.43 5.20 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 1.13 0.00 0.00 75 L 9.16 5.45 0.00 1.51 1.50 0.79 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 76 I 8.68 4.86 1.98 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.78 0.11 0.00 0.00 77 L 8.91 4.85 0.00 1.69 1.46 1.03 0.79 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 78 F 9.22 5.30 0.00 3.03 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 79 K 9.00 4.44 0.00 1.81 1.66 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.35 1.40 7.81 80 G 9.30 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 81 G 8.56 4.41 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 0.00 82 R 7.52 4.91 0.00 1.98 1.86 0.00 3.15 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 83 P 0.00 4.26 0.00 2.10 1.74 0.00 4.01 0.00 0.00 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.28 0.00 84 V 8.61 4.40 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 0.75 0.00 0.00 0.98 0.00 0.00 85 K 7.51 4.56 0.00 1.80 1.53 0.00 1.52 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.37 1.45 7.81 86 Q 8.58 4.97 0.00 1.99 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.46 0.00 0.00 0.00 0.00 0.00 2.18 2.45 0.00 87 L 9.04 4.77 0.00 1.51 1.47 0.85 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 88 I 8.62 4.52 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.55 0.92 0.00 0.00 89 G 9.11 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 90 Y 8.37 3.98 0.00 2.94 2.93 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 0.00 0.00 0.00 91 Q 7.33 4.28 0.00 1.71 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.83 0.00 0.00 0.00 0.00 0.00 2.27 2.08 0.00 92 P 0.00 4.34 0.00 2.32 2.42 0.00 3.71 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 93 K 8.59 3.79 0.00 1.86 1.91 0.00 1.77 0.00 0.00 1.85 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.57 1.65 7.81 94 E 8.26 3.97 0.00 2.06 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 2.42 2.44 0.00 95 Q 7.93 3.95 0.00 2.15 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.88 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 96 L 7.82 3.73 0.00 1.66 1.18 0.49 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 97 E 8.41 4.17 0.00 2.19 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 0.00 2.68 2.58 0.00 98 A 7.78 4.03 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 99 Q 8.43 4.07 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 100 L 8.04 4.49 0.00 1.86 1.78 0.20 0.72 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 0.00 101 A 7.73 4.05 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.05 4.50 0.00 2.64 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 0.00 103 V 7.88 4.35 2.27 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 0.83 0.00 0.00 0.95 0.00 0.00 104 L 9.21 4.43 0.00 1.85 1.63 0.93 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 105 Q 7.89 4.23 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.65 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00