NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4073 8.1927 115.4090 57.9004 64.5459 174.0579 2 M 3.8123 8.3112 119.3498 56.9050 31.9685 176.0642 3 T 4.6696 8.4424 107.8378 62.5573 70.1578 174.5392 4 D 4.6022 7.9886 121.5043 55.4942 41.3123 176.8077 5 L 4.5984 7.7803 117.7502 54.8807 44.0142 176.3540 6 L 4.9204 7.9679 116.8969 51.9907 45.3291 175.7132 7 S 4.4604 8.4337 114.5801 57.9006 64.0957 174.7970 8 A 4.0242 8.6528 130.7058 55.4471 18.2327 179.4653 9 E 3.8823 8.2338 117.1671 59.6805 29.5861 178.7121 10 D 4.3504 8.3242 118.7953 57.2962 40.8254 178.7550 11 I 3.7560 7.9770 120.3523 64.3344 37.2111 178.2479 12 K 3.9325 8.3083 120.5763 59.5381 31.7802 178.6709 13 K 3.9387 7.9090 118.3077 59.3814 32.3071 178.3347 14 A 4.2135 8.3107 121.3370 55.3874 18.3396 179.7524 15 I 4.1505 8.3828 118.7090 64.5508 37.0090 178.9240 16 G 3.7195 8.1550 105.1985 47.1841 0.0000 174.9190 17 A 4.0284 7.4409 121.3775 53.1382 18.6615 177.2405 18 F 5.1614 8.1147 115.9285 55.9695 40.2876 176.6792 19 T 3.9985 8.2812 112.5352 64.3638 69.1717 174.8141 20 A 4.1338 7.8585 124.2218 51.0935 19.1482 176.3112 21 A 3.9405 8.5441 123.6753 53.9415 18.6621 177.3120 22 D 4.6118 8.8175 121.5065 55.3978 38.2284 174.8599 23 S 4.5345 7.8272 114.5598 58.9096 63.8682 174.0198 24 F 3.6889 8.3078 124.2861 58.5636 39.5033 174.7615 25 D 4.0636 6.0556 125.7387 51.6612 43.1082 175.1556 26 H 3.0379 7.9010 124.3885 58.1659 28.4151 177.5251 27 K 4.2509 7.1114 121.8289 58.7360 31.9838 179.3645 28 K 4.1786 7.9486 118.5716 59.1830 31.8425 179.3124 29 F 4.2505 7.9288 121.2222 61.3897 39.3770 177.2752 30 F 4.4360 8.1793 117.8142 60.5133 38.2889 177.6166 31 Q 4.0031 8.2283 117.7223 59.4467 28.3759 178.9660 32 M 4.0721 7.8414 118.2907 58.2253 32.1200 178.8348 33 V 3.7123 7.5419 117.6128 62.7984 31.9703 177.1249 34 G 4.0128 7.7509 108.3368 45.2378 0.0000 175.3636 35 L 4.0807 7.8712 120.7971 57.4549 41.7244 179.5399 36 K 4.1484 7.9649 116.4935 58.4690 32.1746 178.0106 37 K 4.1984 7.6858 117.4214 57.8130 32.4212 177.6634 38 K 4.2437 7.4366 118.3220 55.4909 32.8390 177.6272 39 S 4.3283 8.4526 116.9054 58.3084 65.0472 175.3146 40 A 4.0147 8.4931 124.0280 55.3799 18.0662 179.5822 41 D 4.3091 8.0275 116.2021 57.6377 41.3431 178.0720 42 D 4.4273 8.1775 119.4901 57.1689 40.7907 178.8578 43 V 3.7061 7.9891 118.9801 65.9393 31.4835 178.3182 44 K 4.1270 8.1098 118.0060 59.3594 31.9161 179.4788 45 K 4.0598 8.1435 118.9165 59.2847 32.0327 179.4797 46 V 3.4753 8.0823 118.6990 65.9870 31.4939 177.5774 47 F 3.1842 8.0322 120.2686 61.6956 38.8444 176.9346 48 H 4.0001 7.9593 114.2505 58.6558 28.4939 177.5932 49 I 3.7418 7.2220 120.6736 64.2815 36.9860 178.1858 50 L 4.0748 7.2248 118.3297 56.3562 42.9292 178.3278 51 D 4.5252 7.3683 119.3821 53.2165 38.0935 176.3268 52 K 3.8711 8.0157 123.0476 58.5675 32.6248 177.7430 53 D 4.6102 8.3091 115.2323 52.3044 39.6200 176.2540 54 K 3.9733 7.7998 117.5270 57.7602 29.9883 176.7577 55 S 4.1988 8.3727 114.2360 59.6209 63.2214 175.1965 56 G 3.7028 9.4060 109.8122 45.0055 0.0000 173.0361 57 F 5.3611 7.5559 116.1946 55.7551 43.4956 174.8387 58 I 4.8477 9.1198 123.4094 59.9099 37.9838 175.7656 59 E 4.5558 8.7841 127.3136 55.1378 31.4102 177.5635 60 E 3.9247 8.9419 120.5971 59.7772 29.5318 178.3127 61 D 4.3692 8.0766 118.5300 56.6989 39.4285 178.2541 62 E 4.0517 8.0951 119.1520 58.5151 29.5572 179.1130 63 L 4.0677 8.0810 119.6928 57.7188 41.7209 179.2735 64 G 3.8908 8.0076 105.6543 48.1911 0.0000 174.7583 65 S 4.7486 7.5178 114.6827 58.1561 63.0719 175.7409 66 I 3.7148 7.5723 124.9807 64.5262 37.6251 177.9856 67 L 4.1571 7.7108 119.0788 57.6535 41.2579 179.3813 68 K 4.4223 7.8482 117.8102 59.2952 31.9615 179.2135 69 G 3.6343 7.7663 105.0603 47.3305 0.0000 175.4836 70 F 4.4588 8.1511 118.6645 58.4537 39.8883 176.1470 71 S 4.6533 8.2030 113.2344 56.2794 65.0413 174.7033 72 S 4.2791 8.9776 122.9759 61.0861 62.7373 174.7620 73 D 4.5408 8.0144 117.8560 53.6039 39.9008 176.4809 74 A 4.2051 7.8290 123.7514 51.7500 18.9508 177.6478 75 R 4.1362 8.2037 116.6855 55.9661 30.2430 176.3196 76 D 4.6696 8.2154 118.6736 54.0442 41.6686 176.4005 77 L 4.2638 8.4988 122.4884 54.5638 42.3718 177.4502 78 S 4.3245 9.3481 117.7746 57.9395 64.2471 174.9276 79 A 3.9563 8.8313 122.2102 55.4584 17.8597 180.0312 80 K 3.8897 7.9131 117.2320 59.7335 32.4590 178.7152 81 E 4.0067 8.2545 118.8739 59.7185 29.2090 179.5693 82 T 3.7891 8.2405 116.0424 66.5425 68.4773 176.4344 83 K 3.8831 8.1019 121.4633 59.9698 32.1088 178.8817 84 T 3.8666 7.9252 115.8319 66.5868 68.4151 176.5477 85 L 3.9829 7.9660 122.3308 58.1229 42.0258 178.5497 86 M 4.0135 8.4205 118.3270 58.6765 31.9977 177.8822 87 A 3.9772 8.0451 119.4607 55.3453 18.5922 179.1804 88 A 4.1927 8.1239 118.2077 54.9534 18.5333 179.4477 89 G 3.9319 8.0108 102.7571 45.9343 0.0000 174.7574 90 D 4.9024 8.1571 122.2012 52.8170 38.5276 176.5721 91 K 4.0342 8.2011 122.7116 58.5128 32.7119 177.7713 92 D 4.5810 8.3632 115.6531 52.5219 39.7491 177.0052 93 G 3.9406 7.8606 106.7382 46.4619 0.0000 175.2857 94 S 4.0668 8.4127 115.2275 59.3266 63.0913 175.5703 95 G 3.9297 10.0191 109.6444 45.0315 0.0000 172.4391 96 K 4.6870 7.4131 116.1061 55.6411 36.6271 175.4731 97 I 4.9201 8.7107 121.6128 59.2752 38.7413 175.9143 98 E 4.8583 9.1094 127.1112 55.5144 30.9748 178.2314 99 V 2.0102 8.0501 121.5091 64.7335 30.9674 178.1283 100 E 3.8504 7.9241 119.1980 59.0838 29.4076 178.4898 101 E 4.0292 8.1483 118.1085 59.2627 29.5162 179.0384 102 F 4.2324 8.0548 120.4767 61.3943 39.4531 177.3652 103 S 4.0182 8.2208 114.8344 61.9429 62.5970 176.9923 104 T 3.8378 7.8629 118.3434 66.2947 67.9803 176.3209 105 L 3.9777 7.7927 121.5114 58.4174 42.3534 179.1231 106 V 3.5162 7.4849 117.5329 65.9095 31.2371 177.9167 107 A 4.0269 8.0315 119.5923 54.6605 18.2678 178.4492 108 E 4.3476 7.9226 114.3601 56.6900 30.2489 176.7671 109 S 4.3509 7.9600 121.9135 58.8033 63.0536 173.9350 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 4.41 0.00 4.00 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 2 M 8.31 3.81 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.38 0.00 3 T 8.44 4.67 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 1.26 0.00 0.00 4 D 7.99 4.60 0.00 2.82 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 5 L 7.78 4.60 0.00 1.72 1.71 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 6 L 7.97 4.92 0.00 1.77 1.61 1.24 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.43 4.46 0.00 3.91 3.89 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 8 A 8.65 4.02 1.36 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 0.00 0.00 9 E 8.23 3.88 0.00 2.16 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 2.38 1.98 0.00 10 D 8.32 4.35 0.00 2.94 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 11 I 7.98 3.76 2.13 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.91 1.19 0.00 0.00 12 K 8.31 3.93 0.00 1.94 1.98 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.50 7.81 13 K 7.91 3.94 0.00 1.95 1.82 0.00 1.85 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.45 7.81 14 A 8.31 4.21 1.25 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 0.00 0.00 0.00 15 I 8.38 4.15 2.02 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.35 1.02 0.00 0.00 16 G 8.16 3.72 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 0.00 0.00 0.00 17 A 7.44 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 F 8.11 5.16 0.00 3.20 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 19 T 8.28 4.00 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 1.28 0.00 0.00 20 A 7.86 4.13 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 21 A 8.54 3.94 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 22 D 8.82 4.61 0.00 2.86 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 23 S 7.83 4.53 0.00 4.11 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 24 F 8.31 3.69 0.00 2.88 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 25 D 6.06 4.06 0.00 2.54 2.25 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 0.00 26 H 7.90 3.04 0.00 2.80 3.35 0.00 5.51 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 K 7.11 4.25 0.00 1.76 1.80 0.00 1.85 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 0.95 7.81 28 K 7.95 4.18 0.00 2.05 2.00 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.80 7.81 29 F 7.93 4.25 0.00 2.32 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.18 4.44 0.00 3.04 2.95 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 0.00 0.00 0.00 0.00 31 Q 8.23 4.00 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 32 M 7.84 4.07 0.00 1.96 2.20 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.53 0.00 33 V 7.54 3.71 1.15 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 0.71 0.00 0.00 0.80 0.00 0.00 34 G 7.75 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 35 L 7.87 4.08 0.00 1.96 1.64 0.85 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 36 K 7.96 4.15 0.00 1.75 1.87 0.00 1.81 0.00 0.00 1.86 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.42 7.81 37 K 7.69 4.20 0.00 1.89 1.87 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.41 7.81 38 K 7.44 4.24 0.00 1.85 1.76 0.00 1.91 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.67 1.56 7.81 39 S 8.45 4.33 0.00 4.05 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 40 A 8.49 4.01 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 41 D 8.03 4.31 0.00 2.76 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 42 D 8.18 4.43 0.00 2.90 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 43 V 7.99 3.71 2.25 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 1.08 0.00 0.00 1.00 0.00 0.00 44 K 8.11 4.13 0.00 2.12 1.91 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.67 7.81 45 K 8.14 4.06 0.00 2.02 1.88 0.00 1.87 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.48 1.59 7.81 46 V 8.08 3.48 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 1.12 0.00 0.00 1.05 0.00 0.00 47 F 8.03 3.18 0.00 2.77 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 48 H 7.96 4.00 0.00 3.31 3.28 0.00 5.71 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.22 3.74 1.81 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 1.44 0.57 0.75 0.00 0.00 50 L 7.22 4.07 0.00 1.33 1.50 0.95 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 51 D 7.37 4.53 0.00 2.03 2.34 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 52 K 8.02 3.87 0.00 2.11 1.80 0.00 1.90 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.44 1.00 7.81 53 D 8.31 4.61 0.00 2.76 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 54 K 7.80 3.97 0.00 1.93 1.89 0.00 1.66 0.00 0.00 1.76 0.00 0.00 3.26 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.33 1.46 7.81 55 S 8.37 4.20 0.00 4.21 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 56 G 9.41 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 0.00 0.00 0.00 57 F 7.56 5.36 0.00 3.20 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 58 I 9.12 4.85 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 0.86 0.70 0.91 0.00 0.00 59 E 8.78 4.56 0.00 2.13 1.89 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 2.40 2.39 0.00 60 E 8.94 3.92 0.00 2.03 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 0.00 2.38 2.38 0.00 61 D 8.08 4.37 0.00 2.89 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 62 E 8.10 4.05 0.00 2.16 1.97 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 2.34 2.36 0.00 63 L 8.08 4.07 0.00 1.91 1.73 1.04 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.01 3.89 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 0.00 0.00 0.00 65 S 7.52 4.75 0.00 3.85 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 66 I 7.57 3.71 1.98 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.63 0.69 0.00 0.00 67 L 7.71 4.16 0.00 1.80 1.65 0.67 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 68 K 7.85 4.42 0.00 1.89 1.88 0.00 1.80 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.69 1.60 7.81 69 G 7.77 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.15 4.46 0.00 3.42 3.37 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 71 S 8.20 4.65 0.00 3.94 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 72 S 8.98 4.28 0.00 4.02 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 73 D 8.01 4.54 0.00 2.81 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 74 A 7.83 4.21 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 75 R 8.20 4.14 0.00 1.91 1.95 0.00 3.02 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 76 D 8.22 4.67 0.00 2.54 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 8.50 4.26 0.00 1.32 1.43 0.56 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 78 S 9.35 4.32 0.00 3.86 3.99 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 79 A 8.83 3.96 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 80 K 7.91 3.89 0.00 1.84 1.81 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.53 7.81 81 E 8.25 4.01 0.00 2.24 1.97 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 2.40 2.53 0.00 82 T 8.24 3.79 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 1.23 0.00 0.00 83 K 8.10 3.88 0.00 1.90 2.01 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.50 7.81 84 T 7.93 3.87 4.46 0.00 0.00 0.00 0.00 0.00 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 85 L 7.97 3.98 0.00 1.95 1.85 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 86 M 8.42 4.01 0.00 2.28 2.07 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 2.62 2.62 0.00 87 A 8.05 3.98 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 88 A 8.12 4.19 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 89 G 8.01 3.93 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 0.00 0.00 0.00 90 D 8.16 4.90 0.00 2.85 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 91 K 8.20 4.03 0.00 2.19 1.88 0.00 1.90 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.44 1.00 7.81 92 D 8.36 4.58 0.00 2.80 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 93 G 7.86 3.94 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 0.00 0.00 0.00 94 S 8.41 4.07 0.00 3.92 4.21 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 95 G 10.02 3.93 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 0.00 0.00 0.00 96 K 7.41 4.69 0.00 1.94 1.75 0.00 1.29 0.00 0.00 1.47 0.00 0.00 2.13 0.00 0.00 2.37 0.00 0.00 0.00 0.00 1.16 1.35 7.81 97 I 8.71 4.92 2.11 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.82 1.22 0.00 0.00 98 E 9.11 4.86 0.00 2.06 1.92 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 2.62 2.94 0.00 99 V 8.05 2.01 0.96 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 0.62 0.00 0.00 0.42 0.00 0.00 100 E 7.92 3.85 0.00 2.01 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 2.36 2.38 0.00 101 E 8.15 4.03 0.00 2.31 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 0.00 2.44 2.41 0.00 102 F 8.05 4.23 0.00 3.39 3.18 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 0.00 103 S 8.22 4.02 0.00 4.02 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 0.00 104 T 7.86 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 0.00 105 L 7.79 3.98 0.00 1.82 1.62 0.93 1.46 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 0.00 106 V 7.48 3.52 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 0.76 0.00 0.00 -0.13 0.00 0.00 107 A 8.03 4.03 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 0.00 108 E 7.92 4.35 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 2.31 2.46 0.00 109 S 7.96 4.35 0.00 4.20 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